A0A087YBQ2_POEFO Loading...

Probable RNA-binding protein 19

Plays a role in embryo pre-implantation development.

AlphaFold DB , UniProt , Accession A0A087YBQ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 920 aa.

						>A0A087YBQ2_POEFO|A0A087YBQ2
MSRLIVKNLPNGLKEERFRSMFAAFGTVTDCSLKFTKEGKFRKFGFVGFKSEEDASRALKHFNKSFVDTSRVTVEMCKAFGDPTKGKAWSKHTQSSEQDKPSAASSTTDTKKTKTGEKETSSALGNLEAEDGFNEFLSVHQNRSQAQTWANDMAQDPADSGGVQKQKKKKPAPDDYLNFDSDESEDEKHDDDDDDDDDDDDEDKVSSKEALKSGLSDKDYLRSKVAQTMEESDEENEADEEEEEGPVQHGDSAYESGERENISKPKPFAGNKKQSAQEEMEPTTDFTVKLRGVPFNVKEQQIREFMTPLRPAAIRIGRNETGNRTGYVYVDLHSDEEVEKALKKNKDYIGGRYIEVFRVDSSGAKSKRNKNDKEIDRNFTRKLKEDEEEEDVSESGRLFIRNLPYTCTEEEMKELFVKYGPLSEILFPIDNLTKKPKGFAFVTYMIPENAVVALAKLDGHIFQGRMLHVLPSTVKKEKSESSESGGPGSSSYKRQKDAKNKASSSSSHNWNSLFLGTSAVADAIAEKYNATKSQVLDHESKGSVAVRMALGETEIVQETRQFLLDNSVCLDSFSQAAAVRSTTVILVKNLPAGVTTTELEELFSPHGSLGRVLLPPSGLTAIIEFLEPTEAKRAFARLAYSKFHHVPLYLEWAPVGVFTAAKPETDKEKTVNKEKKKEEDEQEEEDEEEAVPGSTLFIKNLNFSTTEEKLQEIFSKCGTVKSCSISKKRDKSGNVLSMGYGFVQYQTVEAAQKALRQLQHCMVDDHQLEVKISERATRTAEVSRKKKQAEKKQTGSKILVRNVPFQATVREIRELFCTFGELKTVRLPKKAAGSGNHRGFAFVDFLTKRDAKKAFAALCHSTHLYGRRLVLEWADAEDTVETLRQKTAEHFHGDLPKKRRKAEVMEGILESMETDGGVEH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61	Low	84.7	Confident	116 Å²	116	48.7 Å²	48.7	57%	0.571	24%	0.244	S	C	*	.				0	119.5	0	-71.5	180	-78.4	0	0	111.1	R3 E52 M76 C77	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 2.88Å; M1-E52 PolarHBondContact N-OE1 3.41Å; M1-E52 PolarHBondContact N-OE2 2.97Å; M1-M76 VanDerWaalsContact O-SD 3.35Å; M1-C77 VanDerWaalsContact CE-O 3.23Å; M1-C77 WeakPolarHBondContact CE-O 3.41Å
2	S	83.8	Confident	83.9	Confident	38 Å²	38	50.6 Å²	50.6	27%	0.266	29%	0.285	S	S	.	.			trans	-83.6	21	-179.1	64.3	0	0	0	0	116.1	F49 S51	S2-F49 VanDerWaalsContact CB-O 3.28Å; S2-F49 WeakPolarHBondContact CB-O 3.41Å; S2-F49 PolarHBondContact O-N 3.37Å; S2-F49 PolarHBondContact OG-O 3.11Å; S2-S51 WeakPolarHBondContact CB-O 3.27Å
3	R	89.1	Confident	83.7	Confident	84 Å²	84	47.5 Å²	47.5	32%	0.317	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.1	-177	-164.3	-174.9	-173	106.4	14	111.3	M1 D30 V47 C77	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 2.88Å; R3-D30 IonicContact CZ-OD2 2.76Å; R3-D30 IonicContact NH1-OD2 3.29Å; R3-D30 PolarHBondContact NH1-OD2 3.22Å; R3-D30 IonicContact NH2-OD1 2.73Å; R3-D30 PolarHBondContact NH2-OD1 3.21Å; R3-D30 VanDerWaalsContact NH2-OD1 3.08Å; R3-D30 IonicContact NH2-OD2 3.8Å; R3-D30 PolarHBondContact NH2-OD2 3.48Å; R3-V47 CarbonylContact C-O 3.59Å; R3-V47 WeakPolarHBondContact CA-O 3.48Å; R3-V47 WeakPolarHBondContact CG-O 3.46Å; R3-C77 HydrophobicContact CB-CB 4.12Å; R3-C77 HydrophobicContact CG-CB 4.37Å; R3-C77 VanDerWaalsContact O-CB 3.26Å; R3-C77 WeakPolarHBondContact O-CB 3.48Å; R3-C77 PolarHBondContact O-N 2.86Å; R3-C77 PolarHBondContact O-SG 2.77Å; R3-C77 VanDerWaalsContact O-SG 3.38Å
4	L	89.4	Confident	83.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	150.2	176.1	-56.2	-178	0	0	0	111.6	F46 V47 F49 A55 A58 L59 V74 E75 M76	L4-F46 WeakPolarHBondContact O-CA 3.49Å; L4-V47 PolarHBondContact N-O 2.68Å; L4-V47 PolarHBondContact O-N 3.26Å; L4-F49 HydrophobicContact CD1-CD2 4.4Å; L4-F49 HydrophobicContact CD1-CE2 3.87Å; L4-F49 HydrophobicContact CG-CE2 4.45Å; L4-A55 WeakPolarHBondContact CD1-O 3.18Å; L4-A55 HydrophobicContact CD2-CB 4.14Å; L4-A55 HydrophobicContact CG-CB 4.2Å; L4-A58 HydrophobicContact CD1-CB 3.96Å; L4-L59 HydrophobicContact CD1-CB 4.42Å; L4-L59 HydrophobicContact CD2-CB 4.15Å; L4-V74 HydrophobicContact CB-CG1 4.11Å; L4-V74 HydrophobicContact CD1-CG1 3.83Å; L4-V74 HydrophobicContact CD2-CG1 4.47Å; L4-V74 HydrophobicContact CG-CG1 4.37Å; L4-E75 WeakPolarHBondContact CA-O 3.35Å; L4-M76 HydrophobicContact CD2-SD 3.5Å; L4-M76 VanDerWaalsContact CD2-SD 3.5Å
5	I	91.3	Very high	84	Confident	25 Å²	25	56.3 Å²	56.3	13%	0.128	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132	162.7	-174.9	176.5	0	0	0	108.6	K7 F44 F46 V74 E75	I5-K7 HydrophobicContact CD1-CG 4.41Å; I5-K7 HydrophobicContact CG1-CG 4.31Å; I5-F44 HydrophobicContact CD1-CD2 4.23Å; I5-F46 HydrophobicContact CB-CD1 3.93Å; I5-F46 HydrophobicContact CB-CE1 3.88Å; I5-F46 HydrophobicContact CD1-CE1 3.74Å; I5-F46 HydrophobicContact CD1-CZ 3.99Å; I5-F46 HydrophobicContact CG1-CD1 4.06Å; I5-F46 HydrophobicContact CG1-CE1 3.79Å; I5-F46 HydrophobicContact CG1-CZ 4.35Å; I5-V74 WeakPolarHBondContact O-CA 3.47Å; I5-E75 HydrophobicContact CG2-CB 3.78Å; I5-E75 PolarHBondContact N-O 2.78Å; I5-E75 PolarHBondContact O-N 2.87Å
6	V	90.2	Very high	84.1	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.9	177.8	-173.3	0	0	0	0	108.2	L9 F18 F22 F44 G45 V47 V72 T73 V74	V6-L9 HydrophobicContact CG1-CD1 4.4Å; V6-L9 HydrophobicContact CG1-CD2 3.69Å; V6-L9 HydrophobicContact CG1-CG 4.07Å; V6-F18 HydrophobicContact CB-CE2 4.06Å; V6-F18 HydrophobicContact CB-CZ 4.05Å; V6-F18 HydrophobicContact CG1-CE2 4.21Å; V6-F18 HydrophobicContact CG2-CE2 4.08Å; V6-F18 HydrophobicContact CG2-CZ 3.93Å; V6-F22 HydrophobicContact CG1-CZ 4.49Å; V6-F22 HydrophobicContact CG2-CE1 4.26Å; V6-F22 HydrophobicContact CG2-CE2 4.06Å; V6-F22 HydrophobicContact CG2-CZ 3.59Å; V6-F44 CarbonylContact O-C 3.6Å; V6-F44 WeakPolarHBondContact O-CA 3.2Å; V6-F44 VanDerWaalsContact O-CB 3.28Å; V6-F44 WeakPolarHBondContact O-CB 3.47Å; V6-G45 PolarHBondContact N-O 3.49Å; V6-G45 PolarHBondContact O-N 2.84Å; V6-V47 HydrophobicContact CG2-CG2 4.34Å; V6-V72 HydrophobicContact CG1-CB 4.28Å; V6-V72 HydrophobicContact CG1-CG1 4.5Å; V6-T73 WeakPolarHBondContact CA-O 3.33Å; V6-V74 HydrophobicContact CG1-CG2 4.16Å; V6-V74 HydrophobicContact CG2-CG1 4.33Å; V6-V74 HydrophobicContact CG2-CG2 4.18Å
7	K	90.3	Very high	84.2	Confident	69 Å²	69	65.5 Å²	65.5	30%	0.3	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	159	-177.1	-48.7	171.1	-170.8	168.6	0	111.1	I5 K43 F44 V72 T73 E75	I5-K7 HydrophobicContact CD1-CG 4.41Å; I5-K7 HydrophobicContact CG1-CG 4.31Å; K7-K43 CarbonylContact C-O 3.53Å; K7-F44 HydrophobicContact CB-CB 4.49Å; K7-F44 HydrophobicContact CG-CB 4.44Å; K7-V72 WeakPolarHBondContact O-CA 3.48Å; K7-T73 PolarHBondContact N-O 3.43Å; K7-T73 PolarHBondContact O-N 2.8Å; K7-E75 WeakPolarHBondContact CE-OE2 3.25Å; K7-E75 IonicContact NZ-OE1 3.06Å; K7-E75 PolarHBondContact NZ-OE1 3.04Å; K7-E75 IonicContact NZ-OE2 2.7Å; K7-E75 PolarHBondContact NZ-OE2 2.85Å
8	N	87.1	Confident	84.5	Confident	73 Å²	73	61.9 Å²	61.9	39%	0.39	31%	0.313	S	S	.	.	S	Bend	trans	61.1	45	-176.1	-160.9	45.7	0	0	0	113.6	K43 S70 R71	N8-K43 WeakPolarHBondContact CA-O 3.3Å; N8-K43 PolarHBondContact N-O 3.47Å; N8-S70 WeakPolarHBondContact O-CB 3.49Å; N8-R71 PolarHBondContact ND2-O 3.44Å
9	L	87.4	Confident	84.7	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	32%	0.322	C	S	.	.			trans	-73.7	145.9	172	-68.2	170.7	0	0	0	111.3	V6 L13 F18 L33 F41 K43 V72	V6-L9 HydrophobicContact CG1-CD1 4.4Å; V6-L9 HydrophobicContact CG1-CD2 3.69Å; V6-L9 HydrophobicContact CG1-CG 4.07Å; L9-L13 HydrophobicContact CD2-CD2 3.84Å; L9-F18 HydrophobicContact CD1-CD2 4.2Å; L9-F18 HydrophobicContact CD1-CE2 3.73Å; L9-F18 HydrophobicContact CD1-CZ 4.18Å; L9-F18 HydrophobicContact CD2-CD2 4.22Å; L9-F18 HydrophobicContact CD2-CE2 3.96Å; L9-L33 HydrophobicContact CD1-CD2 3.84Å; L9-F41 HydrophobicContact CB-CE1 3.88Å; L9-F41 HydrophobicContact CB-CZ 3.81Å; L9-F41 HydrophobicContact CD1-CZ 4.02Å; L9-K43 PolarHBondContact N-O 2.69Å; L9-K43 WeakPolarHBondContact O-CB 3.3Å; L9-K43 WeakPolarHBondContact O-CG 3.27Å; L9-V72 HydrophobicContact CD2-CG1 3.91Å
10	P	84.8	Confident	84.9	Confident	9 Å²	9	66.3 Å²	66.3	6%	0.058	34%	0.335	C	S	.	.			trans	-67.8	150.8	-179.8	26.4	-32.5	0	0	0	112.5	G12 L13 F41 V67 D68	P10-G12 PolarHBondContact O-N 2.97Å; P10-L13 HydrophobicContact CG-CB 4.34Å; P10-F41 WeakPolarHBondContact O-CE1 3.38Å; P10-V67 HydrophobicContact CG-CG1 4.28Å; P10-D68 HydrophobicContact CG-CB 4.28Å
11	N	77.4	Confident	84.9	Confident	119 Å²	119	65.1 Å²	65.1	64%	0.636	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	114.2	174.9	-75.9	-7.6	0	0	0	109.6	K43	N11-K43 WeakPolarHBondContact OD1-CE 3.43Å
12	G	75.4	Confident	86.1	Confident	71 Å²	71	59.8 Å²	59.8	73%	0.732	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.1	-5.3	178.9	0	0	0	0	0	115	P10 K14	P10-G12 PolarHBondContact O-N 2.97Å; G12-K14 PolarHBondContact O-N 3.35Å; G12-K14 VanDerWaalsContact O-N 3.17Å
13	L	80.8	Confident	86.3	Confident	11 Å²	11	60.5 Å²	60.5	6%	0.058	31%	0.311	C	S	.	.			trans	-66.4	113.8	177.3	-171.1	66.5	0	0	0	111.6	L9 P10 R17 F18 M21 L33	L9-L13 HydrophobicContact CD2-CD2 3.84Å; P10-L13 HydrophobicContact CG-CB 4.34Å; L13-R17 HydrophobicContact CD1-CB 4.15Å; L13-R17 HydrophobicContact CD1-CG 3.98Å; L13-F18 HydrophobicContact CD2-CB 4.06Å; L13-F18 HydrophobicContact CD2-CD2 3.87Å; L13-F18 HydrophobicContact CD2-CG 4.37Å; L13-F18 HydrophobicContact CG-CB 4.33Å; L13-M21 HydrophobicContact CD1-CE 4.07Å; L13-M21 HydrophobicContact CD2-CE 3.99Å; L13-L33 WeakPolarHBondContact O-CD1 3.34Å
14	K	86.4	Confident	86.1	Confident	148 Å²	148	60.4 Å²	60.4	64%	0.643	33%	0.328	S	S	*	.			trans	-71.7	150.1	172.1	-65.8	-173.5	179.2	-176.7	0	111.7	G12 E16 R17 F18	G12-K14 PolarHBondContact O-N 3.35Å; G12-K14 VanDerWaalsContact O-N 3.17Å; K14-E16 VanDerWaalsContact C-N 3.3Å; K14-E16 PolarHBondContact O-N 3.03Å; K14-R17 PolarHBondContact O-N 2.85Å; K14-F18 PolarHBondContact O-N 3.2Å
15	E	85.9	Confident	85.7	Confident	78 Å²	78	63.1 Å²	63.1	36%	0.364	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-33.3	-178.4	-168	166.8	115.5	0	0	113.1	F18 R19 C31 S32 L33	E15-F18 WeakPolarHBondContact O-CB 3.34Å; E15-F18 PolarHBondContact O-N 2.82Å; E15-R19 WeakPolarHBondContact O-CB 3.23Å; E15-R19 PolarHBondContact O-N 2.87Å; E15-C31 HydrophobicContact CG-CB 4.34Å; E15-C31 PolarHBondContact OE1-SG 3.09Å; E15-S32 WeakPolarHBondContact OE2-CA 3.41Å; E15-L33 HydrophobicContact CB-CD1 4.03Å; E15-L33 HydrophobicContact CB-CG 4.31Å; E15-L33 HydrophobicContact CG-CG 4.36Å; E15-L33 PolarHBondContact OE2-N 2.94Å; E15-L33 VanDerWaalsContact OE2-N 3.11Å
16	E	86.1	Confident	85.4	Confident	150 Å²	150	62.8 Å²	62.8	70%	0.701	34%	0.342	S	S	*	.	H	α-helix	trans	-59.7	-48.3	175.7	-60.2	160.5	152.9	0	0	111.9	K14 R19 S20	K14-E16 VanDerWaalsContact C-N 3.3Å; K14-E16 PolarHBondContact O-N 3.03Å; E16-R19 PolarHBondContact O-N 3.06Å; E16-S20 WeakPolarHBondContact O-CB 3.46Å; E16-S20 PolarHBondContact O-N 3.26Å
17	R	85.8	Confident	85.3	Confident	120 Å²	120	67 Å²	67	45%	0.453	37%	0.368	S	S	.	.	H	α-helix	trans	-66.7	-39.2	177.3	-173.1	172.8	177.6	-124.2	-1.6	111	L13 K14 S20 M21 D68	L13-R17 HydrophobicContact CD1-CB 4.15Å; L13-R17 HydrophobicContact CD1-CG 3.98Å; K14-R17 PolarHBondContact O-N 2.85Å; R17-S20 PolarHBondContact O-N 3.23Å; R17-M21 WeakPolarHBondContact O-CG 3.14Å; R17-M21 PolarHBondContact O-N 2.85Å; R17-D68 IonicContact CZ-OD1 3.63Å; R17-D68 IonicContact CZ-OD2 3.72Å; R17-D68 VanDerWaalsContact NH1-CG 3.29Å; R17-D68 IonicContact NH1-OD1 2.67Å; R17-D68 PolarHBondContact NH1-OD1 2.67Å; R17-D68 IonicContact NH1-OD2 3.17Å; R17-D68 PolarHBondContact NH1-OD2 3.37Å; R17-D68 IonicContact NH2-OD1 2.7Å; R17-D68 PolarHBondContact NH2-OD1 3.24Å; R17-D68 IonicContact NH2-OD2 2.86Å
18	F	88.6	Confident	85.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.1	-48.9	172.9	-177.1	-116.2	0	0	0	111.6	V6 L9 L13 K14 E15 S20 M21 F22 L33 V47	V6-F18 HydrophobicContact CB-CE2 4.06Å; V6-F18 HydrophobicContact CB-CZ 4.05Å; V6-F18 HydrophobicContact CG1-CE2 4.21Å; V6-F18 HydrophobicContact CG2-CE2 4.08Å; V6-F18 HydrophobicContact CG2-CZ 3.93Å; L9-F18 HydrophobicContact CD1-CD2 4.2Å; L9-F18 HydrophobicContact CD1-CE2 3.73Å; L9-F18 HydrophobicContact CD1-CZ 4.18Å; L9-F18 HydrophobicContact CD2-CD2 4.22Å; L9-F18 HydrophobicContact CD2-CE2 3.96Å; L13-F18 HydrophobicContact CD2-CB 4.06Å; L13-F18 HydrophobicContact CD2-CD2 3.87Å; L13-F18 HydrophobicContact CD2-CG 4.37Å; L13-F18 HydrophobicContact CG-CB 4.33Å; K14-F18 PolarHBondContact O-N 3.2Å; E15-F18 WeakPolarHBondContact O-CB 3.34Å; E15-F18 PolarHBondContact O-N 2.82Å; F18-S20 PolarHBondContact O-N 2.61Å; F18-M21 HydrophobicContact CD2-CE 4.42Å; F18-M21 PolarHBondContact O-N 2.9Å; F18-F22 HydrophobicContact CD2-CD2 4.28Å; F18-F22 AromaticContact CD2-CE2 3.98Å; F18-F22 HydrophobicContact CD2-CE2 3.98Å; F18-F22 HydrophobicContact CE2-CD2 4.12Å; F18-F22 AromaticContact CE2-CE2 3.56Å; F18-F22 HydrophobicContact CE2-CE2 3.56Å; F18-F22 HydrophobicContact CE2-CZ 4.5Å; F18-F22 HydrophobicContact CZ-CD2 4.48Å; F18-F22 HydrophobicContact CZ-CE2 4.16Å; F18-F22 WeakPolarHBondContact O-CD2 3.36Å; F18-L33 HydrophobicContact CB-CD2 4.47Å; F18-L33 HydrophobicContact CD1-CD2 3.71Å; F18-L33 HydrophobicContact CD1-CG 4.33Å; F18-L33 HydrophobicContact CD2-CD2 4.37Å; F18-L33 HydrophobicContact CE1-CD2 3.92Å; F18-L33 HydrophobicContact CG-CD2 3.95Å; F18-L33 HydrophobicContact CZ-CD2 4.34Å; F18-V47 HydrophobicContact CD1-CG2 4.49Å; F18-V47 HydrophobicContact CE1-CG2 3.53Å; F18-V47 HydrophobicContact CE2-CG2 4.4Å; F18-V47 HydrophobicContact CZ-CG2 3.48Å; F18-V47 VanDerWaalsContact CZ-CG2 3.48Å
19	R	88.6	Confident	85.2	Confident	129 Å²	129	65 Å²	65	49%	0.487	36%	0.364	S	S	.	.	H	α-helix	trans	-60.3	-43.7	177.4	-169.2	-178.3	-171.8	172	3.5	112	E15 E16 M21 F22 A23 V28 C31	E15-R19 WeakPolarHBondContact O-CB 3.23Å; E15-R19 PolarHBondContact O-N 2.87Å; E16-R19 PolarHBondContact O-N 3.06Å; R19-M21 PolarHBondContact O-N 3.09Å; R19-F22 PolarHBondContact O-N 2.76Å; R19-A23 WeakPolarHBondContact O-CB 3.21Å; R19-A23 PolarHBondContact O-N 3.21Å; R19-V28 HydrophobicContact CG-CG1 4.21Å; R19-C31 HydrophobicContact CB-CB 4.37Å; R19-C31 HydrophobicContact CG-CB 4.4Å
20	S	88.4	Confident	85	Confident	82 Å²	82	67.6 Å²	67.6	57%	0.573	38%	0.378	S	S	*	.	H	α-helix	trans	-58.7	-46.1	179.6	-173.4	0	0	0	0	112.6	E16 R17 F18 F22 A23	E16-S20 WeakPolarHBondContact O-CB 3.46Å; E16-S20 PolarHBondContact O-N 3.26Å; R17-S20 PolarHBondContact O-N 3.23Å; F18-S20 PolarHBondContact O-N 2.61Å; S20-F22 VanDerWaalsContact C-N 3.29Å; S20-F22 PolarHBondContact O-N 2.87Å; S20-A23 PolarHBondContact O-N 3.18Å
21	M	85.1	Confident	85.1	Confident	42 Å²	42	68.2 Å²	68.2	21%	0.207	38%	0.383	C	S	.	.	H	α-helix	trans	-59	-36.4	178.6	-70.9	-175.3	-66.2	0	0	113.4	L13 R17 F18 R19 F62 V67	L13-M21 HydrophobicContact CD1-CE 4.07Å; L13-M21 HydrophobicContact CD2-CE 3.99Å; R17-M21 WeakPolarHBondContact O-CG 3.14Å; R17-M21 PolarHBondContact O-N 2.85Å; F18-M21 HydrophobicContact CD2-CE 4.42Å; F18-M21 PolarHBondContact O-N 2.9Å; R19-M21 PolarHBondContact O-N 3.09Å; M21-F62 HydrophobicContact CB-CZ 4.25Å; M21-F62 WeakPolarHBondContact O-CZ 3.43Å; M21-V67 HydrophobicContact CE-CG1 3.99Å; M21-V67 HydrophobicContact SD-CG1 4.06Å; M21-V67 HydrophobicContact SD-CG2 4.49Å
22	F	87.3	Confident	85.5	Confident	5 Å²	5	63.8 Å²	63.8	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-87	-25.5	179.4	-74.5	-82.4	0	0	0	113.4	V6 F18 R19 S20 A24 F25 V28 V47 F49 A58 F62	V6-F22 HydrophobicContact CG1-CZ 4.49Å; V6-F22 HydrophobicContact CG2-CE1 4.26Å; V6-F22 HydrophobicContact CG2-CE2 4.06Å; V6-F22 HydrophobicContact CG2-CZ 3.59Å; F18-F22 HydrophobicContact CD2-CD2 4.28Å; F18-F22 AromaticContact CD2-CE2 3.98Å; F18-F22 HydrophobicContact CD2-CE2 3.98Å; F18-F22 HydrophobicContact CE2-CD2 4.12Å; F18-F22 AromaticContact CE2-CE2 3.56Å; F18-F22 HydrophobicContact CE2-CE2 3.56Å; F18-F22 HydrophobicContact CE2-CZ 4.5Å; F18-F22 HydrophobicContact CZ-CD2 4.48Å; F18-F22 HydrophobicContact CZ-CE2 4.16Å; F18-F22 WeakPolarHBondContact O-CD2 3.36Å; R19-F22 PolarHBondContact O-N 2.76Å; S20-F22 VanDerWaalsContact C-N 3.29Å; S20-F22 PolarHBondContact O-N 2.87Å; F22-A24 PolarHBondContact O-N 3.22Å; F22-F25 PolarHBondContact O-N 3Å; F22-F25 VanDerWaalsContact O-N 3.13Å; F22-V28 HydrophobicContact CB-CG2 3.93Å; F22-V47 HydrophobicContact CB-CG1 3.93Å; F22-V47 HydrophobicContact CB-CG2 4.5Å; F22-V47 HydrophobicContact CD1-CG1 4.44Å; F22-V47 HydrophobicContact CD1-CG2 4.39Å; F22-V47 HydrophobicContact CD2-CG2 3.89Å; F22-V47 HydrophobicContact CE2-CG2 4.26Å; F22-V47 HydrophobicContact CG-CG1 4.13Å; F22-V47 HydrophobicContact CG-CG2 3.98Å; F22-F49 HydrophobicContact CB-CZ 3.95Å; F22-F49 HydrophobicContact CD1-CE2 4.28Å; F22-F49 HydrophobicContact CD1-CZ 4.03Å; F22-F49 HydrophobicContact CG-CZ 4.47Å; F22-F49 WeakPolarHBondContact O-CE1 3.45Å; F22-A58 HydrophobicContact CD1-CB 4.15Å; F22-A58 HydrophobicContact CE1-CB 4.45Å; F22-F62 AromaticContact CD1-CD2 3.92Å; F22-F62 HydrophobicContact CD1-CD2 3.92Å; F22-F62 AromaticContact CD1-CE2 3.93Å; F22-F62 HydrophobicContact CD1-CE2 3.93Å; F22-F62 HydrophobicContact CE1-CB 4.29Å; F22-F62 AromaticContact CE1-CD2 3.38Å; F22-F62 HydrophobicContact CE1-CD2 3.38Å; F22-F62 AromaticContact CE1-CE2 3.8Å; F22-F62 HydrophobicContact CE1-CE2 3.8Å; F22-F62 AromaticContact CE1-CG 3.95Å; F22-F62 HydrophobicContact CE1-CG 3.95Å; F22-F62 HydrophobicContact CG-CE2 4.49Å; F22-F62 HydrophobicContact CZ-CB 4.35Å; F22-F62 AromaticContact CZ-CD2 3.88Å; F22-F62 HydrophobicContact CZ-CD2 3.88Å; F22-F62 HydrophobicContact CZ-CE2 4.25Å; F22-F62 HydrophobicContact CZ-CG 4.04Å
23	A	86.9	Confident	86.2	Confident	53 Å²	53	60.9 Å²	60.9	44%	0.438	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-25.6	176.3	0	0	0	0	0	113.5	R19 S20 F25 G26 V28	R19-A23 WeakPolarHBondContact O-CB 3.21Å; R19-A23 PolarHBondContact O-N 3.21Å; S20-A23 PolarHBondContact O-N 3.18Å; A23-F25 PolarHBondContact O-N 3.09Å; A23-G26 PolarHBondContact O-N 2.88Å; A23-V28 HydrophobicContact CB-CG2 4.48Å
24	A	84.5	Confident	86.5	Confident	82 Å²	82	64 Å²	64	68%	0.678	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.2	174.6	0	0	0	0	0	114.3	F22	F22-A24 PolarHBondContact O-N 3.22Å
25	F	82.1	Confident	86.5	Confident	56 Å²	56	62.2 Å²	62.2	25%	0.246	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-5	-175.3	-66	-92.5	0	0	0	114.1	F22 A23 A58 H61 F62	F22-F25 PolarHBondContact O-N 3Å; F22-F25 VanDerWaalsContact O-N 3.13Å; A23-F25 PolarHBondContact O-N 3.09Å; F25-A58 HydrophobicContact CB-CB 4.03Å; F25-A58 HydrophobicContact CG-CB 4.39Å; F25-H61 HydrophobicContact CE1-CB 3.82Å; F25-H61 AromaticContact CE1-CD2 3.96Å; F25-H61 AromaticContact CE1-CG 3.64Å; F25-H61 AromaticContact CE1-ND1 3.98Å; F25-H61 HydrophobicContact CZ-CB 4.14Å; F25-H61 AromaticContact CZ-CD2 3.96Å; F25-H61 AromaticContact CZ-CE1 3.72Å; F25-H61 AromaticContact CZ-CG 3.57Å; F25-H61 AromaticContact CZ-ND1 3.41Å; F25-H61 WeakPolarHBondContact CZ-ND1 3.13Å; F25-F62 AromaticContact CD2-CE2 3.58Å; F25-F62 HydrophobicContact CD2-CE2 3.58Å; F25-F62 HydrophobicContact CD2-CZ 4.22Å; F25-F62 HydrophobicContact CE2-CD2 4.38Å; F25-F62 AromaticContact CE2-CE2 3.36Å; F25-F62 HydrophobicContact CE2-CE2 3.36Å; F25-F62 AromaticContact CE2-CZ 3.64Å; F25-F62 HydrophobicContact CE2-CZ 3.64Å; F25-F62 HydrophobicContact CG-CE2 4.49Å; F25-F62 HydrophobicContact CZ-CE2 4.12Å; F25-F62 HydrophobicContact CZ-CZ 4.4Å
26	G	84.7	Confident	86.4	Confident	18 Å²	18	61 Å²	61	19%	0.186	33%	0.332	C	S	.	.	S	Bend	trans	159.5	173	-178.6	0	0	0	0	0	113.2	A23 V28 D54	A23-G26 PolarHBondContact O-N 2.88Å; G26-V28 PolarHBondContact O-N 3.47Å; G26-V28 VanDerWaalsContact O-N 3.1Å; G26-D54 WeakPolarHBondContact CA-OD2 3.18Å
27	T	86.9	Confident	86	Confident	90 Å²	90	63.9 Å²	63.9	55%	0.552	34%	0.343	S	S	*	.			trans	-74	105.4	-178.7	-47.9	0	0	0	0	111	T29 K50	T27-T29 PolarHBondContact O-N 3.04Å; T27-K50 PolarHBondContact O-N 3.44Å
28	V	88.8	Confident	85.3	Confident	12 Å²	12	65.3 Å²	65.3	7%	0.073	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.9	176.3	175.9	0	0	0	0	110.8	R19 F22 A23 G26 D30 C31 V47 G48 F49	R19-V28 HydrophobicContact CG-CG1 4.21Å; F22-V28 HydrophobicContact CB-CG2 3.93Å; A23-V28 HydrophobicContact CB-CG2 4.48Å; G26-V28 PolarHBondContact O-N 3.47Å; G26-V28 VanDerWaalsContact O-N 3.1Å; V28-D30 WeakPolarHBondContact CG1-O 3.34Å; V28-C31 HydrophobicContact CG1-CB 4.42Å; V28-V47 HydrophobicContact CG1-CG1 3.94Å; V28-V47 HydrophobicContact CG2-CG1 4.02Å; V28-G48 CarbonylContact C-O 3.58Å; V28-G48 WeakPolarHBondContact CA-O 3.35Å; V28-F49 HydrophobicContact CG2-CD1 4.3Å; V28-F49 HydrophobicContact CG2-CE1 3.86Å; V28-F49 HydrophobicContact CG2-CZ 4.22Å
29	T	86.4	Confident	84.7	Confident	87 Å²	87	68 Å²	68	53%	0.534	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-28.7	-177.8	49.6	0	0	0	0	113.7	T27 G48 K50	T27-T29 PolarHBondContact O-N 3.04Å; T29-G48 PolarHBondContact N-O 3.36Å; T29-G48 PolarHBondContact OG1-O 3.43Å; T29-K50 HydrophobicContact CG2-CB 3.9Å
30	D	83.5	Confident	84.4	Confident	57 Å²	57	69.3 Å²	69.3	31%	0.305	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	133	-179.7	176.9	-30.9	0	0	0	108	R3 V28 V47 G48	R3-D30 IonicContact CZ-OD2 2.76Å; R3-D30 IonicContact NH1-OD2 3.29Å; R3-D30 PolarHBondContact NH1-OD2 3.22Å; R3-D30 IonicContact NH2-OD1 2.73Å; R3-D30 PolarHBondContact NH2-OD1 3.21Å; R3-D30 VanDerWaalsContact NH2-OD1 3.08Å; R3-D30 IonicContact NH2-OD2 3.8Å; R3-D30 PolarHBondContact NH2-OD2 3.48Å; V28-D30 WeakPolarHBondContact CG1-O 3.34Å; D30-V47 CarbonylContact O-C 3.54Å; D30-V47 WeakPolarHBondContact O-CA 3.41Å; D30-G48 PolarHBondContact O-N 3.27Å
31	C	88.2	Confident	84.2	Confident	22 Å²	22	67 Å²	67	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	136.9	164.6	54.6	0	0	0	0	108.1	E15 R19 V28 F46	E15-C31 HydrophobicContact CG-CB 4.34Å; E15-C31 PolarHBondContact OE1-SG 3.09Å; R19-C31 HydrophobicContact CB-CB 4.37Å; R19-C31 HydrophobicContact CG-CB 4.4Å; V28-C31 HydrophobicContact CG1-CB 4.42Å; C31-F46 WeakPolarHBondContact CA-O 3.44Å
32	S	84.9	Confident	84.1	Confident	27 Å²	27	71.5 Å²	71.5	19%	0.189	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	113.3	176	-170.3	0	0	0	0	112.3	E15 K34 G45 F46	E15-S32 WeakPolarHBondContact OE2-CA 3.41Å; S32-K34 PolarHBondContact OG-NZ 3.29Å; S32-G45 CarbonylContact O-C 3.59Å; S32-G45 VanDerWaalsContact O-CA 3.24Å; S32-G45 WeakPolarHBondContact O-CA 3.38Å; S32-F46 PolarHBondContact N-O 2.94Å; S32-F46 PolarHBondContact O-N 3.2Å
33	L	89.4	Confident	84.1	Confident	10 Å²	10	75.2 Å²	75.2	5%	0.052	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	141.6	169.2	-64.1	-177.8	0	0	0	110.7	L9 L13 E15 F18 F35 F41	L9-L33 HydrophobicContact CD1-CD2 3.84Å; L13-L33 WeakPolarHBondContact O-CD1 3.34Å; E15-L33 HydrophobicContact CB-CD1 4.03Å; E15-L33 HydrophobicContact CB-CG 4.31Å; E15-L33 HydrophobicContact CG-CG 4.36Å; E15-L33 PolarHBondContact OE2-N 2.94Å; E15-L33 VanDerWaalsContact OE2-N 3.11Å; F18-L33 HydrophobicContact CB-CD2 4.47Å; F18-L33 HydrophobicContact CD1-CD2 3.71Å; F18-L33 HydrophobicContact CD1-CG 4.33Å; F18-L33 HydrophobicContact CD2-CD2 4.37Å; F18-L33 HydrophobicContact CE1-CD2 3.92Å; F18-L33 HydrophobicContact CG-CD2 3.95Å; F18-L33 HydrophobicContact CZ-CD2 4.34Å; L33-F35 HydrophobicContact CB-CE2 3.85Å; L33-F35 HydrophobicContact CB-CZ 4.23Å; L33-F41 HydrophobicContact CB-CE2 3.97Å; L33-F41 HydrophobicContact CD1-CE2 4.49Å; L33-F41 HydrophobicContact CD2-CE2 4.13Å; L33-F41 HydrophobicContact CD2-CZ 4.18Å; L33-F41 HydrophobicContact CG-CE2 4.42Å
34	K	87.8	Confident	84.2	Confident	77 Å²	77	74.7 Å²	74.7	34%	0.335	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.3	-178.4	-62.4	-49.9	-174	-162.5	0	113.3	S32 F41 R42 F44 F46	S32-K34 PolarHBondContact OG-NZ 3.29Å; K34-F41 WeakPolarHBondContact O-CD2 3.21Å; K34-R42 VanDerWaalsContact O-CB 3.31Å; K34-R42 WeakPolarHBondContact O-CB 3.41Å; K34-R42 PolarHBondContact O-N 2.83Å; K34-F44 HydrophobicContact CB-CD2 4.25Å; K34-F44 HydrophobicContact CB-CE2 3.78Å; K34-F44 HydrophobicContact CB-CZ 4.02Å; K34-F44 HydrophobicContact CG-CD2 4.3Å; K34-F44 HydrophobicContact CG-CE2 3.75Å; K34-F44 HydrophobicContact CG-CZ 4.38Å; K34-F44 PolarHBondContact N-O 3.48Å; K34-F44 VanDerWaalsContact N-O 3.12Å; K34-F46 HydrophobicContact CG-CD2 4.17Å; K34-F46 HydrophobicContact CG-CE2 3.92Å
35	F	85.8	Confident	84.5	Confident	110 Å²	110	70.8 Å²	70.8	48%	0.482	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	167.8	179.5	-57.5	-95.9	0	0	0	110	L33 G39 K40 F41 R42	L33-F35 HydrophobicContact CB-CE2 3.85Å; L33-F35 HydrophobicContact CB-CZ 4.23Å; F35-G39 WeakPolarHBondContact CD1-O 3.23Å; F35-K40 CarbonylContact C-O 3.59Å; F35-K40 VanDerWaalsContact CA-O 3.27Å; F35-K40 WeakPolarHBondContact CA-O 3.44Å; F35-F41 HydrophobicContact CD1-CB 3.87Å; F35-F41 HydrophobicContact CD1-CD2 4.17Å; F35-F41 HydrophobicContact CE1-CB 3.77Å; F35-F41 AromaticContact CE1-CD2 3.84Å; F35-F41 HydrophobicContact CE1-CD2 3.84Å; F35-F41 HydrophobicContact CE1-CG 4.16Å; F35-F41 HydrophobicContact CZ-CD2 4.04Å; F35-R42 VanDerWaalsContact O-CD 3.22Å; F35-R42 WeakPolarHBondContact O-CD 3.38Å
36	T	83.9	Confident	85	Confident	52 Å²	52	70.3 Å²	70.3	32%	0.319	36%	0.355	S	S	.	.			trans	-85.3	175.1	169.6	68.9	0	0	0	0	110.8	E38 G39 K40 R42	T36-E38 WeakPolarHBondContact CB-OE2 3.27Å; T36-E38 PolarHBondContact O-N 3.49Å; T36-E38 PolarHBondContact OG1-N 3Å; T36-E38 PolarHBondContact OG1-OE2 3.21Å; T36-G39 PolarHBondContact O-N 2.87Å; T36-G39 VanDerWaalsContact O-N 3.12Å; T36-K40 HydrophobicContact CG2-CB 4.45Å; T36-K40 PolarHBondContact N-O 2.94Å; T36-K40 PolarHBondContact OG1-N 3.35Å; T36-R42 HydrophobicContact CG2-CG 3.62Å
37	K	78.3	Confident	85.3	Confident	211 Å²	211	69.5 Å²	69.5	92%	0.917	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.9	176.5	-69.6	-171.8	176.1	-171.9	0	112.1	G39	K37-G39 VanDerWaalsContact C-N 3.32Å
38	E	71.1	Confident	85.5	Confident	150 Å²	150	65.4 Å²	65.4	70%	0.701	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	17.5	179.4	-40.5	71.1	-151.5	0	0	112	T36 K40	T36-E38 WeakPolarHBondContact CB-OE2 3.27Å; T36-E38 PolarHBondContact O-N 3.49Å; T36-E38 PolarHBondContact OG1-N 3Å; T36-E38 PolarHBondContact OG1-OE2 3.21Å; E38-K40 VanDerWaalsContact C-N 3.26Å; E38-K40 PolarHBondContact O-N 3.42Å
39	G	76.6	Confident	85.6	Confident	55 Å²	55	65 Å²	65	57%	0.567	32%	0.319	S	S	*	.	S	Bend	trans	75.1	-0.4	175.6	0	0	0	0	0	116.1	F35 T36 K37	F35-G39 WeakPolarHBondContact CD1-O 3.23Å; T36-G39 PolarHBondContact O-N 2.87Å; T36-G39 VanDerWaalsContact O-N 3.12Å; K37-G39 VanDerWaalsContact C-N 3.32Å
40	K	82.6	Confident	85.7	Confident	157 Å²	157	68.6 Å²	68.6	68%	0.683	33%	0.327	S	S	*	.			trans	-76.6	128.6	-176.8	-167.1	168.4	-175	169.2	0	111.4	F35 T36 E38 R42	F35-K40 CarbonylContact C-O 3.59Å; F35-K40 VanDerWaalsContact CA-O 3.27Å; F35-K40 WeakPolarHBondContact CA-O 3.44Å; T36-K40 HydrophobicContact CG2-CB 4.45Å; T36-K40 PolarHBondContact N-O 2.94Å; T36-K40 PolarHBondContact OG1-N 3.35Å; E38-K40 VanDerWaalsContact C-N 3.26Å; E38-K40 PolarHBondContact O-N 3.42Å; K40-R42 PolarHBondContact O-N 2.83Å
41	F	83.4	Confident	86	Confident	33 Å²	33	67.7 Å²	67.7	15%	0.145	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	132.8	178.8	-178.4	-132	0	0	0	111.7	L9 P10 L33 K34 F35 K43	L9-F41 HydrophobicContact CB-CE1 3.88Å; L9-F41 HydrophobicContact CB-CZ 3.81Å; L9-F41 HydrophobicContact CD1-CZ 4.02Å; P10-F41 WeakPolarHBondContact O-CE1 3.38Å; L33-F41 HydrophobicContact CB-CE2 3.97Å; L33-F41 HydrophobicContact CD1-CE2 4.49Å; L33-F41 HydrophobicContact CD2-CE2 4.13Å; L33-F41 HydrophobicContact CD2-CZ 4.18Å; L33-F41 HydrophobicContact CG-CE2 4.42Å; K34-F41 WeakPolarHBondContact O-CD2 3.21Å; F35-F41 HydrophobicContact CD1-CB 3.87Å; F35-F41 HydrophobicContact CD1-CD2 4.17Å; F35-F41 HydrophobicContact CE1-CB 3.77Å; F35-F41 AromaticContact CE1-CD2 3.84Å; F35-F41 HydrophobicContact CE1-CD2 3.84Å; F35-F41 HydrophobicContact CE1-CG 4.16Å; F35-F41 HydrophobicContact CZ-CD2 4.04Å; F41-K43 VanDerWaalsContact C-N 3.34Å; F41-K43 HydrophobicContact CD1-CG 4.42Å; F41-K43 PolarHBondContact O-N 2.93Å
42	R	83.1	Confident	85.9	Confident	137 Å²	137	71.2 Å²	71.2	52%	0.517	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	8.7	-175.3	-62	179	66	179.1	-0.6	114	K34 F35 T36 K40 F44	K34-R42 VanDerWaalsContact O-CB 3.31Å; K34-R42 WeakPolarHBondContact O-CB 3.41Å; K34-R42 PolarHBondContact O-N 2.83Å; F35-R42 VanDerWaalsContact O-CD 3.22Å; F35-R42 WeakPolarHBondContact O-CD 3.38Å; T36-R42 HydrophobicContact CG2-CG 3.62Å; K40-R42 PolarHBondContact O-N 2.83Å; R42-F44 HydrophobicContact CB-CD1 3.83Å; R42-F44 HydrophobicContact CB-CE1 3.63Å; R42-F44 HydrophobicContact CB-CZ 4.47Å; R42-F44 WeakPolarHBondContact O-CD1 3.4Å; R42-F44 PolarHBondContact O-N 2.99Å
43	K	86.7	Confident	86	Confident	83 Å²	83	76.6 Å²	76.6	36%	0.361	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.4	24.9	-177.1	-59.2	-168.9	172.1	-169.9	0	115	K7 N8 L9 N11 F41	K7-K43 CarbonylContact C-O 3.53Å; N8-K43 WeakPolarHBondContact CA-O 3.3Å; N8-K43 PolarHBondContact N-O 3.47Å; L9-K43 PolarHBondContact N-O 2.69Å; L9-K43 WeakPolarHBondContact O-CB 3.3Å; L9-K43 WeakPolarHBondContact O-CG 3.27Å; N11-K43 WeakPolarHBondContact OD1-CE 3.43Å; F41-K43 VanDerWaalsContact C-N 3.34Å; F41-K43 HydrophobicContact CD1-CG 4.42Å; F41-K43 PolarHBondContact O-N 2.93Å
44	F	90.1	Very high	86	Confident	43 Å²	43	77 Å²	77	19%	0.189	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	156.3	170.4	72.9	-95.9	0	0	0	112.3	I5 V6 K7 K34 R42 F46	I5-F44 HydrophobicContact CD1-CD2 4.23Å; V6-F44 CarbonylContact O-C 3.6Å; V6-F44 WeakPolarHBondContact O-CA 3.2Å; V6-F44 VanDerWaalsContact O-CB 3.28Å; V6-F44 WeakPolarHBondContact O-CB 3.47Å; K7-F44 HydrophobicContact CB-CB 4.49Å; K7-F44 HydrophobicContact CG-CB 4.44Å; K34-F44 HydrophobicContact CB-CD2 4.25Å; K34-F44 HydrophobicContact CB-CE2 3.78Å; K34-F44 HydrophobicContact CB-CZ 4.02Å; K34-F44 HydrophobicContact CG-CD2 4.3Å; K34-F44 HydrophobicContact CG-CE2 3.75Å; K34-F44 HydrophobicContact CG-CZ 4.38Å; K34-F44 PolarHBondContact N-O 3.48Å; K34-F44 VanDerWaalsContact N-O 3.12Å; R42-F44 HydrophobicContact CB-CD1 3.83Å; R42-F44 HydrophobicContact CB-CE1 3.63Å; R42-F44 HydrophobicContact CB-CZ 4.47Å; R42-F44 WeakPolarHBondContact O-CD1 3.4Å; R42-F44 PolarHBondContact O-N 2.99Å; F44-F46 HydrophobicContact CD2-CE2 4.3Å; F44-F46 AromaticContact CE2-CE2 3.95Å; F44-F46 HydrophobicContact CE2-CE2 3.95Å; F44-F46 HydrophobicContact CE2-CZ 4.23Å
45	G	90.2	Very high	86	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	171.1	178.3	0	0	0	0	0	111.9	V6 S32	V6-G45 PolarHBondContact N-O 3.49Å; V6-G45 PolarHBondContact O-N 2.84Å; S32-G45 CarbonylContact O-C 3.59Å; S32-G45 VanDerWaalsContact O-CA 3.24Å; S32-G45 WeakPolarHBondContact O-CA 3.38Å
46	F	92.3	Very high	86	Confident	46 Å²	46	70.6 Å²	70.6	20%	0.202	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	147.4	177.7	-62.9	-83.6	0	0	0	110.9	L4 I5 C31 S32 K34 F44	L4-F46 WeakPolarHBondContact O-CA 3.49Å; I5-F46 HydrophobicContact CB-CD1 3.93Å; I5-F46 HydrophobicContact CB-CE1 3.88Å; I5-F46 HydrophobicContact CD1-CE1 3.74Å; I5-F46 HydrophobicContact CD1-CZ 3.99Å; I5-F46 HydrophobicContact CG1-CD1 4.06Å; I5-F46 HydrophobicContact CG1-CE1 3.79Å; I5-F46 HydrophobicContact CG1-CZ 4.35Å; C31-F46 WeakPolarHBondContact CA-O 3.44Å; S32-F46 PolarHBondContact N-O 2.94Å; S32-F46 PolarHBondContact O-N 3.2Å; K34-F46 HydrophobicContact CG-CD2 4.17Å; K34-F46 HydrophobicContact CG-CE2 3.92Å; F44-F46 HydrophobicContact CD2-CE2 4.3Å; F44-F46 AromaticContact CE2-CE2 3.95Å; F44-F46 HydrophobicContact CE2-CE2 3.95Å; F44-F46 HydrophobicContact CE2-CZ 4.23Å
47	V	91.5	Very high	86.2	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.006	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	123	174.1	-174.7	0	0	0	0	108.6	R3 L4 V6 F18 F22 V28 D30 F49	R3-V47 CarbonylContact C-O 3.59Å; R3-V47 WeakPolarHBondContact CA-O 3.48Å; R3-V47 WeakPolarHBondContact CG-O 3.46Å; L4-V47 PolarHBondContact N-O 2.68Å; L4-V47 PolarHBondContact O-N 3.26Å; V6-V47 HydrophobicContact CG2-CG2 4.34Å; F18-V47 HydrophobicContact CD1-CG2 4.49Å; F18-V47 HydrophobicContact CE1-CG2 3.53Å; F18-V47 HydrophobicContact CE2-CG2 4.4Å; F18-V47 HydrophobicContact CZ-CG2 3.48Å; F18-V47 VanDerWaalsContact CZ-CG2 3.48Å; F22-V47 HydrophobicContact CB-CG1 3.93Å; F22-V47 HydrophobicContact CB-CG2 4.5Å; F22-V47 HydrophobicContact CD1-CG1 4.44Å; F22-V47 HydrophobicContact CD1-CG2 4.39Å; F22-V47 HydrophobicContact CD2-CG2 3.89Å; F22-V47 HydrophobicContact CE2-CG2 4.26Å; F22-V47 HydrophobicContact CG-CG1 4.13Å; F22-V47 HydrophobicContact CG-CG2 3.98Å; V28-V47 HydrophobicContact CG1-CG1 3.94Å; V28-V47 HydrophobicContact CG2-CG1 4.02Å; D30-V47 CarbonylContact O-C 3.54Å; D30-V47 WeakPolarHBondContact O-CA 3.41Å; V47-F49 HydrophobicContact CB-CE2 4.45Å; V47-F49 HydrophobicContact CG1-CD2 4.1Å; V47-F49 HydrophobicContact CG1-CE2 3.63Å; V47-F49 HydrophobicContact CG1-CZ 4.08Å
48	G	90.1	Very high	86.7	Confident	4 Å²	4	65 Å²	65	4%	0.041	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137.4	167.5	0	0	0	0	0	110.6	V28 T29 D30	V28-G48 CarbonylContact C-O 3.58Å; V28-G48 WeakPolarHBondContact CA-O 3.35Å; T29-G48 PolarHBondContact N-O 3.36Å; T29-G48 PolarHBondContact OG1-O 3.43Å; D30-G48 PolarHBondContact O-N 3.27Å
49	F	91.4	Very high	87.6	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.009	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	155.4	170.2	-75.3	-87.6	0	0	0	111.4	S2 L4 F22 V28 V47 S51 D54 A55 A58	S2-F49 VanDerWaalsContact CB-O 3.28Å; S2-F49 WeakPolarHBondContact CB-O 3.41Å; S2-F49 PolarHBondContact O-N 3.37Å; S2-F49 PolarHBondContact OG-O 3.11Å; L4-F49 HydrophobicContact CD1-CD2 4.4Å; L4-F49 HydrophobicContact CD1-CE2 3.87Å; L4-F49 HydrophobicContact CG-CE2 4.45Å; F22-F49 HydrophobicContact CB-CZ 3.95Å; F22-F49 HydrophobicContact CD1-CE2 4.28Å; F22-F49 HydrophobicContact CD1-CZ 4.03Å; F22-F49 HydrophobicContact CG-CZ 4.47Å; F22-F49 WeakPolarHBondContact O-CE1 3.45Å; V28-F49 HydrophobicContact CG2-CD1 4.3Å; V28-F49 HydrophobicContact CG2-CE1 3.86Å; V28-F49 HydrophobicContact CG2-CZ 4.22Å; V47-F49 HydrophobicContact CB-CE2 4.45Å; V47-F49 HydrophobicContact CG1-CD2 4.1Å; V47-F49 HydrophobicContact CG1-CE2 3.63Å; V47-F49 HydrophobicContact CG1-CZ 4.08Å; F49-S51 VanDerWaalsContact CB-O 3.31Å; F49-S51 WeakPolarHBondContact CB-O 3.33Å; F49-D54 HydrophobicContact CB-CB 4.02Å; F49-D54 HydrophobicContact CD1-CB 3.6Å; F49-D54 HydrophobicContact CE1-CB 4.28Å; F49-D54 HydrophobicContact CG-CB 3.95Å; F49-A55 HydrophobicContact CB-CB 4.24Å; F49-A55 HydrophobicContact CD2-CB 3.87Å; F49-A55 HydrophobicContact CG-CB 4.33Å; F49-A58 HydrophobicContact CE2-CB 3.84Å; F49-A58 HydrophobicContact CZ-CB 3.66Å
50	K	88.7	Confident	88.1	Confident	163 Å²	163	66.3 Å²	66.3	71%	0.709	30%	0.299	S	S	*	.	S	Bend	trans	-69.6	-35.4	173.1	-170.7	177.1	177.8	-176	0	112.5	T27 T29	T27-K50 PolarHBondContact O-N 3.44Å; T29-K50 HydrophobicContact CG2-CB 3.9Å
51	S	89.1	Confident	88.3	Confident	39 Å²	39	64.2 Å²	64.2	27%	0.273	29%	0.292	S	S	.	.	S	Bend	trans	-110.9	149.3	172.6	-176.9	0	0	0	0	111.8	S2 F49 E53 A55	S2-S51 WeakPolarHBondContact CB-O 3.27Å; F49-S51 VanDerWaalsContact CB-O 3.31Å; F49-S51 WeakPolarHBondContact CB-O 3.33Å; S51-E53 VanDerWaalsContact C-N 3.31Å; S51-E53 PolarHBondContact OG-N 3.13Å; S51-A55 PolarHBondContact O-N 2.77Å
52	E	87.3	Confident	88.4	Confident	96 Å²	96	63.6 Å²	63.6	45%	0.449	29%	0.289	S	S	.	.	H	α-helix	trans	-75.4	-23.4	170.8	-176.2	151	-172.7	0	0	112.5	M1 S56	M1-E52 PolarHBondContact N-OE1 3.41Å; M1-E52 PolarHBondContact N-OE2 2.97Å; E52-S56 WeakPolarHBondContact O-CB 3.39Å; E52-S56 PolarHBondContact O-N 2.89Å; E52-S56 PolarHBondContact O-OG 3.35Å
53	E	87.1	Confident	88.7	Confident	140 Å²	140	60.3 Å²	60.3	65%	0.654	28%	0.282	S	S	*	.	H	α-helix	trans	-68.6	-41.4	172.5	-59.7	173.5	171.4	0	0	110.7	S51 S56 R57	S51-E53 VanDerWaalsContact C-N 3.31Å; S51-E53 PolarHBondContact OG-N 3.13Å; E53-S56 PolarHBondContact O-N 3.38Å; E53-R57 WeakPolarHBondContact O-CG 3.47Å; E53-R57 PolarHBondContact O-N 3.1Å
54	D	88.9	Confident	88.7	Confident	18 Å²	18	62.9 Å²	62.9	10%	0.096	29%	0.293	C	S	.	.	H	α-helix	trans	-60.1	-48.2	173.5	-64.2	-11	0	0	0	111.1	G26 F49 S56 R57 A58	G26-D54 WeakPolarHBondContact CA-OD2 3.18Å; F49-D54 HydrophobicContact CB-CB 4.02Å; F49-D54 HydrophobicContact CD1-CB 3.6Å; F49-D54 HydrophobicContact CE1-CB 4.28Å; F49-D54 HydrophobicContact CG-CB 3.95Å; D54-S56 VanDerWaalsContact C-N 3.27Å; D54-S56 PolarHBondContact O-N 2.89Å; D54-R57 PolarHBondContact O-N 2.76Å; D54-R57 IonicContact OD1-CZ 3.6Å; D54-R57 IonicContact OD1-NE 3.63Å; D54-R57 IonicContact OD1-NH2 3.02Å; D54-R57 PolarHBondContact OD1-NH2 3.41Å; D54-A58 WeakPolarHBondContact O-CB 3.12Å; D54-A58 PolarHBondContact O-N 3.45Å
55	A	87	Confident	88.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.4	-40.5	175.4	0	0	0	0	0	111.7	L4 F49 S51 L59 M76	L4-A55 WeakPolarHBondContact CD1-O 3.18Å; L4-A55 HydrophobicContact CD2-CB 4.14Å; L4-A55 HydrophobicContact CG-CB 4.2Å; F49-A55 HydrophobicContact CB-CB 4.24Å; F49-A55 HydrophobicContact CD2-CB 3.87Å; F49-A55 HydrophobicContact CG-CB 4.33Å; S51-A55 PolarHBondContact O-N 2.77Å; A55-L59 WeakPolarHBondContact O-CB 3.46Å; A55-L59 PolarHBondContact O-N 3.4Å; A55-M76 HydrophobicContact CB-SD 4.39Å
56	S	87.6	Confident	88.3	Confident	52 Å²	52	68.9 Å²	68.9	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-69	-36.9	177.9	-59.3	0	0	0	0	112.8	E52 E53 D54 K60	E52-S56 WeakPolarHBondContact O-CB 3.39Å; E52-S56 PolarHBondContact O-N 2.89Å; E52-S56 PolarHBondContact O-OG 3.35Å; E53-S56 PolarHBondContact O-N 3.38Å; D54-S56 VanDerWaalsContact C-N 3.27Å; D54-S56 PolarHBondContact O-N 2.89Å; S56-K60 PolarHBondContact O-N 3.26Å; S56-K60 VanDerWaalsContact O-N 3.09Å
57	R	88.1	Confident	87.9	Confident	147 Å²	147	67.3 Å²	67.3	56%	0.555	32%	0.317	S	S	*	.	H	α-helix	trans	-65.8	-48.9	173.1	-72.3	-172.8	-70.5	-170	-0.5	111.5	E53 D54 L59 K60 H61	E53-R57 WeakPolarHBondContact O-CG 3.47Å; E53-R57 PolarHBondContact O-N 3.1Å; D54-R57 PolarHBondContact O-N 2.76Å; D54-R57 IonicContact OD1-CZ 3.6Å; D54-R57 IonicContact OD1-NE 3.63Å; D54-R57 IonicContact OD1-NH2 3.02Å; D54-R57 PolarHBondContact OD1-NH2 3.41Å; R57-L59 VanDerWaalsContact C-N 3.35Å; R57-L59 PolarHBondContact O-N 3.2Å; R57-K60 PolarHBondContact O-N 3.24Å; R57-H61 PolarHBondContact O-N 3.27Å; R57-H61 VanDerWaalsContact O-N 3.13Å
58	A	88.1	Confident	87.4	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.1	-40.3	176.8	0	0	0	0	0	112.3	L4 F22 F25 F49 D54 H61 F62	L4-A58 HydrophobicContact CD1-CB 3.96Å; F22-A58 HydrophobicContact CD1-CB 4.15Å; F22-A58 HydrophobicContact CE1-CB 4.45Å; F25-A58 HydrophobicContact CB-CB 4.03Å; F25-A58 HydrophobicContact CG-CB 4.39Å; F49-A58 HydrophobicContact CE2-CB 3.84Å; F49-A58 HydrophobicContact CZ-CB 3.66Å; D54-A58 WeakPolarHBondContact O-CB 3.12Å; D54-A58 PolarHBondContact O-N 3.45Å; A58-H61 PolarHBondContact O-N 3.26Å; A58-F62 HydrophobicContact CB-CD2 4.49Å; A58-F62 PolarHBondContact O-N 3.36Å
59	L	89.1	Confident	87.1	Confident	39 Å²	39	77.3 Å²	77.3	20%	0.204	38%	0.375	C	S	.	.	H	α-helix	trans	-58.5	-46.9	174	175.2	64.2	0	0	0	111.9	L4 A55 R57 H61 N63 V74 M76	L4-L59 HydrophobicContact CD1-CB 4.42Å; L4-L59 HydrophobicContact CD2-CB 4.15Å; A55-L59 WeakPolarHBondContact O-CB 3.46Å; A55-L59 PolarHBondContact O-N 3.4Å; R57-L59 VanDerWaalsContact C-N 3.35Å; R57-L59 PolarHBondContact O-N 3.2Å; L59-H61 VanDerWaalsContact C-N 3.31Å; L59-H61 PolarHBondContact O-N 2.94Å; L59-N63 HydrophobicContact CD1-CB 4.47Å; L59-N63 WeakPolarHBondContact O-CB 3.36Å; L59-N63 PolarHBondContact O-N 2.93Å; L59-N63 VanDerWaalsContact O-N 3.16Å; L59-V74 VanDerWaalsContact CD1-C 3.48Å; L59-V74 HydrophobicContact CD1-CB 4.02Å; L59-V74 HydrophobicContact CD1-CG1 3.81Å; L59-V74 WeakPolarHBondContact CD1-O 3.19Å; L59-M76 HydrophobicContact CD2-CE 3.95Å
60	K	88.5	Confident	86.9	Confident	192 Å²	192	78 Å²	78	84%	0.835	38%	0.38	S	S	*	.	H	α-helix	trans	-66.7	-31	180	-170	176.4	-179.5	-178.4	0	112.8	S56 R57	S56-K60 PolarHBondContact O-N 3.26Å; S56-K60 VanDerWaalsContact O-N 3.09Å; R57-K60 PolarHBondContact O-N 3.24Å
61	H	86.4	Confident	86.9	Confident	113 Å²	113	76.7 Å²	76.7	52%	0.523	37%	0.371	S	S	.	.	H	α-helix	trans	-83.7	-45.3	-179	-171.1	-89.6	0	0	0	113.5	F25 R57 A58 L59	F25-H61 HydrophobicContact CE1-CB 3.82Å; F25-H61 AromaticContact CE1-CD2 3.96Å; F25-H61 AromaticContact CE1-CG 3.64Å; F25-H61 AromaticContact CE1-ND1 3.98Å; F25-H61 HydrophobicContact CZ-CB 4.14Å; F25-H61 AromaticContact CZ-CD2 3.96Å; F25-H61 AromaticContact CZ-CE1 3.72Å; F25-H61 AromaticContact CZ-CG 3.57Å; F25-H61 AromaticContact CZ-ND1 3.41Å; F25-H61 WeakPolarHBondContact CZ-ND1 3.13Å; R57-H61 PolarHBondContact O-N 3.27Å; R57-H61 VanDerWaalsContact O-N 3.13Å; A58-H61 PolarHBondContact O-N 3.26Å; L59-H61 VanDerWaalsContact C-N 3.31Å; L59-H61 PolarHBondContact O-N 2.94Å
62	F	86.3	Confident	86.9	Confident	20 Å²	20	74.9 Å²	74.9	9%	0.088	36%	0.358	C	S	.	.	H	α-helix	trans	-92	-16	-173	-74	-71	0	0	0	114.8	M21 F22 F25 A58 K64 S65 V72 V74	M21-F62 HydrophobicContact CB-CZ 4.25Å; M21-F62 WeakPolarHBondContact O-CZ 3.43Å; F22-F62 AromaticContact CD1-CD2 3.92Å; F22-F62 HydrophobicContact CD1-CD2 3.92Å; F22-F62 AromaticContact CD1-CE2 3.93Å; F22-F62 HydrophobicContact CD1-CE2 3.93Å; F22-F62 HydrophobicContact CE1-CB 4.29Å; F22-F62 AromaticContact CE1-CD2 3.38Å; F22-F62 HydrophobicContact CE1-CD2 3.38Å; F22-F62 AromaticContact CE1-CE2 3.8Å; F22-F62 HydrophobicContact CE1-CE2 3.8Å; F22-F62 AromaticContact CE1-CG 3.95Å; F22-F62 HydrophobicContact CE1-CG 3.95Å; F22-F62 HydrophobicContact CG-CE2 4.49Å; F22-F62 HydrophobicContact CZ-CB 4.35Å; F22-F62 AromaticContact CZ-CD2 3.88Å; F22-F62 HydrophobicContact CZ-CD2 3.88Å; F22-F62 HydrophobicContact CZ-CE2 4.25Å; F22-F62 HydrophobicContact CZ-CG 4.04Å; F25-F62 AromaticContact CD2-CE2 3.58Å; F25-F62 HydrophobicContact CD2-CE2 3.58Å; F25-F62 HydrophobicContact CD2-CZ 4.22Å; F25-F62 HydrophobicContact CE2-CD2 4.38Å; F25-F62 AromaticContact CE2-CE2 3.36Å; F25-F62 HydrophobicContact CE2-CE2 3.36Å; F25-F62 AromaticContact CE2-CZ 3.64Å; F25-F62 HydrophobicContact CE2-CZ 3.64Å; F25-F62 HydrophobicContact CG-CE2 4.49Å; F25-F62 HydrophobicContact CZ-CE2 4.12Å; F25-F62 HydrophobicContact CZ-CZ 4.4Å; A58-F62 HydrophobicContact CB-CD2 4.49Å; A58-F62 PolarHBondContact O-N 3.36Å; F62-K64 PolarHBondContact O-N 3.18Å; F62-S65 PolarHBondContact O-N 3.05Å; F62-S65 VanDerWaalsContact O-N 3.17Å; F62-S65 PolarHBondContact O-OG 3.32Å; F62-V72 WeakPolarHBondContact O-CG2 3.42Å; F62-V74 HydrophobicContact CB-CG2 3.7Å
63	N	88.6	Confident	87.1	Confident	68 Å²	68	72.8 Å²	72.8	36%	0.364	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	123	179.1	-168.1	18.5	0	0	0	111.1	L59 S65 V74	L59-N63 HydrophobicContact CD1-CB 4.47Å; L59-N63 WeakPolarHBondContact O-CB 3.36Å; L59-N63 PolarHBondContact O-N 2.93Å; L59-N63 VanDerWaalsContact O-N 3.16Å; N63-S65 VanDerWaalsContact C-N 3.27Å; N63-S65 PolarHBondContact O-N 3.43Å; N63-V74 HydrophobicContact CB-CB 4.15Å; N63-V74 VanDerWaalsContact CG-O 3.29Å; N63-V74 PolarHBondContact ND2-O 3Å; N63-V74 PolarHBondContact OD1-N 3.16Å; N63-V74 VanDerWaalsContact OD1-N 3.13Å; N63-V74 PolarHBondContact OD1-O 2.86Å
64	K	85.5	Confident	87.2	Confident	137 Å²	137	66.1 Å²	66.1	60%	0.596	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	8.8	-173.1	-49.5	179.6	178.6	179.3	0	115.4	F62 R71 V72	F62-K64 PolarHBondContact O-N 3.18Å; K64-R71 PolarHBondContact O-NE 3.4Å; K64-V72 VanDerWaalsContact CA-O 3.27Å; K64-V72 WeakPolarHBondContact CA-O 3.29Å; K64-V72 PolarHBondContact N-O 3.21Å
65	S	89.4	Confident	87.3	Confident	31 Å²	31	68.7 Å²	68.7	22%	0.217	33%	0.332	C	S	.	.			trans	-74.3	173.2	171.5	83.7	0	0	0	0	111.4	F62 N63 R71 V72	F62-S65 PolarHBondContact O-N 3.05Å; F62-S65 VanDerWaalsContact O-N 3.17Å; F62-S65 PolarHBondContact O-OG 3.32Å; N63-S65 VanDerWaalsContact C-N 3.27Å; N63-S65 PolarHBondContact O-N 3.43Å; S65-R71 CarbonylContact O-C 3.55Å; S65-R71 WeakPolarHBondContact O-CA 3.27Å; S65-R71 WeakPolarHBondContact O-CG 3.22Å; S65-V72 WeakPolarHBondContact O-CG2 3.44Å; S65-V72 PolarHBondContact O-N 3.44Å; S65-V72 WeakPolarHBondContact OG-CG2 3.45Å
66	F	84.3	Confident	87.2	Confident	138 Å²	138	71.4 Å²	71.4	61%	0.605	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	145.4	170.2	-72	-99.6	0	0	0	110.7	R71	F66-R71 HydrophobicContact CD1-CB 3.95Å; F66-R71 HydrophobicContact CD1-CG 4.42Å; F66-R71 HydrophobicContact CD2-CG 4.26Å; F66-R71 HydrophobicContact CE1-CB 3.69Å; F66-R71 HydrophobicContact CE1-CG 4.17Å; F66-R71 HydrophobicContact CE2-CB 4.41Å; F66-R71 HydrophobicContact CE2-CG 3.99Å; F66-R71 HydrophobicContact CG-CB 4.43Å; F66-R71 HydrophobicContact CG-CG 4.47Å; F66-R71 HydrophobicContact CZ-CB 3.94Å; F66-R71 HydrophobicContact CZ-CG 3.95Å
67	V	82.4	Confident	86.9	Confident	13 Å²	13	69.7 Å²	69.7	8%	0.079	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	115.3	168.2	175.9	0	0	0	0	106.3	P10 M21 T69 S70 V72	P10-V67 HydrophobicContact CG-CG1 4.28Å; M21-V67 HydrophobicContact CE-CG1 3.99Å; M21-V67 HydrophobicContact SD-CG1 4.06Å; M21-V67 HydrophobicContact SD-CG2 4.49Å; V67-T69 PolarHBondContact O-N 2.96Å; V67-S70 PolarHBondContact N-O 3.2Å; V67-S70 PolarHBondContact O-N 2.93Å; V67-V72 HydrophobicContact CB-CG1 3.88Å; V67-V72 HydrophobicContact CG2-CB 4.48Å; V67-V72 HydrophobicContact CG2-CG1 3.74Å; V67-V72 HydrophobicContact CG2-CG2 3.86Å
68	D	82.7	Confident	86.4	Confident	85 Å²	85	67 Å²	67	46%	0.455	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	-124.1	-165.1	-49.7	-41.5	0	0	0	110.3	P10 R17 S70	P10-D68 HydrophobicContact CG-CB 4.28Å; R17-D68 IonicContact CZ-OD1 3.63Å; R17-D68 IonicContact CZ-OD2 3.72Å; R17-D68 VanDerWaalsContact NH1-CG 3.29Å; R17-D68 IonicContact NH1-OD1 2.67Å; R17-D68 PolarHBondContact NH1-OD1 2.67Å; R17-D68 IonicContact NH1-OD2 3.17Å; R17-D68 PolarHBondContact NH1-OD2 3.37Å; R17-D68 IonicContact NH2-OD1 2.7Å; R17-D68 PolarHBondContact NH2-OD1 3.24Å; R17-D68 IonicContact NH2-OD2 2.86Å; D68-S70 VanDerWaalsContact C-N 3.35Å
69	T	83.4	Confident	85.6	Confident	131 Å²	131	69.9 Å²	69.9	80%	0.804	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-1.9	179.2	56.4	0	0	0	0	114.6	V67	V67-T69 PolarHBondContact O-N 2.96Å
70	S	85.6	Confident	84.2	Confident	17 Å²	17	78.5 Å²	78.5	12%	0.119	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.1	-168.4	-63.4	0	0	0	0	112.8	N8 V67 D68 V72	N8-S70 WeakPolarHBondContact O-CB 3.49Å; V67-S70 PolarHBondContact N-O 3.2Å; V67-S70 PolarHBondContact O-N 2.93Å; D68-S70 VanDerWaalsContact C-N 3.35Å; S70-V72 PolarHBondContact O-N 2.88Å
71	R	88.9	Confident	82.9	Confident	135 Å²	135	72.9 Å²	72.9	51%	0.509	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	112.6	172.1	-161.4	-178.9	-168.2	173.6	8.4	110.1	N8 K64 S65 F66	N8-R71 PolarHBondContact ND2-O 3.44Å; K64-R71 PolarHBondContact O-NE 3.4Å; S65-R71 CarbonylContact O-C 3.55Å; S65-R71 WeakPolarHBondContact O-CA 3.27Å; S65-R71 WeakPolarHBondContact O-CG 3.22Å; F66-R71 HydrophobicContact CD1-CB 3.95Å; F66-R71 HydrophobicContact CD1-CG 4.42Å; F66-R71 HydrophobicContact CD2-CG 4.26Å; F66-R71 HydrophobicContact CE1-CB 3.69Å; F66-R71 HydrophobicContact CE1-CG 4.17Å; F66-R71 HydrophobicContact CE2-CB 4.41Å; F66-R71 HydrophobicContact CE2-CG 3.99Å; F66-R71 HydrophobicContact CG-CB 4.43Å; F66-R71 HydrophobicContact CG-CG 4.47Å; F66-R71 HydrophobicContact CZ-CB 3.94Å; F66-R71 HydrophobicContact CZ-CG 3.95Å
72	V	90.6	Very high	81.9	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.006	37%	0.37	C	S	.	.			trans	-85.9	152	-177.9	-64.8	0	0	0	0	111.5	V6 K7 L9 F62 K64 S65 V67 S70	V6-V72 HydrophobicContact CG1-CB 4.28Å; V6-V72 HydrophobicContact CG1-CG1 4.5Å; K7-V72 WeakPolarHBondContact O-CA 3.48Å; L9-V72 HydrophobicContact CD2-CG1 3.91Å; F62-V72 WeakPolarHBondContact O-CG2 3.42Å; K64-V72 VanDerWaalsContact CA-O 3.27Å; K64-V72 WeakPolarHBondContact CA-O 3.29Å; K64-V72 PolarHBondContact N-O 3.21Å; S65-V72 WeakPolarHBondContact O-CG2 3.44Å; S65-V72 PolarHBondContact O-N 3.44Å; S65-V72 WeakPolarHBondContact OG-CG2 3.45Å; V67-V72 HydrophobicContact CB-CG1 3.88Å; V67-V72 HydrophobicContact CG2-CB 4.48Å; V67-V72 HydrophobicContact CG2-CG1 3.74Å; V67-V72 HydrophobicContact CG2-CG2 3.86Å; S70-V72 PolarHBondContact O-N 2.88Å
73	T	90.1	Very high	80.6	Confident	51 Å²	51	74.9 Å²	74.9	31%	0.313	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.6	171.1	43	0	0	0	0	109.2	V6 K7	V6-T73 WeakPolarHBondContact CA-O 3.33Å; K7-T73 PolarHBondContact N-O 3.43Å; K7-T73 PolarHBondContact O-N 2.8Å
74	V	90.8	Very high	79.5	Confident	1 Å²	1	76 Å²	76	1%	0.006	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	132.6	-175.7	-172.3	0	0	0	0	108.5	L4 I5 V6 L59 F62 N63	L4-V74 HydrophobicContact CB-CG1 4.11Å; L4-V74 HydrophobicContact CD1-CG1 3.83Å; L4-V74 HydrophobicContact CD2-CG1 4.47Å; L4-V74 HydrophobicContact CG-CG1 4.37Å; I5-V74 WeakPolarHBondContact O-CA 3.47Å; V6-V74 HydrophobicContact CG1-CG2 4.16Å; V6-V74 HydrophobicContact CG2-CG1 4.33Å; V6-V74 HydrophobicContact CG2-CG2 4.18Å; L59-V74 VanDerWaalsContact CD1-C 3.48Å; L59-V74 HydrophobicContact CD1-CB 4.02Å; L59-V74 HydrophobicContact CD1-CG1 3.81Å; L59-V74 WeakPolarHBondContact CD1-O 3.19Å; F62-V74 HydrophobicContact CB-CG2 3.7Å; N63-V74 HydrophobicContact CB-CB 4.15Å; N63-V74 VanDerWaalsContact CG-O 3.29Å; N63-V74 PolarHBondContact ND2-O 3Å; N63-V74 PolarHBondContact OD1-N 3.16Å; N63-V74 VanDerWaalsContact OD1-N 3.13Å; N63-V74 PolarHBondContact OD1-O 2.86Å
75	E	89.6	Confident	78.1	Confident	71 Å²	71	74.7 Å²	74.7	33%	0.332	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.1	-180	-75.3	165.5	-150.4	0	0	110	L4 I5 K7	L4-E75 WeakPolarHBondContact CA-O 3.35Å; I5-E75 HydrophobicContact CG2-CB 3.78Å; I5-E75 PolarHBondContact N-O 2.78Å; I5-E75 PolarHBondContact O-N 2.87Å; K7-E75 WeakPolarHBondContact CE-OE2 3.25Å; K7-E75 IonicContact NZ-OE1 3.06Å; K7-E75 PolarHBondContact NZ-OE1 3.04Å; K7-E75 IonicContact NZ-OE2 2.7Å; K7-E75 PolarHBondContact NZ-OE2 2.85Å
76	M	86.4	Confident	76.5	Confident	57 Å²	57	77 Å²	77	28%	0.281	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	136.3	166.2	-149.2	72.8	83	0	0	109.5	M1 L4 A55 L59 K78	M1-M76 VanDerWaalsContact O-SD 3.35Å; L4-M76 HydrophobicContact CD2-SD 3.5Å; L4-M76 VanDerWaalsContact CD2-SD 3.5Å; A55-M76 HydrophobicContact CB-SD 4.39Å; L59-M76 HydrophobicContact CD2-CE 3.95Å; M76-K78 PolarHBondContact O-N 3.08Å
77	C	80.9	Confident	75.1	Confident	16 Å²	16	80.5 Å²	80.5	11%	0.108	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-67.6	127.9	174.7	-70.4	0	0	0	0	110.2	M1 R3	M1-C77 VanDerWaalsContact CE-O 3.23Å; M1-C77 WeakPolarHBondContact CE-O 3.41Å; R3-C77 HydrophobicContact CB-CB 4.12Å; R3-C77 HydrophobicContact CG-CB 4.37Å; R3-C77 VanDerWaalsContact O-CB 3.26Å; R3-C77 WeakPolarHBondContact O-CB 3.48Å; R3-C77 PolarHBondContact O-N 2.86Å; R3-C77 PolarHBondContact O-SG 2.77Å; R3-C77 VanDerWaalsContact O-SG 3.38Å
78	K	78	Confident	73.4	Confident	90 Å²	90	84.2 Å²	84.2	39%	0.391	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-83.1	153.8	161.3	-65.2	-168.7	174.7	-167.5	0	109.4	M76 D82 T84 K85	M76-K78 PolarHBondContact O-N 3.08Å; K78-D82 HydrophobicContact CB-CB 4.4Å; K78-D82 WeakPolarHBondContact CD-OD2 3.29Å; K78-T84 PolarHBondContact NZ-O 3.13Å; K78-T84 PolarHBondContact NZ-OG1 3.49Å; K78-K85 HydrophobicContact CD-CD 4.05Å; K78-K85 HydrophobicContact CD-CG 4.17Å
79	A	70.8	Confident	71.1	Confident	62 Å²	62	91.5 Å²	91.5	51%	0.512	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-62.4	155.1	174.9	0	0	0	0	0	111.8	G81 D82	A79-G81 PolarHBondContact O-N 3.26Å; A79-D82 PolarHBondContact O-N 3.48Å
80	F	58.3	Low	69.6	Low	220 Å²	220	87.7 Å²	87.7	97%	0.965	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	117.8	176.6	-168.7	-91.6	0	0	0	109.5
81	G	61.3	Low	67.4	Low	73 Å²	73	96.3 Å²	96.3	75%	0.753	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	1.5	-176.6	0	0	0	0	0	115.9	A79	A79-G81 PolarHBondContact O-N 3.26Å
82	D	66	Low	65.1	Low	51 Å²	51	98.4 Å²	98.4	27%	0.273	53%	0.534	S	S	.	.			trans	-60.1	119.7	177.2	-177	-23.9	0	0	0	112	K78 A79 T84 K85	K78-D82 HydrophobicContact CB-CB 4.4Å; K78-D82 WeakPolarHBondContact CD-OD2 3.29Å; A79-D82 PolarHBondContact O-N 3.48Å; D82-T84 VanDerWaalsContact CG-OG1 3.23Å; D82-T84 PolarHBondContact O-N 2.71Å; D82-T84 VanDerWaalsContact O-N 3.16Å; D82-T84 WeakPolarHBondContact OD1-CB 3.27Å; D82-T84 PolarHBondContact OD1-N 3.07Å; D82-T84 PolarHBondContact OD1-OG1 2.9Å; D82-T84 PolarHBondContact OD2-OG1 2.85Å; D82-K85 PolarHBondContact O-N 2.78Å
83	P	59.3	Low	62.7	Low	124 Å²	124	103.4 Å²	103.4	81%	0.805	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-11.2	-175.9	29.1	-36	0	0	0	113.8	K85	P83-K85 PolarHBondContact O-N 3.12Å; P83-K85 VanDerWaalsContact O-N 3.1Å
84	T	64.2	Low	60.2	Low	93 Å²	93	110.3 Å²	110.3	57%	0.571	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	23.7	176.8	67.8	0	0	0	0	113.6	K78 D82	K78-T84 PolarHBondContact NZ-O 3.13Å; K78-T84 PolarHBondContact NZ-OG1 3.49Å; D82-T84 VanDerWaalsContact CG-OG1 3.23Å; D82-T84 PolarHBondContact O-N 2.71Å; D82-T84 VanDerWaalsContact O-N 3.16Å; D82-T84 WeakPolarHBondContact OD1-CB 3.27Å; D82-T84 PolarHBondContact OD1-N 3.07Å; D82-T84 PolarHBondContact OD1-OG1 2.9Å; D82-T84 PolarHBondContact OD2-OG1 2.85Å
85	K	58.2	Low	57.3	Low	109 Å²	109	115.5 Å²	115.5	47%	0.474	63%	0.63	S	S	.	*	S	Bend	trans	-135.8	128.1	170.2	-86.1	-177.5	167.7	172.8	0	110.5	K78 D82 P83	K78-K85 HydrophobicContact CD-CD 4.05Å; K78-K85 HydrophobicContact CD-CG 4.17Å; D82-K85 PolarHBondContact O-N 2.78Å; P83-K85 PolarHBondContact O-N 3.12Å; P83-K85 VanDerWaalsContact O-N 3.1Å
86	G	54.5	Low	54.6	Low	78 Å²	78	118 Å²	118	80%	0.804	66%	0.655	S	S	*	*			trans	-58.1	138	170.6	0	0	0	0	0	111.6	A88	G86-A88 PolarHBondContact O-N 2.65Å
87	K	54.4	Low	51.9	Low	212 Å²	212	123.9 Å²	123.9	92%	0.922	68%	0.682	S	S	*	*			trans	-63.7	117.1	-176.2	-164.3	169	-174.7	174.3	0	109.8	W89	K87-W89 PolarHBondContact O-N 2.96Å; K87-W89 VanDerWaalsContact O-N 3.11Å
88	A	47	Very low	49.5	Very low	92 Å²	92	132.2 Å²	132.2	76%	0.76	72%	0.719	S	S	*	*			trans	-64.4	113	-174.2	0	0	0	0	0	111.2	G86 S90	G86-A88 PolarHBondContact O-N 2.65Å; A88-S90 PolarHBondContact O-N 3.22Å
89	W	35.3	Very low	47.2	Very low	237 Å²	237	135.7 Å²	135.7	90%	0.898	74%	0.742	S	S	*	*			trans	-65.2	128.4	-178.2	-176.9	-94.1	0	0	0	111.5	K87	K87-W89 PolarHBondContact O-N 2.96Å; K87-W89 VanDerWaalsContact O-N 3.11Å
90	S	51.8	Low	45.2	Very low	51 Å²	51	142.3 Å²	142.3	36%	0.357	76%	0.759	S	S	.	*			trans	-136.2	145.1	172.9	97.6	0	0	0	0	109.7	A88 H92 T93	A88-S90 PolarHBondContact O-N 3.22Å; S90-H92 PolarHBondContact O-N 2.84Å; S90-H92 VanDerWaalsContact O-N 3.14Å; S90-H92 PolarHBondContact OG-N 2.93Å; S90-T93 PolarHBondContact O-OG1 3.47Å; S90-T93 WeakPolarHBondContact OG-CG2 3.13Å; S90-T93 PolarHBondContact OG-N 2.62Å; S90-T93 PolarHBondContact OG-OG1 3.13Å
91	K	39.7	Very low	43.8	Very low	199 Å²	199	137.9 Å²	137.9	87%	0.865	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	1.8	177.2	-71	-170.8	175.1	-175.8	0	114
92	H	40.3	Very low	42	Very low	179 Å²	179	139.8 Å²	139.8	83%	0.829	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.6	16.4	-167.2	-76	18.6	0	0	0	113.8	S90	S90-H92 PolarHBondContact O-N 2.84Å; S90-H92 VanDerWaalsContact O-N 3.14Å; S90-H92 PolarHBondContact OG-N 2.93Å
93	T	38.9	Very low	40.2	Very low	105 Å²	105	142.1 Å²	142.1	64%	0.644	78%	0.781	S	S	*	*			trans	-108.2	110.1	171.2	39.9	0	0	0	0	109.3	S90	S90-T93 PolarHBondContact O-OG1 3.47Å; S90-T93 WeakPolarHBondContact OG-CG2 3.13Å; S90-T93 PolarHBondContact OG-N 2.62Å; S90-T93 PolarHBondContact OG-OG1 3.13Å
94	Q	37.5	Very low	38.6	Very low	197 Å²	197	140.2 Å²	140.2	92%	0.921	78%	0.775	S	S	*	*			trans	-66.7	149	174.2	-71.2	-173.7	-12.4	0	0	111.3
95	S	31.1	Very low	36.7	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	79%	0.789	S	S	*	*			trans	-94.6	105.1	174	49.9	0	0	0	0	109.9	E97	S95-E97 PolarHBondContact O-N 2.98Å
96	S	31.6	Very low	35.1	Very low	122 Å²	122	141 Å²	141	85%	0.853	80%	0.799	S	S	*	*			trans	-71.9	117.9	170.1	54.8	0	0	0	0	110.3	Q98	S96-Q98 PolarHBondContact O-N 3.04Å
97	E	31.6	Very low	33.6	Very low	182 Å²	182	143.2 Å²	143.2	85%	0.85	80%	0.797	S	S	*	*			trans	-80.7	112.3	170.7	-63.3	-175.7	120.4	0	0	110.3	S95	S95-E97 PolarHBondContact O-N 2.98Å
98	Q	30.2	Very low	32.2	Very low	191 Å²	191	138.9 Å²	138.9	89%	0.893	79%	0.788	S	S	*	*			trans	171.4	113.3	143.2	-97.3	163.2	43.6	0	0	109.6	S96	S96-Q98 PolarHBondContact O-N 3.04Å
99	D	29.7	Very low	31.2	Very low	163 Å²	163	141.2 Å²	141.2	87%	0.872	79%	0.788	S	S	*	*				-168.1	128.7	129.9	-118.5	-29.2	0	0	0	110.4
100	K	28.1	Very low	30.7	Very low	200 Å²	200	135.8 Å²	135.8	87%	0.87	78%	0.781	S	S	*	*			trans	-158.6	92.6	178.6	-126.3	-175.1	-174.7	-179.2	0	111.5
101	P	29.9	Very low	29.6	Very low	128 Å²	128	143.3 Å²	143.3	83%	0.831	81%	0.807	S	S	*	*			trans	-71.1	166	167.5	29.5	-32.6	0	0	0	111.3
102	S	23.6	Very low	28.9	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	81%	0.808	S	S	*	*			trans	-124.1	161.7	-158.5	57	0	0	0	0	114.9
103	A	27.4	Very low	28.2	Very low	100 Å²	100	141.1 Å²	141.1	83%	0.826	81%	0.806	S	S	*	*			trans	68.7	150.4	163	0	0	0	0	0	118.3
104	A	25.5	Very low	27.6	Very low	84 Å²	84	145.3 Å²	145.3	69%	0.694	82%	0.816	S	S	*	*			cis	-165	161.7	-19.2	0	0	0	0	0	112.4
105	S	24.9	Very low	27.2	Very low	121 Å²	121	141.8 Å²	141.8	85%	0.846	81%	0.808	S	S	*	*			trans	72	152.8	166.8	86.9	0	0	0	0	116.7
106	S	24.3	Very low	26.9	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	81%	0.813	S	S	*	*			cis	-150	154.6	7.2	48.3	0	0	0	0	114.4
107	T	23.1	Very low	27.3	Very low	125 Å²	125	143.8 Å²	143.8	77%	0.767	81%	0.814	S	S	*	*			trans	66.4	146.4	151.3	41.3	0	0	0	0	124.6
108	T	24.5	Very low	27.5	Very low	120 Å²	120	143.8 Å²	143.8	74%	0.736	81%	0.812	S	S	*	*			trans	68.2	98.2	154.9	44.8	0	0	0	0	122.2
109	D	25.6	Very low	27.7	Very low	142 Å²	142	143.3 Å²	143.3	76%	0.759	81%	0.809	S	S	*	*				81.2	146.4	116.6	-92.5	-65	0	0	0	126.7
110	T	25.9	Very low	28.2	Very low	123 Å²	123	140.8 Å²	140.8	76%	0.755	80%	0.8	S	S	*	*			trans	57.9	104.7	164.4	54	0	0	0	0	120.6	K112	T110-K112 PolarHBondContact O-N 3.33Å
111	K	27.8	Very low	28.7	Very low	208 Å²	208	134.9 Å²	134.9	90%	0.904	78%	0.784	S	S	*	*			trans	-58.8	113.6	164.9	-175	-178.7	-171.3	176.8	0	112.4
112	K	25	Very low	29.2	Very low	202 Å²	202	132.9 Å²	132.9	88%	0.878	77%	0.773	S	S	*	*			trans	-124.5	122.1	170.1	-110.3	179.5	-178	172.6	0	112	T110	T110-K112 PolarHBondContact O-N 3.33Å
113	T	25.7	Very low	30.2	Very low	130 Å²	130	130.6 Å²	130.6	80%	0.798	76%	0.761	S	S	*	*			trans	-98.2	119.3	167.8	46.3	0	0	0	0	110
114	K	27	Very low	31.1	Very low	193 Å²	193	130 Å²	130	84%	0.839	74%	0.743	S	S	*	*			trans	-169.5	140.3	151.9	-117.5	-178.7	-178.2	-171.1	0	114.5
115	T	28.5	Very low	32.1	Very low	124 Å²	124	127.8 Å²	127.8	76%	0.761	73%	0.729	S	S	*	*			trans	24.6	122.6	143.5	53.9	0	0	0	0	120.1
116	G	25.8	Very low	33.3	Very low	85 Å²	85	128.4 Å²	128.4	88%	0.876	72%	0.722	S	S	*	*			trans	-112.1	28.6	171.5	0	0	0	0	0	115.5	K118	G116-K118 PolarHBondContact O-N 3.33Å
117	E	38.7	Very low	34.8	Very low	188 Å²	188	127.7 Å²	127.7	88%	0.879	71%	0.711	S	S	*	*			trans	-90.5	86.7	165.7	-77.8	-171	136.1	0	0	110
118	K	36.3	Very low	36	Very low	183 Å²	183	127.5 Å²	127.5	80%	0.796	70%	0.701	S	S	*	*			trans	173.7	79.9	153.9	-103.5	177.2	177.7	-172.8	0	111.6	G116	G116-K118 PolarHBondContact O-N 3.33Å
119	E	35.6	Very low	37.3	Very low	180 Å²	180	125.9 Å²	125.9	84%	0.841	70%	0.699	S	S	*	*	S	Bend	trans	-152.4	1.1	160.8	-125.9	162.3	-135.8	0	0	114.4
120	T	39.2	Very low	39.1	Very low	110 Å²	110	124.9 Å²	124.9	68%	0.675	69%	0.69	S	S	*	*	S	Bend	trans	-96.4	-17.8	176.3	47.8	0	0	0	0	114.1
121	S	38.3	Very low	40.6	Very low	77 Å²	77	126 Å²	126	54%	0.538	69%	0.692	S	S	.	*	H	α-helix	trans	-76.2	-25.1	-173.3	57.8	0	0	0	0	114.5	G125	S121-G125 PolarHBondContact O-N 3.07Å
122	S	40.5	Very low	42.5	Very low	85 Å²	85	118.1 Å²	118.1	59%	0.594	67%	0.67	S	S	*	*	H	α-helix	trans	-77.6	-24.8	177.8	45.2	0	0	0	0	113.4
123	A	44.5	Very low	43.7	Very low	64 Å²	64	111.8 Å²	111.8	53%	0.529	64%	0.642	S	S	.	*	H	α-helix	trans	-81.9	-29.6	175	0	0	0	0	0	112.5
124	L	45.8	Very low	45.1	Very low	88 Å²	88	109.9 Å²	109.9	46%	0.461	63%	0.627	S	S	.	*	H	α-helix	trans	-71.9	-48	178.9	-106.6	151.5	0	0	0	112.5	N126 L127 E128	L124-N126 PolarHBondContact O-N 3.23Å; L124-N126 VanDerWaalsContact O-N 3.09Å; L124-L127 PolarHBondContact O-N 2.78Å; L124-E128 PolarHBondContact O-N 2.69Å
125	G	47	Very low	46.6	Very low	37 Å²	37	107.3 Å²	107.3	38%	0.381	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.6	-16.8	-178.7	0	0	0	0	0	115.1	S121	S121-G125 PolarHBondContact O-N 3.07Å
126	N	50.9	Low	47.8	Very low	134 Å²	134	107.2 Å²	107.2	72%	0.717	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-7.4	173.5	-76.6	6	0	0	0	113.6	L124	L124-N126 PolarHBondContact O-N 3.23Å; L124-N126 VanDerWaalsContact O-N 3.09Å
127	L	54.2	Low	49.5	Very low	84 Å²	84	107.2 Å²	107.2	44%	0.44	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.6	-18.8	178.2	-76.5	163.1	0	0	0	112.8	L124 A129 E130 F133	L124-L127 PolarHBondContact O-N 2.78Å; L127-A129 PolarHBondContact O-N 2.89Å; L127-E130 PolarHBondContact O-N 2.8Å; L127-F133 WeakPolarHBondContact O-CB 3.43Å
128	E	48.8	Very low	50.2	Low	121 Å²	121	102.3 Å²	102.3	57%	0.565	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-9.2	168.6	-69.2	173.8	163.8	0	0	113.2	L124	L124-E128 PolarHBondContact O-N 2.69Å
129	A	52.9	Low	51.3	Low	85 Å²	85	98.8 Å²	98.8	70%	0.702	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	1.9	179.5	0	0	0	0	0	114.7	L127	L127-A129 PolarHBondContact O-N 2.89Å
130	E	62.8	Low	52	Low	122 Å²	122	96.4 Å²	96.4	57%	0.57	56%	0.556	S	S	*	*	S	Bend	trans	-98.5	122.7	171.8	-67.7	-168.6	162.1	0	0	110.6	L127 G132 F133	L127-E130 PolarHBondContact O-N 2.8Å; E130-G132 PolarHBondContact O-N 2.89Å; E130-G132 VanDerWaalsContact O-N 3.12Å; E130-F133 WeakPolarHBondContact O-CB 3.48Å; E130-F133 PolarHBondContact O-N 3.35Å
131	D	57.3	Low	52.5	Low	146 Å²	146	97.9 Å²	97.9	78%	0.781	56%	0.555	S	S	*	*	H	α-helix	trans	-53.8	-37.1	-176.8	-66.3	-51.6	0	0	0	113.2	F133 N134 E135	D131-F133 PolarHBondContact O-N 3.23Å; D131-N134 PolarHBondContact O-N 3.41Å; D131-E135 PolarHBondContact O-N 2.89Å
132	G	67	Low	52.6	Low	43 Å²	43	100.4 Å²	100.4	44%	0.443	56%	0.562	S	S	.	*	H	α-helix	trans	-63.8	-20	177.9	0	0	0	0	0	114.7	E130 F136	E130-G132 PolarHBondContact O-N 2.89Å; E130-G132 VanDerWaalsContact O-N 3.12Å; G132-F136 WeakPolarHBondContact O-CB 3.46Å; G132-F136 PolarHBondContact O-N 2.69Å
133	F	50.7	Low	52.8	Low	68 Å²	68	108.1 Å²	108.1	30%	0.298	58%	0.578	S	S	.	*	H	α-helix	trans	-76.4	-37.7	174.9	-168.9	-111.7	0	0	0	111.7	L127 E130 D131 L137	L127-F133 WeakPolarHBondContact O-CB 3.43Å; E130-F133 WeakPolarHBondContact O-CB 3.48Å; E130-F133 PolarHBondContact O-N 3.35Å; D131-F133 PolarHBondContact O-N 3.23Å; F133-L137 HydrophobicContact CD1-CD1 4.05Å; F133-L137 HydrophobicContact CE1-CD1 3.74Å; F133-L137 HydrophobicContact CZ-CD1 4.25Å; F133-L137 WeakPolarHBondContact O-CB 3.45Å; F133-L137 PolarHBondContact O-N 3.19Å
134	N	54.4	Low	53.1	Low	90 Å²	90	110.1 Å²	110.1	48%	0.481	59%	0.588	S	S	.	*	H	α-helix	trans	-70.9	-35.3	172	-82.4	-34.8	0	0	0	112.3	D131 L137 S138	D131-N134 PolarHBondContact O-N 3.41Å; N134-L137 PolarHBondContact O-N 3.16Å; N134-S138 PolarHBondContact O-N 3.48Å; N134-S138 PolarHBondContact O-OG 3.08Å
135	E	60.1	Low	53.5	Low	139 Å²	139	114.4 Å²	114.4	65%	0.65	61%	0.606	S	S	*	*	H	α-helix	trans	-61.9	-47.7	172.2	-168.8	176.8	-145.9	0	0	110.7	D131 L137 S138 V139	D131-E135 PolarHBondContact O-N 2.89Å; E135-L137 PolarHBondContact O-N 3.13Å; E135-S138 PolarHBondContact O-N 2.74Å; E135-S138 VanDerWaalsContact O-N 3.15Å; E135-V139 WeakPolarHBondContact O-CG2 3.32Å; E135-V139 PolarHBondContact O-N 2.97Å
136	F	52	Low	53	Low	123 Å²	123	116 Å²	116	54%	0.539	62%	0.616	S	S	.	*	H	α-helix	trans	-59.4	-41.6	175	-178.1	-100.2	0	0	0	113	G132 S138 H140	G132-F136 WeakPolarHBondContact O-CB 3.46Å; G132-F136 PolarHBondContact O-N 2.69Å; F136-S138 VanDerWaalsContact C-N 3.32Å; F136-S138 PolarHBondContact O-N 3.44Å; F136-H140 AromaticContact CD2-CD2 3.98Å; F136-H140 AromaticContact CE2-CD2 3.5Å; F136-H140 VanDerWaalsContact CE2-CD2 3.5Å; F136-H140 WeakPolarHBondContact CE2-CD2 3.4Å; F136-H140 AromaticContact CE2-NE2 3.83Å; F136-H140 AromaticContact CZ-CD2 3.72Å; F136-H140 PolarHBondContact O-N 2.82Å
137	L	61.5	Low	52.5	Low	84 Å²	84	119.1 Å²	119.1	44%	0.44	63%	0.626	S	S	.	*	H	α-helix	trans	-66.9	-28.9	175.8	-97.1	160.1	0	0	0	113.6	F133 N134 E135 Q141	F133-L137 HydrophobicContact CD1-CD1 4.05Å; F133-L137 HydrophobicContact CE1-CD1 3.74Å; F133-L137 HydrophobicContact CZ-CD1 4.25Å; F133-L137 WeakPolarHBondContact O-CB 3.45Å; F133-L137 PolarHBondContact O-N 3.19Å; N134-L137 PolarHBondContact O-N 3.16Å; E135-L137 PolarHBondContact O-N 3.13Å; L137-Q141 WeakPolarHBondContact O-CG 3.36Å; L137-Q141 PolarHBondContact O-NE2 3.01Å
138	S	55.3	Low	51.7	Low	86 Å²	86	121.2 Å²	121.2	60%	0.601	64%	0.643	S	S	*	*	H	α-helix	trans	-78.1	-41	176.2	-59.1	0	0	0	0	111.9	N134 E135 F136 H140	N134-S138 PolarHBondContact O-N 3.48Å; N134-S138 PolarHBondContact O-OG 3.08Å; E135-S138 PolarHBondContact O-N 2.74Å; E135-S138 VanDerWaalsContact O-N 3.15Å; F136-S138 VanDerWaalsContact C-N 3.32Å; F136-S138 PolarHBondContact O-N 3.44Å; S138-H140 VanDerWaalsContact C-N 3.26Å; S138-H140 PolarHBondContact O-N 3.05Å
139	V	58.6	Low	50.9	Low	108 Å²	108	127.3 Å²	127.3	66%	0.655	66%	0.661	S	S	*	*	H	α-helix	trans	-69	-20.8	-177.8	171.5	0	0	0	0	113.3	E135	E135-V139 WeakPolarHBondContact O-CG2 3.32Å; E135-V139 PolarHBondContact O-N 2.97Å
140	H	49.9	Very low	49.8	Very low	131 Å²	131	127.8 Å²	127.8	61%	0.606	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	16.7	-176.9	-81.5	-47.6	0	0	0	116.3	F136 S138	F136-H140 AromaticContact CD2-CD2 3.98Å; F136-H140 AromaticContact CE2-CD2 3.5Å; F136-H140 VanDerWaalsContact CE2-CD2 3.5Å; F136-H140 WeakPolarHBondContact CE2-CD2 3.4Å; F136-H140 AromaticContact CE2-NE2 3.83Å; F136-H140 AromaticContact CZ-CD2 3.72Å; F136-H140 PolarHBondContact O-N 2.82Å; S138-H140 VanDerWaalsContact C-N 3.26Å; S138-H140 PolarHBondContact O-N 3.05Å
141	Q	50.8	Low	48.2	Very low	140 Å²	140	129.2 Å²	129.2	65%	0.654	68%	0.676	S	S	*	*	S	Bend	trans	-79.8	148	168	-72.4	178.8	38.7	0	0	112.3	L137	L137-Q141 WeakPolarHBondContact O-CG 3.36Å; L137-Q141 PolarHBondContact O-NE2 3.01Å
142	N	39.8	Very low	46.8	Very low	130 Å²	130	130 Å²	130	70%	0.695	68%	0.68	S	S	*	*			trans	-67.7	134.3	-175.8	-80.5	-10.6	0	0	0	112.1	S144 Q145	N142-S144 PolarHBondContact O-N 3.16Å; N142-Q145 PolarHBondContact O-N 3.09Å; N142-Q145 VanDerWaalsContact O-N 3.17Å
143	R	43.6	Very low	45	Very low	247 Å²	247	136.4 Å²	136.4	93%	0.932	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-0	-177.4	-160	177.7	177.5	-164.1	-1.6	115.5
144	S	50.9	Low	44.1	Very low	106 Å²	106	137 Å²	137	74%	0.741	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-0.5	176.2	55.1	0	0	0	0	114.9	N142	N142-S144 PolarHBondContact O-N 3.16Å
145	Q	54.3	Low	42.9	Very low	178 Å²	178	142 Å²	142	83%	0.832	74%	0.739	S	S	*	*	S	Bend	trans	-126.7	4.4	174	-70.5	-169.5	-35.4	0	0	114.3	N142 Q147	N142-Q145 PolarHBondContact O-N 3.09Å; N142-Q145 VanDerWaalsContact O-N 3.17Å; Q145-Q147 PolarHBondContact O-N 3.09Å
146	A	37	Very low	41.3	Very low	72 Å²	72	142.8 Å²	142.8	60%	0.595	75%	0.747	S	S	*	*			trans	-82.4	103.7	173.6	0	0	0	0	0	110.7	T148	A146-T148 PolarHBondContact O-N 3.06Å
147	Q	41.1	Very low	40.8	Very low	198 Å²	198	142.4 Å²	142.4	93%	0.925	76%	0.757	S	S	*	*			trans	-77.5	107.9	176.2	-174.1	171.2	-14	0	0	110	Q145 W149	Q145-Q147 PolarHBondContact O-N 3.09Å; Q147-W149 PolarHBondContact O-N 3.17Å
148	T	36.5	Very low	39	Very low	128 Å²	128	143 Å²	143	79%	0.785	77%	0.774	S	S	*	*			trans	-77.5	113.3	-172.4	48.4	0	0	0	0	113.1	A146	A146-T148 PolarHBondContact O-N 3.06Å
149	W	33.2	Very low	37.6	Very low	250 Å²	250	146 Å²	146	95%	0.947	78%	0.783	S	S	*	*			trans	39.1	107.5	156.1	-69.6	-17.9	0	0	0	120.3	Q147	Q147-W149 PolarHBondContact O-N 3.17Å
150	A	29.5	Very low	36	Very low	94 Å²	94	145.5 Å²	145.5	78%	0.777	79%	0.785	S	S	*	*				-146.1	142.6	126.2	0	0	0	0	0	107.2
151	N	29.7	Very low	34.8	Very low	153 Å²	153	142.4 Å²	142.4	82%	0.818	79%	0.788	S	S	*	*			cis	-154.8	158.7	-9.4	-118.1	-1.9	0	0	0	107.6
152	D	27.8	Very low	33.5	Very low	161 Å²	161	139.5 Å²	139.5	86%	0.861	80%	0.796	S	S	*	*			trans	-131.3	101.1	162.9	-163	3.1	0	0	0	109.9
153	M	28	Very low	32.8	Very low	179 Å²	179	139.5 Å²	139.5	88%	0.882	80%	0.8	S	S	*	*			trans	-153.4	136.2	174.5	-110	-68.1	170.1	0	0	106.9
154	A	32.6	Very low	32	Very low	80 Å²	80	136.1 Å²	136.1	66%	0.661	80%	0.795	S	S	*	*			trans	-97.9	156.4	-147.4	0	0	0	0	0	115.9
155	Q	28.9	Very low	30.8	Very low	196 Å²	196	141 Å²	141	92%	0.916	80%	0.803	S	S	*	*			trans	74.5	130.9	156.2	-69.6	174.4	-15.9	0	0	120
156	D	26.8	Very low	29.4	Very low	155 Å²	155	140.6 Å²	140.6	83%	0.829	80%	0.801	S	S	*	*			trans	-58.9	172.7	161.8	-81.1	-62.4	0	0	0	114.3
157	P	41.4	Very low	28.8	Very low	115 Å²	115	145.8 Å²	145.8	75%	0.747	81%	0.81	S	S	*	*			cis	-134.5	-176.9	-4.6	23.8	0.6	0	0	0	115.3
158	A	24	Very low	27.8	Very low	95 Å²	95	145.3 Å²	145.3	79%	0.785	81%	0.805	S	S	*	*			trans	106.6	123	134.5	0	0	0	0	0	121.5
159	D	25.7	Very low	27.5	Very low	149 Å²	149	149 Å²	149	80%	0.797	81%	0.81	S	S	*	*			trans	92.6	148.2	138.9	-153.4	42	0	0	0	122.8
160	S	24.6	Very low	27	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	81%	0.808	S	S	*	*			trans	2.7	154.5	166.7	68.3	0	0	0	0	122.9
161	G	24.4	Very low	27	Very low	66 Å²	66	147.6 Å²	147.6	68%	0.68	80%	0.804	S	S	*	*				158.2	-32.1	129	0	0	0	0	0	121.4
162	G	24.4	Very low	27.2	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	80%	0.798	S	S	*	*			trans	58.9	-151	173.3	0	0	0	0	0	118.2
163	V	25	Very low	27.4	Very low	130 Å²	130	142.5 Å²	142.5	79%	0.788	80%	0.795	S	S	*	*			trans	71	107.9	178.7	-170.3	0	0	0	0	118.6
164	Q	27	Very low	27.3	Very low	176 Å²	176	140.8 Å²	140.8	82%	0.822	79%	0.79	S	S	*	*			trans	8.9	139.5	143.1	-52.4	175.6	0.1	0	0	120.6
165	K	25.5	Very low	27	Very low	208 Å²	208	144.6 Å²	144.6	90%	0.904	80%	0.799	S	S	*	*				-160.3	134	118.5	-109.8	155.5	-169.5	169.5	0	114.5
166	Q	25.3	Very low	27.3	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.794	79%	0.789	S	S	*	*			trans	-81.9	148.9	153.1	-62.2	173.9	-18.3	0	0	108.9
167	K	23	Very low	27.8	Very low	180 Å²	180	139.3 Å²	139.3	78%	0.783	77%	0.765	S	S	*	*				175.3	138.1	108.3	-97.3	171.6	-179.3	172.4	0	114.7
168	K	21.2	Very low	27.4	Very low	189 Å²	189	137.5 Å²	137.5	82%	0.822	75%	0.749	S	S	*	*			trans	46.4	124.6	137.9	-66.1	-171.9	172.4	-167.1	0	121.3
169	K	30.7	Very low	27.7	Very low	206 Å²	206	140.1 Å²	140.1	90%	0.896	74%	0.743	S	S	*	*			trans	-38.9	142.3	143.2	-56.6	-179.9	172.5	-167.6	0	113.5
170	K	21.9	Very low	28.2	Very low	205 Å²	205	139 Å²	139	89%	0.891	74%	0.736	S	S	*	*				-158.4	163.5	122.2	-100	-131.8	168.5	-167.3	0	110
171	P	28.5	Very low	28.6	Very low	109 Å²	109	139.1 Å²	139.1	71%	0.708	74%	0.737	S	S	*	*			trans	-123.3	-169.1	-151.8	44.7	-32.8	0	0	0	114.7
172	A	35.3	Very low	28.8	Very low	84 Å²	84	143.1 Å²	143.1	69%	0.694	74%	0.743	S	S	*	*			trans	73.4	155	166.5	0	0	0	0	0	114.5
173	P	30.7	Very low	29	Very low	123 Å²	123	147.4 Å²	147.4	80%	0.799	74%	0.742	S	S	*	*			cis	-109.4	-168.2	17.9	43.5	-34.5	0	0	0	115.3
174	D	27.3	Very low	29.3	Very low	143 Å²	143	145.8 Å²	145.8	77%	0.765	74%	0.736	S	S	*	*			trans	-104.4	162	-161	-29.3	-81.7	0	0	0	112.1
175	D	26.3	Very low	29.7	Very low	159 Å²	159	145.7 Å²	145.7	85%	0.85	74%	0.736	S	S	*	*			trans	-161	156.2	156.1	-104.3	-29.2	0	0	0	109
176	Y	34.1	Very low	29.6	Very low	181 Å²	181	141.7 Å²	141.7	71%	0.71	72%	0.724	S	S	*	*			trans	-66.4	127.2	-164.1	-65.1	-135	0	0	0	116.3
177	L	38.3	Very low	29.7	Very low	60 Å²	60	141.7 Å²	141.7	31%	0.314	72%	0.724	S	S	.	*				155.4	179	121.8	-50.3	122.9	0	0	0	116.3	D192 D193 D194	L177-D192 HydrophobicContact CB-CB 3.58Å; L177-D192 HydrophobicContact CD1-CB 3.9Å; L177-D192 HydrophobicContact CG-CB 4.01Å; L177-D193 HydrophobicContact CB-CB 3.62Å; L177-D193 HydrophobicContact CD2-CB 3.68Å; L177-D193 HydrophobicContact CG-CB 3.37Å; L177-D194 HydrophobicContact CD2-CB 3.85Å; L177-D194 WeakPolarHBondContact CD2-OD2 3.4Å
178	N	32.3	Very low	29.9	Very low	77 Å²	77	140.6 Å²	140.6	41%	0.412	72%	0.72	S	S	.	*			cis	-161	127.2	0.1	172.2	-127	0	0	0	116	D192 D193	N178-D192 CarbonylContact C-O 3.52Å; N178-D192 WeakPolarHBondContact CA-O 3.46Å; N178-D192 PolarHBondContact ND2-N 3.4Å; N178-D192 PolarHBondContact ND2-O 3.38Å; N178-D193 VanDerWaalsContact C-CG 3.4Å; N178-D193 VanDerWaalsContact CA-CB 3.44Å; N178-D193 WeakPolarHBondContact CA-OD2 3.3Å; N178-D193 PolarHBondContact N-OD2 3.28Å; N178-D193 VanDerWaalsContact N-OD2 3.09Å
179	F	30.4	Very low	30.3	Very low	150 Å²	150	137 Å²	137	66%	0.658	71%	0.705	S	S	*	*			trans	-140.9	145.9	179.7	-176.6	-113.8	0	0	0	119.1	D192 D193	F179-D192 PolarHBondContact N-O 3.13Å; F179-D193 HydrophobicContact CB-CB 4.47Å; F179-D193 WeakPolarHBondContact CB-OD1 3.26Å; F179-D193 WeakPolarHBondContact CB-OD2 3.26Å; F179-D193 VanDerWaalsContact N-CG 3.27Å; F179-D193 PolarHBondContact N-OD2 3.12Å; F179-D193 VanDerWaalsContact N-OD2 3.15Å
180	D	35.5	Very low	30.1	Very low	125 Å²	125	134.1 Å²	134.1	67%	0.668	70%	0.7	S	S	*	*			trans	69.8	118.5	167.4	-124.8	3.9	0	0	0	125.1
181	S	33.9	Very low	30.5	Very low	101 Å²	101	128.6 Å²	128.6	71%	0.706	68%	0.68	S	S	*	*			trans	52.4	105.4	144.6	-174.4	0	0	0	0	123.8
182	D	28.8	Very low	30.5	Very low	151 Å²	151	128 Å²	128	81%	0.807	67%	0.671	S	S	*	*				-171	-157.1	97.9	-153	-8.2	0	0	0	112.6	S184	D182-S184 PolarHBondContact O-N 3.44Å
183	E	28.2	Very low	30.3	Very low	169 Å²	169	127 Å²	127	79%	0.79	65%	0.654	S	S	*	*			trans	-57.5	118.2	-173.1	-72.3	-163.1	120.2	0	0	117.2
184	S	30.1	Very low	30.3	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	64%	0.643	S	S	*	*				53.8	151.4	129.9	75	0	0	0	0	123.6	D182	D182-S184 PolarHBondContact O-N 3.44Å
185	E	35.8	Very low	30.4	Very low	174 Å²	174	125.7 Å²	125.7	81%	0.813	64%	0.64	S	S	*	*			trans	78.2	95.4	166.3	-52.6	-160.7	151.2	0	0	116.2	E187	E185-E187 CarbonylContact O-C 3.57Å; E185-E187 VanDerWaalsContact O-C 3.32Å
186	D	24.7	Very low	30.5	Very low	123 Å²	123	124.3 Å²	124.3	66%	0.658	63%	0.633	S	S	*	*			trans	-81.5	126.5	153.4	-123.3	74.5	0	0	0	108.8	K188 H189	D186-K188 WeakPolarHBondContact OD1-CA 3.34Å; D186-K188 WeakPolarHBondContact OD2-CA 3.14Å; D186-H189 WeakPolarHBondContact OD1-CB 3.5Å; D186-H189 PolarHBondContact OD1-N 2.58Å
187	E	26.1	Very low	30.2	Very low	170 Å²	170	121.8 Å²	121.8	79%	0.794	63%	0.632	S	S	*	*	S	Bend	cis	-70	119.5	15.8	-58.4	-177.4	-143.7	0	0	114.8	E185	E185-E187 CarbonylContact O-C 3.57Å; E185-E187 VanDerWaalsContact O-C 3.32Å
188	K	27.8	Very low	29.6	Very low	158 Å²	158	125.2 Å²	125.2	69%	0.687	65%	0.65	S	S	*	*			cis	-156.7	159.1	15.4	-57.4	-172.6	-180	175.5	0	115.4	D186	D186-K188 WeakPolarHBondContact OD1-CA 3.34Å; D186-K188 WeakPolarHBondContact OD2-CA 3.14Å
189	H	28.9	Very low	29.4	Very low	113 Å²	113	127.9 Å²	127.9	52%	0.523	66%	0.664	S	S	.	*			trans	-124.1	130.8	176.5	177.7	-32.8	0	0	0	112	D186 D191	D186-H189 WeakPolarHBondContact OD1-CB 3.5Å; D186-H189 PolarHBondContact OD1-N 2.58Å; H189-D191 IonicContact CE1-OD1 2.73Å; H189-D191 PolarHBondContact CE1-OD1 3.25Å; H189-D191 VanDerWaalsContact CE1-OD1 3.25Å; H189-D191 IonicContact ND1-OD1 3.58Å
190	D	26.9	Very low	29.2	Very low	145 Å²	145	127.3 Å²	127.3	78%	0.775	67%	0.668	S	S	*	*			trans	-154.8	97.2	165.8	-63.1	-72.1	0	0	0	104
191	D	29.6	Very low	28.9	Very low	90 Å²	90	127.9 Å²	127.9	48%	0.481	67%	0.672	S	S	.	*				68.8	140	102.7	-59.7	-24.5	0	0	0	116	H189	H189-D191 IonicContact CE1-OD1 2.73Å; H189-D191 PolarHBondContact CE1-OD1 3.25Å; H189-D191 VanDerWaalsContact CE1-OD1 3.25Å; H189-D191 IonicContact ND1-OD1 3.58Å
192	D	30.1	Very low	28.5	Very low	96 Å²	96	130.7 Å²	130.7	51%	0.513	67%	0.673	S	S	.	*			trans	139.2	122.8	-166.3	44.8	-93.4	0	0	0	115.1	L177 N178 F179	L177-D192 HydrophobicContact CB-CB 3.58Å; L177-D192 HydrophobicContact CD1-CB 3.9Å; L177-D192 HydrophobicContact CG-CB 4.01Å; N178-D192 CarbonylContact C-O 3.52Å; N178-D192 WeakPolarHBondContact CA-O 3.46Å; N178-D192 PolarHBondContact ND2-N 3.4Å; N178-D192 PolarHBondContact ND2-O 3.38Å; F179-D192 PolarHBondContact N-O 3.13Å
193	D	30.5	Very low	28.5	Very low	62 Å²	62	128.6 Å²	128.6	33%	0.332	66%	0.662	S	S	.	*			trans	-168.9	-167.7	-171.7	-144.9	-25.7	0	0	0	112.5	L177 N178 F179	L177-D193 HydrophobicContact CB-CB 3.62Å; L177-D193 HydrophobicContact CD2-CB 3.68Å; L177-D193 HydrophobicContact CG-CB 3.37Å; N178-D193 VanDerWaalsContact C-CG 3.4Å; N178-D193 VanDerWaalsContact CA-CB 3.44Å; N178-D193 WeakPolarHBondContact CA-OD2 3.3Å; N178-D193 PolarHBondContact N-OD2 3.28Å; N178-D193 VanDerWaalsContact N-OD2 3.09Å; F179-D193 HydrophobicContact CB-CB 4.47Å; F179-D193 WeakPolarHBondContact CB-OD1 3.26Å; F179-D193 WeakPolarHBondContact CB-OD2 3.26Å; F179-D193 VanDerWaalsContact N-CG 3.27Å; F179-D193 PolarHBondContact N-OD2 3.12Å; F179-D193 VanDerWaalsContact N-OD2 3.15Å
194	D	30.4	Very low	28.4	Very low	109 Å²	109	128.1 Å²	128.1	58%	0.583	66%	0.657	S	S	*	*			trans	53.1	125.2	161.8	-69	-2.9	0	0	0	116	L177	L177-D194 HydrophobicContact CD2-CB 3.85Å; L177-D194 WeakPolarHBondContact CD2-OD2 3.4Å
195	D	28.8	Very low	28.2	Very low	131 Å²	131	129.4 Å²	129.4	70%	0.701	66%	0.661	S	S	*	*			cis	-160.5	-155.7	1.2	-139.9	-15.2	0	0	0	107
196	D	28.6	Very low	27.7	Very low	129 Å²	129	126.2 Å²	126.2	69%	0.69	66%	0.658	S	S	*	*			trans	-10.3	147.2	146.3	-60.2	-20	0	0	0	117.4
197	D	27.9	Very low	27.8	Very low	129 Å²	129	125.2 Å²	125.2	69%	0.69	66%	0.661	S	S	*	*			cis	-168.5	179.1	14.5	-129.9	-25.5	0	0	0	112.5
198	D	26.7	Very low	28	Very low	132 Å²	132	126.9 Å²	126.9	71%	0.706	67%	0.665	S	S	*	*			trans	66.9	146.1	146.8	-76.5	-22.3	0	0	0	125.4
199	D	27	Very low	28	Very low	132 Å²	132	128.2 Å²	128.2	71%	0.706	67%	0.674	S	S	*	*			trans	69.8	104.7	143.4	-71	0.3	0	0	0	125.1
200	D	27.2	Very low	28	Very low	139 Å²	139	127 Å²	127	74%	0.743	68%	0.684	S	S	*	*				66.3	124.8	113.8	-80.9	3.8	0	0	0	125.2
201	D	28.2	Very low	28.4	Very low	137 Å²	137	127.9 Å²	127.9	73%	0.733	69%	0.688	S	S	*	*			trans	71	140.7	132.1	-89.9	-12.2	0	0	0	127.1
202	E	27.3	Very low	28.6	Very low	159 Å²	159	132.3 Å²	132.3	74%	0.743	70%	0.703	S	S	*	*			trans	40	127.2	145.8	-61.3	-154.3	139.2	0	0	125
203	D	27	Very low	28.9	Very low	107 Å²	107	133.2 Å²	133.2	57%	0.572	72%	0.716	S	S	*	*			trans	69.6	119.3	132.5	-92.1	-17.2	0	0	0	124.8
204	K	26.8	Very low	29	Very low	159 Å²	159	133.9 Å²	133.9	69%	0.691	74%	0.738	S	S	*	*				78.7	111.8	124.9	-73.6	167.5	-173.3	139.5	0	123.2
205	V	25.5	Very low	29.3	Very low	123 Å²	123	137.3 Å²	137.3	75%	0.745	76%	0.755	S	S	*	*				85.1	126.2	118.8	172.4	0	0	0	0	120
206	S	25.7	Very low	29.8	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	75%	0.75	S	S	*	*			trans	72.3	145.7	159.8	77.3	0	0	0	0	117.3
207	S	26.7	Very low	30.2	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	75%	0.746	S	S	*	*			cis	-165.3	138.1	-12.4	42.7	0	0	0	0	111.1
208	K	30.5	Very low	31.5	Very low	205 Å²	205	135.9 Å²	135.9	89%	0.891	75%	0.747	S	S	*	*				-179.5	137.7	127.9	-105.8	171.7	-177.9	175.1	0	114.4
209	E	27.8	Very low	32.6	Very low	185 Å²	185	135.3 Å²	135.3	86%	0.864	74%	0.743	S	S	*	*			trans	-66.3	156.5	155.8	-70	156.1	105.7	0	0	110.7
210	A	28.4	Very low	33.7	Very low	88 Å²	88	136.7 Å²	136.7	73%	0.727	74%	0.74	S	S	*	*			cis	-158.7	165.2	-3.1	0	0	0	0	0	109.4
211	L	34.9	Very low	34.6	Very low	164 Å²	164	136 Å²	136	86%	0.859	74%	0.736	S	S	*	*			trans	-167.7	99.8	132.4	-104.4	170.6	0	0	0	112
212	K	35	Very low	35.3	Very low	183 Å²	183	139.4 Å²	139.4	80%	0.796	74%	0.738	S	S	*	*			trans	35.8	115.2	152.5	-65.6	-172.7	175.8	-174.4	0	121
213	S	35.1	Very low	36.1	Very low	114 Å²	114	135.7 Å²	135.7	80%	0.797	73%	0.73	S	S	*	*			trans	48.8	103.8	137.1	61.6	0	0	0	0	119.3
214	G	33	Very low	36.7	Very low	77 Å²	77	139 Å²	139	79%	0.794	74%	0.739	S	S	*	*			trans	-83.8	-178	152.3	0	0	0	0	0	112.3
215	L	37	Very low	37.4	Very low	181 Å²	181	137.9 Å²	137.9	95%	0.948	75%	0.745	S	S	*	*			trans	-147.9	160.1	165.5	-106.3	166.9	0	0	0	109.6
216	S	38.8	Very low	37.8	Very low	84 Å²	84	136.2 Å²	136.2	59%	0.587	75%	0.745	S	S	*	*			trans	-98.1	138.2	-162.5	-167.6	0	0	0	0	114.1	K218	S216-K218 PolarHBondContact O-N 3.14Å
217	D	37.1	Very low	38	Very low	113 Å²	113	139.7 Å²	139.7	60%	0.604	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	64.6	177.8	-169.8	22.5	0	0	0	112.8	Y220	D217-Y220 VanDerWaalsContact OD1-CB 3.28Å; D217-Y220 WeakPolarHBondContact OD1-CB 3.34Å
218	K	55.6	Low	37.9	Very low	162 Å²	162	142.1 Å²	142.1	70%	0.704	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	-18.8	173.9	-72.9	-173.5	176	175.7	0	114.1	S216	S216-K218 PolarHBondContact O-N 3.14Å
219	D	49.2	Very low	38	Very low	119 Å²	119	141.3 Å²	141.3	64%	0.636	76%	0.761	S	S	*	*	S	Bend	trans	-91.2	-24.6	174.6	-64.8	-57.1	0	0	0	113.2	L221 R222 S223	D219-L221 VanDerWaalsContact C-N 3.3Å; D219-L221 PolarHBondContact O-N 2.94Å; D219-R222 PolarHBondContact O-N 2.86Å; D219-S223 PolarHBondContact O-N 2.98Å
220	Y	50.6	Low	37.9	Very low	161 Å²	161	141.2 Å²	141.2	63%	0.631	76%	0.761	S	S	*	*	H	α-helix	trans	-59.8	-39.5	177.3	-170	-111.1	0	0	0	112.1	D217 R222 S223	D217-Y220 VanDerWaalsContact OD1-CB 3.28Å; D217-Y220 WeakPolarHBondContact OD1-CB 3.34Å; Y220-R222 VanDerWaalsContact C-N 3.3Å; Y220-R222 PolarHBondContact O-N 3.42Å; Y220-S223 VanDerWaalsContact O-CB 3.28Å; Y220-S223 WeakPolarHBondContact O-CB 3.45Å; Y220-S223 PolarHBondContact O-N 3.16Å; Y220-S223 VanDerWaalsContact O-N 3.13Å
221	L	45.6	Very low	37.9	Very low	126 Å²	126	145.4 Å²	145.4	66%	0.66	77%	0.765	S	S	*	*	H	α-helix	trans	-70.2	-19	177.1	-82.4	85.3	0	0	0	114.3	D219	D219-L221 VanDerWaalsContact C-N 3.3Å; D219-L221 PolarHBondContact O-N 2.94Å
222	R	44.6	Very low	37.4	Very low	208 Å²	208	142 Å²	142	79%	0.785	76%	0.755	S	S	*	*	H	α-helix	trans	-76.9	-24.1	170.4	-75	-170.3	171.8	-146.7	1.1	112.6	D219 Y220 K224	D219-R222 PolarHBondContact O-N 2.86Å; Y220-R222 VanDerWaalsContact C-N 3.3Å; Y220-R222 PolarHBondContact O-N 3.42Å; R222-K224 PolarHBondContact O-N 2.88Å
223	S	43.1	Very low	37.2	Very low	80 Å²	80	140.5 Å²	140.5	56%	0.559	76%	0.756	S	S	*	*	H	α-helix	trans	-69.7	-31.5	-172.6	-169.5	0	0	0	0	114.2	D219 Y220 V225	D219-S223 PolarHBondContact O-N 2.98Å; Y220-S223 VanDerWaalsContact O-CB 3.28Å; Y220-S223 WeakPolarHBondContact O-CB 3.45Å; Y220-S223 PolarHBondContact O-N 3.16Å; Y220-S223 VanDerWaalsContact O-N 3.13Å; S223-V225 PolarHBondContact O-N 3.33Å
224	K	39.9	Very low	37	Very low	176 Å²	176	143.5 Å²	143.5	77%	0.765	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	7.3	-164.7	-145.2	169.5	-173.2	171.2	0	116.5	R222	R222-K224 PolarHBondContact O-N 2.88Å
225	V	40.4	Very low	36.9	Very low	137 Å²	137	147.2 Å²	147.2	83%	0.83	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-7.3	-175.6	-177.8	0	0	0	0	112.9	S223	S223-V225 PolarHBondContact O-N 3.33Å
226	A	34.2	Very low	36.4	Very low	88 Å²	88	144.8 Å²	144.8	73%	0.727	74%	0.742	S	S	*	*	S	Bend	trans	-128.4	47.7	-172.9	0	0	0	0	0	113.9
227	Q	30	Very low	36	Very low	181 Å²	181	149.9 Å²	149.9	85%	0.846	76%	0.756	S	S	*	*			trans	-138.6	86.4	170.8	-101.1	-173	-6	0	0	112.7
228	T	25.1	Very low	35.7	Very low	152 Å²	152	148.3 Å²	148.3	93%	0.933	76%	0.759	S	S	*	*			trans	-165.2	77.1	140	27.2	0	0	0	0	107.4
229	M	32.3	Very low	34.5	Very low	189 Å²	189	147.3 Å²	147.3	93%	0.931	76%	0.761	S	S	*	*			trans	-151.4	111.9	171.2	-169	163.8	177.4	0	0	110
230	E	26.9	Very low	33.8	Very low	183 Å²	183	149.6 Å²	149.6	86%	0.855	77%	0.769	S	S	*	*			trans	-131	151	167.4	-68.6	171.9	148.9	0	0	104.6
231	E	28	Very low	32.9	Very low	175 Å²	175	150.3 Å²	150.3	82%	0.818	78%	0.778	S	S	*	*			cis	-154.4	160.8	22.7	-151.9	170.7	-162.4	0	0	111
232	S	24.6	Very low	32.2	Very low	93 Å²	93	153.3 Å²	153.3	65%	0.65	79%	0.788	S	S	*	*			trans	63.1	98.4	158.5	53.6	0	0	0	0	124.2
233	D	31	Very low	31.7	Very low	151 Å²	151	151.8 Å²	151.8	81%	0.807	79%	0.79	S	S	*	*				59.4	156.5	108.5	-49.5	-36.6	0	0	0	122.2
234	E	30.5	Very low	30.9	Very low	177 Å²	177	156.2 Å²	156.2	83%	0.827	80%	0.802	S	S	*	*			cis	-156.4	169.8	22.5	-152.4	167.5	-149.7	0	0	114.8
235	E	30.2	Very low	30.2	Very low	156 Å²	156	150.8 Å²	150.8	73%	0.729	80%	0.795	S	S	*	*			trans	81.3	100.2	160.9	-58.4	-152	140.3	0	0	125.2
236	N	27	Very low	30.2	Very low	129 Å²	129	149.7 Å²	149.7	69%	0.69	79%	0.791	S	S	*	*				80	109.9	117.4	-60.3	-27.6	0	0	0	127.3
237	E	30.2	Very low	29.8	Very low	191 Å²	191	151.4 Å²	151.4	89%	0.893	79%	0.793	S	S	*	*				79.3	147.1	124.3	-74.2	-163.2	168.2	0	0	127.4
238	A	30.8	Very low	29.7	Very low	81 Å²	81	151 Å²	151	67%	0.669	79%	0.791	S	S	*	*			trans	96.9	81.9	150	0	0	0	0	0	122.5
239	D	29.9	Very low	29.8	Very low	140 Å²	140	152 Å²	152	75%	0.749	79%	0.785	S	S	*	*				61.9	122.9	118.8	-49.6	-10	0	0	0	125.1
240	E	34.6	Very low	29.4	Very low	168 Å²	168	146.7 Å²	146.7	79%	0.785	78%	0.778	S	S	*	*				56.2	149.7	124.7	-61.6	176.7	172.4	0	0	121.8
241	E	32.8	Very low	29.2	Very low	176 Å²	176	145.4 Å²	145.4	82%	0.822	78%	0.777	S	S	*	*			cis	-152.5	-171.7	4.9	-136.1	177.5	-173.4	0	0	112
242	E	31	Very low	29.1	Very low	188 Å²	188	143.1 Å²	143.1	88%	0.879	78%	0.78	S	S	*	*			trans	-91.5	-177.1	-174	-51.7	-166.7	139.1	0	0	114.6
243	E	33	Very low	29.3	Very low	176 Å²	176	143.3 Å²	143.3	82%	0.822	79%	0.788	S	S	*	*				-172.5	152.5	73.8	-135	-163.5	173	0	0	114.2
244	E	27.4	Very low	29.2	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.813	79%	0.79	S	S	*	*			trans	52	166	143.5	-77.7	-68.1	129.8	0	0	125.7
245	G	24.2	Very low	29.1	Very low	61 Å²	61	146.1 Å²	146.1	63%	0.629	79%	0.788	S	S	*	*			trans	-121.6	-140.9	-175	0	0	0	0	0	115
246	P	40.2	Very low	28.9	Very low	115 Å²	115	144.4 Å²	144.4	75%	0.747	79%	0.794	S	S	*	*			cis	-143.1	179.2	-10.6	43.7	-25	0	0	0	116.7
247	V	26.8	Very low	28.9	Very low	124 Å²	124	141.5 Å²	141.5	75%	0.752	79%	0.794	S	S	*	*			trans	23.8	130.6	159.8	-62.7	0	0	0	0	124.8
248	Q	27.4	Very low	28.7	Very low	173 Å²	173	140 Å²	140	81%	0.808	79%	0.787	S	S	*	*				167.2	157.6	106.1	-87.4	-157.6	14.4	0	0	116.4
249	H	26.6	Very low	28.5	Very low	173 Å²	173	144.5 Å²	144.5	80%	0.801	79%	0.786	S	S	*	*			trans	-3.5	149.7	166.7	-72.9	-87.1	0	0	0	124.4
250	G	24.2	Very low	28.3	Very low	77 Å²	77	144.6 Å²	144.6	79%	0.794	78%	0.783	S	S	*	*			trans	174.5	114.7	153.8	0	0	0	0	0	115.1
251	D	23.4	Very low	27.8	Very low	155 Å²	155	143.4 Å²	143.4	83%	0.829	78%	0.782	S	S	*	*			trans	-85.9	157.3	178.1	-60	-76.1	0	0	0	114.1
252	S	26	Very low	27.5	Very low	127 Å²	127	142 Å²	142	89%	0.888	78%	0.778	S	S	*	*				164.1	164	126.7	50.4	0	0	0	0	113.1
253	A	28.1	Very low	27.2	Very low	98 Å²	98	138.4 Å²	138.4	81%	0.81	77%	0.774	S	S	*	*			trans	-145.4	146.3	-177.6	0	0	0	0	0	113.1
254	Y	28.9	Very low	26.9	Very low	216 Å²	216	139.4 Å²	139.4	85%	0.847	78%	0.776	S	S	*	*			trans	-167.7	134.4	151.5	69.5	-79.9	0	0	0	106.4
255	E	28.2	Very low	27	Very low	171 Å²	171	137.2 Å²	137.2	80%	0.799	78%	0.776	S	S	*	*				87.7	104.6	52	-164.7	-177	-152.3	0	0	114
256	S	26.3	Very low	27.2	Very low	120 Å²	120	143.2 Å²	143.2	84%	0.839	79%	0.785	S	S	*	*			trans	139	142.6	141.7	-64.7	0	0	0	0	112.7
257	G	26.1	Very low	26.7	Very low	68 Å²	68	143.7 Å²	143.7	70%	0.701	79%	0.788	S	S	*	*			cis	161.7	148.7	-8	0	0	0	0	0	112.4
258	E	27.1	Very low	26.6	Very low	158 Å²	158	147.7 Å²	147.7	74%	0.738	80%	0.796	S	S	*	*			trans	61.3	161.8	159.9	-60	-159.8	156	0	0	119.5
259	R	26.7	Very low	26.6	Very low	176 Å²	176	144.4 Å²	144.4	66%	0.664	80%	0.798	S	S	*	*			cis	-157.2	153.5	-0.8	-133.1	172.9	168.8	117.2	4.8	114.9
260	E	26	Very low	26.5	Very low	143 Å²	143	139.8 Å²	139.8	67%	0.668	80%	0.798	S	S	*	*			trans	27.5	109.3	147.9	-68.7	169.5	-119.3	0	0	125.2
261	N	24	Very low	26.7	Very low	143 Å²	143	143.6 Å²	143.6	77%	0.765	80%	0.8	S	S	*	*				38.8	131.6	108.9	-170.6	26.6	0	0	0	122.9
262	I	25.1	Very low	27	Very low	145 Å²	145	145 Å²	145	74%	0.744	80%	0.798	S	S	*	*				174.7	150.3	127.8	-95.2	162.3	0	0	0	116.7
263	S	25.6	Very low	27.1	Very low	113 Å²	113	148.9 Å²	148.9	79%	0.79	80%	0.8	S	S	*	*			trans	92.5	159.2	157.2	77.9	0	0	0	0	122.2
264	K	27.4	Very low	27.2	Very low	198 Å²	198	151.9 Å²	151.9	86%	0.861	80%	0.797	S	S	*	*			trans	-136.5	162.2	-173.6	-53.3	171.1	-177.7	166.6	0	109.3
265	P	29.8	Very low	27.3	Very low	127 Å²	127	145.3 Å²	145.3	83%	0.825	78%	0.783	S	S	*	*				-146.9	178.6	90.3	37	-19.4	0	0	0	115.4
266	K	27	Very low	27.7	Very low	187 Å²	187	142.9 Å²	142.9	81%	0.813	79%	0.791	S	S	*	*			trans	-107.8	160	166	-73	-173.3	176.4	-176.6	0	110.4
267	P	29.4	Very low	28.1	Very low	126 Å²	126	144.2 Å²	144.2	82%	0.818	78%	0.784	S	S	*	*				-127.8	-176.9	116.4	37.6	-32.4	0	0	0	113.6
268	F	24.7	Very low	28.7	Very low	207 Å²	207	148.3 Å²	148.3	91%	0.908	79%	0.785	S	S	*	*			trans	-92.3	134.3	-175.3	-80.1	-112.7	0	0	0	113.2
269	A	27.3	Very low	29.4	Very low	104 Å²	104	149.7 Å²	149.7	86%	0.86	79%	0.792	S	S	*	*			trans	-156.3	143.7	139.5	0	0	0	0	0	107.7
270	G	26.2	Very low	30.7	Very low	77 Å²	77	148.2 Å²	148.2	79%	0.794	79%	0.794	S	S	*	*			trans	-117.7	142.4	-175.3	0	0	0	0	0	112.8
271	N	27.8	Very low	31.9	Very low	156 Å²	156	148.6 Å²	148.6	83%	0.834	80%	0.796	S	S	*	*			trans	-149.7	165.7	150.9	-143.5	-15.6	0	0	0	111.7
272	K	28.9	Very low	33.2	Very low	184 Å²	184	144.2 Å²	144.2	80%	0.8	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-74	141.6	-169.1	-58.7	162.5	-175.6	170.2	0	111.8
273	K	27.7	Very low	34.7	Very low	210 Å²	210	142.3 Å²	142.3	91%	0.913	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-80.7	122.3	152.4	-81.7	-170.1	172.6	-173.2	0	108.2
274	Q	32	Very low	36.6	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-75.5	143.9	162.2	-78.3	164	-96.6	0	0	109.3
275	S	30.8	Very low	38.6	Very low	79 Å²	79	135 Å²	135	55%	0.552	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-90.9	142	176.4	43.7	0	0	0	0	110.5	Q277	S275-Q277 PolarHBondContact O-N 3.42Å
276	A	35.1	Very low	41.1	Very low	119 Å²	119	132.5 Å²	132.5	98%	0.983	71%	0.71	S	S	*	*	S	Bend	trans	-73.6	66.2	179.5	0	0	0	0	0	112.1
277	Q	36.5	Very low	43.8	Very low	148 Å²	148	123.7 Å²	123.7	69%	0.692	67%	0.672	S	S	*	*			trans	-124.8	0.6	-172.5	-156.8	165.8	17.3	0	0	113	S275	S275-Q277 PolarHBondContact O-N 3.42Å
278	E	38.1	Very low	46.6	Very low	155 Å²	155	117.7 Å²	117.7	72%	0.724	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-81.6	-15.1	-174.5	-71.9	172.3	146.4	0	0	114.3	M280	E278-M280 VanDerWaalsContact C-N 3.33Å; E278-M280 PolarHBondContact O-N 3.26Å
279	E	41.4	Very low	49.7	Very low	186 Å²	186	110.4 Å²	110.4	87%	0.869	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-81.1	-2.9	-179.1	-65	-161.8	158.9	0	0	115.1
280	M	54	Low	52.6	Low	145 Å²	145	105.5 Å²	105.5	71%	0.714	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-111.4	4.8	-166.7	-158.4	170.4	173.6	0	0	115.5	E278	E278-M280 VanDerWaalsContact C-N 3.33Å; E278-M280 PolarHBondContact O-N 3.26Å
281	E	51.5	Low	55.6	Low	151 Å²	151	107 Å²	107	71%	0.706	54%	0.542	S	S	*	.	S	Bend	trans	-88.7	150.8	174.3	-63.2	-157.9	149.8	0	0	112.2	T283 R315	E281-T283 PolarHBondContact O-N 2.65Å; E281-R315 PolarHBondContact O-NH1 3.17Å
282	P	51.9	Low	58.1	Low	52 Å²	52	101.1 Å²	101.1	34%	0.338	52%	0.519	S	S	.	.			trans	-67.9	119.6	176.4	27.3	-32.9	0	0	0	110.7	T284	P282-T284 VanDerWaalsContact C-N 3.27Å; P282-T284 PolarHBondContact O-N 3.42Å
283	T	56.3	Low	60.8	Low	104 Å²	104	92.5 Å²	92.5	64%	0.638	48%	0.481	S	S	*	.	S	Bend	trans	-75	-14.3	178.3	13	0	0	0	0	113.7	E281 R315 D331	E281-T283 PolarHBondContact O-N 2.65Å; T283-R315 VanDerWaalsContact OG1-CZ 3.24Å; T283-R315 PolarHBondContact OG1-NH2 2.79Å; T283-R315 VanDerWaalsContact OG1-NH2 3.11Å; T283-D331 PolarHBondContact OG1-OD2 3.33Å
284	T	64.9	Low	63.5	Low	50 Å²	50	83.5 Å²	83.5	31%	0.307	44%	0.444	S	S	.	.	S	Bend	trans	-151	150	-175.9	55.5	0	0	0	0	110.9	P282 F286 T287	P282-T284 VanDerWaalsContact C-N 3.27Å; P282-T284 PolarHBondContact O-N 3.42Å; T284-F286 PolarHBondContact O-N 2.75Å; T284-F286 VanDerWaalsContact O-N 3.1Å; T284-T287 PolarHBondContact O-OG1 3.35Å; T284-T287 VanDerWaalsContact O-OG1 3.09Å; T284-T287 PolarHBondContact OG1-OG1 2.98Å
285	D	69.3	Low	65.9	Low	109 Å²	109	81.5 Å²	81.5	58%	0.583	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-0.9	178.4	-59.4	-32.6	0	0	0	114.7	S361	D285-S361 WeakPolarHBondContact CA-OG 3.49Å; D285-S361 WeakPolarHBondContact OD1-CB 3.43Å; D285-S361 PolarHBondContact OD1-OG 3.29Å
286	F	81.8	Confident	68.3	Low	74 Å²	74	84.5 Å²	84.5	33%	0.325	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	34.1	-178.9	-49.4	-56.6	0	0	0	112.2	T284 L332 D335 V338	T284-F286 PolarHBondContact O-N 2.75Å; T284-F286 VanDerWaalsContact O-N 3.1Å; F286-L332 HydrophobicContact CB-CB 4.35Å; F286-L332 WeakPolarHBondContact CB-O 3.19Å; F286-L332 WeakPolarHBondContact O-CB 3.34Å; F286-L332 PolarHBondContact O-N 3.23Å; F286-D335 HydrophobicContact CD1-CB 4.11Å; F286-D335 HydrophobicContact CE1-CB 3.95Å; F286-V338 HydrophobicContact CB-CG2 3.9Å
287	T	84.5	Confident	70.6	Confident	2 Å²	2	79.1 Å²	79.1	1%	0.012	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	133	-179.8	-65.7	0	0	0	0	112.4	T284 Y329 D331 V359	T284-T287 PolarHBondContact O-OG1 3.35Å; T284-T287 VanDerWaalsContact O-OG1 3.09Å; T284-T287 PolarHBondContact OG1-OG1 2.98Å; T287-Y329 HydrophobicContact CG2-CD1 4.22Å; T287-D331 WeakPolarHBondContact CG2-OD1 3.31Å; T287-D331 PolarHBondContact OG1-OD1 3.22Å; T287-V359 HydrophobicContact CG2-CB 4.3Å; T287-V359 PolarHBondContact O-N 3.36Å
288	V	87.5	Confident	72.9	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.7	176.9	179.1	0	0	0	0	110	L290 Y329 V330 L332 V338 A341 V356 F357	V288-L290 HydrophobicContact CG1-CD2 4.35Å; V288-Y329 CarbonylContact O-C 3.6Å; V288-Y329 WeakPolarHBondContact O-CA 3.48Å; V288-V330 PolarHBondContact N-O 2.95Å; V288-V330 PolarHBondContact O-N 3.1Å; V288-L332 HydrophobicContact CG2-CD1 3.75Å; V288-L332 HydrophobicContact CG2-CG 4.47Å; V288-V338 HydrophobicContact CG2-CB 4.31Å; V288-V338 HydrophobicContact CG2-CG1 3.99Å; V288-V338 HydrophobicContact CG2-CG2 4.07Å; V288-A341 HydrophobicContact CG2-CB 4.41Å; V288-V356 HydrophobicContact CG1-CG1 3.4Å; V288-F357 CarbonylContact C-O 3.54Å; V288-F357 WeakPolarHBondContact CA-O 3.4Å
289	K	89.8	Confident	75.1	Confident	54 Å²	54	75 Å²	75	24%	0.235	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.6	177.2	-179.7	177.8	-171.3	156.3	0	111.1	Y327 Y329 F357 V359	K289-Y327 VanDerWaalsContact CE-CD1 3.48Å; K289-Y329 HydrophobicContact CB-CD1 3.97Å; K289-Y329 HydrophobicContact CB-CE1 3.94Å; K289-Y329 HydrophobicContact CD-CD1 4.47Å; K289-Y329 HydrophobicContact CD-CE1 3.64Å; K289-Y329 WeakPolarHBondContact CE-OH 3.47Å; K289-Y329 HydrophobicContact CG-CD1 4.13Å; K289-Y329 HydrophobicContact CG-CE1 3.76Å; K289-Y329 PolarHBondContact NZ-OH 3.44Å; K289-F357 HydrophobicContact CB-CB 4.42Å; K289-F357 PolarHBondContact N-O 3.34Å; K289-F357 PolarHBondContact O-N 3.26Å; K289-V359 HydrophobicContact CB-CG2 3.6Å
290	L	89.3	Confident	77.1	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	138.7	170.2	-48.5	-179	0	0	0	109.9	V288 V293 I302 M306 Y327 V328 V330 I354 E355 V356	V288-L290 HydrophobicContact CG1-CD2 4.35Å; L290-V293 HydrophobicContact CB-CG2 3.83Å; L290-I302 HydrophobicContact CD1-CG2 3.99Å; L290-M306 HydrophobicContact CD1-CE 3.97Å; L290-M306 HydrophobicContact CD2-CE 3.66Å; L290-M306 HydrophobicContact CG-CE 4.34Å; L290-Y327 WeakPolarHBondContact O-CA 3.41Å; L290-V328 HydrophobicContact CB-CB 4.23Å; L290-V328 HydrophobicContact CD1-CB 4.4Å; L290-V328 PolarHBondContact N-O 2.89Å; L290-V328 PolarHBondContact O-N 3.04Å; L290-V330 HydrophobicContact CD1-CG2 3.83Å; L290-V330 HydrophobicContact CG-CG2 4.13Å; L290-I354 HydrophobicContact CB-CG2 3.88Å; L290-I354 HydrophobicContact CD2-CG2 4.14Å; L290-I354 HydrophobicContact CG-CG2 4.47Å; L290-E355 CarbonylContact C-O 3.41Å; L290-E355 WeakPolarHBondContact CA-O 3.06Å; L290-V356 HydrophobicContact CD2-CB 4.38Å; L290-V356 HydrophobicContact CD2-CG1 4.02Å; L290-V356 HydrophobicContact CD2-CG2 3.85Å
291	R	87.6	Confident	78.5	Confident	108 Å²	108	70.1 Å²	70.1	41%	0.408	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.1	178.1	171.8	175.5	-171.1	-118.1	4.5	110.4	Y327 I354 E355 F357	R291-Y327 HydrophobicContact CB-CD1 4.02Å; R291-Y327 HydrophobicContact CB-CE1 4.02Å; R291-Y327 HydrophobicContact CG-CD1 4.12Å; R291-Y327 HydrophobicContact CG-CE1 3.63Å; R291-I354 WeakPolarHBondContact O-CA 3.21Å; R291-E355 HydrophobicContact CB-CB 4.26Å; R291-E355 VanDerWaalsContact CD-OE2 3.26Å; R291-E355 WeakPolarHBondContact CD-OE2 3.48Å; R291-E355 IonicContact CZ-OE2 3.7Å; R291-E355 PolarHBondContact N-O 3.2Å; R291-E355 IonicContact NE-OE2 2.71Å; R291-E355 IonicContact NH1-OE1 2.75Å; R291-E355 IonicContact NH1-OE2 3.6Å; R291-E355 PolarHBondContact NH1-OE2 3.17Å; R291-E355 PolarHBondContact O-N 3.28Å; R291-F357 HydrophobicContact CB-CD2 4.49Å; R291-F357 HydrophobicContact CB-CE2 4.06Å
292	G	81.3	Confident	80.1	Confident	34 Å²	34	62.9 Å²	62.9	35%	0.351	32%	0.319	S	S	.	.	S	Bend	trans	95.3	0.8	179.4	0	0	0	0	0	114.6	G326	G292-G326 PolarHBondContact N-O 3.16Å; G292-G326 VanDerWaalsContact N-O 3.08Å
293	V	86	Confident	81.7	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.012	32%	0.319	C	S	.	.			trans	-61.8	133	-175.7	-159.6	0	0	0	0	110.7	L290 V297 G326 V328 I354	L290-V293 HydrophobicContact CB-CG2 3.83Å; V293-V297 HydrophobicContact CG1-CB 4Å; V293-V297 HydrophobicContact CG1-CG1 3.76Å; V293-V297 HydrophobicContact CG1-CG2 3.98Å; V293-G326 PolarHBondContact N-O 3.05Å; V293-G326 WeakPolarHBondContact O-CA 3.08Å; V293-V328 HydrophobicContact CB-CG2 4.3Å; V293-V328 HydrophobicContact CG1-CG2 4.49Å; V293-V328 HydrophobicContact CG2-CG2 3.95Å; V293-I354 HydrophobicContact CB-CD1 4.38Å; V293-I354 HydrophobicContact CG1-CD1 4.09Å; V293-I354 HydrophobicContact CG2-CD1 3.96Å; V293-I354 HydrophobicContact CG2-CG1 4.27Å; V293-I354 HydrophobicContact CG2-CG2 4.49Å
294	P	83.1	Confident	83.1	Confident	21 Å²	21	66.5 Å²	66.5	14%	0.136	32%	0.32	C	S	.	.			trans	-56.6	140.3	179.9	-26.7	34.4	0	0	0	113.7	N296 V297 I349 R352	P294-N296 PolarHBondContact O-N 2.67Å; P294-N296 VanDerWaalsContact O-N 3.15Å; P294-V297 VanDerWaalsContact O-CB 3.29Å; P294-V297 WeakPolarHBondContact O-CB 3.46Å; P294-V297 WeakPolarHBondContact O-CG1 3.37Å; P294-V297 PolarHBondContact O-N 2.72Å; P294-I349 WeakPolarHBondContact CG-O 3.34Å; P294-R352 HydrophobicContact CG-CB 4.28Å; P294-R352 HydrophobicContact CG-CG 4.43Å
295	F	82.9	Confident	84	Confident	119 Å²	119	65.4 Å²	65.4	52%	0.522	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.9	-175.5	-53.9	-55.7	0	0	0	113.7	V297 R324	F295-V297 VanDerWaalsContact C-N 3.31Å; F295-V297 PolarHBondContact O-N 3.39Å; F295-R324 WeakPolarHBondContact CD1-O 3.45Å; F295-R324 WeakPolarHBondContact O-CD 3.37Å; F295-R324 PolarHBondContact O-NH1 2.94Å
296	N	81	Confident	84.7	Confident	141 Å²	141	60.2 Å²	60.2	75%	0.754	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	4.5	178.3	-159.5	19.4	0	0	0	114.3	P294	P294-N296 PolarHBondContact O-N 2.67Å; P294-N296 VanDerWaalsContact O-N 3.15Å
297	V	83.6	Confident	84.6	Confident	6 Å²	6	61 Å²	61	4%	0.036	29%	0.294	C	S	.	.			trans	-59.9	142.7	-176.6	75.2	0	0	0	0	112.5	V293 P294 F295 Q301 I302 I316 R324 I349	V293-V297 HydrophobicContact CG1-CB 4Å; V293-V297 HydrophobicContact CG1-CG1 3.76Å; V293-V297 HydrophobicContact CG1-CG2 3.98Å; P294-V297 VanDerWaalsContact O-CB 3.29Å; P294-V297 WeakPolarHBondContact O-CB 3.46Å; P294-V297 WeakPolarHBondContact O-CG1 3.37Å; P294-V297 PolarHBondContact O-N 2.72Å; F295-V297 VanDerWaalsContact C-N 3.31Å; F295-V297 PolarHBondContact O-N 3.39Å; V297-Q301 HydrophobicContact CG2-CB 4Å; V297-I302 HydrophobicContact CG1-CD1 3.93Å; V297-I302 HydrophobicContact CG2-CD1 4.01Å; V297-I302 HydrophobicContact CG2-CG1 3.84Å; V297-I316 HydrophobicContact CG1-CD1 4.48Å; V297-R324 PolarHBondContact O-NH1 2.88Å; V297-I349 HydrophobicContact CG2-CG2 4.29Å
298	K	85.3	Confident	84.4	Confident	131 Å²	131	66.5 Å²	66.5	57%	0.57	33%	0.33	S	S	*	.			trans	-101.8	153.1	168.4	-68	-178.6	-179.7	176.9	0	110.2	Q300 Q301 I302	K298-Q300 PolarHBondContact O-N 3.1Å; K298-Q301 WeakPolarHBondContact O-CB 3.35Å; K298-Q301 PolarHBondContact O-N 3.46Å; K298-I302 PolarHBondContact O-N 2.92Å
299	E	83.3	Confident	84.1	Confident	85 Å²	85	67.4 Å²	67.4	40%	0.397	33%	0.334	S	S	.	.	H	α-helix	trans	-54.1	-38	178.8	-167.5	-166.8	137.2	0	0	112.5	Q301 I302 R303 I314	E299-Q301 VanDerWaalsContact C-N 3.3Å; E299-Q301 PolarHBondContact O-N 3.12Å; E299-I302 WeakPolarHBondContact O-CB 3.26Å; E299-I302 PolarHBondContact O-N 3.13Å; E299-R303 PolarHBondContact O-N 2.86Å; E299-R303 IonicContact OE1-CZ 2.69Å; E299-R303 IonicContact OE1-NE 3.8Å; E299-R303 PolarHBondContact OE1-NE 3.03Å; E299-R303 IonicContact OE1-NH2 3.31Å; E299-R303 PolarHBondContact OE1-NH2 3.3Å; E299-I314 HydrophobicContact CG-CB 3.93Å; E299-I314 HydrophobicContact CG-CD1 3.74Å; E299-I314 HydrophobicContact CG-CG1 4.42Å; E299-I314 HydrophobicContact CG-CG2 4.04Å
300	Q	83.4	Confident	83.5	Confident	146 Å²	146	74.5 Å²	74.5	68%	0.682	36%	0.36	S	S	*	.	H	α-helix	trans	-55.2	-40.8	176.2	-70.1	167.8	-44.3	0	0	112.8	K298 I302 R303 E304	K298-Q300 PolarHBondContact O-N 3.1Å; Q300-I302 VanDerWaalsContact C-N 3.31Å; Q300-I302 PolarHBondContact O-N 2.83Å; Q300-R303 PolarHBondContact O-N 2.89Å; Q300-E304 WeakPolarHBondContact O-CB 3.22Å; Q300-E304 PolarHBondContact O-N 3.49Å
301	Q	84.3	Confident	83.1	Confident	83 Å²	83	74.9 Å²	74.9	39%	0.388	36%	0.362	S	S	.	.	H	α-helix	trans	-70.7	-28.8	178.9	-64.5	169.9	-49	0	0	112	V297 K298 E299 F305	V297-Q301 HydrophobicContact CG2-CB 4Å; K298-Q301 WeakPolarHBondContact O-CB 3.35Å; K298-Q301 PolarHBondContact O-N 3.46Å; E299-Q301 VanDerWaalsContact C-N 3.3Å; E299-Q301 PolarHBondContact O-N 3.12Å; Q301-F305 VanDerWaalsContact O-CB 3.31Å; Q301-F305 WeakPolarHBondContact O-CB 3.5Å; Q301-F305 PolarHBondContact O-N 2.68Å
302	I	85.4	Confident	82.7	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-75.5	-35.8	174.2	-62.7	153.2	0	0	0	110.3	L290 V297 K298 E299 Q300 M306 I314 I316 V328 V330	L290-I302 HydrophobicContact CD1-CG2 3.99Å; V297-I302 HydrophobicContact CG1-CD1 3.93Å; V297-I302 HydrophobicContact CG2-CD1 4.01Å; V297-I302 HydrophobicContact CG2-CG1 3.84Å; K298-I302 PolarHBondContact O-N 2.92Å; E299-I302 WeakPolarHBondContact O-CB 3.26Å; E299-I302 PolarHBondContact O-N 3.13Å; Q300-I302 VanDerWaalsContact C-N 3.31Å; Q300-I302 PolarHBondContact O-N 2.83Å; I302-M306 WeakPolarHBondContact O-CG 3.49Å; I302-M306 PolarHBondContact O-N 3.35Å; I302-I314 HydrophobicContact CB-CD1 4.28Å; I302-I314 HydrophobicContact CD1-CG2 4.19Å; I302-I314 HydrophobicContact CG2-CD1 3.92Å; I302-I314 HydrophobicContact CG2-CG1 4.4Å; I302-I314 HydrophobicContact CG2-CG2 4.07Å; I302-I316 HydrophobicContact CD1-CD1 4.06Å; I302-I316 HydrophobicContact CD1-CG1 4.27Å; I302-V328 HydrophobicContact CD1-CG1 4.17Å; I302-V328 HydrophobicContact CD1-CG2 4.13Å; I302-V330 HydrophobicContact CG2-CG2 4.18Å
303	R	85.3	Confident	82.6	Confident	93 Å²	93	72.3 Å²	72.3	35%	0.351	36%	0.36	S	S	.	.	H	α-helix	trans	-65.4	-45.7	171	-67.7	-176.4	178.2	-84.4	-0.7	111.4	E299 Q300 M306 T307 P311 I314	E299-R303 PolarHBondContact O-N 2.86Å; E299-R303 IonicContact OE1-CZ 2.69Å; E299-R303 IonicContact OE1-NE 3.8Å; E299-R303 PolarHBondContact OE1-NE 3.03Å; E299-R303 IonicContact OE1-NH2 3.31Å; E299-R303 PolarHBondContact OE1-NH2 3.3Å; Q300-R303 PolarHBondContact O-N 2.89Å; R303-M306 PolarHBondContact O-N 2.88Å; R303-M306 VanDerWaalsContact O-N 3.1Å; R303-T307 PolarHBondContact O-N 3.19Å; R303-T307 PolarHBondContact O-OG1 3.15Å; R303-P311 HydrophobicContact CG-CG 4.17Å; R303-P311 PolarHBondContact NH1-O 3.48Å; R303-I314 HydrophobicContact CG-CD1 3.4Å; R303-I314 VanDerWaalsContact CG-CD1 3.4Å
304	E	85	Confident	82.6	Confident	139 Å²	139	73.2 Å²	73.2	65%	0.65	37%	0.365	S	S	*	.	H	α-helix	trans	-57	-51.3	175.9	-178.2	176.4	-156.8	0	0	111.6	Q300 M306 T307	Q300-E304 WeakPolarHBondContact O-CB 3.22Å; Q300-E304 PolarHBondContact O-N 3.49Å; E304-M306 PolarHBondContact O-N 3.12Å; E304-T307 WeakPolarHBondContact O-CB 3.46Å; E304-T307 PolarHBondContact O-N 3.35Å; E304-T307 VanDerWaalsContact O-N 3.15Å; E304-T307 PolarHBondContact O-OG1 3.46Å
305	F	85.1	Confident	82.6	Confident	27 Å²	27	75.2 Å²	75.2	12%	0.118	37%	0.37	C	S	.	.	H	α-helix	trans	-55.8	-32.7	174	177.3	-92.8	0	0	0	113.3	Q301 K344 D347 I349 I354	Q301-F305 VanDerWaalsContact O-CB 3.31Å; Q301-F305 WeakPolarHBondContact O-CB 3.5Å; Q301-F305 PolarHBondContact O-N 2.68Å; F305-K344 HydrophobicContact CE1-CB 4.31Å; F305-K344 HydrophobicContact CZ-CB 4.2Å; F305-K344 PolarHBondContact O-NZ 2.92Å; F305-D347 HydrophobicContact CE2-CB 3.5Å; F305-D347 HydrophobicContact CZ-CB 3.8Å; F305-I349 HydrophobicContact CB-CD1 3.57Å; F305-I349 HydrophobicContact CB-CG1 4.05Å; F305-I349 HydrophobicContact CD1-CD1 4.29Å; F305-I349 HydrophobicContact CD2-CD1 3.68Å; F305-I349 HydrophobicContact CD2-CG1 3.39Å; F305-I349 HydrophobicContact CE2-CD1 4.39Å; F305-I349 HydrophobicContact CE2-CG1 3.97Å; F305-I349 HydrophobicContact CG-CD1 3.61Å; F305-I349 HydrophobicContact CG-CG1 3.88Å; F305-I354 HydrophobicContact CE2-CD1 4.41Å; F305-I354 HydrophobicContact CZ-CB 4.38Å; F305-I354 HydrophobicContact CZ-CD1 4.41Å
306	M	82.4	Confident	82.7	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-78.8	-24	179.9	-75.6	-63.9	170.5	0	0	114.4	L290 I302 R303 E304 L309 A341 K344	L290-M306 HydrophobicContact CD1-CE 3.97Å; L290-M306 HydrophobicContact CD2-CE 3.66Å; L290-M306 HydrophobicContact CG-CE 4.34Å; I302-M306 WeakPolarHBondContact O-CG 3.49Å; I302-M306 PolarHBondContact O-N 3.35Å; R303-M306 PolarHBondContact O-N 2.88Å; R303-M306 VanDerWaalsContact O-N 3.1Å; E304-M306 PolarHBondContact O-N 3.12Å; M306-L309 HydrophobicContact CB-CB 4.46Å; M306-L309 WeakPolarHBondContact O-CB 3.5Å; M306-L309 PolarHBondContact O-N 2.76Å; M306-A341 HydrophobicContact SD-CB 4.24Å; M306-K344 PolarHBondContact O-NZ 2.97Å
307	T	81.3	Confident	82.6	Confident	90 Å²	90	65.9 Å²	65.9	55%	0.552	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.5	127.8	177.3	-47.4	0	0	0	0	113	R303 E304 K344	R303-T307 PolarHBondContact O-N 3.19Å; R303-T307 PolarHBondContact O-OG1 3.15Å; E304-T307 WeakPolarHBondContact O-CB 3.46Å; E304-T307 PolarHBondContact O-N 3.35Å; E304-T307 VanDerWaalsContact O-N 3.15Å; E304-T307 PolarHBondContact O-OG1 3.46Å; T307-K344 PolarHBondContact O-NZ 3.3Å
308	P	79.2	Confident	82.5	Confident	117 Å²	117	74 Å²	74	76%	0.76	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.5	0.8	10.6	34.8	-37.7	0	0	0	115.7
309	L	80.9	Confident	82.1	Confident	19 Å²	19	72.3 Å²	72.3	10%	0.099	36%	0.357	C	S	.	.	S	Bend	trans	-69.9	138.3	179.3	-52.1	176.8	0	0	0	110.4	M306 P311 E337 K340 A341	M306-L309 HydrophobicContact CB-CB 4.46Å; M306-L309 WeakPolarHBondContact O-CB 3.5Å; M306-L309 PolarHBondContact O-N 2.76Å; L309-P311 VanDerWaalsContact O-CD 3.31Å; L309-P311 WeakPolarHBondContact O-CD 3.3Å; L309-E337 WeakPolarHBondContact CD1-O 3.4Å; L309-E337 HydrophobicContact CD2-CB 4.18Å; L309-E337 HydrophobicContact CD2-CG 4.18Å; L309-K340 HydrophobicContact CD1-CB 3.96Å; L309-K340 HydrophobicContact CD2-CB 3.91Å; L309-K340 HydrophobicContact CD2-CD 4.12Å; L309-K340 HydrophobicContact CG-CB 4.47Å; L309-A341 HydrophobicContact CD1-CB 3.91Å
310	R	77.8	Confident	81.4	Confident	204 Å²	204	78.3 Å²	78.3	77%	0.77	39%	0.385	S	S	*	.			trans	-109.2	94.9	-179.1	-64.6	-176	72.5	172.9	2.6	109.6	H333	R310-H333 PolarHBondContact O-CE1 3.42Å; R310-H333 PolarHBondContact O-ND1 2.99Å; R310-H333 VanDerWaalsContact O-ND1 3.14Å
311	P	81.6	Confident	80.9	Confident	8 Å²	8	76.6 Å²	76.6	5%	0.052	38%	0.384	C	S	.	.			trans	-68.5	139	-176.2	26.9	-34.6	0	0	0	112.5	R303 L309 I314 V330 L332	R303-P311 HydrophobicContact CG-CG 4.17Å; R303-P311 PolarHBondContact NH1-O 3.48Å; L309-P311 VanDerWaalsContact O-CD 3.31Å; L309-P311 WeakPolarHBondContact O-CD 3.3Å; P311-I314 HydrophobicContact CB-CD1 4.43Å; P311-I314 HydrophobicContact CB-CG1 4.23Å; P311-I314 HydrophobicContact CG-CD1 3.84Å; P311-I314 HydrophobicContact CG-CG1 4.18Å; P311-V330 HydrophobicContact CB-CG1 3.42Å; P311-V330 VanDerWaalsContact CB-CG1 3.42Å; P311-V330 HydrophobicContact CG-CG1 4.33Å; P311-L332 HydrophobicContact CB-CD2 3.92Å
312	A	78.4	Confident	80.2	Confident	50 Å²	50	74.7 Å²	74.7	41%	0.413	39%	0.387	S	S	.	.	S	Bend	trans	-68.2	-53.3	-179.8	0	0	0	0	0	110.7	D331 H333	A312-D331 WeakPolarHBondContact CB-O 3.39Å; A312-D331 PolarHBondContact N-O 2.89Å; A312-H333 WeakPolarHBondContact CB-NE2 3.33Å
313	A	80.3	Confident	79.8	Confident	37 Å²	37	79.9 Å²	79.9	31%	0.306	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.4	177.1	0	0	0	0	0	111.3	V330 D331	A313-V330 WeakPolarHBondContact O-CA 3.34Å; A313-D331 HydrophobicContact CB-CB 4.21Å; A313-D331 PolarHBondContact N-O 3.34Å; A313-D331 PolarHBondContact O-N 2.93Å
314	I	84.2	Confident	79.5	Confident	22 Å²	22	80 Å²	80	11%	0.113	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	119.2	176.6	-64.7	168.1	0	0	0	108	E299 I302 R303 P311 I316 V328 Y329 V330	E299-I314 HydrophobicContact CG-CB 3.93Å; E299-I314 HydrophobicContact CG-CD1 3.74Å; E299-I314 HydrophobicContact CG-CG1 4.42Å; E299-I314 HydrophobicContact CG-CG2 4.04Å; I302-I314 HydrophobicContact CB-CD1 4.28Å; I302-I314 HydrophobicContact CD1-CG2 4.19Å; I302-I314 HydrophobicContact CG2-CD1 3.92Å; I302-I314 HydrophobicContact CG2-CG1 4.4Å; I302-I314 HydrophobicContact CG2-CG2 4.07Å; R303-I314 HydrophobicContact CG-CD1 3.4Å; R303-I314 VanDerWaalsContact CG-CD1 3.4Å; P311-I314 HydrophobicContact CB-CD1 4.43Å; P311-I314 HydrophobicContact CB-CG1 4.23Å; P311-I314 HydrophobicContact CG-CD1 3.84Å; P311-I314 HydrophobicContact CG-CG1 4.18Å; I314-I316 HydrophobicContact CG2-CG1 4.43Å; I314-V328 HydrophobicContact CG2-CG1 3.6Å; I314-Y329 WeakPolarHBondContact CA-O 3.44Å; I314-V330 HydrophobicContact CG1-CG1 4.32Å; I314-V330 HydrophobicContact CG1-CG2 4.38Å
315	R	83.9	Confident	79.2	Confident	63 Å²	63	75 Å²	75	24%	0.238	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	100.4	-174.5	-66.2	-178.2	-76.2	155.5	-2	109.6	E281 T283 G317 Y329 D331	E281-R315 PolarHBondContact O-NH1 3.17Å; T283-R315 VanDerWaalsContact OG1-CZ 3.24Å; T283-R315 PolarHBondContact OG1-NH2 2.79Å; T283-R315 VanDerWaalsContact OG1-NH2 3.11Å; R315-G317 PolarHBondContact O-N 3.16Å; R315-Y329 PolarHBondContact N-O 2.82Å; R315-Y329 PolarHBondContact O-N 2.83Å; R315-D331 IonicContact CZ-OD1 2.76Å; R315-D331 IonicContact CZ-OD2 3.76Å; R315-D331 IonicContact NE-OD1 3.63Å; R315-D331 IonicContact NE-OD2 2.68Å; R315-D331 IonicContact NH2-OD1 2.83Å; R315-D331 PolarHBondContact NH2-OD1 3.42Å; R315-D331 IonicContact NH2-OD2 2.59Å; R315-D331 PolarHBondContact NH2-OD2 2.95Å
316	I	84.8	Confident	78.8	Confident	44 Å²	44	74.2 Å²	74.2	23%	0.226	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	114.4	179.8	-57.7	177.6	0	0	0	109.1	V297 I302 I314 R318 R324 V328	V297-I316 HydrophobicContact CG1-CD1 4.48Å; I302-I316 HydrophobicContact CD1-CD1 4.06Å; I302-I316 HydrophobicContact CD1-CG1 4.27Å; I314-I316 HydrophobicContact CG2-CG1 4.43Å; I316-R318 PolarHBondContact O-N 3.38Å; I316-R324 HydrophobicContact CG2-CG 4.41Å; I316-V328 HydrophobicContact CB-CG2 4.47Å; I316-V328 HydrophobicContact CG1-CG1 4.14Å; I316-V328 HydrophobicContact CG1-CG2 4.09Å; I316-V328 HydrophobicContact CG2-CG2 4.34Å
317	G	79.1	Confident	79	Confident	19 Å²	19	78.3 Å²	78.3	20%	0.196	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	127.6	-176.6	0	0	0	0	0	112.4	R315 T325 Y327	R315-G317 PolarHBondContact O-N 3.16Å; G317-T325 WeakPolarHBondContact O-CB 3.47Å; G317-T325 WeakPolarHBondContact O-CG2 3.22Å; G317-T325 PolarHBondContact O-N 3.14Å; G317-T325 PolarHBondContact O-OG1 2.79Å; G317-Y327 PolarHBondContact N-O 2.88Å
318	R	81.3	Confident	79.3	Confident	178 Å²	178	74.1 Å²	74.1	67%	0.672	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	147.4	173.7	-54.3	-174.7	-163.6	-165.7	8.1	109.9	I316 N323	I316-R318 PolarHBondContact O-N 3.38Å; R318-N323 CarbonylContact C-O 3.57Å; R318-N323 WeakPolarHBondContact CA-O 3.41Å
319	N	76.2	Confident	79.8	Confident	95 Å²	95	70.7 Å²	70.7	51%	0.508	36%	0.356	S	S	.	.			trans	-73.2	167.9	170	-82.2	-20.4	0	0	0	110.8	T321 G322 N323 T325	N319-T321 PolarHBondContact O-N 2.78Å; N319-G322 WeakPolarHBondContact O-CA 3.42Å; N319-G322 PolarHBondContact O-N 3.34Å; N319-N323 PolarHBondContact N-O 2.99Å; N319-T325 HydrophobicContact CB-CG2 4.33Å; N319-T325 WeakPolarHBondContact OD1-CG2 3.33Å
320	E	70.6	Confident	80.2	Confident	211 Å²	211	69.8 Å²	69.8	99%	0.986	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-25.2	172.4	-58.9	176	156.5	0	0	113.1
321	T	71.8	Confident	80.7	Confident	110 Å²	110	60.2 Å²	60.2	68%	0.675	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	15.8	174.7	53.2	0	0	0	0	114.1	N319 N323	N319-T321 PolarHBondContact O-N 2.78Å; T321-N323 PolarHBondContact O-N 2.68Å
322	G	70	Confident	80.9	Confident	43 Å²	43	60 Å²	60	44%	0.443	32%	0.315	S	S	.	.	S	Bend	trans	76.6	-17.1	178.3	0	0	0	0	0	115.9	N319	N319-G322 WeakPolarHBondContact O-CA 3.42Å; N319-G322 PolarHBondContact O-N 3.34Å
323	N	76.1	Confident	81.1	Confident	109 Å²	109	63.4 Å²	63.4	58%	0.583	32%	0.321	S	S	*	.			trans	-65.7	138	-178	-75	-41.7	0	0	0	113.1	R318 N319 T321	R318-N323 CarbonylContact C-O 3.57Å; R318-N323 WeakPolarHBondContact CA-O 3.41Å; N319-N323 PolarHBondContact N-O 2.99Å; T321-N323 PolarHBondContact O-N 2.68Å
324	R	80.6	Confident	81.3	Confident	95 Å²	95	63.8 Å²	63.8	36%	0.358	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	134.3	-179.8	-66	170.2	172.7	-160.7	-5.8	111.2	F295 V297 I316	F295-R324 WeakPolarHBondContact CD1-O 3.45Å; F295-R324 WeakPolarHBondContact O-CD 3.37Å; F295-R324 PolarHBondContact O-NH1 2.94Å; V297-R324 PolarHBondContact O-NH1 2.88Å; I316-R324 HydrophobicContact CG2-CG 4.41Å
325	T	76.9	Confident	81.2	Confident	33 Å²	33	66.1 Å²	66.1	20%	0.202	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-8.5	-167.2	60.2	0	0	0	0	115.7	G317 N319 Y327	G317-T325 WeakPolarHBondContact O-CB 3.47Å; G317-T325 WeakPolarHBondContact O-CG2 3.22Å; G317-T325 PolarHBondContact O-N 3.14Å; G317-T325 PolarHBondContact O-OG1 2.79Å; N319-T325 HydrophobicContact CB-CG2 4.33Å; N319-T325 WeakPolarHBondContact OD1-CG2 3.33Å; T325-Y327 PolarHBondContact O-N 2.66Å; T325-Y327 WeakPolarHBondContact OG1-CD2 3.34Å; T325-Y327 PolarHBondContact OG1-N 2.72Å
326	G	77.1	Confident	81.1	Confident	12 Å²	12	68.9 Å²	68.9	12%	0.124	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75	6.9	-169.6	0	0	0	0	0	114.3	G292 V293	G292-G326 PolarHBondContact N-O 3.16Å; G292-G326 VanDerWaalsContact N-O 3.08Å; V293-G326 PolarHBondContact N-O 3.05Å; V293-G326 WeakPolarHBondContact O-CA 3.08Å
327	Y	87.4	Confident	81.1	Confident	85 Å²	85	68.6 Å²	68.6	33%	0.333	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	138.9	166.8	-59	-70.5	0	0	0	110.8	K289 L290 R291 G317 T325	K289-Y327 VanDerWaalsContact CE-CD1 3.48Å; L290-Y327 WeakPolarHBondContact O-CA 3.41Å; R291-Y327 HydrophobicContact CB-CD1 4.02Å; R291-Y327 HydrophobicContact CB-CE1 4.02Å; R291-Y327 HydrophobicContact CG-CD1 4.12Å; R291-Y327 HydrophobicContact CG-CE1 3.63Å; G317-Y327 PolarHBondContact N-O 2.88Å; T325-Y327 PolarHBondContact O-N 2.66Å; T325-Y327 WeakPolarHBondContact OG1-CD2 3.34Å; T325-Y327 PolarHBondContact OG1-N 2.72Å
328	V	88.3	Confident	81.4	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.012	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	134.8	172.8	-175.7	0	0	0	0	108.4	L290 V293 I302 I314 I316 V330	L290-V328 HydrophobicContact CB-CB 4.23Å; L290-V328 HydrophobicContact CD1-CB 4.4Å; L290-V328 PolarHBondContact N-O 2.89Å; L290-V328 PolarHBondContact O-N 3.04Å; V293-V328 HydrophobicContact CB-CG2 4.3Å; V293-V328 HydrophobicContact CG1-CG2 4.49Å; V293-V328 HydrophobicContact CG2-CG2 3.95Å; I302-V328 HydrophobicContact CD1-CG1 4.17Å; I302-V328 HydrophobicContact CD1-CG2 4.13Å; I314-V328 HydrophobicContact CG2-CG1 3.6Å; I316-V328 HydrophobicContact CB-CG2 4.47Å; I316-V328 HydrophobicContact CG1-CG1 4.14Å; I316-V328 HydrophobicContact CG1-CG2 4.09Å; I316-V328 HydrophobicContact CG2-CG2 4.34Å; V328-V330 HydrophobicContact CG1-CG2 4.13Å
329	Y	89.5	Confident	81.5	Confident	45 Å²	45	64.6 Å²	64.6	18%	0.176	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	137.1	169.3	-59.1	-87.9	0	0	0	109	T287 V288 K289 I314 R315 V359	T287-Y329 HydrophobicContact CG2-CD1 4.22Å; V288-Y329 CarbonylContact O-C 3.6Å; V288-Y329 WeakPolarHBondContact O-CA 3.48Å; K289-Y329 HydrophobicContact CB-CD1 3.97Å; K289-Y329 HydrophobicContact CB-CE1 3.94Å; K289-Y329 HydrophobicContact CD-CD1 4.47Å; K289-Y329 HydrophobicContact CD-CE1 3.64Å; K289-Y329 WeakPolarHBondContact CE-OH 3.47Å; K289-Y329 HydrophobicContact CG-CD1 4.13Å; K289-Y329 HydrophobicContact CG-CE1 3.76Å; K289-Y329 PolarHBondContact NZ-OH 3.44Å; I314-Y329 WeakPolarHBondContact CA-O 3.44Å; R315-Y329 PolarHBondContact N-O 2.82Å; R315-Y329 PolarHBondContact O-N 2.83Å; Y329-V359 HydrophobicContact CD1-CG2 4.4Å; Y329-V359 HydrophobicContact CE1-CG2 4.36Å
330	V	88.9	Confident	81.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	114.5	-176.9	-177.8	0	0	0	0	107.5	V288 L290 I302 P311 A313 I314 V328 L332	V288-V330 PolarHBondContact N-O 2.95Å; V288-V330 PolarHBondContact O-N 3.1Å; L290-V330 HydrophobicContact CD1-CG2 3.83Å; L290-V330 HydrophobicContact CG-CG2 4.13Å; I302-V330 HydrophobicContact CG2-CG2 4.18Å; P311-V330 HydrophobicContact CB-CG1 3.42Å; P311-V330 VanDerWaalsContact CB-CG1 3.42Å; P311-V330 HydrophobicContact CG-CG1 4.33Å; A313-V330 WeakPolarHBondContact O-CA 3.34Å; I314-V330 HydrophobicContact CG1-CG1 4.32Å; I314-V330 HydrophobicContact CG1-CG2 4.38Å; V328-V330 HydrophobicContact CG1-CG2 4.13Å; V330-L332 HydrophobicContact CG1-CD2 3.89Å
331	D	87.3	Confident	82.6	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	128.5	179.2	-64.3	6.4	0	0	0	108.1	T283 T287 A312 A313 R315	T283-D331 PolarHBondContact OG1-OD2 3.33Å; T287-D331 WeakPolarHBondContact CG2-OD1 3.31Å; T287-D331 PolarHBondContact OG1-OD1 3.22Å; A312-D331 WeakPolarHBondContact CB-O 3.39Å; A312-D331 PolarHBondContact N-O 2.89Å; A313-D331 HydrophobicContact CB-CB 4.21Å; A313-D331 PolarHBondContact N-O 3.34Å; A313-D331 PolarHBondContact O-N 2.93Å; R315-D331 IonicContact CZ-OD1 2.76Å; R315-D331 IonicContact CZ-OD2 3.76Å; R315-D331 IonicContact NE-OD1 3.63Å; R315-D331 IonicContact NE-OD2 2.68Å; R315-D331 IonicContact NH2-OD1 2.83Å; R315-D331 PolarHBondContact NH2-OD1 3.42Å; R315-D331 IonicContact NH2-OD2 2.59Å; R315-D331 PolarHBondContact NH2-OD2 2.95Å
332	L	86.8	Confident	83.2	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	26%	0.261	C	S	.	.			trans	-112.8	171.7	-177.3	-58.4	178.9	0	0	0	111.4	F286 V288 P311 V330 E337 V338 A341	F286-L332 HydrophobicContact CB-CB 4.35Å; F286-L332 WeakPolarHBondContact CB-O 3.19Å; F286-L332 WeakPolarHBondContact O-CB 3.34Å; F286-L332 PolarHBondContact O-N 3.23Å; V288-L332 HydrophobicContact CG2-CD1 3.75Å; V288-L332 HydrophobicContact CG2-CG 4.47Å; P311-L332 HydrophobicContact CB-CD2 3.92Å; V330-L332 HydrophobicContact CG1-CD2 3.89Å; L332-E337 HydrophobicContact CB-CB 4.08Å; L332-E337 HydrophobicContact CD1-CB 3.97Å; L332-E337 HydrophobicContact CG-CB 4.49Å; L332-V338 HydrophobicContact CB-CG2 4.47Å; L332-V338 HydrophobicContact CD1-CG2 4.07Å; L332-A341 HydrophobicContact CD1-CB 4.01Å
333	H	82.4	Confident	84	Confident	120 Å²	120	56.5 Å²	56.5	56%	0.556	27%	0.27	S	S	*	.	S	Bend	trans	-97.2	-14.4	-174.8	-57.1	94	0	0	0	113.9	R310 A312 E337	R310-H333 PolarHBondContact O-CE1 3.42Å; R310-H333 PolarHBondContact O-ND1 2.99Å; R310-H333 VanDerWaalsContact O-ND1 3.14Å; A312-H333 WeakPolarHBondContact CB-NE2 3.33Å; H333-E337 WeakPolarHBondContact CB-OE2 3.48Å; H333-E337 IonicContact CG-OE2 2.77Å; H333-E337 PolarHBondContact N-OE2 2.8Å; H333-E337 IonicContact ND1-OE2 2.72Å
334	S	85.2	Confident	84.2	Confident	46 Å²	46	53.1 Å²	53.1	32%	0.322	25%	0.25	S	C	.	.			trans	-154.2	151.2	-178.4	173.8	0	0	0	0	112.3	E336 E337 V338	S334-E336 PolarHBondContact O-N 3.16Å; S334-E336 PolarHBondContact OG-N 3.33Å; S334-E337 WeakPolarHBondContact O-CA 3.17Å; S334-E337 WeakPolarHBondContact O-CB 3.34Å; S334-E337 PolarHBondContact O-N 2.85Å; S334-V338 PolarHBondContact O-N 3.47Å
335	D	82.1	Confident	84.5	Confident	70 Å²	70	52 Å²	52	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-60.2	-28.9	173.7	-156.1	56.5	0	0	0	112.4	F286 E337 V338 E339 R358	F286-D335 HydrophobicContact CD1-CB 4.11Å; F286-D335 HydrophobicContact CE1-CB 3.95Å; D335-E337 VanDerWaalsContact C-N 3.29Å; D335-E337 PolarHBondContact O-N 2.97Å; D335-V338 WeakPolarHBondContact O-CB 3.48Å; D335-V338 PolarHBondContact O-N 2.84Å; D335-E339 PolarHBondContact O-N 3.16Å; D335-R358 IonicContact OD1-CZ 3.83Å; D335-R358 IonicContact OD1-NH1 2.73Å; D335-R358 PolarHBondContact OD1-NH1 3.25Å; D335-R358 IonicContact OD1-NH2 2.83Å; D335-R358 PolarHBondContact OD1-NH2 2.84Å; D335-R358 IonicContact OD2-NH1 3.7Å
336	E	81.9	Confident	84.8	Confident	122 Å²	122	57.1 Å²	57.1	57%	0.57	27%	0.271	S	S	*	.	H	α-helix	trans	-63.3	-34.4	170.5	-75.5	-167.2	-144	0	0	112.8	S334 K340	S334-E336 PolarHBondContact O-N 3.16Å; S334-E336 PolarHBondContact OG-N 3.33Å; E336-K340 WeakPolarHBondContact O-CB 3.42Å; E336-K340 WeakPolarHBondContact O-CD 3.35Å; E336-K340 WeakPolarHBondContact O-CE 3.27Å; E336-K340 WeakPolarHBondContact O-CG 2.96Å; E336-K340 PolarHBondContact O-N 3.46Å; E336-K340 VanDerWaalsContact O-N 3.09Å; E336-K340 IonicContact OE2-NZ 3.16Å; E336-K340 PolarHBondContact OE2-NZ 2.78Å
337	E	84.8	Confident	85.1	Confident	38 Å²	38	60.2 Å²	60.2	18%	0.178	28%	0.284	C	S	.	.	H	α-helix	trans	-72.7	-36.2	175.6	-59.7	-170	133.5	0	0	110.4	L309 L332 H333 S334 D335 K340 A341	L309-E337 WeakPolarHBondContact CD1-O 3.4Å; L309-E337 HydrophobicContact CD2-CB 4.18Å; L309-E337 HydrophobicContact CD2-CG 4.18Å; L332-E337 HydrophobicContact CB-CB 4.08Å; L332-E337 HydrophobicContact CD1-CB 3.97Å; L332-E337 HydrophobicContact CG-CB 4.49Å; H333-E337 WeakPolarHBondContact CB-OE2 3.48Å; H333-E337 IonicContact CG-OE2 2.77Å; H333-E337 PolarHBondContact N-OE2 2.8Å; H333-E337 IonicContact ND1-OE2 2.72Å; S334-E337 WeakPolarHBondContact O-CA 3.17Å; S334-E337 WeakPolarHBondContact O-CB 3.34Å; S334-E337 PolarHBondContact O-N 2.85Å; D335-E337 VanDerWaalsContact C-N 3.29Å; D335-E337 PolarHBondContact O-N 2.97Å; E337-K340 PolarHBondContact O-N 2.7Å; E337-A341 WeakPolarHBondContact O-CB 3.4Å; E337-A341 PolarHBondContact O-N 2.76Å
338	V	83.7	Confident	85	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-48	172.2	175	0	0	0	0	110.6	F286 V288 L332 S334 D335 K340 A341 L342 R358	F286-V338 HydrophobicContact CB-CG2 3.9Å; V288-V338 HydrophobicContact CG2-CB 4.31Å; V288-V338 HydrophobicContact CG2-CG1 3.99Å; V288-V338 HydrophobicContact CG2-CG2 4.07Å; L332-V338 HydrophobicContact CB-CG2 4.47Å; L332-V338 HydrophobicContact CD1-CG2 4.07Å; S334-V338 PolarHBondContact O-N 3.47Å; D335-V338 WeakPolarHBondContact O-CB 3.48Å; D335-V338 PolarHBondContact O-N 2.84Å; V338-K340 VanDerWaalsContact C-N 3.34Å; V338-K340 PolarHBondContact O-N 2.84Å; V338-A341 PolarHBondContact O-N 3.19Å; V338-L342 HydrophobicContact CG1-CD1 4.17Å; V338-L342 WeakPolarHBondContact O-CG 3.31Å; V338-L342 PolarHBondContact O-N 2.71Å; V338-R358 HydrophobicContact CG1-CG 4.26Å
339	E	84.6	Confident	84.8	Confident	111 Å²	111	64.5 Å²	64.5	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-33.1	178.6	-153.7	-150.4	-137.6	0	0	112.7	D335 K343	D335-E339 PolarHBondContact O-N 3.16Å; E339-K343 WeakPolarHBondContact O-CD 3.41Å; E339-K343 WeakPolarHBondContact O-CG 3.08Å; E339-K343 PolarHBondContact O-N 3.33Å; E339-K343 WeakPolarHBondContact OE2-CE 3.49Å; E339-K343 IonicContact OE2-NZ 3.95Å; E339-K343 PolarHBondContact OE2-NZ 3.23Å
340	K	84.4	Confident	83.9	Confident	91 Å²	91	65.9 Å²	65.9	40%	0.396	33%	0.329	S	S	.	.	H	α-helix	trans	-70.3	-33.5	172.8	-69	159.4	-159.1	166.1	0	111.9	L309 E336 E337 V338	L309-K340 HydrophobicContact CD1-CB 3.96Å; L309-K340 HydrophobicContact CD2-CB 3.91Å; L309-K340 HydrophobicContact CD2-CD 4.12Å; L309-K340 HydrophobicContact CG-CB 4.47Å; E336-K340 WeakPolarHBondContact O-CB 3.42Å; E336-K340 WeakPolarHBondContact O-CD 3.35Å; E336-K340 WeakPolarHBondContact O-CE 3.27Å; E336-K340 WeakPolarHBondContact O-CG 2.96Å; E336-K340 PolarHBondContact O-N 3.46Å; E336-K340 VanDerWaalsContact O-N 3.09Å; E336-K340 IonicContact OE2-NZ 3.16Å; E336-K340 PolarHBondContact OE2-NZ 2.78Å; E337-K340 PolarHBondContact O-N 2.7Å; V338-K340 VanDerWaalsContact C-N 3.34Å; V338-K340 PolarHBondContact O-N 2.84Å
341	A	84.3	Confident	83.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-72.1	-40.1	175.1	0	0	0	0	0	112.3	V288 M306 L309 L332 E337 V338 K343 K344	V288-A341 HydrophobicContact CG2-CB 4.41Å; M306-A341 HydrophobicContact SD-CB 4.24Å; L309-A341 HydrophobicContact CD1-CB 3.91Å; L332-A341 HydrophobicContact CD1-CB 4.01Å; E337-A341 WeakPolarHBondContact O-CB 3.4Å; E337-A341 PolarHBondContact O-N 2.76Å; V338-A341 PolarHBondContact O-N 3.19Å; A341-K343 PolarHBondContact O-N 3.37Å; A341-K344 WeakPolarHBondContact O-CB 3.3Å; A341-K344 PolarHBondContact O-N 3.09Å
342	L	85.5	Confident	82.9	Confident	55 Å²	55	75 Å²	75	29%	0.288	39%	0.386	S	S	.	.	H	α-helix	trans	-60	-24.9	175.7	-73.9	167.5	0	0	0	113.2	V338 K344 N345 V356 R358	V338-L342 HydrophobicContact CG1-CD1 4.17Å; V338-L342 WeakPolarHBondContact O-CG 3.31Å; V338-L342 PolarHBondContact O-N 2.71Å; L342-K344 PolarHBondContact O-N 2.84Å; L342-N345 VanDerWaalsContact O-CB 3.3Å; L342-N345 WeakPolarHBondContact O-CB 3.36Å; L342-N345 PolarHBondContact O-N 3.32Å; L342-V356 HydrophobicContact CD2-CG1 4.27Å; L342-R358 HydrophobicContact CD1-CB 4.48Å
343	K	85.9	Confident	82.8	Confident	143 Å²	143	81.1 Å²	81.1	62%	0.622	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-12	175.3	-69.8	163.1	-168.4	166.7	0	113.7	E339 A341 N345	E339-K343 WeakPolarHBondContact O-CD 3.41Å; E339-K343 WeakPolarHBondContact O-CG 3.08Å; E339-K343 PolarHBondContact O-N 3.33Å; E339-K343 WeakPolarHBondContact OE2-CE 3.49Å; E339-K343 IonicContact OE2-NZ 3.95Å; E339-K343 PolarHBondContact OE2-NZ 3.23Å; A341-K343 PolarHBondContact O-N 3.37Å; K343-N345 VanDerWaalsContact C-N 3.31Å
344	K	81.5	Confident	83.1	Confident	38 Å²	38	75.4 Å²	75.4	17%	0.165	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	16	172.5	-62.8	-174.2	168.4	-179	0	113.9	F305 M306 T307 A341 L342 K346 D347	F305-K344 HydrophobicContact CE1-CB 4.31Å; F305-K344 HydrophobicContact CZ-CB 4.2Å; F305-K344 PolarHBondContact O-NZ 2.92Å; M306-K344 PolarHBondContact O-NZ 2.97Å; T307-K344 PolarHBondContact O-NZ 3.3Å; A341-K344 WeakPolarHBondContact O-CB 3.3Å; A341-K344 PolarHBondContact O-N 3.09Å; L342-K344 PolarHBondContact O-N 2.84Å; K344-K346 PolarHBondContact O-N 3.41Å; K344-D347 VanDerWaalsContact CA-OD2 3.26Å; K344-D347 WeakPolarHBondContact CA-OD2 3.38Å; K344-D347 VanDerWaalsContact CB-OD2 3.29Å; K344-D347 WeakPolarHBondContact CB-OD2 3.3Å; K344-D347 WeakPolarHBondContact CG-OD2 3.36Å; K344-D347 WeakPolarHBondContact O-CB 3.46Å; K344-D347 PolarHBondContact O-N 3.4Å
345	N	86.3	Confident	83.2	Confident	72 Å²	72	75.6 Å²	75.6	39%	0.385	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	123.1	178.7	-171.6	16.8	0	0	0	110.7	L342 K343 E355 V356	L342-N345 VanDerWaalsContact O-CB 3.3Å; L342-N345 WeakPolarHBondContact O-CB 3.36Å; L342-N345 PolarHBondContact O-N 3.32Å; K343-N345 VanDerWaalsContact C-N 3.31Å; N345-E355 WeakPolarHBondContact OD1-CA 3.4Å; N345-V356 HydrophobicContact CB-CB 4.2Å; N345-V356 HydrophobicContact CB-CG2 4.44Å; N345-V356 PolarHBondContact OD1-N 3.46Å; N345-V356 VanDerWaalsContact OD1-N 3.12Å
346	K	82.6	Confident	83.5	Confident	141 Å²	141	72.4 Å²	72.4	61%	0.613	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	7.7	-172.4	-49.2	175	-175.5	176.6	0	116.4	K344 I354	K344-K346 PolarHBondContact O-N 3.41Å; K346-I354 VanDerWaalsContact CA-O 3.31Å; K346-I354 WeakPolarHBondContact CA-O 3.5Å; K346-I354 PolarHBondContact N-O 3.14Å
347	D	84.9	Confident	83.8	Confident	77 Å²	77	71 Å²	71	41%	0.412	35%	0.354	S	S	.	.			trans	-67.9	159.5	166.5	-72	-25.2	0	0	0	111.2	F305 K344 Y353 I354	F305-D347 HydrophobicContact CE2-CB 3.5Å; F305-D347 HydrophobicContact CZ-CB 3.8Å; K344-D347 VanDerWaalsContact CA-OD2 3.26Å; K344-D347 WeakPolarHBondContact CA-OD2 3.38Å; K344-D347 VanDerWaalsContact CB-OD2 3.29Å; K344-D347 WeakPolarHBondContact CB-OD2 3.3Å; K344-D347 WeakPolarHBondContact CG-OD2 3.36Å; K344-D347 WeakPolarHBondContact O-CB 3.46Å; K344-D347 PolarHBondContact O-N 3.4Å; D347-Y353 CarbonylContact O-C 3.56Å; D347-Y353 WeakPolarHBondContact O-CA 3.26Å; D347-I354 PolarHBondContact O-N 2.8Å
348	Y	84.5	Confident	83.7	Confident	161 Å²	161	74 Å²	74	63%	0.631	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	139	-168	-70.8	-108.8	0	0	0	113.7	R352	Y348-R352 CarbonylContact C-O 3.49Å; Y348-R352 VanDerWaalsContact CA-O 3.28Å; Y348-R352 WeakPolarHBondContact CA-O 3.38Å
349	I	83.7	Confident	83.6	Confident	16 Å²	16	75.7 Å²	75.7	8%	0.082	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.2	160.2	-61.3	-177.3	0	0	0	108.5	P294 V297 F305 G351 R352 I354	P294-I349 WeakPolarHBondContact CG-O 3.34Å; V297-I349 HydrophobicContact CG2-CG2 4.29Å; F305-I349 HydrophobicContact CB-CD1 3.57Å; F305-I349 HydrophobicContact CB-CG1 4.05Å; F305-I349 HydrophobicContact CD1-CD1 4.29Å; F305-I349 HydrophobicContact CD2-CD1 3.68Å; F305-I349 HydrophobicContact CD2-CG1 3.39Å; F305-I349 HydrophobicContact CE2-CD1 4.39Å; F305-I349 HydrophobicContact CE2-CG1 3.97Å; F305-I349 HydrophobicContact CG-CD1 3.61Å; F305-I349 HydrophobicContact CG-CG1 3.88Å; I349-G351 VanDerWaalsContact C-N 3.25Å; I349-G351 PolarHBondContact O-N 3.45Å; I349-G351 VanDerWaalsContact O-N 3.14Å; I349-R352 PolarHBondContact N-O 2.9Å; I349-R352 PolarHBondContact O-N 3.41Å; I349-I354 HydrophobicContact CB-CD1 3.89Å; I349-I354 HydrophobicContact CD1-CD1 3.38Å; I349-I354 HydrophobicContact CG1-CD1 3.52Å
350	G	69.9	Low	82.8	Confident	73 Å²	73	74.9 Å²	74.9	75%	0.753	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	37.5	170	0	0	0	0	0	114.4
351	G	75.7	Confident	81.5	Confident	71 Å²	71	72.6 Å²	72.6	73%	0.732	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	4.4	-179.5	0	0	0	0	0	116.1	I349	I349-G351 VanDerWaalsContact C-N 3.25Å; I349-G351 PolarHBondContact O-N 3.45Å; I349-G351 VanDerWaalsContact O-N 3.14Å
352	R	79.5	Confident	79.7	Confident	126 Å²	126	78 Å²	78	48%	0.475	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.6	174.2	-65.9	-173.8	179.7	163.5	2.4	111.9	P294 Y348 I349	P294-R352 HydrophobicContact CG-CB 4.28Å; P294-R352 HydrophobicContact CG-CG 4.43Å; Y348-R352 CarbonylContact C-O 3.49Å; Y348-R352 VanDerWaalsContact CA-O 3.28Å; Y348-R352 WeakPolarHBondContact CA-O 3.38Å; I349-R352 PolarHBondContact N-O 2.9Å; I349-R352 PolarHBondContact O-N 3.41Å
353	Y	86.5	Confident	78	Confident	131 Å²	131	78.7 Å²	78.7	51%	0.514	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	146.5	168.8	64.9	-95.1	0	0	0	110.3	D347 E355	D347-Y353 CarbonylContact O-C 3.56Å; D347-Y353 WeakPolarHBondContact O-CA 3.26Å; Y353-E355 HydrophobicContact CE2-CG 4.41Å
354	I	87.8	Confident	75.6	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	44%	0.435	C	S	.	.			trans	-112.4	130.1	-179.8	-68.8	176.7	0	0	0	110	L290 R291 V293 F305 K346 D347 I349 V356	L290-I354 HydrophobicContact CB-CG2 3.88Å; L290-I354 HydrophobicContact CD2-CG2 4.14Å; L290-I354 HydrophobicContact CG-CG2 4.47Å; R291-I354 WeakPolarHBondContact O-CA 3.21Å; V293-I354 HydrophobicContact CB-CD1 4.38Å; V293-I354 HydrophobicContact CG1-CD1 4.09Å; V293-I354 HydrophobicContact CG2-CD1 3.96Å; V293-I354 HydrophobicContact CG2-CG1 4.27Å; V293-I354 HydrophobicContact CG2-CG2 4.49Å; F305-I354 HydrophobicContact CE2-CD1 4.41Å; F305-I354 HydrophobicContact CZ-CB 4.38Å; F305-I354 HydrophobicContact CZ-CD1 4.41Å; K346-I354 VanDerWaalsContact CA-O 3.31Å; K346-I354 WeakPolarHBondContact CA-O 3.5Å; K346-I354 PolarHBondContact N-O 3.14Å; D347-I354 PolarHBondContact O-N 2.8Å; I349-I354 HydrophobicContact CB-CD1 3.89Å; I349-I354 HydrophobicContact CD1-CD1 3.38Å; I349-I354 HydrophobicContact CG1-CD1 3.52Å; I354-V356 HydrophobicContact CG2-CG2 4.17Å
355	E	86.8	Confident	73.6	Confident	50 Å²	50	84 Å²	84	23%	0.234	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	131.8	169.3	-61.5	177.6	151.3	0	0	109.8	L290 R291 N345 Y353 F357	L290-E355 CarbonylContact C-O 3.41Å; L290-E355 WeakPolarHBondContact CA-O 3.06Å; R291-E355 HydrophobicContact CB-CB 4.26Å; R291-E355 VanDerWaalsContact CD-OE2 3.26Å; R291-E355 WeakPolarHBondContact CD-OE2 3.48Å; R291-E355 IonicContact CZ-OE2 3.7Å; R291-E355 PolarHBondContact N-O 3.2Å; R291-E355 IonicContact NE-OE2 2.71Å; R291-E355 IonicContact NH1-OE1 2.75Å; R291-E355 IonicContact NH1-OE2 3.6Å; R291-E355 PolarHBondContact NH1-OE2 3.17Å; R291-E355 PolarHBondContact O-N 3.28Å; N345-E355 WeakPolarHBondContact OD1-CA 3.4Å; Y353-E355 HydrophobicContact CE2-CG 4.41Å; E355-F357 HydrophobicContact CB-CD2 4.34Å; E355-F357 HydrophobicContact CB-CE2 3.47Å; E355-F357 VanDerWaalsContact CB-CE2 3.47Å; E355-F357 HydrophobicContact CB-CZ 3.87Å
356	V	88.6	Confident	70.9	Confident	4 Å²	4	86.2 Å²	86.2	2%	0.024	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123	-175.5	-173.1	0	0	0	0	109.9	V288 L290 L342 N345 I354	V288-V356 HydrophobicContact CG1-CG1 3.4Å; L290-V356 HydrophobicContact CD2-CB 4.38Å; L290-V356 HydrophobicContact CD2-CG1 4.02Å; L290-V356 HydrophobicContact CD2-CG2 3.85Å; L342-V356 HydrophobicContact CD2-CG1 4.27Å; N345-V356 HydrophobicContact CB-CB 4.2Å; N345-V356 HydrophobicContact CB-CG2 4.44Å; N345-V356 PolarHBondContact OD1-N 3.46Å; N345-V356 VanDerWaalsContact OD1-N 3.12Å; I354-V356 HydrophobicContact CG2-CG2 4.17Å
357	F	88	Confident	68.8	Low	92 Å²	92	88.9 Å²	88.9	40%	0.404	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.5	-176.7	-58.4	-86.2	0	0	0	111.7	V288 K289 R291 E355	V288-F357 CarbonylContact C-O 3.54Å; V288-F357 WeakPolarHBondContact CA-O 3.4Å; K289-F357 HydrophobicContact CB-CB 4.42Å; K289-F357 PolarHBondContact N-O 3.34Å; K289-F357 PolarHBondContact O-N 3.26Å; R291-F357 HydrophobicContact CB-CD2 4.49Å; R291-F357 HydrophobicContact CB-CE2 4.06Å; E355-F357 HydrophobicContact CB-CD2 4.34Å; E355-F357 HydrophobicContact CB-CE2 3.47Å; E355-F357 VanDerWaalsContact CB-CE2 3.47Å; E355-F357 HydrophobicContact CB-CZ 3.87Å
358	R	84.1	Confident	66.2	Low	100 Å²	100	96.5 Å²	96.5	38%	0.377	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	146.2	168	-174.1	177.7	179.6	105.3	17.6	110	D335 V338 L342 D360	D335-R358 IonicContact OD1-CZ 3.83Å; D335-R358 IonicContact OD1-NH1 2.73Å; D335-R358 PolarHBondContact OD1-NH1 3.25Å; D335-R358 IonicContact OD1-NH2 2.83Å; D335-R358 PolarHBondContact OD1-NH2 2.84Å; D335-R358 IonicContact OD2-NH1 3.7Å; V338-R358 HydrophobicContact CG1-CG 4.26Å; L342-R358 HydrophobicContact CD1-CB 4.48Å; R358-D360 WeakPolarHBondContact CD-OD1 3.13Å; R358-D360 IonicContact CZ-OD1 2.77Å; R358-D360 IonicContact NE-OD1 3.95Å; R358-D360 PolarHBondContact NE-OD1 2.89Å; R358-D360 IonicContact NH2-OD1 3.73Å
359	V	80.8	Confident	63.5	Low	37 Å²	37	95.5 Å²	95.5	22%	0.224	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	107.5	170.7	-176.6	0	0	0	0	109	T287 K289 Y329	T287-V359 HydrophobicContact CG2-CB 4.3Å; T287-V359 PolarHBondContact O-N 3.36Å; K289-V359 HydrophobicContact CB-CG2 3.6Å; Y329-V359 HydrophobicContact CD1-CG2 4.4Å; Y329-V359 HydrophobicContact CE1-CG2 4.36Å
360	D	67.4	Low	61.2	Low	94 Å²	94	104 Å²	104	50%	0.503	57%	0.566	S	S	.	*			trans	-84	131.2	176.1	-54.3	-61.6	0	0	0	110.6	R358 S362	R358-D360 WeakPolarHBondContact CD-OD1 3.13Å; R358-D360 IonicContact CZ-OD1 2.77Å; R358-D360 IonicContact NE-OD1 3.95Å; R358-D360 PolarHBondContact NE-OD1 2.89Å; R358-D360 IonicContact NH2-OD1 3.73Å; D360-S362 PolarHBondContact O-N 2.92Å
361	S	57.6	Low	59.3	Low	44 Å²	44	107.6 Å²	107.6	31%	0.308	57%	0.567	S	S	.	*	S	Bend	trans	-66	0.4	-175.3	-53.3	0	0	0	0	115.6	D285 G363	D285-S361 WeakPolarHBondContact CA-OG 3.49Å; D285-S361 WeakPolarHBondContact OD1-CB 3.43Å; D285-S361 PolarHBondContact OD1-OG 3.29Å; S361-G363 PolarHBondContact O-N 3.38Å
362	S	47.2	Very low	57.2	Low	113 Å²	113	110.8 Å²	110.8	79%	0.79	57%	0.568	S	S	*	*			trans	-76.1	50.5	-176.3	62.5	0	0	0	0	113.7	D360	D360-S362 PolarHBondContact O-N 2.92Å
363	G	48.4	Very low	55.1	Low	70 Å²	70	113.9 Å²	113.9	72%	0.722	59%	0.585	S	S	*	*			trans	-81.9	-6.8	177.2	0	0	0	0	0	115.1	S361 K365	S361-G363 PolarHBondContact O-N 3.38Å; G363-K365 PolarHBondContact O-N 3.19Å
364	A	35.6	Very low	52.6	Low	96 Å²	96	116.8 Å²	116.8	79%	0.793	60%	0.603	S	S	*	*	S	Bend	trans	-83	80.1	-172.1	0	0	0	0	0	113.9	S366	A364-S366 PolarHBondContact O-N 2.88Å
365	K	40.7	Very low	50.3	Low	196 Å²	196	124.1 Å²	124.1	85%	0.852	64%	0.641	S	S	*	*			trans	15.3	94.6	156.9	-65.4	169.6	-175.3	162.6	0	116.3	G363 K367	G363-K365 PolarHBondContact O-N 3.19Å; K365-K367 PolarHBondContact O-N 3.5Å; K365-K367 VanDerWaalsContact O-N 3.09Å
366	S	28.9	Very low	47.8	Very low	118 Å²	118	129.4 Å²	129.4	83%	0.825	67%	0.67	S	S	*	*			trans	-59.3	113.5	171.9	-175.6	0	0	0	0	111.8	A364 R368	A364-S366 PolarHBondContact O-N 2.88Å; S366-R368 PolarHBondContact O-N 2.9Å; S366-R368 VanDerWaalsContact O-N 3.1Å
367	K	38.2	Very low	45.4	Very low	198 Å²	198	140 Å²	140	86%	0.861	71%	0.71	S	S	*	*			trans	-77.6	85.9	173.8	-70.6	179.2	-178.8	171.6	0	110.1	K365	K365-K367 PolarHBondContact O-N 3.5Å; K365-K367 VanDerWaalsContact O-N 3.09Å
368	R	30	Very low	42.7	Very low	236 Å²	236	142.8 Å²	142.8	89%	0.891	73%	0.729	S	S	*	*			trans	-71.9	147.6	159.9	-105.9	177.9	164.4	158.7	-5.7	110.3	S366	S366-R368 PolarHBondContact O-N 2.9Å; S366-R368 VanDerWaalsContact O-N 3.1Å
369	N	29	Very low	40.4	Very low	141 Å²	141	146.9 Å²	146.9	75%	0.754	75%	0.75	S	S	*	*			trans	-62.7	152.4	-169.5	-73.9	-24.4	0	0	0	113.2
370	K	34.3	Very low	38.1	Very low	194 Å²	194	150.9 Å²	150.9	84%	0.843	78%	0.775	S	S	*	*	S	Bend	trans	-93.4	9.9	-169.9	-150.3	-169.3	173.6	-171.1	0	114.6
371	N	30.4	Very low	36.8	Very low	148 Å²	148	155.3 Å²	155.3	79%	0.791	78%	0.784	S	S	*	*	S	Bend	trans	-111.1	-24.2	-171	-75.4	23.2	0	0	0	115.1	K373	N371-K373 PolarHBondContact O-N 3.37Å; N371-K373 VanDerWaalsContact O-N 3.11Å
372	D	32.2	Very low	35.8	Very low	139 Å²	139	162.6 Å²	162.6	74%	0.743	81%	0.811	S	S	*	*			trans	-90.6	63.9	-176.2	-54.5	-57.8	0	0	0	111.6
373	K	34.2	Very low	35.5	Very low	190 Å²	190	161.8 Å²	161.8	83%	0.826	80%	0.797	S	S	*	*			trans	-122.9	19.3	-165.4	-130.7	-173.7	-177.7	-169.9	0	118.2	N371	N371-K373 PolarHBondContact O-N 3.37Å; N371-K373 VanDerWaalsContact O-N 3.11Å
374	E	34.8	Very low	35	Very low	192 Å²	192	163.8 Å²	163.8	90%	0.897	79%	0.786	S	S	*	*	S	Bend	trans	-123.1	-8.7	179.3	-68	-161.7	126	0	0	116.9
375	I	38.5	Very low	35.6	Very low	154 Å²	154	166.9 Å²	166.9	79%	0.79	78%	0.784	S	S	*	*	S	Bend	trans	-109.2	-40.6	-172.8	-65.9	169.4	0	0	0	114.4	R377	I375-R377 PolarHBondContact O-N 2.99Å
376	D	35	Very low	35.9	Very low	161 Å²	161	163.1 Å²	163.1	86%	0.861	77%	0.773	S	S	*	*			trans	-79.3	76.5	-175	-72.9	-33	0	0	0	113.9
377	R	38.6	Very low	36.9	Very low	228 Å²	228	162.6 Å²	162.6	86%	0.86	76%	0.757	S	S	*	*			trans	-99.3	0.8	169.1	-80.9	-169.1	177.1	-175.5	2.6	114.9	I375 F379	I375-R377 PolarHBondContact O-N 2.99Å; R377-F379 PolarHBondContact O-N 3.26Å; R377-F379 VanDerWaalsContact O-N 3.09Å
378	N	31.5	Very low	37.7	Very low	149 Å²	149	157.1 Å²	157.1	80%	0.797	74%	0.735	S	S	*	*			trans	-82.2	89.4	-179.1	-76.8	18.7	0	0	0	111.9	T380	N378-T380 PolarHBondContact O-N 3.22Å
379	F	35	Very low	38.8	Very low	186 Å²	186	152.5 Å²	152.5	82%	0.816	72%	0.723	S	S	*	*			trans	-79.6	59.4	177.3	-162.3	-96.2	0	0	0	112.3	R377 R381	R377-F379 PolarHBondContact O-N 3.26Å; R377-F379 VanDerWaalsContact O-N 3.09Å; F379-R381 HydrophobicContact CE1-CB 4.26Å; F379-R381 PolarHBondContact O-N 2.82Å
380	T	33.6	Very low	39.9	Very low	121 Å²	121	152.5 Å²	152.5	74%	0.742	72%	0.719	S	S	*	*			trans	-75	88.5	170.8	51.1	0	0	0	0	110.1	N378 K382	N378-T380 PolarHBondContact O-N 3.22Å; T380-K382 PolarHBondContact O-N 3.09Å; T380-K382 VanDerWaalsContact O-N 3.15Å
381	R	38.4	Very low	41.2	Very low	187 Å²	187	146.8 Å²	146.8	71%	0.706	70%	0.698	S	S	*	*			trans	-69.9	101.2	167.4	-173.4	-169.9	-155.1	174.6	6	108.1	F379 L383	F379-R381 HydrophobicContact CE1-CB 4.26Å; F379-R381 PolarHBondContact O-N 2.82Å; R381-L383 VanDerWaalsContact C-N 3.26Å; R381-L383 HydrophobicContact CG-CG 4.46Å; R381-L383 PolarHBondContact O-N 3.47Å
382	K	36.9	Very low	42.7	Very low	198 Å²	198	139.9 Å²	139.9	86%	0.861	66%	0.661	S	S	*	*			trans	-69.4	83.1	172.6	-77.5	-158.9	169.2	-158.4	0	111.4	T380	T380-K382 PolarHBondContact O-N 3.09Å; T380-K382 VanDerWaalsContact O-N 3.15Å
383	L	40.4	Very low	44.1	Very low	95 Å²	95	136.3 Å²	136.3	50%	0.497	65%	0.646	S	S	.	*			trans	-77.3	174.5	143.8	-67.8	166.3	0	0	0	108.1	R381 E388	R381-L383 VanDerWaalsContact C-N 3.26Å; R381-L383 HydrophobicContact CG-CG 4.46Å; R381-L383 PolarHBondContact O-N 3.47Å; L383-E388 WeakPolarHBondContact CD1-OE1 3.47Å
384	K	38.8	Very low	45.7	Very low	113 Å²	113	135.5 Å²	135.5	49%	0.491	65%	0.646	S	S	.	*			trans	-80	137.9	174.9	-66.8	-170.9	-158.5	142.9	0	110.1	D386 E387	K384-D386 VanDerWaalsContact C-N 3.26Å; K384-D386 PolarHBondContact O-N 3.28Å; K384-E387 HydrophobicContact CB-CB 4.38Å; K384-E387 HydrophobicContact CB-CG 4.29Å; K384-E387 HydrophobicContact CD-CG 4.39Å; K384-E387 WeakPolarHBondContact CD-OE1 3.41Å; K384-E387 WeakPolarHBondContact CE-OE1 3.45Å; K384-E387 IonicContact NZ-OE1 3.9Å; K384-E387 PolarHBondContact NZ-OE1 2.94Å; K384-E387 PolarHBondContact O-N 2.95Å
385	E	49.2	Very low	47.5	Very low	161 Å²	161	127.6 Å²	127.6	75%	0.752	61%	0.612	S	S	*	*	H	α-helix	trans	-60.5	-39	172	-69.4	150.7	165.4	0	0	110.3	E387 E388 E389	E385-E387 VanDerWaalsContact C-N 3.31Å; E385-E387 PolarHBondContact O-N 3.19Å; E385-E388 PolarHBondContact O-N 3.46Å; E385-E389 PolarHBondContact O-N 3.34Å
386	D	45.5	Very low	49.6	Very low	117 Å²	117	120.4 Å²	120.4	63%	0.626	58%	0.575	S	S	*	*	H	α-helix	trans	-56.5	-36.4	177.4	-41.1	-53.2	0	0	0	114.3	K384	K384-D386 VanDerWaalsContact C-N 3.26Å; K384-D386 PolarHBondContact O-N 3.28Å
387	E	50.5	Low	52.1	Low	106 Å²	106	113.8 Å²	113.8	50%	0.495	54%	0.538	S	S	.	.	H	α-helix	trans	-83.6	-19.3	-175.1	-72.8	170.9	-159	0	0	112.4	K384 E385	K384-E387 HydrophobicContact CB-CB 4.38Å; K384-E387 HydrophobicContact CB-CG 4.29Å; K384-E387 HydrophobicContact CD-CG 4.39Å; K384-E387 WeakPolarHBondContact CD-OE1 3.41Å; K384-E387 WeakPolarHBondContact CE-OE1 3.45Å; K384-E387 IonicContact NZ-OE1 3.9Å; K384-E387 PolarHBondContact NZ-OE1 2.94Å; K384-E387 PolarHBondContact O-N 2.95Å; E385-E387 VanDerWaalsContact C-N 3.31Å; E385-E387 PolarHBondContact O-N 3.19Å
388	E	54.5	Low	54.5	Low	83 Å²	83	102.9 Å²	102.9	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-91.2	-26.9	-179.9	-66.6	-169.2	-174.8	0	0	112.9	L383 E385 V392 P471	L383-E388 WeakPolarHBondContact CD1-OE1 3.47Å; E385-E388 PolarHBondContact O-N 3.46Å; E388-V392 WeakPolarHBondContact O-CG2 3.41Å; E388-P471 HydrophobicContact CB-CG 4.35Å
389	E	53.3	Low	57.3	Low	139 Å²	139	98.3 Å²	98.3	65%	0.65	47%	0.47	S	S	*	.	H	α-helix	trans	-75.1	-40.7	175.2	-67	-164.5	163.8	0	0	113	E385 D391 V392 S393	E385-E389 PolarHBondContact O-N 3.34Å; E389-D391 PolarHBondContact O-N 3.27Å; E389-V392 PolarHBondContact O-N 2.92Å; E389-S393 PolarHBondContact O-N 3.27Å; E389-S393 VanDerWaalsContact O-N 3.07Å
390	E	53.1	Low	60	Low	141 Å²	141	89.5 Å²	89.5	66%	0.659	43%	0.432	S	S	*	.	H	α-helix	trans	-59.5	-45.2	178.3	-71.5	-171.1	161.7	0	0	111.4	V392 S393 E394	E390-V392 VanDerWaalsContact C-N 3.33Å; E390-V392 PolarHBondContact O-N 3.24Å; E390-S393 WeakPolarHBondContact O-CB 3.23Å; E390-S393 PolarHBondContact O-N 3.06Å; E390-S393 VanDerWaalsContact O-N 3.09Å; E390-S393 PolarHBondContact O-OG 3.28Å; E390-E394 PolarHBondContact O-N 3.13Å
391	D	61	Low	62.7	Low	75 Å²	75	88.1 Å²	88.1	40%	0.401	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-33.6	-178.5	-129.3	16.9	0	0	0	112.8	E389 S395 T473	E389-D391 PolarHBondContact O-N 3.27Å; D391-S395 WeakPolarHBondContact O-CB 3.28Å; D391-S395 PolarHBondContact O-N 2.8Å; D391-T473 WeakPolarHBondContact OD1-CG2 3.38Å; D391-T473 WeakPolarHBondContact OD2-CG2 3.42Å
392	V	62.1	Low	65.1	Low	2 Å²	2	82.8 Å²	82.8	1%	0.012	40%	0.398	C	S	.	.	H	α-helix	trans	-74.2	-41.1	173.2	-178	0	0	0	0	111	E388 E389 E390 E394 S395 G396 L398 A450 V451 L454 P471	E388-V392 WeakPolarHBondContact O-CG2 3.41Å; E389-V392 PolarHBondContact O-N 2.92Å; E390-V392 VanDerWaalsContact C-N 3.33Å; E390-V392 PolarHBondContact O-N 3.24Å; V392-E394 VanDerWaalsContact C-N 3.31Å; V392-E394 PolarHBondContact O-N 3.03Å; V392-S395 PolarHBondContact O-N 2.84Å; V392-G396 PolarHBondContact O-N 3Å; V392-L398 HydrophobicContact CG1-CD2 4.31Å; V392-A450 HydrophobicContact CG1-CB 4.01Å; V392-V451 HydrophobicContact CB-CG2 4.27Å; V392-V451 HydrophobicContact CG1-CG2 3.62Å; V392-L454 HydrophobicContact CG2-CD2 4.07Å; V392-P471 HydrophobicContact CG2-CB 3.54Å; V392-P471 HydrophobicContact CG2-CG 3.57Å
393	S	61.5	Low	67.6	Low	64 Å²	64	73.4 Å²	73.4	45%	0.448	36%	0.358	S	S	.	.	H	α-helix	trans	-63	-35.3	-179	82	0	0	0	0	112.7	E389 E390 P447	E389-S393 PolarHBondContact O-N 3.27Å; E389-S393 VanDerWaalsContact O-N 3.07Å; E390-S393 WeakPolarHBondContact O-CB 3.23Å; E390-S393 PolarHBondContact O-N 3.06Å; E390-S393 VanDerWaalsContact O-N 3.09Å; E390-S393 PolarHBondContact O-OG 3.28Å; S393-P447 WeakPolarHBondContact O-CB 3.33Å; S393-P447 WeakPolarHBondContact O-CG 3.32Å
394	E	67.6	Low	69.7	Low	173 Å²	173	69 Å²	69	81%	0.808	34%	0.335	S	S	*	.	H	α-helix	trans	-83.2	-42.5	174.1	-67	-153	156.9	0	0	112.6	E390 V392	E390-E394 PolarHBondContact O-N 3.13Å; V392-E394 VanDerWaalsContact C-N 3.31Å; V392-E394 PolarHBondContact O-N 3.03Å
395	S	72.1	Confident	71.9	Confident	26 Å²	26	70.3 Å²	70.3	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-89.4	-20.5	-169.5	-167.6	0	0	0	0	115.4	D391 V392 R397 S472 T473 V474	D391-S395 WeakPolarHBondContact O-CB 3.28Å; D391-S395 PolarHBondContact O-N 2.8Å; V392-S395 PolarHBondContact O-N 2.84Å; S395-R397 WeakPolarHBondContact O-CB 3.44Å; S395-R397 PolarHBondContact O-N 3.45Å; S395-S472 PolarHBondContact OG-O 3.42Å; S395-T473 WeakPolarHBondContact OG-CA 3.44Å; S395-V474 PolarHBondContact OG-N 2.83Å; S395-V474 VanDerWaalsContact OG-N 3.17Å
396	G	82.6	Confident	73.6	Confident	3 Å²	3	67.5 Å²	67.5	3%	0.031	33%	0.332	C	S	.	.			trans	56.4	15.7	177.9	0	0	0	0	0	116.2	V392 Y444	V392-G396 PolarHBondContact O-N 3Å; G396-Y444 PolarHBondContact O-N 3.38Å
397	R	87.4	Confident	75.4	Confident	22 Å²	22	62.2 Å²	62.2	8%	0.083	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.7	-168.8	174.8	-178.1	175.1	129.6	0.3	110.9	S395 E424 V442 T443 S472	S395-R397 WeakPolarHBondContact O-CB 3.44Å; S395-R397 PolarHBondContact O-N 3.45Å; R397-E424 IonicContact NH1-OE2 3.95Å; R397-V442 WeakPolarHBondContact CA-O 3.41Å; R397-T443 HydrophobicContact CB-CG2 4.3Å; R397-S472 VanDerWaalsContact CB-O 3.3Å; R397-S472 WeakPolarHBondContact CB-O 3.49Å; R397-S472 WeakPolarHBondContact CG-O 3.44Å; R397-S472 PolarHBondContact O-N 2.99Å
398	L	89.7	Confident	77	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	147.2	-177.9	-55.5	177.2	0	0	0	110.3	V392 F416 F441 V442 Y444 A450 A453 L454 V469 L470	V392-L398 HydrophobicContact CG1-CD2 4.31Å; L398-F416 HydrophobicContact CD1-CE1 4.2Å; L398-F441 VanDerWaalsContact O-CA 3.29Å; L398-F441 WeakPolarHBondContact O-CA 3.13Å; L398-V442 PolarHBondContact N-O 3.06Å; L398-V442 PolarHBondContact O-N 2.87Å; L398-Y444 HydrophobicContact CD1-CD2 4.42Å; L398-Y444 HydrophobicContact CD1-CE2 3.86Å; L398-A450 HydrophobicContact CD1-CB 4.32Å; L398-A450 HydrophobicContact CD2-CB 4.09Å; L398-A450 HydrophobicContact CG-CB 4.1Å; L398-A453 HydrophobicContact CD1-CB 4.01Å; L398-L454 HydrophobicContact CD2-CB 4.18Å; L398-V469 HydrophobicContact CB-CG1 3.96Å; L398-V469 HydrophobicContact CD1-CG1 3.82Å; L398-V469 HydrophobicContact CD2-CG1 4.29Å; L398-V469 HydrophobicContact CG-CG1 4.24Å; L398-L470 WeakPolarHBondContact CA-O 3.28Å
399	F	91.3	Very high	78.3	Confident	53 Å²	53	57.9 Å²	57.9	23%	0.232	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.6	167.9	168	-110.6	0	0	0	109.3	R401 F439 F441 L470	F399-R401 HydrophobicContact CE1-CB 3.97Å; F399-R401 HydrophobicContact CZ-CB 4.23Å; F399-F439 HydrophobicContact CD2-CD2 4.41Å; F399-F439 HydrophobicContact CE2-CB 3.69Å; F399-F439 AromaticContact CE2-CD2 3.6Å; F399-F439 HydrophobicContact CE2-CD2 3.6Å; F399-F439 HydrophobicContact CE2-CE2 4.39Å; F399-F439 AromaticContact CE2-CG 3.81Å; F399-F439 HydrophobicContact CE2-CG 3.81Å; F399-F439 HydrophobicContact CZ-CB 4.02Å; F399-F439 HydrophobicContact CZ-CD2 4.48Å; F399-F439 HydrophobicContact CZ-CG 4.31Å; F399-F441 HydrophobicContact CB-CD1 4Å; F399-F441 HydrophobicContact CB-CE1 4.03Å; F399-F441 AromaticContact CD2-CD1 3.88Å; F399-F441 HydrophobicContact CD2-CD1 3.88Å; F399-F441 AromaticContact CD2-CE1 3.46Å; F399-F441 HydrophobicContact CD2-CE1 3.46Å; F399-F441 VanDerWaalsContact CD2-CE1 3.46Å; F399-F441 HydrophobicContact CD2-CE2 4.44Å; F399-F441 AromaticContact CD2-CZ 3.77Å; F399-F441 HydrophobicContact CD2-CZ 3.77Å; F399-F441 HydrophobicContact CE2-CE1 4.27Å; F399-F441 HydrophobicContact CE2-CZ 4.15Å; F399-F441 HydrophobicContact CG-CD1 4.42Å; F399-F441 HydrophobicContact CG-CE1 4.1Å; F399-L470 HydrophobicContact CD1-CB 4.33Å; F399-L470 HydrophobicContact CD1-CD1 4.06Å; F399-L470 HydrophobicContact CE1-CD1 4.38Å; F399-L470 PolarHBondContact N-O 3.08Å; F399-L470 PolarHBondContact O-N 3.3Å
400	I	91.1	Very high	79.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.9	-176.2	-51.3	155	0	0	0	107.2	L403 M412 F416 F439 A440 V442 L467 H468	I400-L403 HydrophobicContact CB-CD1 4.1Å; I400-L403 HydrophobicContact CG2-CD1 3.79Å; I400-L403 HydrophobicContact CG2-CD2 4.23Å; I400-L403 HydrophobicContact CG2-CG 3.9Å; I400-M412 HydrophobicContact CD1-SD 4.41Å; I400-F416 HydrophobicContact CD1-CD2 4.25Å; I400-F416 HydrophobicContact CD1-CE1 3.81Å; I400-F416 HydrophobicContact CD1-CE2 3.44Å; I400-F416 VanDerWaalsContact CD1-CE2 3.44Å; I400-F416 HydrophobicContact CD1-CZ 3.22Å; I400-F416 HydrophobicContact CG1-CE1 4.2Å; I400-F416 HydrophobicContact CG1-CE2 4.29Å; I400-F416 HydrophobicContact CG1-CZ 3.64Å; I400-F439 CarbonylContact O-C 3.56Å; I400-F439 WeakPolarHBondContact O-CA 3.35Å; I400-F439 VanDerWaalsContact O-CB 3.23Å; I400-F439 WeakPolarHBondContact O-CB 3.47Å; I400-A440 HydrophobicContact CB-CB 4.44Å; I400-A440 HydrophobicContact CD1-CB 4.22Å; I400-A440 PolarHBondContact N-O 3.03Å; I400-A440 PolarHBondContact O-N 2.82Å; I400-V442 HydrophobicContact CD1-CB 4.3Å; I400-V442 HydrophobicContact CD1-CG2 3.57Å; I400-L467 HydrophobicContact CG2-CD2 4.36Å; I400-H468 CarbonylContact C-O 3.48Å; I400-H468 WeakPolarHBondContact CA-O 3.1Å
401	R	90.3	Very high	81.4	Confident	93 Å²	93	53.9 Å²	53.9	35%	0.351	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	163.2	178.3	68.8	-175.5	165.7	84.2	5.1	111.1	F399 L403 H468	F399-R401 HydrophobicContact CE1-CB 3.97Å; F399-R401 HydrophobicContact CZ-CB 4.23Å; R401-L403 VanDerWaalsContact C-N 3.34Å; R401-H468 HydrophobicContact CG-CB 3.48Å; R401-H468 VanDerWaalsContact CG-CB 3.48Å; R401-H468 PolarHBondContact N-O 3.38Å; R401-H468 PolarHBondContact NH1-CD2 3.13Å; R401-H468 VanDerWaalsContact NH1-CG 3.3Å; R401-H468 VanDerWaalsContact NH2-CG 3.29Å; R401-H468 PolarHBondContact NH2-ND1 3.24Å; R401-H468 PolarHBondContact O-N 2.73Å; R401-H468 VanDerWaalsContact O-N 3.11Å
402	N	89	Confident	82.6	Confident	74 Å²	74	50.3 Å²	50.3	40%	0.396	25%	0.25	S	C	.	.	S	Bend	trans	66.6	28	-177.8	-163	42.5	0	0	0	114.8	G438 M466	N402-G438 PolarHBondContact N-O 2.98Å; N402-G438 VanDerWaalsContact N-O 3.13Å; N402-M466 PolarHBondContact ND2-O 3.25Å
403	L	88.4	Confident	83.8	Confident	2 Å²	2	56 Å²	56	1%	0.01	27%	0.274	C	S	.	.			trans	-64.6	148.6	173.9	-78.9	158.4	0	0	0	111.5	I400 R401 M412 F427 G438 A440 F462 R465 L467	I400-L403 HydrophobicContact CB-CD1 4.1Å; I400-L403 HydrophobicContact CG2-CD1 3.79Å; I400-L403 HydrophobicContact CG2-CD2 4.23Å; I400-L403 HydrophobicContact CG2-CG 3.9Å; R401-L403 VanDerWaalsContact C-N 3.34Å; L403-M412 HydrophobicContact CD1-SD 4.29Å; L403-M412 HydrophobicContact CD2-CE 3.55Å; L403-M412 HydrophobicContact CD2-CG 4.44Å; L403-M412 HydrophobicContact CD2-SD 3.5Å; L403-M412 WeakPolarHBondContact CD2-SD 3.31Å; L403-F427 HydrophobicContact CD1-CE2 4.24Å; L403-G438 PolarHBondContact N-O 3.28Å; L403-A440 HydrophobicContact CD1-CB 3.59Å; L403-F462 HydrophobicContact CD2-CD1 4.48Å; L403-R465 PolarHBondContact O-NH1 2.82Å; L403-L467 HydrophobicContact CD2-CD2 3.45Å; L403-L467 VanDerWaalsContact CD2-CD2 3.45Å; L403-L467 HydrophobicContact CG-CD2 4.11Å
404	P	85.9	Confident	85.2	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.019	28%	0.282	C	S	.	.			trans	-73.7	147.9	174.6	28	-26.8	0	0	0	111	T406 C407 F462 Q463	P404-T406 PolarHBondContact O-N 3.49Å; P404-C407 HydrophobicContact CG-CB 4.06Å; P404-C407 VanDerWaalsContact O-CB 3.31Å; P404-C407 WeakPolarHBondContact O-CB 3.41Å; P404-C407 PolarHBondContact O-N 3.49Å; P404-F462 HydrophobicContact CG-CD1 3.62Å; P404-F462 HydrophobicContact CG-CE1 3.68Å; P404-Q463 HydrophobicContact CB-CB 4.31Å; P404-Q463 HydrophobicContact CG-CB 3.93Å; P404-Q463 HydrophobicContact CG-CG 4.28Å
405	Y	84.4	Confident	86.2	Confident	139 Å²	139	51.8 Å²	51.8	55%	0.545	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-3.6	-176.9	-65.9	-61.2	0	0	0	114.1	P436	Y405-P436 WeakPolarHBondContact CD1-O 3.44Å; Y405-P436 WeakPolarHBondContact CE1-O 3.27Å
406	T	83.9	Confident	87	Confident	103 Å²	103	50.6 Å²	50.6	63%	0.632	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-8.6	176	38.2	0	0	0	0	113.4	P404 Q463	P404-T406 PolarHBondContact O-N 3.49Å; T406-Q463 PolarHBondContact OG1-OE1 3.09Å
407	C	83.8	Confident	87.4	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.041	26%	0.259	C	S	.	.			trans	-70.4	139.2	-174	-171.8	0	0	0	0	112.9	P404 E411 F427 F462	P404-C407 HydrophobicContact CG-CB 4.06Å; P404-C407 VanDerWaalsContact O-CB 3.31Å; P404-C407 WeakPolarHBondContact O-CB 3.41Å; P404-C407 PolarHBondContact O-N 3.49Å; C407-E411 VanDerWaalsContact CA-OE2 3.28Å; C407-E411 WeakPolarHBondContact CA-OE2 3.23Å; C407-F427 HydrophobicContact CB-CZ 3.99Å; C407-F427 WeakPolarHBondContact O-CE1 3.45Å; C407-F427 VanDerWaalsContact O-CZ 3.22Å; C407-F427 WeakPolarHBondContact O-CZ 3.24Å; C407-F462 HydrophobicContact CB-CE1 4.13Å
408	T	83.9	Confident	87.6	Confident	56 Å²	56	60.5 Å²	60.5	34%	0.344	29%	0.288	S	S	.	.			trans	-98.6	169	171.4	78	0	0	0	0	113.1	E410 E411	T408-E410 PolarHBondContact O-N 3.48Å; T408-E410 PolarHBondContact OG1-N 3.06Å; T408-E411 PolarHBondContact N-OE2 2.93Å; T408-E411 VanDerWaalsContact N-OE2 3.07Å; T408-E411 PolarHBondContact OG1-N 3.4Å
409	E	82	Confident	87.5	Confident	42 Å²	42	63.2 Å²	63.2	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-27.6	170.6	-168.5	175.9	136.6	0	0	111	K413 I425 K632	E409-K413 WeakPolarHBondContact O-CB 3.49Å; E409-K413 PolarHBondContact O-N 3.39Å; E409-I425 HydrophobicContact CG-CB 4.3Å; E409-I425 HydrophobicContact CG-CG2 3.9Å; E409-K632 IonicContact OE1-NZ 3.71Å; E409-K632 PolarHBondContact OE1-NZ 3.48Å; E409-K632 IonicContact OE2-NZ 3.75Å; E409-K632 PolarHBondContact OE2-NZ 3.46Å
410	E	84.3	Confident	87.4	Confident	133 Å²	133	61.3 Å²	61.3	62%	0.621	29%	0.294	S	S	*	.	H	α-helix	trans	-74	-46.7	-179.2	-66.6	139.2	166.7	0	0	112.3	T408 M412 K413 E414	T408-E410 PolarHBondContact O-N 3.48Å; T408-E410 PolarHBondContact OG1-N 3.06Å; E410-M412 PolarHBondContact O-N 3.22Å; E410-K413 WeakPolarHBondContact O-CA 3.29Å; E410-K413 WeakPolarHBondContact O-CB 3.37Å; E410-K413 PolarHBondContact O-N 3.36Å; E410-E414 PolarHBondContact O-N 3.25Å
411	E	87.2	Confident	87.2	Confident	62 Å²	62	64.5 Å²	64.5	29%	0.29	32%	0.315	S	S	.	.	H	α-helix	trans	-59.3	-38.2	175.5	-65.4	-179.6	114.6	0	0	111.7	C407 T408 L415 F462 Q463	C407-E411 VanDerWaalsContact CA-OE2 3.28Å; C407-E411 WeakPolarHBondContact CA-OE2 3.23Å; T408-E411 PolarHBondContact N-OE2 2.93Å; T408-E411 VanDerWaalsContact N-OE2 3.07Å; T408-E411 PolarHBondContact OG1-N 3.4Å; E411-L415 VanDerWaalsContact O-CB 3.28Å; E411-L415 WeakPolarHBondContact O-CB 3.4Å; E411-L415 PolarHBondContact O-N 3.13Å; E411-F462 HydrophobicContact CB-CZ 3.95Å; E411-Q463 PolarHBondContact OE1-NE2 2.88Å; E411-Q463 PolarHBondContact OE2-NE2 3.34Å
412	M	86.7	Confident	87.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.2	-41.5	172.7	-77.8	-65.4	102.4	0	0	112.3	I400 L403 E410 L415 F416 F427 F462	I400-M412 HydrophobicContact CD1-SD 4.41Å; L403-M412 HydrophobicContact CD1-SD 4.29Å; L403-M412 HydrophobicContact CD2-CE 3.55Å; L403-M412 HydrophobicContact CD2-CG 4.44Å; L403-M412 HydrophobicContact CD2-SD 3.5Å; L403-M412 WeakPolarHBondContact CD2-SD 3.31Å; E410-M412 PolarHBondContact O-N 3.22Å; M412-L415 HydrophobicContact CE-CD1 4.46Å; M412-L415 PolarHBondContact O-N 2.87Å; M412-F416 WeakPolarHBondContact O-CB 3.5Å; M412-F416 WeakPolarHBondContact O-CD2 3.46Å; M412-F416 PolarHBondContact O-N 2.71Å; M412-F416 HydrophobicContact SD-CD2 4.27Å; M412-F416 HydrophobicContact SD-CE2 3.88Å; M412-F427 HydrophobicContact CG-CD2 4.44Å; M412-F427 HydrophobicContact CG-CE2 4.08Å; M412-F462 HydrophobicContact CE-CD1 4Å; M412-F462 HydrophobicContact CE-CD2 4.35Å; M412-F462 HydrophobicContact CE-CE1 3.71Å; M412-F462 HydrophobicContact CE-CE2 4.07Å; M412-F462 HydrophobicContact CE-CG 4.32Å; M412-F462 HydrophobicContact CE-CZ 3.76Å
413	K	87.4	Confident	86.9	Confident	123 Å²	123	62 Å²	62	54%	0.535	32%	0.315	S	S	.	.	H	α-helix	trans	-60.3	-48.4	175.7	-173.2	-178.9	175.6	-170.9	0	111	E409 E410 L415 F416 V417 I425	E409-K413 WeakPolarHBondContact O-CB 3.49Å; E409-K413 PolarHBondContact O-N 3.39Å; E410-K413 WeakPolarHBondContact O-CA 3.29Å; E410-K413 WeakPolarHBondContact O-CB 3.37Å; E410-K413 PolarHBondContact O-N 3.36Å; K413-L415 PolarHBondContact O-N 3.25Å; K413-F416 PolarHBondContact O-N 3.32Å; K413-V417 HydrophobicContact CG-CG2 4.12Å; K413-V417 WeakPolarHBondContact O-CB 3.32Å; K413-V417 WeakPolarHBondContact O-CG2 3.39Å; K413-V417 PolarHBondContact O-N 2.82Å; K413-I425 HydrophobicContact CB-CD1 3.57Å; K413-I425 HydrophobicContact CG-CD1 3.94Å
414	E	89.3	Confident	86.6	Confident	130 Å²	130	66 Å²	66	61%	0.607	33%	0.334	S	S	*	.	H	α-helix	trans	-63.2	-38.8	177.9	-71.5	-175.6	-171.8	0	0	113.5	E410 K418	E410-E414 PolarHBondContact O-N 3.25Å; E414-K418 WeakPolarHBondContact O-CD 3.43Å; E414-K418 VanDerWaalsContact O-CE 3.28Å; E414-K418 WeakPolarHBondContact O-CE 3.24Å; E414-K418 WeakPolarHBondContact O-CG 3.4Å
415	L	89	Confident	86.6	Confident	18 Å²	18	66.5 Å²	66.5	9%	0.094	34%	0.336	C	S	.	.	H	α-helix	trans	-69.1	-42.2	179.3	-172.4	145.5	0	0	0	111.5	E411 M412 K413 Y419 L457 F462 L467	E411-L415 VanDerWaalsContact O-CB 3.28Å; E411-L415 WeakPolarHBondContact O-CB 3.4Å; E411-L415 PolarHBondContact O-N 3.13Å; M412-L415 HydrophobicContact CE-CD1 4.46Å; M412-L415 PolarHBondContact O-N 2.87Å; K413-L415 PolarHBondContact O-N 3.25Å; L415-Y419 WeakPolarHBondContact O-CD2 3.41Å; L415-Y419 VanDerWaalsContact O-CE2 3.24Å; L415-Y419 WeakPolarHBondContact O-CE2 3.23Å; L415-L457 HydrophobicContact CD2-CD1 3.58Å; L415-L457 HydrophobicContact CD2-CD2 3.76Å; L415-L457 HydrophobicContact CD2-CG 4.29Å; L415-F462 HydrophobicContact CD1-CD2 3.41Å; L415-F462 VanDerWaalsContact CD1-CD2 3.41Å; L415-F462 HydrophobicContact CD1-CE2 3.86Å; L415-F462 HydrophobicContact CD1-CG 4.24Å; L415-L467 HydrophobicContact CD1-CD1 4.3Å; L415-L467 HydrophobicContact CD2-CD1 4.22Å
416	F	89.3	Confident	86.5	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-83.9	-31.2	-178.2	-77.9	-101.5	0	0	0	113.7	L398 I400 M412 K413 K418 Y419 L422 V442 Y444 L457 V469	L398-F416 HydrophobicContact CD1-CE1 4.2Å; I400-F416 HydrophobicContact CD1-CD2 4.25Å; I400-F416 HydrophobicContact CD1-CE1 3.81Å; I400-F416 HydrophobicContact CD1-CE2 3.44Å; I400-F416 VanDerWaalsContact CD1-CE2 3.44Å; I400-F416 HydrophobicContact CD1-CZ 3.22Å; I400-F416 HydrophobicContact CG1-CE1 4.2Å; I400-F416 HydrophobicContact CG1-CE2 4.29Å; I400-F416 HydrophobicContact CG1-CZ 3.64Å; M412-F416 WeakPolarHBondContact O-CB 3.5Å; M412-F416 WeakPolarHBondContact O-CD2 3.46Å; M412-F416 PolarHBondContact O-N 2.71Å; M412-F416 HydrophobicContact SD-CD2 4.27Å; M412-F416 HydrophobicContact SD-CE2 3.88Å; K413-F416 PolarHBondContact O-N 3.32Å; F416-K418 PolarHBondContact O-N 3.17Å; F416-K418 VanDerWaalsContact O-N 3.1Å; F416-Y419 PolarHBondContact O-N 3.06Å; F416-L422 HydrophobicContact CB-CD1 3.88Å; F416-L422 HydrophobicContact CB-CD2 4.05Å; F416-V442 HydrophobicContact CB-CG1 4.27Å; F416-V442 HydrophobicContact CD1-CB 4.33Å; F416-V442 HydrophobicContact CD1-CG1 4.01Å; F416-V442 HydrophobicContact CD1-CG2 4.38Å; F416-V442 HydrophobicContact CG-CG1 4.27Å; F416-V442 HydrophobicContact CG-CG2 4.35Å; F416-Y444 HydrophobicContact CD1-CE2 4.23Å; F416-Y444 WeakPolarHBondContact CD1-OH 3.48Å; F416-Y444 PolarHBondContact O-OH 2.89Å; F416-L457 HydrophobicContact CD1-CD1 3.86Å; F416-L457 HydrophobicContact CD2-CD1 4.31Å; F416-L457 HydrophobicContact CE1-CD1 3.51Å; F416-L457 HydrophobicContact CE2-CD1 4.02Å; F416-L457 HydrophobicContact CG-CD1 4.22Å; F416-L457 HydrophobicContact CZ-CD1 3.58Å; F416-V469 HydrophobicContact CZ-CG2 4.4Å
417	V	91.8	Very high	86.5	Confident	73 Å²	73	57.9 Å²	57.9	44%	0.442	29%	0.294	S	S	.	.	H	α-helix	trans	-57.2	-28.8	176.9	160.6	0	0	0	0	112.9	K413 Y419 G420 L422	K413-V417 HydrophobicContact CG-CG2 4.12Å; K413-V417 WeakPolarHBondContact O-CB 3.32Å; K413-V417 WeakPolarHBondContact O-CG2 3.39Å; K413-V417 PolarHBondContact O-N 2.82Å; V417-Y419 PolarHBondContact O-N 2.88Å; V417-Y419 VanDerWaalsContact O-N 3.08Å; V417-G420 PolarHBondContact O-N 3.47Å; V417-G420 VanDerWaalsContact O-N 3.1Å; V417-L422 HydrophobicContact CG2-CD1 3.82Å; V417-L422 HydrophobicContact CG2-CG 3.94Å
418	K	90.4	Very high	86.5	Confident	161 Å²	161	59 Å²	59	70%	0.7	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.3	176.5	-69.8	165.5	-172.4	170.7	0	114.1	E414 F416	E414-K418 WeakPolarHBondContact O-CD 3.43Å; E414-K418 VanDerWaalsContact O-CE 3.28Å; E414-K418 WeakPolarHBondContact O-CE 3.24Å; E414-K418 WeakPolarHBondContact O-CG 3.4Å; F416-K418 PolarHBondContact O-N 3.17Å; F416-K418 VanDerWaalsContact O-N 3.1Å
419	Y	89.1	Confident	86.4	Confident	57 Å²	57	57.1 Å²	57.1	22%	0.224	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-8.8	-179.5	-53.5	-86	0	0	0	113	L415 F416 V417 N449 V452 A453 K456 L457	L415-Y419 WeakPolarHBondContact O-CD2 3.41Å; L415-Y419 VanDerWaalsContact O-CE2 3.24Å; L415-Y419 WeakPolarHBondContact O-CE2 3.23Å; F416-Y419 PolarHBondContact O-N 3.06Å; V417-Y419 PolarHBondContact O-N 2.88Å; V417-Y419 VanDerWaalsContact O-N 3.08Å; Y419-N449 WeakPolarHBondContact O-CB 2.98Å; Y419-N449 PolarHBondContact O-OD1 3.45Å; Y419-V452 HydrophobicContact CD1-CG1 4.4Å; Y419-A453 HydrophobicContact CD2-CB 4.49Å; Y419-A453 HydrophobicContact CG-CB 4.12Å; Y419-K456 HydrophobicContact CD1-CB 4.36Å; Y419-K456 HydrophobicContact CD1-CD 3.93Å; Y419-K456 HydrophobicContact CE1-CB 3.7Å; Y419-K456 HydrophobicContact CE1-CD 3.62Å; Y419-K456 HydrophobicContact CE1-CG 4.32Å; Y419-L457 HydrophobicContact CD2-CD1 3.88Å; Y419-L457 HydrophobicContact CD2-CG 4.38Å; Y419-L457 HydrophobicContact CE2-CD1 3.62Å; Y419-L457 HydrophobicContact CE2-CD2 3.73Å; Y419-L457 HydrophobicContact CE2-CG 3.78Å; Y419-L457 WeakPolarHBondContact OH-CD2 3.48Å
420	G	87.6	Confident	86.4	Confident	13 Å²	13	57.2 Å²	57.2	13%	0.134	29%	0.291	C	S	.	.	S	Bend	trans	156	169.3	173.1	0	0	0	0	0	114.5	V417 L422	V417-G420 PolarHBondContact O-N 3.47Å; V417-G420 VanDerWaalsContact O-N 3.1Å; G420-L422 PolarHBondContact O-N 2.91Å
421	P	88.4	Confident	86	Confident	67 Å²	67	55.7 Å²	55.7	44%	0.435	29%	0.287	S	S	.	.			trans	-63.3	128.5	175.6	25.4	-34.7	0	0	0	112.1	M445	P421-M445 HydrophobicContact CB-CB 4.45Å; P421-M445 HydrophobicContact CB-CG 4.28Å; P421-M445 HydrophobicContact CB-SD 4Å; P421-M445 HydrophobicContact CG-CB 4.3Å; P421-M445 PolarHBondContact O-N 2.81Å
422	L	88	Confident	85.5	Confident	34 Å²	34	60.4 Å²	60.4	18%	0.178	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137.8	179.6	-51.4	-176.6	0	0	0	110.6	F416 V417 G420 I425 V442 Y444	F416-L422 HydrophobicContact CB-CD1 3.88Å; F416-L422 HydrophobicContact CB-CD2 4.05Å; V417-L422 HydrophobicContact CG2-CD1 3.82Å; V417-L422 HydrophobicContact CG2-CG 3.94Å; G420-L422 PolarHBondContact O-N 2.91Å; L422-I425 HydrophobicContact CD1-CD1 3.75Å; L422-I425 HydrophobicContact CD1-CG1 4.06Å; L422-V442 HydrophobicContact CD1-CG1 4.32Å; L422-V442 HydrophobicContact CD2-CG1 3.77Å; L422-Y444 HydrophobicContact CD2-CD1 3.55Å; L422-Y444 HydrophobicContact CD2-CD2 4.36Å; L422-Y444 HydrophobicContact CD2-CE1 3.26Å; L422-Y444 HydrophobicContact CD2-CE2 4.13Å; L422-Y444 HydrophobicContact CD2-CG 4.11Å
423	S	84.7	Confident	85.2	Confident	81 Å²	81	64.2 Å²	64.2	57%	0.566	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	-39.1	174.4	-171.1	0	0	0	0	112.4	T443	S423-T443 WeakPolarHBondContact CA-O 3.4Å; S423-T443 WeakPolarHBondContact CB-O 3.13Å; S423-T443 PolarHBondContact N-O 3.1Å
424	E	80.8	Confident	84.7	Confident	86 Å²	86	61.8 Å²	61.8	40%	0.402	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	138.8	-178.5	-172.2	-173.5	-163.7	0	0	110.3	R397 T443	R397-E424 IonicContact NH1-OE2 3.95Å; E424-T443 PolarHBondContact N-O 2.94Å; E424-T443 PolarHBondContact O-N 3.32Å
425	I	85.9	Confident	84.2	Confident	13 Å²	13	61.7 Å²	61.7	7%	0.067	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.5	162	-53.2	177.5	0	0	0	107.9	E409 K413 L422 V442 K632	E409-I425 HydrophobicContact CG-CB 4.3Å; E409-I425 HydrophobicContact CG-CG2 3.9Å; K413-I425 HydrophobicContact CB-CD1 3.57Å; K413-I425 HydrophobicContact CG-CD1 3.94Å; L422-I425 HydrophobicContact CD1-CD1 3.75Å; L422-I425 HydrophobicContact CD1-CG1 4.06Å; I425-V442 HydrophobicContact CG1-CG2 4.4Å; I425-V442 HydrophobicContact CG2-CG2 4.3Å; I425-K632 PolarHBondContact O-NZ 3.06Å
426	L	83.4	Confident	83.9	Confident	51 Å²	51	61.6 Å²	61.6	27%	0.267	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	115.6	172	178.1	66.1	0	0	0	108.3	P428 F441	L426-P428 HydrophobicContact CG-CG 4.28Å; L426-P428 WeakPolarHBondContact O-CD 3.37Å; L426-F441 HydrophobicContact CB-CB 4.37Å; L426-F441 HydrophobicContact CD2-CD2 4.07Å; L426-F441 HydrophobicContact CG-CD2 4.45Å; L426-F441 PolarHBondContact N-O 2.88Å; L426-F441 PolarHBondContact O-N 3.39Å
427	F	84.1	Confident	83.6	Confident	9 Å²	9	66 Å²	66	4%	0.039	34%	0.344	C	S	.	.			trans	-120	83.7	-172.2	-168.4	-108.4	0	0	0	109.9	L403 C407 M412 I429 P436 A440 T629	L403-F427 HydrophobicContact CD1-CE2 4.24Å; C407-F427 HydrophobicContact CB-CZ 3.99Å; C407-F427 WeakPolarHBondContact O-CE1 3.45Å; C407-F427 VanDerWaalsContact O-CZ 3.22Å; C407-F427 WeakPolarHBondContact O-CZ 3.24Å; M412-F427 HydrophobicContact CG-CD2 4.44Å; M412-F427 HydrophobicContact CG-CE2 4.08Å; F427-I429 PolarHBondContact O-N 3.48Å; F427-P436 HydrophobicContact CD1-CB 4.22Å; F427-P436 HydrophobicContact CE1-CB 3.44Å; F427-P436 VanDerWaalsContact CE1-CB 3.44Å; F427-P436 HydrophobicContact CE1-CG 4.11Å; F427-P436 HydrophobicContact CZ-CB 3.67Å; F427-P436 HydrophobicContact CZ-CG 4.2Å; F427-A440 HydrophobicContact CD2-CB 3.72Å; F427-A440 HydrophobicContact CE2-CB 4.32Å; F427-T629 HydrophobicContact CB-CG2 4.36Å; F427-T629 WeakPolarHBondContact O-CG2 3.49Å
428	P	83	Confident	83.3	Confident	29 Å²	29	63 Å²	63	19%	0.188	33%	0.327	C	S	.	.			trans	-67	109.4	-166.4	-27.4	40	0	0	0	113.9	L426 K437 F439 F441	L426-P428 HydrophobicContact CG-CG 4.28Å; L426-P428 WeakPolarHBondContact O-CD 3.37Å; P428-K437 HydrophobicContact CB-CD 4.47Å; P428-K437 WeakPolarHBondContact O-CB 3.45Å; P428-K437 VanDerWaalsContact O-CG 3.29Å; P428-K437 WeakPolarHBondContact O-CG 3.14Å; P428-K437 PolarHBondContact O-N 3.47Å; P428-F439 HydrophobicContact CB-CE2 4.08Å; P428-F439 HydrophobicContact CB-CZ 4.33Å; P428-F439 HydrophobicContact CG-CD2 4.31Å; P428-F439 HydrophobicContact CG-CE2 3.75Å; P428-F439 HydrophobicContact CG-CZ 4.48Å; P428-F441 HydrophobicContact CG-CE2 4.46Å
429	I	82.9	Confident	83.3	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.087	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-79.6	150.3	172.1	-56.6	-179.1	0	0	0	110.2	F427 K434 K437 E627 T629	F427-I429 PolarHBondContact O-N 3.48Å; I429-K434 VanDerWaalsContact CG2-C 3.42Å; I429-K437 WeakPolarHBondContact O-CE 3.39Å; I429-E627 WeakPolarHBondContact CD1-OE2 3.5Å; I429-T629 HydrophobicContact CD1-CG2 4.35Å
430	D	82.3	Confident	83.3	Confident	45 Å²	45	55.6 Å²	55.6	24%	0.241	30%	0.296	C	S	.	.			trans	-81.8	134.6	170.1	-179.4	55.3	0	0	0	113.1	L432 T433 K434 K435 K437	D430-L432 PolarHBondContact O-N 3.43Å; D430-L432 PolarHBondContact OD2-N 2.89Å; D430-T433 WeakPolarHBondContact CB-OG1 3.45Å; D430-T433 WeakPolarHBondContact OD2-CB 3.46Å; D430-T433 PolarHBondContact OD2-N 2.67Å; D430-T433 PolarHBondContact OD2-OG1 3.48Å; D430-K434 WeakPolarHBondContact O-CA 3.19Å; D430-K434 PolarHBondContact O-N 3.39Å; D430-K435 WeakPolarHBondContact CB-O 3.28Å; D430-K435 PolarHBondContact N-O 2.73Å; D430-K437 HydrophobicContact CB-CG 4.18Å; D430-K437 IonicContact OD1-NZ 2.73Å
431	N	74.7	Confident	83.4	Confident	101 Å²	101	57 Å²	57	54%	0.54	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-31	-170.3	-163.4	40.5	0	0	0	112.7	E630	N431-E630 PolarHBondContact OD1-OE1 2.86Å
432	L	77.8	Confident	83.5	Confident	161 Å²	161	53.8 Å²	53.8	84%	0.843	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-42.9	-177.8	-178.7	62.8	0	0	0	111.9	D430	D430-L432 PolarHBondContact O-N 3.43Å; D430-L432 PolarHBondContact OD2-N 2.89Å
433	T	80.1	Confident	83.6	Confident	79 Å²	79	53.2 Å²	53.2	49%	0.485	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-10.3	-175.7	59.7	0	0	0	0	114.3	D430 K435	D430-T433 WeakPolarHBondContact CB-OG1 3.45Å; D430-T433 WeakPolarHBondContact OD2-CB 3.46Å; D430-T433 PolarHBondContact OD2-N 2.67Å; D430-T433 PolarHBondContact OD2-OG1 3.48Å; T433-K435 PolarHBondContact O-N 2.76Å
434	K	76.1	Confident	83.8	Confident	72 Å²	72	49.8 Å²	49.8	31%	0.313	25%	0.251	S	S	.	.			trans	50.3	23.6	-172.4	-60.1	-69.2	-177.2	170.3	0	114.2	I429 D430 S608 E630	I429-K434 VanDerWaalsContact CG2-C 3.42Å; D430-K434 WeakPolarHBondContact O-CA 3.19Å; D430-K434 PolarHBondContact O-N 3.39Å; K434-S608 PolarHBondContact NZ-OG 2.89Å; K434-S608 VanDerWaalsContact NZ-OG 3.15Å; K434-E630 IonicContact NZ-OE1 3.72Å; K434-E630 PolarHBondContact NZ-OE1 3.05Å; K434-E630 IonicContact NZ-OE2 3.51Å; K434-E630 PolarHBondContact NZ-OE2 3.42Å
435	K	79.4	Confident	84.1	Confident	129 Å²	129	51.8 Å²	51.8	56%	0.561	26%	0.261	S	S	*	.			trans	-102	148.4	175.8	-73	173.8	-176.9	-179.2	0	110.8	D430 T433	D430-K435 WeakPolarHBondContact CB-O 3.28Å; D430-K435 PolarHBondContact N-O 2.73Å; T433-K435 PolarHBondContact O-N 2.76Å
436	P	83.1	Confident	84.3	Confident	16 Å²	16	54.8 Å²	54.8	10%	0.104	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-65.5	146	178.5	27.6	-34.9	0	0	0	111.4	Y405 F427 G438	Y405-P436 WeakPolarHBondContact CD1-O 3.44Å; Y405-P436 WeakPolarHBondContact CE1-O 3.27Å; F427-P436 HydrophobicContact CD1-CB 4.22Å; F427-P436 HydrophobicContact CE1-CB 3.44Å; F427-P436 VanDerWaalsContact CE1-CB 3.44Å; F427-P436 HydrophobicContact CE1-CG 4.11Å; F427-P436 HydrophobicContact CZ-CB 3.67Å; F427-P436 HydrophobicContact CZ-CG 4.2Å; P436-G438 PolarHBondContact O-N 3.01Å
437	K	82.6	Confident	84.5	Confident	93 Å²	93	54.6 Å²	54.6	40%	0.404	28%	0.279	S	S	.	.			trans	-76.6	12.6	-175.4	-69	179.9	178.9	-179.1	0	115.1	P428 I429 D430 F439	P428-K437 HydrophobicContact CB-CD 4.47Å; P428-K437 WeakPolarHBondContact O-CB 3.45Å; P428-K437 VanDerWaalsContact O-CG 3.29Å; P428-K437 WeakPolarHBondContact O-CG 3.14Å; P428-K437 PolarHBondContact O-N 3.47Å; I429-K437 WeakPolarHBondContact O-CE 3.39Å; D430-K437 HydrophobicContact CB-CG 4.18Å; D430-K437 IonicContact OD1-NZ 2.73Å; K437-F439 HydrophobicContact CB-CD1 3.82Å; K437-F439 HydrophobicContact CB-CE1 3.47Å; K437-F439 VanDerWaalsContact CB-CE1 3.47Å; K437-F439 HydrophobicContact CB-CZ 4.1Å; K437-F439 HydrophobicContact CD-CE1 4.34Å; K437-F439 HydrophobicContact CD-CZ 4.37Å; K437-F439 HydrophobicContact CG-CE1 4.5Å; K437-F439 VanDerWaalsContact O-CD1 3.31Å; K437-F439 WeakPolarHBondContact O-CD1 3.2Å; K437-F439 PolarHBondContact O-N 3.43Å
438	G	84.9	Confident	84.8	Confident	9 Å²	9	61 Å²	61	9%	0.093	31%	0.309	C	S	.	.	S	Bend	trans	71	15.6	-177.9	0	0	0	0	0	114.3	N402 L403 P436	N402-G438 PolarHBondContact N-O 2.98Å; N402-G438 VanDerWaalsContact N-O 3.13Å; L403-G438 PolarHBondContact N-O 3.28Å; P436-G438 PolarHBondContact O-N 3.01Å
439	F	89.8	Confident	85.1	Confident	63 Å²	63	61.1 Å²	61.1	28%	0.276	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	159.1	173.9	67.6	-98.4	0	0	0	112	F399 I400 P428 K437 F441	F399-F439 HydrophobicContact CD2-CD2 4.41Å; F399-F439 HydrophobicContact CE2-CB 3.69Å; F399-F439 AromaticContact CE2-CD2 3.6Å; F399-F439 HydrophobicContact CE2-CD2 3.6Å; F399-F439 HydrophobicContact CE2-CE2 4.39Å; F399-F439 AromaticContact CE2-CG 3.81Å; F399-F439 HydrophobicContact CE2-CG 3.81Å; F399-F439 HydrophobicContact CZ-CB 4.02Å; F399-F439 HydrophobicContact CZ-CD2 4.48Å; F399-F439 HydrophobicContact CZ-CG 4.31Å; I400-F439 CarbonylContact O-C 3.56Å; I400-F439 WeakPolarHBondContact O-CA 3.35Å; I400-F439 VanDerWaalsContact O-CB 3.23Å; I400-F439 WeakPolarHBondContact O-CB 3.47Å; P428-F439 HydrophobicContact CB-CE2 4.08Å; P428-F439 HydrophobicContact CB-CZ 4.33Å; P428-F439 HydrophobicContact CG-CD2 4.31Å; P428-F439 HydrophobicContact CG-CE2 3.75Å; P428-F439 HydrophobicContact CG-CZ 4.48Å; K437-F439 HydrophobicContact CB-CD1 3.82Å; K437-F439 HydrophobicContact CB-CE1 3.47Å; K437-F439 VanDerWaalsContact CB-CE1 3.47Å; K437-F439 HydrophobicContact CB-CZ 4.1Å; K437-F439 HydrophobicContact CD-CE1 4.34Å; K437-F439 HydrophobicContact CD-CZ 4.37Å; K437-F439 HydrophobicContact CG-CE1 4.5Å; K437-F439 VanDerWaalsContact O-CD1 3.31Å; K437-F439 WeakPolarHBondContact O-CD1 3.2Å; K437-F439 PolarHBondContact O-N 3.43Å; F439-F441 HydrophobicContact CD2-CE2 4.28Å; F439-F441 HydrophobicContact CE2-CE2 4.05Å
440	A	89.7	Confident	85.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	164.9	179.8	0	0	0	0	0	111.5	I400 L403 F427	I400-A440 HydrophobicContact CB-CB 4.44Å; I400-A440 HydrophobicContact CD1-CB 4.22Å; I400-A440 PolarHBondContact N-O 3.03Å; I400-A440 PolarHBondContact O-N 2.82Å; L403-A440 HydrophobicContact CD1-CB 3.59Å; F427-A440 HydrophobicContact CD2-CB 3.72Å; F427-A440 HydrophobicContact CE2-CB 4.32Å
441	F	89.8	Confident	85.7	Confident	42 Å²	42	60.8 Å²	60.8	18%	0.184	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137	166.9	-56.1	-91	0	0	0	110	L398 F399 L426 P428 F439	L398-F441 VanDerWaalsContact O-CA 3.29Å; L398-F441 WeakPolarHBondContact O-CA 3.13Å; F399-F441 HydrophobicContact CB-CD1 4Å; F399-F441 HydrophobicContact CB-CE1 4.03Å; F399-F441 AromaticContact CD2-CD1 3.88Å; F399-F441 HydrophobicContact CD2-CD1 3.88Å; F399-F441 AromaticContact CD2-CE1 3.46Å; F399-F441 HydrophobicContact CD2-CE1 3.46Å; F399-F441 VanDerWaalsContact CD2-CE1 3.46Å; F399-F441 HydrophobicContact CD2-CE2 4.44Å; F399-F441 AromaticContact CD2-CZ 3.77Å; F399-F441 HydrophobicContact CD2-CZ 3.77Å; F399-F441 HydrophobicContact CE2-CE1 4.27Å; F399-F441 HydrophobicContact CE2-CZ 4.15Å; F399-F441 HydrophobicContact CG-CD1 4.42Å; F399-F441 HydrophobicContact CG-CE1 4.1Å; L426-F441 HydrophobicContact CB-CB 4.37Å; L426-F441 HydrophobicContact CD2-CD2 4.07Å; L426-F441 HydrophobicContact CG-CD2 4.45Å; L426-F441 PolarHBondContact N-O 2.88Å; L426-F441 PolarHBondContact O-N 3.39Å; P428-F441 HydrophobicContact CG-CE2 4.46Å; F439-F441 HydrophobicContact CD2-CE2 4.28Å; F439-F441 HydrophobicContact CE2-CE2 4.05Å
442	V	90.2	Very high	86.4	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	123.8	177.5	173.7	0	0	0	0	108.7	R397 L398 I400 F416 L422 I425 Y444	R397-V442 WeakPolarHBondContact CA-O 3.41Å; L398-V442 PolarHBondContact N-O 3.06Å; L398-V442 PolarHBondContact O-N 2.87Å; I400-V442 HydrophobicContact CD1-CB 4.3Å; I400-V442 HydrophobicContact CD1-CG2 3.57Å; F416-V442 HydrophobicContact CB-CG1 4.27Å; F416-V442 HydrophobicContact CD1-CB 4.33Å; F416-V442 HydrophobicContact CD1-CG1 4.01Å; F416-V442 HydrophobicContact CD1-CG2 4.38Å; F416-V442 HydrophobicContact CG-CG1 4.27Å; F416-V442 HydrophobicContact CG-CG2 4.35Å; L422-V442 HydrophobicContact CD1-CG1 4.32Å; L422-V442 HydrophobicContact CD2-CG1 3.77Å; I425-V442 HydrophobicContact CG1-CG2 4.4Å; I425-V442 HydrophobicContact CG2-CG2 4.3Å; V442-Y444 HydrophobicContact CG1-CD2 4.42Å; V442-Y444 HydrophobicContact CG1-CE2 4.13Å
443	T	89.6	Confident	87	Confident	22 Å²	22	51 Å²	51	14%	0.135	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123	176.8	-49.8	0	0	0	0	108.6	R397 S423 E424	R397-T443 HydrophobicContact CB-CG2 4.3Å; S423-T443 WeakPolarHBondContact CA-O 3.4Å; S423-T443 WeakPolarHBondContact CB-O 3.13Å; S423-T443 PolarHBondContact N-O 3.1Å; E424-T443 PolarHBondContact N-O 2.94Å; E424-T443 PolarHBondContact O-N 3.32Å
444	Y	90.6	Very high	87.4	Confident	8 Å²	8	49 Å²	49	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	157.2	175.2	-79.5	-91.6	0	0	0	111.8	G396 L398 F416 L422 V442 I446 N449 A450 A453	G396-Y444 PolarHBondContact O-N 3.38Å; L398-Y444 HydrophobicContact CD1-CD2 4.42Å; L398-Y444 HydrophobicContact CD1-CE2 3.86Å; F416-Y444 HydrophobicContact CD1-CE2 4.23Å; F416-Y444 WeakPolarHBondContact CD1-OH 3.48Å; F416-Y444 PolarHBondContact O-OH 2.89Å; L422-Y444 HydrophobicContact CD2-CD1 3.55Å; L422-Y444 HydrophobicContact CD2-CD2 4.36Å; L422-Y444 HydrophobicContact CD2-CE1 3.26Å; L422-Y444 HydrophobicContact CD2-CE2 4.13Å; L422-Y444 HydrophobicContact CD2-CG 4.11Å; V442-Y444 HydrophobicContact CG1-CD2 4.42Å; V442-Y444 HydrophobicContact CG1-CE2 4.13Å; Y444-I446 VanDerWaalsContact C-N 3.27Å; Y444-I446 WeakPolarHBondContact CB-O 3.46Å; Y444-N449 HydrophobicContact CD1-CB 3.5Å; Y444-N449 VanDerWaalsContact CD1-CB 3.5Å; Y444-N449 HydrophobicContact CE1-CB 3.92Å; Y444-N449 HydrophobicContact CG-CB 4.01Å; Y444-A450 HydrophobicContact CD2-CB 3.64Å; Y444-A450 HydrophobicContact CE2-CB 4.32Å; Y444-A450 HydrophobicContact CG-CB 4.29Å; Y444-A453 HydrophobicContact CE2-CB 3.83Å; Y444-A453 WeakPolarHBondContact OH-CB 3.34Å
445	M	86.8	Confident	88	Confident	128 Å²	128	49.7 Å²	49.7	63%	0.631	26%	0.264	S	S	*	.	S	Bend	trans	-74.2	-18.3	170.2	-63.2	-169.1	75.6	0	0	113.3	P421	P421-M445 HydrophobicContact CB-CB 4.45Å; P421-M445 HydrophobicContact CB-CG 4.28Å; P421-M445 HydrophobicContact CB-SD 4Å; P421-M445 HydrophobicContact CG-CB 4.3Å; P421-M445 PolarHBondContact O-N 2.81Å
446	I	89.8	Confident	88.5	Confident	77 Å²	77	49.7 Å²	49.7	40%	0.395	26%	0.264	S	S	.	.	S	Bend	trans	-134.2	121.7	179.7	-54.1	176.1	0	0	0	107.2	Y444 E448 N449	Y444-I446 VanDerWaalsContact C-N 3.27Å; Y444-I446 WeakPolarHBondContact CB-O 3.46Å; I446-E448 VanDerWaalsContact C-N 3.28Å; I446-E448 HydrophobicContact CG2-CB 4.05Å; I446-E448 HydrophobicContact CG2-CG 4.22Å; I446-E448 PolarHBondContact O-N 3.41Å; I446-N449 WeakPolarHBondContact O-CB 3.35Å; I446-N449 PolarHBondContact O-N 2.68Å; I446-N449 VanDerWaalsContact O-N 3.13Å
447	P	88.3	Confident	88.7	Confident	46 Å²	46	49 Å²	49	30%	0.299	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-31.9	-177.2	-27.1	35.9	0	0	0	114.7	S393 N449 A450 V451	S393-P447 WeakPolarHBondContact O-CB 3.33Å; S393-P447 WeakPolarHBondContact O-CG 3.32Å; P447-N449 PolarHBondContact O-N 2.73Å; P447-A450 WeakPolarHBondContact O-CA 3.37Å; P447-A450 VanDerWaalsContact O-CB 3.23Å; P447-A450 WeakPolarHBondContact O-CB 3.41Å; P447-A450 PolarHBondContact O-N 3.25Å; P447-V451 PolarHBondContact O-N 2.76Å
448	E	88.8	Confident	89	Confident	144 Å²	144	48.5 Å²	48.5	67%	0.673	26%	0.261	S	S	*	.	H	α-helix	trans	-53.6	-39.8	174.7	-59.8	175	179.7	0	0	112.2	I446 A450 V451 V452	I446-E448 VanDerWaalsContact C-N 3.28Å; I446-E448 HydrophobicContact CG2-CB 4.05Å; I446-E448 HydrophobicContact CG2-CG 4.22Å; I446-E448 PolarHBondContact O-N 3.41Å; E448-A450 VanDerWaalsContact C-N 3.28Å; E448-A450 PolarHBondContact O-N 3.46Å; E448-V451 PolarHBondContact O-N 3.22Å; E448-V452 WeakPolarHBondContact O-CG2 3.31Å; E448-V452 PolarHBondContact O-N 3.04Å
449	N	90.8	Very high	89	Confident	31 Å²	31	49.6 Å²	49.6	17%	0.166	27%	0.272	C	S	.	.	H	α-helix	trans	-68.6	-27.8	177.8	-64.5	-23.7	0	0	0	112.2	Y419 Y444 I446 P447 A453	Y419-N449 WeakPolarHBondContact O-CB 2.98Å; Y419-N449 PolarHBondContact O-OD1 3.45Å; Y444-N449 HydrophobicContact CD1-CB 3.5Å; Y444-N449 VanDerWaalsContact CD1-CB 3.5Å; Y444-N449 HydrophobicContact CE1-CB 3.92Å; Y444-N449 HydrophobicContact CG-CB 4.01Å; I446-N449 WeakPolarHBondContact O-CB 3.35Å; I446-N449 PolarHBondContact O-N 2.68Å; I446-N449 VanDerWaalsContact O-N 3.13Å; P447-N449 PolarHBondContact O-N 2.73Å; N449-A453 WeakPolarHBondContact O-CB 3.37Å; N449-A453 PolarHBondContact O-N 3.1Å
450	A	88.1	Confident	89	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.6	-40.9	172.6	0	0	0	0	0	111.2	V392 L398 Y444 P447 E448 A453 L454	V392-A450 HydrophobicContact CG1-CB 4.01Å; L398-A450 HydrophobicContact CD1-CB 4.32Å; L398-A450 HydrophobicContact CD2-CB 4.09Å; L398-A450 HydrophobicContact CG-CB 4.1Å; Y444-A450 HydrophobicContact CD2-CB 3.64Å; Y444-A450 HydrophobicContact CE2-CB 4.32Å; Y444-A450 HydrophobicContact CG-CB 4.29Å; P447-A450 WeakPolarHBondContact O-CA 3.37Å; P447-A450 VanDerWaalsContact O-CB 3.23Å; P447-A450 WeakPolarHBondContact O-CB 3.41Å; P447-A450 PolarHBondContact O-N 3.25Å; E448-A450 VanDerWaalsContact C-N 3.28Å; E448-A450 PolarHBondContact O-N 3.46Å; A450-A453 PolarHBondContact O-N 3.1Å; A450-L454 VanDerWaalsContact O-CB 3.28Å; A450-L454 WeakPolarHBondContact O-CB 3.28Å; A450-L454 PolarHBondContact O-N 2.88Å
451	V	88.8	Confident	89	Confident	55 Å²	55	55.9 Å²	55.9	33%	0.333	31%	0.305	S	S	.	.	H	α-helix	trans	-64	-46.3	173.5	-176.1	0	0	0	0	110.8	V392 P447 E448 A453 L454 A455	V392-V451 HydrophobicContact CB-CG2 4.27Å; V392-V451 HydrophobicContact CG1-CG2 3.62Å; P447-V451 PolarHBondContact O-N 2.76Å; E448-V451 PolarHBondContact O-N 3.22Å; V451-A453 VanDerWaalsContact C-N 3.29Å; V451-A453 PolarHBondContact O-N 2.93Å; V451-L454 PolarHBondContact O-N 3.08Å; V451-A455 WeakPolarHBondContact O-CB 3.45Å; V451-A455 PolarHBondContact O-N 3.01Å
452	V	89.7	Confident	88.8	Confident	57 Å²	57	55.1 Å²	55.1	35%	0.345	30%	0.302	S	S	.	.	H	α-helix	trans	-63	-34.7	177.8	172.9	0	0	0	0	112.3	Y419 E448 K456	Y419-V452 HydrophobicContact CD1-CG1 4.4Å; E448-V452 WeakPolarHBondContact O-CG2 3.31Å; E448-V452 PolarHBondContact O-N 3.04Å; V452-K456 HydrophobicContact CG1-CD 4.12Å; V452-K456 WeakPolarHBondContact O-CB 3.49Å; V452-K456 WeakPolarHBondContact O-CD 3.34Å; V452-K456 VanDerWaalsContact O-CG 3.31Å; V452-K456 WeakPolarHBondContact O-CG 3.45Å
453	A	89.4	Confident	88.5	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-73.4	-45.7	174.8	0	0	0	0	0	112	L398 Y419 Y444 N449 A450 V451 A455 K456 L457	L398-A453 HydrophobicContact CD1-CB 4.01Å; Y419-A453 HydrophobicContact CD2-CB 4.49Å; Y419-A453 HydrophobicContact CG-CB 4.12Å; Y444-A453 HydrophobicContact CE2-CB 3.83Å; Y444-A453 WeakPolarHBondContact OH-CB 3.34Å; N449-A453 WeakPolarHBondContact O-CB 3.37Å; N449-A453 PolarHBondContact O-N 3.1Å; A450-A453 PolarHBondContact O-N 3.1Å; V451-A453 VanDerWaalsContact C-N 3.29Å; V451-A453 PolarHBondContact O-N 2.93Å; A453-A455 PolarHBondContact O-N 3.4Å; A453-K456 PolarHBondContact O-N 3.47Å; A453-K456 VanDerWaalsContact O-N 3.13Å; A453-L457 HydrophobicContact CB-CD1 4.34Å; A453-L457 VanDerWaalsContact O-CB 3.24Å; A453-L457 WeakPolarHBondContact O-CB 3.21Å; A453-L457 PolarHBondContact O-N 3.45Å
454	L	89.6	Confident	88.2	Confident	38 Å²	38	61.4 Å²	61.4	20%	0.199	35%	0.348	C	S	.	.	H	α-helix	trans	-52.5	-53	175.7	176.6	63.9	0	0	0	110.9	V392 L398 A450 V451 K456 L457 D458 V469	V392-L454 HydrophobicContact CG2-CD2 4.07Å; L398-L454 HydrophobicContact CD2-CB 4.18Å; A450-L454 VanDerWaalsContact O-CB 3.28Å; A450-L454 WeakPolarHBondContact O-CB 3.28Å; A450-L454 PolarHBondContact O-N 2.88Å; V451-L454 PolarHBondContact O-N 3.08Å; L454-K456 PolarHBondContact O-N 2.86Å; L454-K456 VanDerWaalsContact O-N 3.14Å; L454-L457 PolarHBondContact O-N 2.99Å; L454-D458 PolarHBondContact O-N 2.87Å; L454-D458 VanDerWaalsContact O-N 3.16Å; L454-V469 HydrophobicContact CD1-CB 3.92Å; L454-V469 HydrophobicContact CD1-CG1 3.77Å; L454-V469 WeakPolarHBondContact CD1-O 3.46Å
455	A	89.3	Confident	88.1	Confident	86 Å²	86	65 Å²	65	71%	0.711	36%	0.362	S	S	*	.	H	α-helix	trans	-67.4	-11.1	-178.5	0	0	0	0	0	115.2	V451 A453	V451-A455 WeakPolarHBondContact O-CB 3.45Å; V451-A455 PolarHBondContact O-N 3.01Å; A453-A455 PolarHBondContact O-N 3.4Å
456	K	88.8	Confident	88.1	Confident	129 Å²	129	63.9 Å²	63.9	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-118.1	-14	-178.4	-67.2	177.7	-175.1	172.3	0	114.3	Y419 V452 A453 L454	Y419-K456 HydrophobicContact CD1-CB 4.36Å; Y419-K456 HydrophobicContact CD1-CD 3.93Å; Y419-K456 HydrophobicContact CE1-CB 3.7Å; Y419-K456 HydrophobicContact CE1-CD 3.62Å; Y419-K456 HydrophobicContact CE1-CG 4.32Å; V452-K456 HydrophobicContact CG1-CD 4.12Å; V452-K456 WeakPolarHBondContact O-CB 3.49Å; V452-K456 WeakPolarHBondContact O-CD 3.34Å; V452-K456 VanDerWaalsContact O-CG 3.31Å; V452-K456 WeakPolarHBondContact O-CG 3.45Å; A453-K456 PolarHBondContact O-N 3.47Å; A453-K456 VanDerWaalsContact O-N 3.13Å; L454-K456 PolarHBondContact O-N 2.86Å; L454-K456 VanDerWaalsContact O-N 3.14Å
457	L	88.6	Confident	88.1	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-117.4	-17.6	-175.7	-66.7	178.8	0	0	0	114.5	L415 F416 Y419 A453 L454 G459 H460 V469	L415-L457 HydrophobicContact CD2-CD1 3.58Å; L415-L457 HydrophobicContact CD2-CD2 3.76Å; L415-L457 HydrophobicContact CD2-CG 4.29Å; F416-L457 HydrophobicContact CD1-CD1 3.86Å; F416-L457 HydrophobicContact CD2-CD1 4.31Å; F416-L457 HydrophobicContact CE1-CD1 3.51Å; F416-L457 HydrophobicContact CE2-CD1 4.02Å; F416-L457 HydrophobicContact CG-CD1 4.22Å; F416-L457 HydrophobicContact CZ-CD1 3.58Å; Y419-L457 HydrophobicContact CD2-CD1 3.88Å; Y419-L457 HydrophobicContact CD2-CG 4.38Å; Y419-L457 HydrophobicContact CE2-CD1 3.62Å; Y419-L457 HydrophobicContact CE2-CD2 3.73Å; Y419-L457 HydrophobicContact CE2-CG 3.78Å; Y419-L457 WeakPolarHBondContact OH-CD2 3.48Å; A453-L457 HydrophobicContact CB-CD1 4.34Å; A453-L457 VanDerWaalsContact O-CB 3.24Å; A453-L457 WeakPolarHBondContact O-CB 3.21Å; A453-L457 PolarHBondContact O-N 3.45Å; L454-L457 PolarHBondContact O-N 2.99Å; L457-G459 PolarHBondContact O-N 3.05Å; L457-H460 HydrophobicContact CD2-CB 4.22Å; L457-H460 VanDerWaalsContact O-CB 3.3Å; L457-H460 WeakPolarHBondContact O-CB 3.41Å; L457-H460 PolarHBondContact O-N 3.14Å; L457-H460 VanDerWaalsContact O-N 3.11Å; L457-V469 HydrophobicContact CB-CG2 3.89Å
458	D	88.6	Confident	88.2	Confident	83 Å²	83	60 Å²	60	44%	0.444	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	129.9	168.1	-168.7	52.8	0	0	0	110	L454 H460 H468 V469	L454-D458 PolarHBondContact O-N 2.87Å; L454-D458 VanDerWaalsContact O-N 3.16Å; D458-H460 VanDerWaalsContact C-N 3.26Å; D458-H460 PolarHBondContact O-N 2.85Å; D458-H468 WeakPolarHBondContact OD1-CA 3.44Å; D458-H468 IonicContact OD1-CG 3.56Å; D458-H468 IonicContact OD1-ND1 2.68Å; D458-H468 PolarHBondContact OD1-ND1 2.95Å; D458-V469 HydrophobicContact CB-CB 4.28Å; D458-V469 PolarHBondContact OD1-N 2.9Å
459	G	85.2	Confident	88.2	Confident	32 Å²	32	53.2 Å²	53.2	33%	0.33	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	-7	-172.4	0	0	0	0	0	115.6	L457 I461 L467	L457-G459 PolarHBondContact O-N 3.05Å; G459-I461 PolarHBondContact O-N 2.89Å; G459-L467 WeakPolarHBondContact CA-O 3.3Å; G459-L467 PolarHBondContact N-O 3Å
460	H	88.8	Confident	88.1	Confident	80 Å²	80	54.6 Å²	54.6	37%	0.37	31%	0.308	S	S	.	.			trans	-65.1	131	-178.1	-178.5	-77.3	0	0	0	112	L457 D458 F462 L467	L457-H460 HydrophobicContact CD2-CB 4.22Å; L457-H460 VanDerWaalsContact O-CB 3.3Å; L457-H460 WeakPolarHBondContact O-CB 3.41Å; L457-H460 PolarHBondContact O-N 3.14Å; L457-H460 VanDerWaalsContact O-N 3.11Å; D458-H460 VanDerWaalsContact C-N 3.26Å; D458-H460 PolarHBondContact O-N 2.85Å; H460-F462 PolarHBondContact O-N 3.38Å; H460-L467 WeakPolarHBondContact O-CB 3.48Å; H460-L467 WeakPolarHBondContact O-CG 3.35Å; H460-L467 PolarHBondContact O-N 2.94Å
461	I	89.2	Confident	88.1	Confident	115 Å²	115	56.2 Å²	56.2	59%	0.59	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	117.9	-179.7	-58.3	170.5	0	0	0	110.3	G459 R465 M466	G459-I461 PolarHBondContact O-N 2.89Å; I461-R465 CarbonylContact C-O 3.6Å; I461-R465 WeakPolarHBondContact CA-O 3.44Å; I461-M466 HydrophobicContact CG1-CG 3.97Å
462	F	85.1	Confident	87.8	Confident	26 Å²	26	54.6 Å²	54.6	11%	0.114	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	125.1	177.6	179.5	-98.4	0	0	0	110.3	L403 P404 C407 E411 M412 L415 H460 G464 R465 L467	L403-F462 HydrophobicContact CD2-CD1 4.48Å; P404-F462 HydrophobicContact CG-CD1 3.62Å; P404-F462 HydrophobicContact CG-CE1 3.68Å; C407-F462 HydrophobicContact CB-CE1 4.13Å; E411-F462 HydrophobicContact CB-CZ 3.95Å; M412-F462 HydrophobicContact CE-CD1 4Å; M412-F462 HydrophobicContact CE-CD2 4.35Å; M412-F462 HydrophobicContact CE-CE1 3.71Å; M412-F462 HydrophobicContact CE-CE2 4.07Å; M412-F462 HydrophobicContact CE-CG 4.32Å; M412-F462 HydrophobicContact CE-CZ 3.76Å; L415-F462 HydrophobicContact CD1-CD2 3.41Å; L415-F462 VanDerWaalsContact CD1-CD2 3.41Å; L415-F462 HydrophobicContact CD1-CE2 3.86Å; L415-F462 HydrophobicContact CD1-CG 4.24Å; H460-F462 PolarHBondContact O-N 3.38Å; F462-G464 PolarHBondContact O-N 3.02Å; F462-G464 VanDerWaalsContact O-N 3.09Å; F462-R465 PolarHBondContact N-O 3.18Å; F462-R465 PolarHBondContact O-N 2.98Å; F462-R465 VanDerWaalsContact O-O 3.13Å; F462-L467 HydrophobicContact CB-CD1 3.8Å; F462-L467 HydrophobicContact CB-CD2 3.81Å; F462-L467 HydrophobicContact CB-CG 3.61Å; F462-L467 HydrophobicContact CD1-CD2 4.21Å; F462-L467 HydrophobicContact CG-CD1 4.34Å; F462-L467 HydrophobicContact CG-CD2 4.29Å; F462-L467 HydrophobicContact CG-CG 4.45Å
463	Q	83.8	Confident	87.2	Confident	82 Å²	82	55.3 Å²	55.3	38%	0.383	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	40.2	44.4	-171.5	-53.1	175.5	-9.5	0	0	113.5	P404 T406 E411 R465	P404-Q463 HydrophobicContact CB-CB 4.31Å; P404-Q463 HydrophobicContact CG-CB 3.93Å; P404-Q463 HydrophobicContact CG-CG 4.28Å; T406-Q463 PolarHBondContact OG1-OE1 3.09Å; E411-Q463 PolarHBondContact OE1-NE2 2.88Å; E411-Q463 PolarHBondContact OE2-NE2 3.34Å; Q463-R465 PolarHBondContact O-N 3.3Å
464	G	84.3	Confident	86.3	Confident	71 Å²	71	59.3 Å²	59.3	73%	0.732	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	6.7	178.5	0	0	0	0	0	116.6	F462	F462-G464 PolarHBondContact O-N 3.02Å; F462-G464 VanDerWaalsContact O-N 3.09Å
465	R	87.8	Confident	85	Confident	85 Å²	85	65.8 Å²	65.8	32%	0.321	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.2	171	-62.8	-173.7	-178	-175.2	-3.8	110.5	L403 I461 F462 Q463 L467	L403-R465 PolarHBondContact O-NH1 2.82Å; I461-R465 CarbonylContact C-O 3.6Å; I461-R465 WeakPolarHBondContact CA-O 3.44Å; F462-R465 PolarHBondContact N-O 3.18Å; F462-R465 PolarHBondContact O-N 2.98Å; F462-R465 VanDerWaalsContact O-O 3.13Å; Q463-R465 PolarHBondContact O-N 3.3Å; R465-L467 PolarHBondContact O-N 2.9Å
466	M	87	Confident	83.3	Confident	103 Å²	103	71 Å²	71	51%	0.507	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	115.8	167	-66.7	-172.7	-55.6	0	0	108.8	N402 I461	N402-M466 PolarHBondContact ND2-O 3.25Å; I461-M466 HydrophobicContact CG1-CG 3.97Å
467	L	91	Very high	81.1	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.383	C	S	.	.			trans	-59.2	148.1	163.8	-63	-176.7	0	0	0	108.6	I400 L403 L415 G459 H460 F462 R465	I400-L467 HydrophobicContact CG2-CD2 4.36Å; L403-L467 HydrophobicContact CD2-CD2 3.45Å; L403-L467 VanDerWaalsContact CD2-CD2 3.45Å; L403-L467 HydrophobicContact CG-CD2 4.11Å; L415-L467 HydrophobicContact CD1-CD1 4.3Å; L415-L467 HydrophobicContact CD2-CD1 4.22Å; G459-L467 WeakPolarHBondContact CA-O 3.3Å; G459-L467 PolarHBondContact N-O 3Å; H460-L467 WeakPolarHBondContact O-CB 3.48Å; H460-L467 WeakPolarHBondContact O-CG 3.35Å; H460-L467 PolarHBondContact O-N 2.94Å; F462-L467 HydrophobicContact CB-CD1 3.8Å; F462-L467 HydrophobicContact CB-CD2 3.81Å; F462-L467 HydrophobicContact CB-CG 3.61Å; F462-L467 HydrophobicContact CD1-CD2 4.21Å; F462-L467 HydrophobicContact CG-CD1 4.34Å; F462-L467 HydrophobicContact CG-CD2 4.29Å; F462-L467 HydrophobicContact CG-CG 4.45Å; R465-L467 PolarHBondContact O-N 2.9Å
468	H	88.6	Confident	78.6	Confident	42 Å²	42	82.6 Å²	82.6	19%	0.194	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	130.1	165.9	-75.1	-71.7	0	0	0	109.7	I400 R401 D458	I400-H468 CarbonylContact C-O 3.48Å; I400-H468 WeakPolarHBondContact CA-O 3.1Å; R401-H468 HydrophobicContact CG-CB 3.48Å; R401-H468 VanDerWaalsContact CG-CB 3.48Å; R401-H468 PolarHBondContact N-O 3.38Å; R401-H468 PolarHBondContact NH1-CD2 3.13Å; R401-H468 VanDerWaalsContact NH1-CG 3.3Å; R401-H468 VanDerWaalsContact NH2-CG 3.29Å; R401-H468 PolarHBondContact NH2-ND1 3.24Å; R401-H468 PolarHBondContact O-N 2.73Å; R401-H468 VanDerWaalsContact O-N 3.11Å; D458-H468 WeakPolarHBondContact OD1-CA 3.44Å; D458-H468 IonicContact OD1-CG 3.56Å; D458-H468 IonicContact OD1-ND1 2.68Å; D458-H468 PolarHBondContact OD1-ND1 2.95Å
469	V	90.4	Very high	76.1	Confident	2 Å²	2	82.7 Å²	82.7	1%	0.012	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.9	-174.9	-171.1	0	0	0	0	107.8	L398 F416 L454 L457 D458	L398-V469 HydrophobicContact CB-CG1 3.96Å; L398-V469 HydrophobicContact CD1-CG1 3.82Å; L398-V469 HydrophobicContact CD2-CG1 4.29Å; L398-V469 HydrophobicContact CG-CG1 4.24Å; F416-V469 HydrophobicContact CZ-CG2 4.4Å; L454-V469 HydrophobicContact CD1-CB 3.92Å; L454-V469 HydrophobicContact CD1-CG1 3.77Å; L454-V469 WeakPolarHBondContact CD1-O 3.46Å; L457-V469 HydrophobicContact CB-CG2 3.89Å; D458-V469 HydrophobicContact CB-CB 4.28Å; D458-V469 PolarHBondContact OD1-N 2.9Å
470	L	89	Confident	73.7	Confident	59 Å²	59	89.4 Å²	89.4	31%	0.309	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.8	-177	-70.2	172.9	0	0	0	110.4	L398 F399	L398-L470 WeakPolarHBondContact CA-O 3.28Å; F399-L470 HydrophobicContact CD1-CB 4.33Å; F399-L470 HydrophobicContact CD1-CD1 4.06Å; F399-L470 HydrophobicContact CE1-CD1 4.38Å; F399-L470 PolarHBondContact N-O 3.08Å; F399-L470 PolarHBondContact O-N 3.3Å
471	P	86.4	Confident	71.3	Confident	35 Å²	35	88.5 Å²	88.5	23%	0.227	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.2	142.2	161.1	-24.1	33.3	0	0	0	111.5	E388 V392	E388-P471 HydrophobicContact CB-CG 4.35Å; V392-P471 HydrophobicContact CG2-CB 3.54Å; V392-P471 HydrophobicContact CG2-CG 3.57Å
472	S	82.6	Confident	68.8	Low	20 Å²	20	88 Å²	88	14%	0.14	46%	0.464	C	S	.	.			trans	-145.4	104.4	170.1	174.8	0	0	0	0	110.5	S395 R397	S395-S472 PolarHBondContact OG-O 3.42Å; R397-S472 VanDerWaalsContact CB-O 3.3Å; R397-S472 WeakPolarHBondContact CB-O 3.49Å; R397-S472 WeakPolarHBondContact CG-O 3.44Å; R397-S472 PolarHBondContact O-N 2.99Å
473	T	78.8	Confident	66.6	Low	72 Å²	72	95.4 Å²	95.4	44%	0.442	50%	0.499	S	S	.	.			trans	-49.2	144.3	162.4	52.2	0	0	0	0	110.7	D391 S395 K475	D391-T473 WeakPolarHBondContact OD1-CG2 3.38Å; D391-T473 WeakPolarHBondContact OD2-CG2 3.42Å; S395-T473 WeakPolarHBondContact OG-CA 3.44Å; T473-K475 PolarHBondContact O-N 3.24Å
474	V	69	Low	64.7	Low	85 Å²	85	97.3 Å²	97.3	52%	0.515	52%	0.521	S	S	.	.			trans	-61.1	109.3	169.9	177.3	0	0	0	0	107.7	S395 K476	S395-V474 PolarHBondContact OG-N 2.83Å; S395-V474 VanDerWaalsContact OG-N 3.17Å; V474-K476 VanDerWaalsContact C-N 3.26Å; V474-K476 PolarHBondContact O-N 2.67Å
475	K	62.3	Low	62.5	Low	174 Å²	174	96 Å²	96	76%	0.757	51%	0.507	S	S	*	.			trans	-61.2	92.3	173	-175.7	-174.6	179.1	-174.3	0	108.5	T473 E477	T473-K475 PolarHBondContact O-N 3.24Å; K475-E477 PolarHBondContact O-N 2.81Å
476	K	53.4	Low	60.2	Low	195 Å²	195	94.4 Å²	94.4	85%	0.848	52%	0.518	S	S	*	.			trans	-52.6	105.9	172.8	-160.1	173.8	-165.4	169	0	106.8	V474 K478	V474-K476 VanDerWaalsContact C-N 3.26Å; V474-K476 PolarHBondContact O-N 2.67Å; K476-K478 PolarHBondContact O-N 3.43Å; K476-K478 VanDerWaalsContact O-N 3.17Å
477	E	43.5	Very low	57.8	Low	172 Å²	172	96.4 Å²	96.4	80%	0.804	54%	0.539	S	S	*	.			trans	-55.9	129.2	-175.7	-70	-150.4	126.4	0	0	108.2	K475 S479	K475-E477 PolarHBondContact O-N 2.81Å; E477-S479 PolarHBondContact O-N 2.69Å
478	K	35.8	Very low	55.9	Low	202 Å²	202	100.2 Å²	100.2	88%	0.878	58%	0.578	S	S	*	*			trans	-70.2	93.2	-176.7	-167.8	-174.9	-173.5	-171.1	0	105.5	K476 E480	K476-K478 PolarHBondContact O-N 3.43Å; K476-K478 VanDerWaalsContact O-N 3.17Å; K478-E480 PolarHBondContact O-N 3.07Å; K478-E480 VanDerWaalsContact O-N 3.16Å
479	S	35.8	Very low	54.5	Low	85 Å²	85	101 Å²	101	59%	0.594	59%	0.588	S	S	*	*			trans	-49.7	124.1	-169.4	53.9	0	0	0	0	109.7	E477 S481	E477-S479 PolarHBondContact O-N 2.69Å; S479-S481 PolarHBondContact O-N 2.97Å; S479-S481 PolarHBondContact O-OG 2.71Å
480	E	35.2	Very low	53.9	Low	173 Å²	173	104.3 Å²	104.3	81%	0.808	61%	0.611	S	S	*	*			trans	-73.5	66.1	173.6	-67.6	178.8	142.4	0	0	108.2	K478 S482	K478-E480 PolarHBondContact O-N 3.07Å; K478-E480 VanDerWaalsContact O-N 3.16Å; E480-S482 PolarHBondContact O-N 3.23Å; E480-S482 VanDerWaalsContact O-N 3.1Å
481	S	38.6	Very low	53.4	Low	60 Å²	60	106.5 Å²	106.5	42%	0.42	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.9	21.6	-159.5	52.9	0	0	0	0	113.8	S479 R494	S479-S481 PolarHBondContact O-N 2.97Å; S479-S481 PolarHBondContact O-OG 2.71Å; S481-R494 PolarHBondContact O-NH1 3.47Å; S481-R494 PolarHBondContact O-NH2 3.12Å
482	S	36.8	Very low	52.8	Low	106 Å²	106	112.6 Å²	112.6	74%	0.741	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	-22.1	-176.3	-57.5	0	0	0	0	115.1	E480	E480-S482 PolarHBondContact O-N 3.23Å; E480-S482 VanDerWaalsContact O-N 3.1Å
483	E	37.9	Very low	52.7	Low	180 Å²	180	117.2 Å²	117.2	84%	0.841	67%	0.669	S	S	*	*	S	Bend	trans	-137.6	32.4	-155.5	-128.6	160.6	-168.2	0	0	115.7
484	S	44.3	Very low	52.6	Low	123 Å²	123	119.7 Å²	119.7	86%	0.86	67%	0.67	S	S	*	*	S	Bend	trans	-142.2	12.8	168.3	-55	0	0	0	0	114.1
485	G	37.6	Very low	53.2	Low	42 Å²	42	122.2 Å²	122.2	43%	0.433	68%	0.676	S	S	.	*	S	Bend	trans	-109.3	118.2	162.7	0	0	0	0	0	107.9
486	G	40.7	Very low	54	Low	53 Å²	53	119.5 Å²	119.5	55%	0.546	66%	0.664	S	S	.	*			trans	-59.4	150.9	170.8	0	0	0	0	0	110.9	G488 S489	G486-G488 PolarHBondContact O-N 3.36Å; G486-S489 PolarHBondContact O-N 3.23Å
487	P	37.4	Very low	55.1	Low	145 Å²	145	113.1 Å²	113.1	94%	0.942	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	125.3	-179.6	23.2	-33.1	0	0	0	110.2
488	G	50.9	Low	56.7	Low	80 Å²	80	107.9 Å²	107.9	83%	0.825	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	112.9	-9.9	-179	0	0	0	0	0	116.6	G486 S490	G486-G488 PolarHBondContact O-N 3.36Å; G488-S490 PolarHBondContact O-N 2.86Å
489	S	58	Low	58.8	Low	59 Å²	59	106 Å²	106	41%	0.413	62%	0.617	S	S	.	*			trans	-73.4	119.3	177.8	-173.3	0	0	0	0	112.8	G486	G486-S489 PolarHBondContact O-N 3.23Å
490	S	79.1	Confident	60.6	Low	70 Å²	70	104.1 Å²	104.1	49%	0.49	60%	0.601	S	S	.	*			trans	-64.6	152.1	-178.3	71.4	0	0	0	0	114	G488 Y492 K493 R494	G488-S490 PolarHBondContact O-N 2.86Å; S490-Y492 VanDerWaalsContact C-N 3.29Å; S490-Y492 PolarHBondContact O-N 2.81Å; S490-K493 PolarHBondContact O-N 3.48Å; S490-K493 VanDerWaalsContact O-N 3.12Å; S490-R494 PolarHBondContact O-N 2.99Å
491	S	78.1	Confident	62.6	Low	105 Å²	105	99.6 Å²	99.6	73%	0.734	58%	0.578	S	S	*	*	H	α-helix	trans	-57.7	-38.7	-178.7	55.6	0	0	0	0	113	R494 Q495	S491-R494 PolarHBondContact O-N 3.2Å; S491-Q495 PolarHBondContact O-N 3.08Å
492	Y	74.2	Confident	64.4	Low	164 Å²	164	100.3 Å²	100.3	64%	0.643	59%	0.588	S	S	*	*	H	α-helix	trans	-64.8	-42.9	175.8	179.6	-106.8	0	0	0	112.5	S490 Q495 K496	S490-Y492 VanDerWaalsContact C-N 3.29Å; S490-Y492 PolarHBondContact O-N 2.81Å; Y492-Q495 PolarHBondContact O-N 2.79Å; Y492-K496 WeakPolarHBondContact O-CB 2.96Å; Y492-K496 PolarHBondContact O-N 2.73Å
493	K	79.3	Confident	65.9	Low	117 Å²	117	98.2 Å²	98.2	51%	0.509	57%	0.573	S	S	.	*	H	α-helix	trans	-61	-47.8	175.2	-177	168.2	-178.8	176.7	0	110.4	S490 Q495 K496 D497	S490-K493 PolarHBondContact O-N 3.48Å; S490-K493 VanDerWaalsContact O-N 3.12Å; K493-Q495 VanDerWaalsContact C-N 3.3Å; K493-Q495 PolarHBondContact O-N 3.29Å; K493-K496 WeakPolarHBondContact O-CB 3.32Å; K493-K496 PolarHBondContact O-N 2.87Å; K493-K496 VanDerWaalsContact O-N 3.09Å; K493-D497 WeakPolarHBondContact CG-OD2 3.42Å; K493-D497 VanDerWaalsContact O-CG 3.24Å; K493-D497 PolarHBondContact O-N 3.14Å
494	R	77.6	Confident	67.1	Low	123 Å²	123	90.9 Å²	90.9	46%	0.464	54%	0.542	S	S	.	.	H	α-helix	trans	-57.2	-39.4	175.7	-161.9	178.4	-165.2	-174.6	7.5	113.1	S481 S490 S491 A498	S481-R494 PolarHBondContact O-NH1 3.47Å; S481-R494 PolarHBondContact O-NH2 3.12Å; S490-R494 PolarHBondContact O-N 2.99Å; S491-R494 PolarHBondContact O-N 3.2Å; R494-A498 WeakPolarHBondContact O-CB 3.41Å; R494-A498 PolarHBondContact O-N 2.65Å
495	Q	81	Confident	68	Low	138 Å²	138	89.4 Å²	89.4	65%	0.645	53%	0.532	S	S	*	.	H	α-helix	trans	-70.1	-39.3	176.1	-168.9	-178.9	40.9	0	0	112.4	S491 Y492 K493 K499	S491-Q495 PolarHBondContact O-N 3.08Å; Y492-Q495 PolarHBondContact O-N 2.79Å; K493-Q495 VanDerWaalsContact C-N 3.3Å; K493-Q495 PolarHBondContact O-N 3.29Å; Q495-K499 WeakPolarHBondContact O-CB 3.15Å; Q495-K499 PolarHBondContact O-N 2.94Å
496	K	79.7	Confident	69	Low	117 Å²	117	90.9 Å²	90.9	51%	0.509	54%	0.535	S	S	.	.	H	α-helix	trans	-62.4	-46.7	174.6	-174.2	-177.4	178.4	-175.5	0	110.9	Y492 K493 K499 N500	Y492-K496 WeakPolarHBondContact O-CB 2.96Å; Y492-K496 PolarHBondContact O-N 2.73Å; K493-K496 WeakPolarHBondContact O-CB 3.32Å; K493-K496 PolarHBondContact O-N 2.87Å; K493-K496 VanDerWaalsContact O-N 3.09Å; K496-K499 WeakPolarHBondContact O-CB 3.2Å; K496-K499 PolarHBondContact O-N 3.39Å; K496-N500 WeakPolarHBondContact O-CB 3.29Å; K496-N500 PolarHBondContact O-N 3.21Å; K496-N500 PolarHBondContact O-ND2 3Å; K496-N500 PolarHBondContact O-OD1 3.41Å
497	D	75.4	Confident	69.7	Low	61 Å²	61	92.4 Å²	92.4	33%	0.326	54%	0.538	S	S	.	.	H	α-helix	trans	-68.7	-38.3	-177.8	-61.3	-24.4	0	0	0	111.6	K493 K499 N500 K501	K493-D497 WeakPolarHBondContact CG-OD2 3.42Å; K493-D497 VanDerWaalsContact O-CG 3.24Å; K493-D497 PolarHBondContact O-N 3.14Å; D497-K499 PolarHBondContact O-N 2.92Å; D497-N500 PolarHBondContact O-N 3.49Å; D497-K501 WeakPolarHBondContact O-CB 3.46Å; D497-K501 PolarHBondContact O-N 2.94Å
498	A	77.1	Confident	70.2	Confident	63 Å²	63	91.7 Å²	91.7	52%	0.521	52%	0.522	S	S	.	.	H	α-helix	trans	-62.9	-39.9	171	0	0	0	0	0	112.9	R494 K501 A502	R494-A498 WeakPolarHBondContact O-CB 3.41Å; R494-A498 PolarHBondContact O-N 2.65Å; A498-K501 PolarHBondContact O-N 3.43Å; A498-A502 PolarHBondContact O-N 2.87Å
499	K	79.6	Confident	70.2	Confident	161 Å²	161	91 Å²	91	70%	0.7	50%	0.499	S	S	*	.	H	α-helix	trans	-66.3	-40.3	174.6	-176	179.8	177.9	-177.5	0	111.7	Q495 K496 D497 A502 S503	Q495-K499 WeakPolarHBondContact O-CB 3.15Å; Q495-K499 PolarHBondContact O-N 2.94Å; K496-K499 WeakPolarHBondContact O-CB 3.2Å; K496-K499 PolarHBondContact O-N 3.39Å; D497-K499 PolarHBondContact O-N 2.92Å; K499-A502 PolarHBondContact O-N 2.84Å; K499-S503 PolarHBondContact O-N 2.89Å
500	N	74.3	Confident	70.1	Confident	47 Å²	47	96.1 Å²	96.1	25%	0.251	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-45.7	174.8	-66.6	-14.7	0	0	0	110.5	K496 D497 A502 S503 S504 Y640	K496-N500 WeakPolarHBondContact O-CB 3.29Å; K496-N500 PolarHBondContact O-N 3.21Å; K496-N500 PolarHBondContact O-ND2 3Å; K496-N500 PolarHBondContact O-OD1 3.41Å; D497-N500 PolarHBondContact O-N 3.49Å; N500-A502 PolarHBondContact O-N 3.38Å; N500-S503 WeakPolarHBondContact CA-OG 3.47Å; N500-S503 CarbonylContact O-C 3.49Å; N500-S503 WeakPolarHBondContact O-CA 3.45Å; N500-S503 WeakPolarHBondContact O-CB 3.39Å; N500-S503 PolarHBondContact O-N 2.84Å; N500-S503 PolarHBondContact O-OG 3.15Å; N500-S504 PolarHBondContact O-N 2.99Å; N500-Y640 VanDerWaalsContact C-CE2 3.41Å; N500-Y640 HydrophobicContact CB-CE1 3.97Å; N500-Y640 HydrophobicContact CB-CE2 4.05Å; N500-Y640 WeakPolarHBondContact O-CE2 3.31Å
501	K	78.2	Confident	69.2	Low	77 Å²	77	95.8 Å²	95.8	34%	0.335	50%	0.502	S	S	.	.	H	α-helix	trans	-58.9	-43.3	176.5	-173.5	163.6	-177.4	145.3	0	113.1	D497 A498 S503 S504 A636 R637 A639 Y640	D497-K501 WeakPolarHBondContact O-CB 3.46Å; D497-K501 PolarHBondContact O-N 2.94Å; A498-K501 PolarHBondContact O-N 3.43Å; K501-S503 VanDerWaalsContact C-N 3.27Å; K501-S503 PolarHBondContact O-N 2.96Å; K501-S504 PolarHBondContact O-N 3.49Å; K501-A636 WeakPolarHBondContact CE-O 3.07Å; K501-A636 PolarHBondContact NZ-O 3.44Å; K501-R637 PolarHBondContact NZ-O 3.41Å; K501-A639 VanDerWaalsContact CD-O 3.3Å; K501-A639 WeakPolarHBondContact CD-O 3.5Å; K501-A639 VanDerWaalsContact CE-O 3.24Å; K501-A639 WeakPolarHBondContact CE-O 3.31Å; K501-A639 PolarHBondContact NZ-O 2.84Å; K501-Y640 VanDerWaalsContact CA-CD2 3.46Å; K501-Y640 HydrophobicContact CB-CD2 3.77Å; K501-Y640 HydrophobicContact CB-CE2 4.37Å; K501-Y640 HydrophobicContact CG-CD2 4.23Å
502	A	74.6	Confident	68.3	Low	76 Å²	76	91.2 Å²	91.2	63%	0.628	47%	0.47	S	S	*	.	H	α-helix	trans	-61	-36.1	171.2	0	0	0	0	0	112.3	A498 K499 N500	A498-A502 PolarHBondContact O-N 2.87Å; K499-A502 PolarHBondContact O-N 2.84Å; N500-A502 PolarHBondContact O-N 3.38Å
503	S	70	Confident	68	Low	61 Å²	61	84.1 Å²	84.1	43%	0.427	44%	0.444	S	S	.	.	H	α-helix	trans	-76.6	-20.3	178.9	73.5	0	0	0	0	115.3	K499 N500 K501 S505 S506	K499-S503 PolarHBondContact O-N 2.89Å; N500-S503 WeakPolarHBondContact CA-OG 3.47Å; N500-S503 CarbonylContact O-C 3.49Å; N500-S503 WeakPolarHBondContact O-CA 3.45Å; N500-S503 WeakPolarHBondContact O-CB 3.39Å; N500-S503 PolarHBondContact O-N 2.84Å; N500-S503 PolarHBondContact O-OG 3.15Å; K501-S503 VanDerWaalsContact C-N 3.27Å; K501-S503 PolarHBondContact O-N 2.96Å; S503-S505 PolarHBondContact O-N 2.76Å; S503-S506 WeakPolarHBondContact O-CB 3.24Å; S503-S506 PolarHBondContact O-N 2.87Å
504	S	62.2	Low	67.6	Low	26 Å²	26	82.2 Å²	82.2	18%	0.182	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-16.4	174	-94.2	0	0	0	0	114.2	N500 K501 Y640	N500-S504 PolarHBondContact O-N 2.99Å; K501-S504 PolarHBondContact O-N 3.49Å; S504-Y640 WeakPolarHBondContact OG-CE2 3.24Å; S504-Y640 PolarHBondContact OG-OH 3.48Å
505	S	62.4	Low	67.5	Low	93 Å²	93	76.9 Å²	76.9	65%	0.65	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.7	168.1	-151.5	0	0	0	0	112.5	S503	S503-S505 PolarHBondContact O-N 2.76Å
506	S	60.3	Low	67.3	Low	72 Å²	72	72.1 Å²	72.1	50%	0.503	40%	0.404	S	S	.	.	S	Bend	trans	-74.1	143.7	175.9	-168.3	0	0	0	0	111.1	S503 H508	S503-S506 WeakPolarHBondContact O-CB 3.24Å; S503-S506 PolarHBondContact O-N 2.87Å; S506-H508 PolarHBondContact O-N 2.98Å
507	S	55.3	Low	67.3	Low	86 Å²	86	71.1 Å²	71.1	60%	0.601	41%	0.408	S	S	*	.			trans	-70.5	20.2	-178.6	55.4	0	0	0	0	115.1	N509 R580	S507-N509 PolarHBondContact O-N 2.96Å; S507-N509 PolarHBondContact O-OD1 2.85Å; S507-R580 PolarHBondContact O-NH1 2.89Å; S507-R580 PolarHBondContact O-NH2 2.78Å
508	H	46.8	Very low	67.7	Low	129 Å²	129	71.1 Å²	71.1	60%	0.597	41%	0.413	S	S	*	.			trans	-71	102.6	-176.3	-162.5	82.1	0	0	0	110.8	S506 W510	S506-H508 PolarHBondContact O-N 2.98Å; H508-W510 AromaticContact CD2-NE1 3.94Å; H508-W510 VanDerWaalsContact O-CD1 3.26Å; H508-W510 PolarHBondContact O-N 3.13Å; H508-W510 VanDerWaalsContact O-N 3.13Å
509	N	51.8	Low	68	Low	66 Å²	66	68.7 Å²	68.7	35%	0.353	39%	0.392	S	S	.	.			trans	-66.9	110.4	-173.9	-40.7	-77.9	0	0	0	111.6	S507 A576 R580	S507-N509 PolarHBondContact O-N 2.96Å; S507-N509 PolarHBondContact O-OD1 2.85Å; N509-A576 WeakPolarHBondContact ND2-CA 3.42Å; N509-A576 PolarHBondContact ND2-O 2.85Å; N509-R580 VanDerWaalsContact OD1-CZ 3.23Å; N509-R580 PolarHBondContact OD1-NH1 2.88Å; N509-R580 PolarHBondContact OD1-NH2 2.84Å
510	W	54.5	Low	68.3	Low	166 Å²	166	61 Å²	61	63%	0.629	36%	0.359	S	S	*	.			trans	-90.4	118.4	164.1	-68.6	80.9	0	0	0	107.6	H508 S512 K588 E651	H508-W510 AromaticContact CD2-NE1 3.94Å; H508-W510 VanDerWaalsContact O-CD1 3.26Å; H508-W510 PolarHBondContact O-N 3.13Å; H508-W510 VanDerWaalsContact O-N 3.13Å; W510-S512 PolarHBondContact O-N 3.44Å; W510-S512 VanDerWaalsContact O-N 3.12Å; W510-K588 PolarHBondContact O-NZ 3.02Å; W510-E651 PolarHBondContact N-OE1 3.46Å
511	N	61.1	Low	68.9	Low	63 Å²	63	58.8 Å²	58.8	34%	0.337	35%	0.347	S	S	.	.			trans	-46.9	123.7	174.2	179.1	8.3	0	0	0	109.5	L513 F514	N511-L513 PolarHBondContact O-N 2.8Å; N511-L513 PolarHBondContact OD1-N 2.95Å; N511-F514 HydrophobicContact CB-CB 4.31Å; N511-F514 PolarHBondContact O-N 3.4Å; N511-F514 VanDerWaalsContact O-N 3.08Å
512	S	58.9	Low	69.3	Low	10 Å²	10	57 Å²	57	7%	0.07	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.9	-175.5	51.7	0	0	0	0	112.5	W510 F514 F573	W510-S512 PolarHBondContact O-N 3.44Å; W510-S512 VanDerWaalsContact O-N 3.12Å; S512-F514 VanDerWaalsContact C-N 3.35Å; S512-F573 WeakPolarHBondContact OG-CB 3.39Å; S512-F573 WeakPolarHBondContact OG-CD1 3.4Å; S512-F573 WeakPolarHBondContact OG-CG 3.21Å
513	L	68.6	Low	69.9	Low	15 Å²	15	53.7 Å²	53.7	8%	0.079	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	12.6	179.5	-54.7	-179.9	0	0	0	113.8	N511 V556 T559 L563	N511-L513 PolarHBondContact O-N 2.8Å; N511-L513 PolarHBondContact OD1-N 2.95Å; L513-V556 HydrophobicContact CB-CG1 3.86Å; L513-V556 HydrophobicContact CD1-CG1 4.16Å; L513-V556 HydrophobicContact CD2-CG1 4.31Å; L513-V556 HydrophobicContact CG-CG1 4.34Å; L513-V556 WeakPolarHBondContact O-CG2 3.45Å; L513-T559 HydrophobicContact CD2-CG2 4.23Å; L513-L563 HydrophobicContact CD2-CD1 4.44Å
514	F	70.7	Confident	70.7	Confident	77 Å²	77	51.7 Å²	51.7	34%	0.338	30%	0.298	S	S	.	.			trans	-93.9	119.9	171.1	179.5	-112.2	0	0	0	110.5	N511 S512 H863	N511-F514 HydrophobicContact CB-CB 4.31Å; N511-F514 PolarHBondContact O-N 3.4Å; N511-F514 VanDerWaalsContact O-N 3.08Å; S512-F514 VanDerWaalsContact C-N 3.35Å; F514-H863 AromaticContact CD2-CE1 3.51Å; F514-H863 AromaticContact CD2-ND1 3.84Å; F514-H863 AromaticContact CD2-NE2 3.65Å; F514-H863 AromaticContact CE2-CD2 3.96Å
515	L	75.6	Confident	72	Confident	11 Å²	11	50.9 Å²	50.9	6%	0.058	29%	0.293	C	S	.	.			trans	-109.4	144.1	-176.7	-59.4	170	0	0	0	110.2	V520 I555 V556 L619 T620	L515-V520 HydrophobicContact CB-CG2 3.48Å; L515-V520 VanDerWaalsContact CB-CG2 3.48Å; L515-V520 HydrophobicContact CD1-CG2 4.11Å; L515-V520 HydrophobicContact CG-CG2 4.46Å; L515-I555 HydrophobicContact CD1-CB 4.31Å; L515-I555 HydrophobicContact CD1-CG2 3.6Å; L515-V556 HydrophobicContact CD1-CG2 3.64Å; L515-V556 HydrophobicContact CG-CG2 4.24Å; L515-L619 HydrophobicContact CD1-CD1 4.15Å; L515-L619 HydrophobicContact CD2-CB 4.05Å; L515-L619 HydrophobicContact CD2-CD1 4.1Å; L515-T620 HydrophobicContact CD2-CG2 3.94Å
516	G	75.4	Confident	73.1	Confident	38 Å²	38	51 Å²	51	39%	0.392	28%	0.283	S	S	.	.			trans	-71.2	134.8	174.2	0	0	0	0	0	110.7	S518 A519 V520	G516-S518 PolarHBondContact O-N 3.4Å; G516-S518 VanDerWaalsContact O-N 3.14Å; G516-A519 WeakPolarHBondContact O-CA 3.39Å; G516-A519 WeakPolarHBondContact O-CB 3.4Å; G516-A519 PolarHBondContact O-N 2.77Å; G516-V520 PolarHBondContact O-N 2.79Å
517	T	79.8	Confident	74.3	Confident	95 Å²	95	51.7 Å²	51.7	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-57.8	-30.6	-176.9	50.3	0	0	0	0	113.9	A521 M548	T517-A521 WeakPolarHBondContact O-CB 3.16Å; T517-A521 PolarHBondContact O-N 2.86Å; T517-M548 HydrophobicContact CG2-CG 4.18Å; T517-M548 VanDerWaalsContact O-SD 3.36Å
518	S	84.2	Confident	75.8	Confident	62 Å²	62	54 Å²	54	43%	0.434	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-53.8	169.2	-179.1	0	0	0	0	111.2	G516 V520 A521 D522 K532	G516-S518 PolarHBondContact O-N 3.4Å; G516-S518 VanDerWaalsContact O-N 3.14Å; S518-V520 VanDerWaalsContact C-N 3.26Å; S518-V520 PolarHBondContact O-N 3.24Å; S518-A521 CarbonylContact O-C 3.56Å; S518-A521 WeakPolarHBondContact O-CA 3.3Å; S518-A521 VanDerWaalsContact O-CB 3.3Å; S518-A521 WeakPolarHBondContact O-CB 3.41Å; S518-A521 PolarHBondContact O-N 3.23Å; S518-D522 VanDerWaalsContact C-OD2 3.27Å; S518-D522 PolarHBondContact O-N 2.86Å; S518-D522 PolarHBondContact OG-OD2 3.19Å; S518-K532 PolarHBondContact OG-NZ 3.44Å
519	A	83	Confident	77.7	Confident	11 Å²	11	55.4 Å²	55.4	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-35.9	-177.2	0	0	0	0	0	111.8	G516 D522 A523 L619	G516-A519 WeakPolarHBondContact O-CA 3.39Å; G516-A519 WeakPolarHBondContact O-CB 3.4Å; G516-A519 PolarHBondContact O-N 2.77Å; A519-D522 PolarHBondContact O-N 2.94Å; A519-A523 WeakPolarHBondContact O-CB 3.22Å; A519-A523 PolarHBondContact O-N 2.91Å; A519-L619 HydrophobicContact CB-CD1 3.99Å; A519-L619 HydrophobicContact CB-CD2 3.96Å; A519-L619 WeakPolarHBondContact O-CD1 3.29Å
520	V	85.9	Confident	79.3	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-62.2	-47.5	169.5	175.2	0	0	0	0	111	L515 G516 S518 D522 A523 I524 M548 E552 I555	L515-V520 HydrophobicContact CB-CG2 3.48Å; L515-V520 VanDerWaalsContact CB-CG2 3.48Å; L515-V520 HydrophobicContact CD1-CG2 4.11Å; L515-V520 HydrophobicContact CG-CG2 4.46Å; G516-V520 PolarHBondContact O-N 2.79Å; S518-V520 VanDerWaalsContact C-N 3.26Å; S518-V520 PolarHBondContact O-N 3.24Å; V520-D522 VanDerWaalsContact C-N 3.3Å; V520-D522 PolarHBondContact O-N 3.42Å; V520-A523 PolarHBondContact O-N 3.49Å; V520-I524 HydrophobicContact CG1-CD1 3.62Å; V520-I524 HydrophobicContact CG1-CG1 4.32Å; V520-I524 WeakPolarHBondContact O-CB 3.48Å; V520-I524 WeakPolarHBondContact O-CD1 3.31Å; V520-I524 WeakPolarHBondContact O-CG1 3.37Å; V520-I524 PolarHBondContact O-N 2.93Å; V520-M548 HydrophobicContact CB-SD 3.86Å; V520-M548 HydrophobicContact CG1-SD 3.53Å; V520-M548 VanDerWaalsContact CG1-SD 3.53Å; V520-E552 HydrophobicContact CG1-CB 4.06Å; V520-E552 HydrophobicContact CG2-CB 4.29Å; V520-E552 HydrophobicContact CG2-CG 4.27Å; V520-I555 HydrophobicContact CG1-CD1 4.37Å
521	A	88	Confident	80.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-40.1	175.6	0	0	0	0	0	112.7	T517 S518 A525 K532 V535 L536 M548	T517-A521 WeakPolarHBondContact O-CB 3.16Å; T517-A521 PolarHBondContact O-N 2.86Å; S518-A521 CarbonylContact O-C 3.56Å; S518-A521 WeakPolarHBondContact O-CA 3.3Å; S518-A521 VanDerWaalsContact O-CB 3.3Å; S518-A521 WeakPolarHBondContact O-CB 3.41Å; S518-A521 PolarHBondContact O-N 3.23Å; A521-A525 VanDerWaalsContact O-CB 3.24Å; A521-A525 WeakPolarHBondContact O-CB 3.35Å; A521-A525 PolarHBondContact O-N 3.19Å; A521-K532 HydrophobicContact CB-CG 4.3Å; A521-V535 HydrophobicContact CB-CG1 4.4Å; A521-L536 HydrophobicContact CB-CD2 4.14Å; A521-L536 HydrophobicContact CB-CG 4.34Å; A521-M548 HydrophobicContact CB-CE 3.67Å; A521-M548 HydrophobicContact CB-SD 4.27Å
522	D	87.3	Confident	82.2	Confident	40 Å²	40	50 Å²	50	21%	0.214	27%	0.273	C	S	.	.	H	α-helix	trans	-67.6	-43.8	179.8	-65.1	-47.8	0	0	0	111.5	S518 A519 V520 A525 E526 K532 A592	S518-D522 VanDerWaalsContact C-OD2 3.27Å; S518-D522 PolarHBondContact O-N 2.86Å; S518-D522 PolarHBondContact OG-OD2 3.19Å; A519-D522 PolarHBondContact O-N 2.94Å; V520-D522 VanDerWaalsContact C-N 3.3Å; V520-D522 PolarHBondContact O-N 3.42Å; D522-A525 WeakPolarHBondContact O-CB 3.5Å; D522-A525 PolarHBondContact O-N 2.7Å; D522-E526 PolarHBondContact O-N 2.79Å; D522-K532 WeakPolarHBondContact OD1-CD 3.5Å; D522-K532 WeakPolarHBondContact OD1-CE 3.5Å; D522-K532 IonicContact OD1-NZ 3.47Å; D522-K532 PolarHBondContact OD1-NZ 3.32Å; D522-K532 IonicContact OD2-NZ 2.73Å; D522-K532 PolarHBondContact OD2-NZ 2.94Å; D522-A592 HydrophobicContact CB-CB 4.35Å
523	A	86.7	Confident	83.5	Confident	6 Å²	6	54 Å²	54	5%	0.05	30%	0.3	C	S	.	.	H	α-helix	trans	-70.9	-34.3	175.4	0	0	0	0	0	113.5	A519 V520 K527 I555 L619	A519-A523 WeakPolarHBondContact O-CB 3.22Å; A519-A523 PolarHBondContact O-N 2.91Å; V520-A523 PolarHBondContact O-N 3.49Å; A523-K527 WeakPolarHBondContact O-CB 3.41Å; A523-K527 PolarHBondContact O-N 2.97Å; A523-I555 HydrophobicContact CB-CD1 3.77Å; A523-L619 HydrophobicContact CB-CD1 4.06Å; A523-L619 HydrophobicContact CB-CD2 4.05Å; A523-L619 HydrophobicContact CB-CG 4.16Å
524	I	87	Confident	84.4	Confident	18 Å²	18	58.9 Å²	58.9	9%	0.092	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-44.4	171.4	-68.7	164.7	0	0	0	110.1	V520 K527 Y528 V535 M548 I555	V520-I524 HydrophobicContact CG1-CD1 3.62Å; V520-I524 HydrophobicContact CG1-CG1 4.32Å; V520-I524 WeakPolarHBondContact O-CB 3.48Å; V520-I524 WeakPolarHBondContact O-CD1 3.31Å; V520-I524 WeakPolarHBondContact O-CG1 3.37Å; V520-I524 PolarHBondContact O-N 2.93Å; I524-K527 PolarHBondContact O-N 3.03Å; I524-Y528 HydrophobicContact CG2-CD2 3.79Å; I524-Y528 HydrophobicContact CG2-CE2 4.02Å; I524-Y528 VanDerWaalsContact O-CD2 3.29Å; I524-Y528 WeakPolarHBondContact O-CD2 3.31Å; I524-Y528 PolarHBondContact O-N 3.48Å; I524-Y528 VanDerWaalsContact O-N 3.15Å; I524-V535 HydrophobicContact CB-CG1 4.21Å; I524-V535 HydrophobicContact CB-CG2 4.42Å; I524-V535 HydrophobicContact CD1-CG1 4.4Å; I524-V535 HydrophobicContact CG2-CB 4.49Å; I524-V535 HydrophobicContact CG2-CG1 3.8Å; I524-V535 HydrophobicContact CG2-CG2 3.78Å; I524-M548 HydrophobicContact CD1-SD 4.46Å; I524-I555 HydrophobicContact CG1-CD1 4.11Å
525	A	89.1	Confident	85	Confident	9 Å²	9	55.9 Å²	55.9	7%	0.074	31%	0.311	C	S	.	.	H	α-helix	trans	-57.7	-51	178.4	0	0	0	0	0	110.9	A521 D522 N529 A530 V535	A521-A525 VanDerWaalsContact O-CB 3.24Å; A521-A525 WeakPolarHBondContact O-CB 3.35Å; A521-A525 PolarHBondContact O-N 3.19Å; D522-A525 WeakPolarHBondContact O-CB 3.5Å; D522-A525 PolarHBondContact O-N 2.7Å; A525-N529 WeakPolarHBondContact O-CA 3.41Å; A525-N529 PolarHBondContact O-N 3.12Å; A525-N529 VanDerWaalsContact O-N 3.09Å; A525-A530 CarbonylContact C-O 3.56Å; A525-A530 WeakPolarHBondContact CA-O 3.41Å; A525-A530 VanDerWaalsContact CB-O 3.31Å; A525-A530 WeakPolarHBondContact CB-O 3.46Å; A525-A530 PolarHBondContact O-N 2.87Å; A525-A530 VanDerWaalsContact O-O 3.08Å; A525-V535 HydrophobicContact CB-CG2 4.06Å
526	E	86	Confident	85.5	Confident	97 Å²	97	58.6 Å²	58.6	45%	0.453	33%	0.325	S	S	.	.	H	α-helix	trans	-58.8	-52.7	174.2	-177.9	171.1	-128.2	0	0	112.3	D522 Y528 N529 A592 G593	D522-E526 PolarHBondContact O-N 2.79Å; E526-Y528 PolarHBondContact O-N 3.26Å; E526-Y528 VanDerWaalsContact O-N 3.13Å; E526-N529 PolarHBondContact O-N 2.67Å; E526-A592 HydrophobicContact CB-CB 4.48Å; E526-A592 WeakPolarHBondContact OE2-CB 3.4Å; E526-G593 WeakPolarHBondContact OE1-CA 3.15Å; E526-G593 PolarHBondContact OE1-N 3.4Å; E526-G593 PolarHBondContact OE2-N 3.04Å
527	K	84.9	Confident	86	Confident	85 Å²	85	59.4 Å²	59.4	37%	0.37	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-30.2	-174.1	-168.3	173.8	-169	-178.4	0	114	A523 I524 E554 E558	A523-K527 WeakPolarHBondContact O-CB 3.41Å; A523-K527 PolarHBondContact O-N 2.97Å; I524-K527 PolarHBondContact O-N 3.03Å; K527-E554 IonicContact NZ-OE1 3.79Å; K527-E554 PolarHBondContact NZ-OE1 3.01Å; K527-E558 IonicContact NZ-OE1 2.66Å; K527-E558 IonicContact NZ-OE2 3.58Å; K527-E558 PolarHBondContact NZ-OE2 3.39Å
528	Y	85.9	Confident	85.8	Confident	135 Å²	135	62.7 Å²	62.7	53%	0.529	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	8.3	178.3	-59.6	-67.3	0	0	0	114.3	I524 E526 A530 E554	I524-Y528 HydrophobicContact CG2-CD2 3.79Å; I524-Y528 HydrophobicContact CG2-CE2 4.02Å; I524-Y528 VanDerWaalsContact O-CD2 3.29Å; I524-Y528 WeakPolarHBondContact O-CD2 3.31Å; I524-Y528 PolarHBondContact O-N 3.48Å; I524-Y528 VanDerWaalsContact O-N 3.15Å; E526-Y528 PolarHBondContact O-N 3.26Å; E526-Y528 VanDerWaalsContact O-N 3.13Å; Y528-A530 PolarHBondContact O-N 2.83Å; Y528-E554 PolarHBondContact OH-OE1 3.42Å; Y528-E554 PolarHBondContact OH-OE2 3.37Å
529	N	87	Confident	85.2	Confident	158 Å²	158	68.5 Å²	68.5	85%	0.845	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	36.5	-173.4	-61.6	-88.8	0	0	0	113.4	A525 E526	A525-N529 WeakPolarHBondContact O-CA 3.41Å; A525-N529 PolarHBondContact O-N 3.12Å; A525-N529 VanDerWaalsContact O-N 3.09Å; E526-N529 PolarHBondContact O-N 2.67Å
530	A	86.8	Confident	84.6	Confident	34 Å²	34	70.1 Å²	70.1	28%	0.281	36%	0.36	S	S	.	.			trans	-102.1	162.2	176.1	0	0	0	0	0	110.7	A525 Y528 V535	A525-A530 CarbonylContact C-O 3.56Å; A525-A530 WeakPolarHBondContact CA-O 3.41Å; A525-A530 VanDerWaalsContact CB-O 3.31Å; A525-A530 WeakPolarHBondContact CB-O 3.46Å; A525-A530 PolarHBondContact O-N 2.87Å; A525-A530 VanDerWaalsContact O-O 3.08Å; Y528-A530 PolarHBondContact O-N 2.83Å; A530-V535 HydrophobicContact CB-CG2 4.4Å
531	T	87.8	Confident	83.7	Confident	72 Å²	72	80.7 Å²	80.7	44%	0.442	41%	0.406	S	S	.	.			trans	-80.7	150.4	168.1	63.4	0	0	0	0	110.9	S533 Q534 V535	T531-S533 PolarHBondContact O-N 3.31Å; T531-Q534 PolarHBondContact O-N 2.92Å; T531-Q534 VanDerWaalsContact OG1-CG 3.29Å; T531-Q534 WeakPolarHBondContact OG1-CG 3.47Å; T531-Q534 PolarHBondContact OG1-N 3.14Å; T531-Q534 PolarHBondContact OG1-OE1 2.91Å; T531-V535 PolarHBondContact O-N 3.44Å; T531-V535 VanDerWaalsContact O-N 3.14Å
532	K	87.2	Confident	83	Confident	76 Å²	76	81.9 Å²	81.9	33%	0.33	42%	0.418	S	S	.	.	H	α-helix	trans	-52.5	-37.3	172.3	-169.7	-174	-164.5	145.1	0	112.4	S518 A521 D522 V535 L536	S518-K532 PolarHBondContact OG-NZ 3.44Å; A521-K532 HydrophobicContact CB-CG 4.3Å; D522-K532 WeakPolarHBondContact OD1-CD 3.5Å; D522-K532 WeakPolarHBondContact OD1-CE 3.5Å; D522-K532 IonicContact OD1-NZ 3.47Å; D522-K532 PolarHBondContact OD1-NZ 3.32Å; D522-K532 IonicContact OD2-NZ 2.73Å; D522-K532 PolarHBondContact OD2-NZ 2.94Å; K532-V535 PolarHBondContact O-N 2.79Å; K532-L536 HydrophobicContact CG-CD1 4Å; K532-L536 WeakPolarHBondContact O-CB 3.14Å; K532-L536 WeakPolarHBondContact O-CG 3.22Å; K532-L536 PolarHBondContact O-N 2.94Å
533	S	87.6	Confident	82.9	Confident	93 Å²	93	81.1 Å²	81.1	65%	0.65	42%	0.416	S	S	*	.	H	α-helix	trans	-60.8	-46.7	175.9	-50.5	0	0	0	0	111.8	T531 V535 L536 D537	T531-S533 PolarHBondContact O-N 3.31Å; S533-V535 VanDerWaalsContact C-N 3.31Å; S533-V535 PolarHBondContact O-N 2.98Å; S533-L536 CarbonylContact O-C 3.32Å; S533-L536 PolarHBondContact O-N 3.1Å; S533-D537 WeakPolarHBondContact O-CB 3.22Å; S533-D537 PolarHBondContact O-N 3.27Å
534	Q	85.6	Confident	82.9	Confident	119 Å²	119	81.8 Å²	81.8	56%	0.556	42%	0.419	S	S	*	.	H	α-helix	trans	-64.6	-32.2	176.3	-72.1	157	-32.6	0	0	112.9	T531	T531-Q534 PolarHBondContact O-N 2.92Å; T531-Q534 VanDerWaalsContact OG1-CG 3.29Å; T531-Q534 WeakPolarHBondContact OG1-CG 3.47Å; T531-Q534 PolarHBondContact OG1-N 3.14Å; T531-Q534 PolarHBondContact OG1-OE1 2.91Å
535	V	84.9	Confident	82.9	Confident	13 Å²	13	81.8 Å²	81.8	8%	0.079	42%	0.422	C	S	.	.	H	α-helix	trans	-67.7	-39	174	178.2	0	0	0	0	111.3	A521 I524 A525 A530 T531 K532 S533 R547 M548	A521-V535 HydrophobicContact CB-CG1 4.4Å; I524-V535 HydrophobicContact CB-CG1 4.21Å; I524-V535 HydrophobicContact CB-CG2 4.42Å; I524-V535 HydrophobicContact CD1-CG1 4.4Å; I524-V535 HydrophobicContact CG2-CB 4.49Å; I524-V535 HydrophobicContact CG2-CG1 3.8Å; I524-V535 HydrophobicContact CG2-CG2 3.78Å; A525-V535 HydrophobicContact CB-CG2 4.06Å; A530-V535 HydrophobicContact CB-CG2 4.4Å; T531-V535 PolarHBondContact O-N 3.44Å; T531-V535 VanDerWaalsContact O-N 3.14Å; K532-V535 PolarHBondContact O-N 2.79Å; S533-V535 VanDerWaalsContact C-N 3.31Å; S533-V535 PolarHBondContact O-N 2.98Å; V535-R547 PolarHBondContact O-NH2 3.26Å; V535-M548 HydrophobicContact CG1-CE 4.13Å
536	L	85.6	Confident	82.9	Confident	69 Å²	69	81.3 Å²	81.3	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-90.7	-6.7	-176.8	-65.5	176.7	0	0	0	114.9	A521 K532 S533 V544 M548	A521-L536 HydrophobicContact CB-CD2 4.14Å; A521-L536 HydrophobicContact CB-CG 4.34Å; K532-L536 HydrophobicContact CG-CD1 4Å; K532-L536 WeakPolarHBondContact O-CB 3.14Å; K532-L536 WeakPolarHBondContact O-CG 3.22Å; K532-L536 PolarHBondContact O-N 2.94Å; S533-L536 CarbonylContact O-C 3.32Å; S533-L536 PolarHBondContact O-N 3.1Å; L536-V544 HydrophobicContact CD2-CG1 4.18Å; L536-V544 WeakPolarHBondContact O-CG2 3.29Å; L536-M548 HydrophobicContact CD2-CE 3.63Å
537	D	85.6	Confident	83	Confident	54 Å²	54	79.6 Å²	79.6	29%	0.289	41%	0.407	S	S	.	.			trans	-60.1	133.9	-175.5	159.7	52.6	0	0	0	113.3	S533 E539 S540 V544 R547	S533-D537 WeakPolarHBondContact O-CB 3.22Å; S533-D537 PolarHBondContact O-N 3.27Å; D537-E539 WeakPolarHBondContact OD1-CB 3.46Å; D537-E539 PolarHBondContact OD1-N 2.84Å; D537-E539 PolarHBondContact OD2-N 3.41Å; D537-S540 PolarHBondContact O-OG 2.96Å; D537-S540 WeakPolarHBondContact OD2-CA 3.42Å; D537-S540 WeakPolarHBondContact OD2-CB 3.49Å; D537-S540 PolarHBondContact OD2-N 2.93Å; D537-S540 PolarHBondContact OD2-OG 3.4Å; D537-V544 VanDerWaalsContact O-CG2 3.26Å; D537-V544 WeakPolarHBondContact O-CG2 3.26Å; D537-R547 PolarHBondContact O-NH1 2.78Å; D537-R547 PolarHBondContact O-NH2 2.86Å
538	H	75.9	Confident	83.2	Confident	164 Å²	164	76.5 Å²	76.5	76%	0.759	40%	0.395	S	S	*	.	S	Bend	trans	-88.2	-12.7	-178.8	-76.8	-93.7	0	0	0	114.4
539	E	70.9	Confident	83.4	Confident	184 Å²	184	70.1 Å²	70.1	86%	0.86	37%	0.37	S	S	*	.	S	Bend	trans	-86.6	-35.7	-174	-165.8	167.2	-113.6	0	0	112.5	D537	D537-E539 WeakPolarHBondContact OD1-CB 3.46Å; D537-E539 PolarHBondContact OD1-N 2.84Å; D537-E539 PolarHBondContact OD2-N 3.41Å
540	S	72.1	Confident	83.4	Confident	45 Å²	45	64.6 Å²	64.6	32%	0.315	34%	0.34	S	S	.	.	S	Bend	trans	-58.5	141.3	172.4	49.9	0	0	0	0	113.1	D537 G542 R547	D537-S540 PolarHBondContact O-OG 2.96Å; D537-S540 WeakPolarHBondContact OD2-CA 3.42Å; D537-S540 WeakPolarHBondContact OD2-CB 3.49Å; D537-S540 PolarHBondContact OD2-N 2.93Å; D537-S540 PolarHBondContact OD2-OG 3.4Å; S540-G542 PolarHBondContact O-N 2.91Å; S540-R547 PolarHBondContact O-NH1 3.48Å; S540-R547 PolarHBondContact OG-NH1 3.44Å; S540-R547 PolarHBondContact OG-NH2 3.21Å
541	K	65.6	Low	83.5	Confident	224 Å²	224	63.4 Å²	63.4	97%	0.974	33%	0.331	S	S	*	.	S	Bend	trans	-65.7	81.6	-170	-66.7	175.7	-178.5	169.2	0	114.2
542	G	73	Confident	83.4	Confident	25 Å²	25	60.5 Å²	60.5	26%	0.258	31%	0.312	S	S	.	.	S	Bend	trans	165.4	159.8	170.1	0	0	0	0	0	111.4	S540 V544 R547 E814	S540-G542 PolarHBondContact O-N 2.91Å; G542-V544 PolarHBondContact O-N 3.38Å; G542-R547 PolarHBondContact O-NH1 3.41Å; G542-E814 WeakPolarHBondContact CA-OE1 3.47Å
543	S	85.7	Confident	83.4	Confident	24 Å²	24	57.3 Å²	57.3	17%	0.168	30%	0.3	C	S	.	.			trans	-74.4	126.3	175.5	176.4	0	0	0	0	110.8	A545 V546 R547 E811 E814	S543-A545 PolarHBondContact O-N 2.94Å; S543-A545 VanDerWaalsContact O-N 3.15Å; S543-A545 PolarHBondContact OG-N 2.82Å; S543-V546 WeakPolarHBondContact O-CA 3.36Å; S543-V546 WeakPolarHBondContact O-CB 3.24Å; S543-V546 PolarHBondContact O-N 2.94Å; S543-R547 PolarHBondContact O-N 3.47Å; S543-E811 WeakPolarHBondContact CB-OE1 3.31Å; S543-E811 PolarHBondContact OG-OE1 3.43Å; S543-E814 PolarHBondContact N-OE1 2.79Å; S543-E814 PolarHBondContact N-OE2 3.06Å
544	V	87.9	Confident	83.4	Confident	19 Å²	19	56.6 Å²	56.6	12%	0.115	29%	0.286	C	S	.	.	H	α-helix	trans	-50.5	-39.4	173.6	-176.1	0	0	0	0	111.4	L536 D537 G542 V546 R547 M548	L536-V544 HydrophobicContact CD2-CG1 4.18Å; L536-V544 WeakPolarHBondContact O-CG2 3.29Å; D537-V544 VanDerWaalsContact O-CG2 3.26Å; D537-V544 WeakPolarHBondContact O-CG2 3.26Å; G542-V544 PolarHBondContact O-N 3.38Å; V544-V546 VanDerWaalsContact C-N 3.31Å; V544-V546 PolarHBondContact O-N 3.39Å; V544-R547 PolarHBondContact O-N 3.27Å; V544-M548 VanDerWaalsContact O-CB 3.29Å; V544-M548 WeakPolarHBondContact O-CB 3.27Å; V544-M548 PolarHBondContact O-N 2.93Å
545	A	87.1	Confident	83.5	Confident	18 Å²	18	51.1 Å²	51.1	15%	0.149	26%	0.26	C	S	.	.	H	α-helix	trans	-66.1	-31.4	178	0	0	0	0	0	112.9	S543 A549 L864 Y865	S543-A545 PolarHBondContact O-N 2.94Å; S543-A545 VanDerWaalsContact O-N 3.15Å; S543-A545 PolarHBondContact OG-N 2.82Å; A545-A549 VanDerWaalsContact O-CB 3.3Å; A545-A549 WeakPolarHBondContact O-CB 3.5Å; A545-A549 PolarHBondContact O-N 2.69Å; A545-A549 VanDerWaalsContact O-N 3.14Å; A545-L864 HydrophobicContact CB-CD1 4.21Å; A545-Y865 HydrophobicContact CB-CD1 4.25Å; A545-Y865 HydrophobicContact CB-CE1 3.68Å; A545-Y865 HydrophobicContact CB-CE2 4.06Å
546	V	89.1	Confident	83.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-77.9	-44.1	176.1	175.4	0	0	0	0	111	S543 V544 M548 A549 L550 E811 E814 L815	S543-V546 WeakPolarHBondContact O-CA 3.36Å; S543-V546 WeakPolarHBondContact O-CB 3.24Å; S543-V546 PolarHBondContact O-N 2.94Å; V544-V546 VanDerWaalsContact C-N 3.31Å; V544-V546 PolarHBondContact O-N 3.39Å; V546-M548 VanDerWaalsContact C-N 3.3Å; V546-M548 PolarHBondContact O-N 3.38Å; V546-A549 PolarHBondContact O-N 3.4Å; V546-L550 HydrophobicContact CG1-CD1 3.83Å; V546-L550 HydrophobicContact CG1-CG 4.31Å; V546-L550 WeakPolarHBondContact O-CB 3.47Å; V546-L550 VanDerWaalsContact O-CG 3.32Å; V546-L550 WeakPolarHBondContact O-CG 3.37Å; V546-L550 PolarHBondContact O-N 3.15Å; V546-E811 HydrophobicContact CG2-CB 3.58Å; V546-E811 HydrophobicContact CG2-CG 3.88Å; V546-E811 WeakPolarHBondContact CG2-O 3.5Å; V546-E814 HydrophobicContact CB-CG 4.45Å; V546-E814 HydrophobicContact CG1-CB 4.1Å; V546-E814 HydrophobicContact CG1-CG 3.86Å; V546-E814 HydrophobicContact CG2-CB 4.38Å; V546-L815 HydrophobicContact CG1-CB 3.96Å; V546-L815 HydrophobicContact CG1-CD1 4.4Å; V546-L815 HydrophobicContact CG2-CB 4.5Å
547	R	88.1	Confident	83.6	Confident	60 Å²	60	52.5 Å²	52.5	23%	0.226	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-43.3	175.1	-59.4	-164.4	-52.7	-114.3	10.9	111.3	V535 D537 S540 G542 S543 V544 L550 G551	V535-R547 PolarHBondContact O-NH2 3.26Å; D537-R547 PolarHBondContact O-NH1 2.78Å; D537-R547 PolarHBondContact O-NH2 2.86Å; S540-R547 PolarHBondContact O-NH1 3.48Å; S540-R547 PolarHBondContact OG-NH1 3.44Å; S540-R547 PolarHBondContact OG-NH2 3.21Å; G542-R547 PolarHBondContact O-NH1 3.41Å; S543-R547 PolarHBondContact O-N 3.47Å; V544-R547 PolarHBondContact O-N 3.27Å; R547-L550 PolarHBondContact O-N 3.14Å; R547-G551 PolarHBondContact O-N 2.61Å
548	M	88.6	Confident	83.7	Confident	20 Å²	20	52.8 Å²	52.8	10%	0.099	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-46.1	174.6	-163.7	57.5	47.5	0	0	112.4	T517 V520 A521 I524 V535 L536 V544 V546 L550 G551 E552	T517-M548 HydrophobicContact CG2-CG 4.18Å; T517-M548 VanDerWaalsContact O-SD 3.36Å; V520-M548 HydrophobicContact CB-SD 3.86Å; V520-M548 HydrophobicContact CG1-SD 3.53Å; V520-M548 VanDerWaalsContact CG1-SD 3.53Å; A521-M548 HydrophobicContact CB-CE 3.67Å; A521-M548 HydrophobicContact CB-SD 4.27Å; I524-M548 HydrophobicContact CD1-SD 4.46Å; V535-M548 HydrophobicContact CG1-CE 4.13Å; L536-M548 HydrophobicContact CD2-CE 3.63Å; V544-M548 VanDerWaalsContact O-CB 3.29Å; V544-M548 WeakPolarHBondContact O-CB 3.27Å; V544-M548 PolarHBondContact O-N 2.93Å; V546-M548 VanDerWaalsContact C-N 3.3Å; V546-M548 PolarHBondContact O-N 3.38Å; M548-L550 VanDerWaalsContact C-N 3.35Å; M548-L550 PolarHBondContact O-N 2.96Å; M548-G551 PolarHBondContact O-N 3.06Å; M548-E552 WeakPolarHBondContact O-CB 3.42Å; M548-E552 PolarHBondContact O-N 2.79Å
549	A	88.8	Confident	84.2	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-35.1	178.8	0	0	0	0	0	113	A545 V546 T553 L815 T862 H863 L864	A545-A549 VanDerWaalsContact O-CB 3.3Å; A545-A549 WeakPolarHBondContact O-CB 3.5Å; A545-A549 PolarHBondContact O-N 2.69Å; A545-A549 VanDerWaalsContact O-N 3.14Å; V546-A549 PolarHBondContact O-N 3.4Å; A549-T553 WeakPolarHBondContact O-CB 3.24Å; A549-T553 PolarHBondContact O-N 3.09Å; A549-T553 PolarHBondContact O-OG1 3.41Å; A549-L815 HydrophobicContact CB-CD1 4.15Å; A549-T862 HydrophobicContact CB-CG2 4.05Å; A549-H863 WeakPolarHBondContact CB-O 3.33Å; A549-L864 HydrophobicContact CB-CD1 4.15Å
550	L	88.2	Confident	84.9	Confident	42 Å²	42	39.6 Å²	39.6	22%	0.22	20%	0.2	C	C	.	.	H	α-helix	trans	-68.9	-49.6	175.7	-73.4	167.1	0	0	0	111.2	V546 R547 M548 T553 E554 L815 T818 F819	V546-L550 HydrophobicContact CG1-CD1 3.83Å; V546-L550 HydrophobicContact CG1-CG 4.31Å; V546-L550 WeakPolarHBondContact O-CB 3.47Å; V546-L550 VanDerWaalsContact O-CG 3.32Å; V546-L550 WeakPolarHBondContact O-CG 3.37Å; V546-L550 PolarHBondContact O-N 3.15Å; R547-L550 PolarHBondContact O-N 3.14Å; M548-L550 VanDerWaalsContact C-N 3.35Å; M548-L550 PolarHBondContact O-N 2.96Å; L550-T553 WeakPolarHBondContact O-CA 3.42Å; L550-T553 WeakPolarHBondContact O-CB 3.4Å; L550-T553 PolarHBondContact O-N 3.46Å; L550-T553 VanDerWaalsContact O-N 3.1Å; L550-E554 PolarHBondContact O-N 3.14Å; L550-L815 HydrophobicContact CD2-CD1 3.78Å; L550-L815 HydrophobicContact CG-CD1 3.89Å; L550-T818 HydrophobicContact CD1-CG2 3.83Å; L550-T818 HydrophobicContact CD2-CG2 4.2Å; L550-F819 HydrophobicContact CD2-CE2 4.07Å; L550-F819 HydrophobicContact CD2-CZ 4.37Å
551	G	88.3	Confident	85.6	Confident	9 Å²	9	42.8 Å²	42.8	9%	0.093	21%	0.21	C	C	.	.	H	α-helix	trans	-67.6	-34.3	178.3	0	0	0	0	0	113.5	R547 M548 T553 E554 I555	R547-G551 PolarHBondContact O-N 2.61Å; M548-G551 PolarHBondContact O-N 3.06Å; G551-T553 VanDerWaalsContact C-N 3.33Å; G551-E554 PolarHBondContact O-N 3.13Å; G551-I555 WeakPolarHBondContact O-CB 3.47Å; G551-I555 VanDerWaalsContact O-CG1 3.32Å; G551-I555 WeakPolarHBondContact O-CG1 3.45Å; G551-I555 PolarHBondContact O-N 3.41Å
552	E	86.3	Confident	86.8	Confident	11 Å²	11	34.7 Å²	34.7	5%	0.051	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-46.9	167	-174	-166.9	-161.5	0	0	110.6	V520 M548 E554 I555 V556 H863	V520-E552 HydrophobicContact CG1-CB 4.06Å; V520-E552 HydrophobicContact CG2-CB 4.29Å; V520-E552 HydrophobicContact CG2-CG 4.27Å; M548-E552 WeakPolarHBondContact O-CB 3.42Å; M548-E552 PolarHBondContact O-N 2.79Å; E552-E554 VanDerWaalsContact C-N 3.33Å; E552-E554 PolarHBondContact O-N 3.05Å; E552-I555 PolarHBondContact O-N 3.29Å; E552-V556 HydrophobicContact CG-CG2 4.26Å; E552-V556 VanDerWaalsContact O-CB 3.31Å; E552-V556 WeakPolarHBondContact O-CB 3.34Å; E552-V556 VanDerWaalsContact O-CG2 3.23Å; E552-V556 WeakPolarHBondContact O-CG2 3.5Å; E552-V556 PolarHBondContact O-N 2.86Å; E552-H863 IonicContact OE1-CE1 3.83Å; E552-H863 IonicContact OE1-CG 3.42Å; E552-H863 IonicContact OE1-ND1 2.72Å; E552-H863 PolarHBondContact OE1-ND1 3.34Å; E552-H863 WeakPolarHBondContact OE2-CB 3.29Å; E552-H863 IonicContact OE2-CG 3.53Å; E552-H863 PolarHBondContact OE2-N 2.8Å; E552-H863 IonicContact OE2-ND1 3.05Å; E552-H863 PolarHBondContact OE2-ND1 3.2Å
553	T	87.4	Confident	87.5	Confident	10 Å²	10	34 Å²	34	6%	0.061	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-40.6	179.8	-56.5	0	0	0	0	111.5	A549 L550 G551 Q557 A857 L858 T862	A549-T553 WeakPolarHBondContact O-CB 3.24Å; A549-T553 PolarHBondContact O-N 3.09Å; A549-T553 PolarHBondContact O-OG1 3.41Å; L550-T553 WeakPolarHBondContact O-CA 3.42Å; L550-T553 WeakPolarHBondContact O-CB 3.4Å; L550-T553 PolarHBondContact O-N 3.46Å; L550-T553 VanDerWaalsContact O-N 3.1Å; G551-T553 VanDerWaalsContact C-N 3.33Å; T553-Q557 VanDerWaalsContact O-CB 3.29Å; T553-Q557 WeakPolarHBondContact O-CB 3.03Å; T553-Q557 PolarHBondContact O-N 3.5Å; T553-A857 HydrophobicContact CG2-CB 4.28Å; T553-L858 HydrophobicContact CG2-CD2 4.2Å; T553-T862 WeakPolarHBondContact OG1-CB 3.42Å; T553-T862 WeakPolarHBondContact OG1-CG2 3.36Å; T553-T862 PolarHBondContact OG1-OG1 3.37Å
554	E	87.3	Confident	87.5	Confident	78 Å²	78	37.1 Å²	37.1	36%	0.364	18%	0.18	S	C	.	.	H	α-helix	trans	-65.1	-53.7	176.9	-171.4	179.3	133.4	0	0	111.6	K527 Y528 L550 G551 E552 V556 Q557 E558	K527-E554 IonicContact NZ-OE1 3.79Å; K527-E554 PolarHBondContact NZ-OE1 3.01Å; Y528-E554 PolarHBondContact OH-OE1 3.42Å; Y528-E554 PolarHBondContact OH-OE2 3.37Å; L550-E554 PolarHBondContact O-N 3.14Å; G551-E554 PolarHBondContact O-N 3.13Å; E552-E554 VanDerWaalsContact C-N 3.33Å; E552-E554 PolarHBondContact O-N 3.05Å; E554-V556 VanDerWaalsContact C-N 3.28Å; E554-V556 PolarHBondContact O-N 2.91Å; E554-Q557 PolarHBondContact O-N 3.31Å; E554-E558 WeakPolarHBondContact O-CB 3.41Å; E554-E558 PolarHBondContact O-N 3.19Å
555	I	87.8	Confident	87.5	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-38.9	-180	-69.2	165.8	0	0	0	111	L515 V520 A523 I524 G551 E552 T559 L619	L515-I555 HydrophobicContact CD1-CB 4.31Å; L515-I555 HydrophobicContact CD1-CG2 3.6Å; V520-I555 HydrophobicContact CG1-CD1 4.37Å; A523-I555 HydrophobicContact CB-CD1 3.77Å; I524-I555 HydrophobicContact CG1-CD1 4.11Å; G551-I555 WeakPolarHBondContact O-CB 3.47Å; G551-I555 VanDerWaalsContact O-CG1 3.32Å; G551-I555 WeakPolarHBondContact O-CG1 3.45Å; G551-I555 PolarHBondContact O-N 3.41Å; E552-I555 PolarHBondContact O-N 3.29Å; I555-T559 VanDerWaalsContact O-CB 3.23Å; I555-T559 WeakPolarHBondContact O-CB 3.44Å; I555-T559 PolarHBondContact O-N 2.91Å; I555-T559 PolarHBondContact O-OG1 3.23Å; I555-L619 HydrophobicContact CG2-CD1 4.43Å
556	V	85.9	Confident	87.5	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.03	21%	0.211	C	C	.	.	H	α-helix	trans	-71.3	-35.7	175.7	175.2	0	0	0	0	111.8	L513 L515 E552 E554 R560	L513-V556 HydrophobicContact CB-CG1 3.86Å; L513-V556 HydrophobicContact CD1-CG1 4.16Å; L513-V556 HydrophobicContact CD2-CG1 4.31Å; L513-V556 HydrophobicContact CG-CG1 4.34Å; L513-V556 WeakPolarHBondContact O-CG2 3.45Å; L515-V556 HydrophobicContact CD1-CG2 3.64Å; L515-V556 HydrophobicContact CG-CG2 4.24Å; E552-V556 HydrophobicContact CG-CG2 4.26Å; E552-V556 VanDerWaalsContact O-CB 3.31Å; E552-V556 WeakPolarHBondContact O-CB 3.34Å; E552-V556 VanDerWaalsContact O-CG2 3.23Å; E552-V556 WeakPolarHBondContact O-CG2 3.5Å; E552-V556 PolarHBondContact O-N 2.86Å; E554-V556 VanDerWaalsContact C-N 3.28Å; E554-V556 PolarHBondContact O-N 2.91Å; V556-R560 WeakPolarHBondContact O-CB 3.47Å; V556-R560 PolarHBondContact O-N 2.94Å
557	Q	85.8	Confident	87.2	Confident	106 Å²	106	46.2 Å²	46.2	50%	0.495	23%	0.23	S	C	.	.	H	α-helix	trans	-66	-43	174.5	-176.2	178.4	-43.9	0	0	111.5	T553 E554 R560 Q561	T553-Q557 VanDerWaalsContact O-CB 3.29Å; T553-Q557 WeakPolarHBondContact O-CB 3.03Å; T553-Q557 PolarHBondContact O-N 3.5Å; E554-Q557 PolarHBondContact O-N 3.31Å; Q557-R560 WeakPolarHBondContact O-CB 3.43Å; Q557-R560 PolarHBondContact O-N 3.21Å; Q557-Q561 PolarHBondContact O-N 3.16Å
558	E	87.2	Confident	87	Confident	60 Å²	60	43.4 Å²	43.4	28%	0.28	22%	0.219	S	C	.	.	H	α-helix	trans	-62.2	-49.1	175.4	-178.6	167.3	-150.9	0	0	111.5	K527 E554 R560 Q561 F562 P616	K527-E558 IonicContact NZ-OE1 2.66Å; K527-E558 IonicContact NZ-OE2 3.58Å; K527-E558 PolarHBondContact NZ-OE2 3.39Å; E554-E558 WeakPolarHBondContact O-CB 3.41Å; E554-E558 PolarHBondContact O-N 3.19Å; E558-R560 VanDerWaalsContact C-N 3.34Å; E558-R560 PolarHBondContact O-N 3.28Å; E558-Q561 PolarHBondContact O-N 3.48Å; E558-F562 WeakPolarHBondContact O-CB 3.48Å; E558-F562 PolarHBondContact O-N 2.93Å; E558-P616 HydrophobicContact CG-CG 3.86Å
559	T	86.9	Confident	86.5	Confident	6 Å²	6	44.4 Å²	44.4	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-43.5	172.7	-62.8	0	0	0	0	111.8	L513 I555 Q561 F562 L563 P615 S617	L513-T559 HydrophobicContact CD2-CG2 4.23Å; I555-T559 VanDerWaalsContact O-CB 3.23Å; I555-T559 WeakPolarHBondContact O-CB 3.44Å; I555-T559 PolarHBondContact O-N 2.91Å; I555-T559 PolarHBondContact O-OG1 3.23Å; T559-Q561 VanDerWaalsContact C-N 3.34Å; T559-Q561 PolarHBondContact O-N 2.86Å; T559-F562 PolarHBondContact O-N 3.11Å; T559-L563 HydrophobicContact CG2-CD1 3.94Å; T559-L563 HydrophobicContact CG2-CG 4.42Å; T559-L563 WeakPolarHBondContact O-CB 3.37Å; T559-L563 VanDerWaalsContact O-CG 3.24Å; T559-L563 WeakPolarHBondContact O-CG 3.21Å; T559-L563 PolarHBondContact O-N 3.36Å; T559-P615 HydrophobicContact CG2-CB 4.3Å; T559-P615 HydrophobicContact CG2-CG 3.92Å; T559-S617 PolarHBondContact OG1-OG 3.13Å
560	R	85.4	Confident	85.9	Confident	65 Å²	65	45.1 Å²	45.1	25%	0.245	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-42.2	178.9	-175.2	-173.1	173.2	86.8	2.6	111.4	V556 Q557 E558 L564 L570 H860	V556-R560 WeakPolarHBondContact O-CB 3.47Å; V556-R560 PolarHBondContact O-N 2.94Å; Q557-R560 WeakPolarHBondContact O-CB 3.43Å; Q557-R560 PolarHBondContact O-N 3.21Å; E558-R560 VanDerWaalsContact C-N 3.34Å; E558-R560 PolarHBondContact O-N 3.28Å; R560-L564 HydrophobicContact CG-CD1 4.49Å; R560-L564 WeakPolarHBondContact O-CG 3.42Å; R560-L564 PolarHBondContact O-N 3.19Å; R560-L570 HydrophobicContact CG-CD1 3.34Å; R560-L570 HydrophobicContact CG-CD2 4.49Å; R560-H860 PolarHBondContact NH1-CD2 3.37Å
561	Q	88.1	Confident	85.1	Confident	112 Å²	112	48.1 Å²	48.1	52%	0.523	25%	0.248	S	C	.	.	H	α-helix	trans	-69.2	-50.4	177.7	-179.3	171.6	-19.4	0	0	111.2	Q557 E558 T559 L563 L564 D565	Q557-Q561 PolarHBondContact O-N 3.16Å; E558-Q561 PolarHBondContact O-N 3.48Å; T559-Q561 VanDerWaalsContact C-N 3.34Å; T559-Q561 PolarHBondContact O-N 2.86Å; Q561-L563 PolarHBondContact O-N 2.87Å; Q561-L564 WeakPolarHBondContact O-CB 3.23Å; Q561-L564 PolarHBondContact O-N 2.89Å; Q561-D565 WeakPolarHBondContact CG-OD2 3.08Å; Q561-D565 VanDerWaalsContact O-CG 3.31Å; Q561-D565 PolarHBondContact O-N 2.96Å
562	F	89.7	Confident	84.4	Confident	53 Å²	53	48.5 Å²	48.5	23%	0.232	25%	0.249	C	C	.	.	H	α-helix	trans	-53.5	-40.8	177.3	176.3	-91	0	0	0	112.7	E558 T559 N566 L613 L614 P615	E558-F562 WeakPolarHBondContact O-CB 3.48Å; E558-F562 PolarHBondContact O-N 2.93Å; T559-F562 PolarHBondContact O-N 3.11Å; F562-N566 WeakPolarHBondContact CZ-ND2 3.38Å; F562-N566 WeakPolarHBondContact O-CB 3.5Å; F562-N566 PolarHBondContact O-N 3.11Å; F562-N566 VanDerWaalsContact O-N 3.09Å; F562-N566 PolarHBondContact O-ND2 2.91Å; F562-L613 HydrophobicContact CE1-CB 4.3Å; F562-L614 WeakPolarHBondContact CZ-O 3.46Å; F562-P615 HydrophobicContact CB-CB 4.34Å; F562-P615 HydrophobicContact CD1-CB 3.75Å; F562-P615 HydrophobicContact CD1-CG 3.8Å; F562-P615 HydrophobicContact CE1-CB 4.28Å; F562-P615 HydrophobicContact CE1-CG 4.15Å; F562-P615 HydrophobicContact CG-CB 4.08Å
563	L	87.5	Confident	83.4	Confident	11 Å²	11	49.3 Å²	49.3	6%	0.058	25%	0.252	C	S	.	.	H	α-helix	trans	-65.1	-44.9	175.7	-72.5	174.4	0	0	0	112.2	L513 T559 Q561 D565 N566 S567 V568 L570 I622	L513-L563 HydrophobicContact CD2-CD1 4.44Å; T559-L563 HydrophobicContact CG2-CD1 3.94Å; T559-L563 HydrophobicContact CG2-CG 4.42Å; T559-L563 WeakPolarHBondContact O-CB 3.37Å; T559-L563 VanDerWaalsContact O-CG 3.24Å; T559-L563 WeakPolarHBondContact O-CG 3.21Å; T559-L563 PolarHBondContact O-N 3.36Å; Q561-L563 PolarHBondContact O-N 2.87Å; L563-D565 PolarHBondContact O-N 2.81Å; L563-N566 CarbonylContact O-C 3.58Å; L563-N566 PolarHBondContact O-N 3.03Å; L563-S567 PolarHBondContact O-N 2.91Å; L563-V568 HydrophobicContact CB-CB 4.04Å; L563-V568 HydrophobicContact CB-CG1 4.36Å; L563-V568 HydrophobicContact CD2-CB 4.25Å; L563-V568 HydrophobicContact CD2-CG1 4.25Å; L563-V568 HydrophobicContact CD2-CG2 4.1Å; L563-V568 WeakPolarHBondContact O-CA 3.33Å; L563-V568 WeakPolarHBondContact O-CB 3.08Å; L563-V568 PolarHBondContact O-N 3.34Å; L563-L570 HydrophobicContact CB-CD2 4.03Å; L563-L570 HydrophobicContact CD1-CD2 3.98Å; L563-I622 HydrophobicContact CD2-CD1 3.58Å; L563-I622 HydrophobicContact CD2-CG1 4.46Å
564	L	86.8	Confident	82.4	Confident	89 Å²	89	52.6 Å²	52.6	47%	0.466	28%	0.276	S	S	.	.	H	α-helix	trans	-61.5	-43.4	176.2	-75.3	165.9	0	0	0	112.3	R560 Q561 N566 S567 L570	R560-L564 HydrophobicContact CG-CD1 4.49Å; R560-L564 WeakPolarHBondContact O-CG 3.42Å; R560-L564 PolarHBondContact O-N 3.19Å; Q561-L564 WeakPolarHBondContact O-CB 3.23Å; Q561-L564 PolarHBondContact O-N 2.89Å; L564-N566 PolarHBondContact O-N 2.84Å; L564-S567 WeakPolarHBondContact O-CA 3.28Å; L564-S567 PolarHBondContact O-N 2.93Å; L564-L570 HydrophobicContact CD1-CD1 3.76Å; L564-L570 HydrophobicContact CD2-CD1 3.8Å; L564-L570 HydrophobicContact CD2-CG 4.17Å; L564-L570 HydrophobicContact CG-CD1 3.58Å; L564-L570 HydrophobicContact CG-CG 4.21Å
565	D	86.9	Confident	81.4	Confident	113 Å²	113	54.2 Å²	54.2	60%	0.604	28%	0.283	S	S	*	.	H	α-helix	trans	-63.7	-33.3	178.8	-63	-21.4	0	0	0	110.9	Q561 L563 S567	Q561-D565 WeakPolarHBondContact CG-OD2 3.08Å; Q561-D565 VanDerWaalsContact O-CG 3.31Å; Q561-D565 PolarHBondContact O-N 2.96Å; L563-D565 PolarHBondContact O-N 2.81Å; D565-S567 PolarHBondContact O-N 2.91Å
566	N	86.7	Confident	79.8	Confident	60 Å²	60	57.5 Å²	57.5	32%	0.321	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	21.4	170.5	-73.5	-87.4	0	0	0	114	F562 L563 L564 V568 L613	F562-N566 WeakPolarHBondContact CZ-ND2 3.38Å; F562-N566 WeakPolarHBondContact O-CB 3.5Å; F562-N566 PolarHBondContact O-N 3.11Å; F562-N566 VanDerWaalsContact O-N 3.09Å; F562-N566 PolarHBondContact O-ND2 2.91Å; L563-N566 CarbonylContact O-C 3.58Å; L563-N566 PolarHBondContact O-N 3.03Å; L564-N566 PolarHBondContact O-N 2.84Å; N566-V568 PolarHBondContact O-N 2.84Å; N566-L613 HydrophobicContact CB-CD1 3.86Å; N566-L613 HydrophobicContact CB-CD2 4.18Å; N566-L613 WeakPolarHBondContact OD1-CD2 3.35Å
567	S	84.5	Confident	78.3	Confident	56 Å²	56	62 Å²	62	39%	0.392	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	22.7	177.5	-59.7	0	0	0	0	115.6	L563 L564 D565 T659	L563-S567 PolarHBondContact O-N 2.91Å; L564-S567 WeakPolarHBondContact O-CA 3.28Å; L564-S567 PolarHBondContact O-N 2.93Å; D565-S567 PolarHBondContact O-N 2.91Å; S567-T659 WeakPolarHBondContact O-CB 3.5Å; S567-T659 PolarHBondContact O-N 3.1Å; S567-T659 PolarHBondContact O-OG1 3.18Å
568	V	83.3	Confident	77.3	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-82.5	121.9	179.8	176.6	0	0	0	0	111.2	L563 N566 L570 F573 L613 I622 V657 F658	L563-V568 HydrophobicContact CB-CB 4.04Å; L563-V568 HydrophobicContact CB-CG1 4.36Å; L563-V568 HydrophobicContact CD2-CB 4.25Å; L563-V568 HydrophobicContact CD2-CG1 4.25Å; L563-V568 HydrophobicContact CD2-CG2 4.1Å; L563-V568 WeakPolarHBondContact O-CA 3.33Å; L563-V568 WeakPolarHBondContact O-CB 3.08Å; L563-V568 PolarHBondContact O-N 3.34Å; N566-V568 PolarHBondContact O-N 2.84Å; V568-L570 PolarHBondContact O-N 3.42Å; V568-L570 VanDerWaalsContact O-N 3.14Å; V568-F573 HydrophobicContact CG1-CE2 3.58Å; V568-F573 HydrophobicContact CG1-CZ 4.28Å; V568-L613 HydrophobicContact CG2-CD1 3.93Å; V568-I622 HydrophobicContact CG1-CD1 4.24Å; V568-I622 HydrophobicContact CG2-CD1 4.44Å; V568-V657 CarbonylContact C-O 3.48Å; V568-V657 VanDerWaalsContact CA-O 3.26Å; V568-V657 WeakPolarHBondContact CA-O 3.31Å; V568-V657 HydrophobicContact CG1-CG1 3.96Å; V568-V657 HydrophobicContact CG2-CG1 4.5Å; V568-F658 HydrophobicContact CG2-CD1 3.91Å; V568-F658 HydrophobicContact CG2-CE1 3.79Å
569	C	78.2	Confident	76.7	Confident	41 Å²	41	61 Å²	61	28%	0.277	36%	0.357	S	S	.	.			trans	-75.8	101.5	178.4	-169.1	0	0	0	0	111.3	D571 S572 F573 V657	C569-D571 VanDerWaalsContact C-N 3.28Å; C569-D571 PolarHBondContact O-N 3.35Å; C569-S572 WeakPolarHBondContact O-CB 3.02Å; C569-S572 PolarHBondContact O-N 3.37Å; C569-F573 WeakPolarHBondContact O-CD2 3.5Å; C569-V657 PolarHBondContact N-O 3.37Å
570	L	75.5	Confident	76.4	Confident	15 Å²	15	63.4 Å²	63.4	8%	0.079	37%	0.365	C	S	.	.	H	α-helix	trans	-64.1	-30.6	179.2	-63.8	171.8	0	0	0	113.6	R560 L563 L564 V568 S572 F573 S574	R560-L570 HydrophobicContact CG-CD1 3.34Å; R560-L570 HydrophobicContact CG-CD2 4.49Å; L563-L570 HydrophobicContact CB-CD2 4.03Å; L563-L570 HydrophobicContact CD1-CD2 3.98Å; L564-L570 HydrophobicContact CD1-CD1 3.76Å; L564-L570 HydrophobicContact CD2-CD1 3.8Å; L564-L570 HydrophobicContact CD2-CG 4.17Å; L564-L570 HydrophobicContact CG-CD1 3.58Å; L564-L570 HydrophobicContact CG-CG 4.21Å; V568-L570 PolarHBondContact O-N 3.42Å; V568-L570 VanDerWaalsContact O-N 3.14Å; L570-S572 PolarHBondContact O-N 3.02Å; L570-F573 PolarHBondContact O-N 2.97Å; L570-F573 VanDerWaalsContact O-N 3.09Å; L570-S574 PolarHBondContact O-N 3.11Å
571	D	71.8	Confident	76.4	Confident	106 Å²	106	61 Å²	61	57%	0.567	36%	0.358	S	S	*	.	H	α-helix	trans	-65.8	-27.4	-179.4	-78.8	-2.9	0	0	0	111.9	C569 F573 S574 Q575	C569-D571 VanDerWaalsContact C-N 3.28Å; C569-D571 PolarHBondContact O-N 3.35Å; D571-F573 VanDerWaalsContact C-N 3.31Å; D571-F573 PolarHBondContact O-N 2.99Å; D571-S574 PolarHBondContact O-N 2.96Å; D571-S574 PolarHBondContact O-OG 2.96Å; D571-Q575 PolarHBondContact O-NE2 3.32Å
572	S	72.6	Confident	76.2	Confident	17 Å²	17	59 Å²	59	12%	0.119	35%	0.353	C	S	.	.	H	α-helix	trans	-61.5	-37.2	172	-56.6	0	0	0	0	112.1	C569 L570 S574 Q575 G656	C569-S572 WeakPolarHBondContact O-CB 3.02Å; C569-S572 PolarHBondContact O-N 3.37Å; L570-S572 PolarHBondContact O-N 3.02Å; S572-S574 VanDerWaalsContact C-N 3.32Å; S572-S574 PolarHBondContact O-N 3.03Å; S572-Q575 PolarHBondContact O-N 2.84Å; S572-G656 PolarHBondContact OG-O 2.89Å
573	F	66.9	Low	76.1	Confident	28 Å²	28	58.3 Å²	58.3	12%	0.123	35%	0.354	C	S	.	.	H	α-helix	trans	-75.4	-17.8	177.7	-66	-90.1	0	0	0	113.7	S512 V568 C569 L570 D571 Q575 L586 I622 A653 P654 V657	S512-F573 WeakPolarHBondContact OG-CB 3.39Å; S512-F573 WeakPolarHBondContact OG-CD1 3.4Å; S512-F573 WeakPolarHBondContact OG-CG 3.21Å; V568-F573 HydrophobicContact CG1-CE2 3.58Å; V568-F573 HydrophobicContact CG1-CZ 4.28Å; C569-F573 WeakPolarHBondContact O-CD2 3.5Å; L570-F573 PolarHBondContact O-N 2.97Å; L570-F573 VanDerWaalsContact O-N 3.09Å; D571-F573 VanDerWaalsContact C-N 3.31Å; D571-F573 PolarHBondContact O-N 2.99Å; F573-Q575 VanDerWaalsContact C-N 3.28Å; F573-Q575 PolarHBondContact O-N 3.25Å; F573-L586 HydrophobicContact CE1-CD2 4.17Å; F573-I622 HydrophobicContact CZ-CD1 3.99Å; F573-A653 HydrophobicContact CE1-CB 4.38Å; F573-P654 HydrophobicContact CD1-CG 4.13Å; F573-P654 HydrophobicContact CD2-CG 4.49Å; F573-P654 HydrophobicContact CE1-CG 4.23Å; F573-P654 HydrophobicContact CG-CG 4.28Å; F573-P654 HydrophobicContact CZ-CG 4.46Å; F573-V657 HydrophobicContact CE2-CG1 4.26Å; F573-V657 HydrophobicContact CE2-CG2 4.1Å; F573-V657 HydrophobicContact CZ-CG1 4.07Å; F573-V657 HydrophobicContact CZ-CG2 3.77Å
574	S	65.9	Low	76.3	Confident	79 Å²	79	58.1 Å²	58.1	55%	0.552	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-14.5	176.7	78.7	0	0	0	0	113.7	L570 D571 S572 A576	L570-S574 PolarHBondContact O-N 3.11Å; D571-S574 PolarHBondContact O-N 2.96Å; D571-S574 PolarHBondContact O-OG 2.96Å; S572-S574 VanDerWaalsContact C-N 3.32Å; S572-S574 PolarHBondContact O-N 3.03Å; S574-A576 PolarHBondContact O-N 3.27Å
575	Q	65.5	Low	76.4	Confident	111 Å²	111	53.9 Å²	53.9	52%	0.519	33%	0.331	S	S	.	.			trans	-96.3	94.3	-167.9	-69.9	178.6	70.1	0	0	112.1	D571 S572 F573 A577 A578	D571-Q575 PolarHBondContact O-NE2 3.32Å; S572-Q575 PolarHBondContact O-N 2.84Å; F573-Q575 VanDerWaalsContact C-N 3.28Å; F573-Q575 PolarHBondContact O-N 3.25Å; Q575-A577 PolarHBondContact O-N 2.87Å; Q575-A578 HydrophobicContact CB-CB 4.12Å; Q575-A578 PolarHBondContact O-N 3.21Å
576	A	54.6	Low	76.5	Confident	73 Å²	73	48.8 Å²	48.8	60%	0.603	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	11.7	-178.6	0	0	0	0	0	116.5	N509 S574	N509-A576 WeakPolarHBondContact ND2-CA 3.42Å; N509-A576 PolarHBondContact ND2-O 2.85Å; S574-A576 PolarHBondContact O-N 3.27Å
577	A	53.9	Low	76.6	Confident	99 Å²	99	46 Å²	46	82%	0.818	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.5	12.8	176.7	0	0	0	0	0	113.1	Q575	Q575-A577 PolarHBondContact O-N 2.87Å
578	A	64.7	Low	76.7	Confident	31 Å²	31	44.3 Å²	44.3	26%	0.256	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-66	147.1	175.1	0	0	0	0	0	111.4	Q575 R580 P654	Q575-A578 HydrophobicContact CB-CB 4.12Å; Q575-A578 PolarHBondContact O-N 3.21Å; A578-R580 PolarHBondContact O-N 2.86Å; A578-P654 HydrophobicContact CB-CB 4.22Å
579	V	74.7	Confident	76.8	Confident	114 Å²	114	46.3 Å²	46.3	69%	0.691	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-60.9	136.5	166.8	-177.6	0	0	0	0	108	V655	V579-V655 HydrophobicContact CB-CG2 4.13Å; V579-V655 HydrophobicContact CG1-CG2 3.91Å; V579-V655 PolarHBondContact O-N 3.16Å
580	R	81.4	Confident	77.3	Confident	58 Å²	58	44.4 Å²	44.4	22%	0.219	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	145	176	-76.6	174.9	162.8	99.7	-17.4	111	S507 N509 A578 E651 W652	S507-R580 PolarHBondContact O-NH1 2.89Å; S507-R580 PolarHBondContact O-NH2 2.78Å; N509-R580 VanDerWaalsContact OD1-CZ 3.23Å; N509-R580 PolarHBondContact OD1-NH1 2.88Å; N509-R580 PolarHBondContact OD1-NH2 2.84Å; A578-R580 PolarHBondContact O-N 2.86Å; R580-E651 IonicContact CZ-OE1 3.15Å; R580-E651 IonicContact NE-OE1 3.61Å; R580-E651 IonicContact NH2-OE1 2.66Å; R580-E651 PolarHBondContact NH2-OE1 2.92Å; R580-W652 HydrophobicContact CB-CB 4.06Å; R580-W652 WeakPolarHBondContact CD-O 3.5Å; R580-W652 HydrophobicContact CG-CB 4.4Å; R580-W652 PolarHBondContact NE-O 3.09Å
581	S	84.8	Confident	77.7	Confident	14 Å²	14	44.3 Å²	44.3	10%	0.098	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	157.5	175.2	69.3	0	0	0	0	111.6	V584 W652 A653	S581-V584 WeakPolarHBondContact OG-CB 3.43Å; S581-V584 PolarHBondContact OG-N 3.05Å; S581-V584 PolarHBondContact OG-O 2.92Å; S581-W652 VanDerWaalsContact O-CE3 3.3Å; S581-A653 WeakPolarHBondContact CB-O 3.36Å; S581-A653 PolarHBondContact N-O 2.73Å; S581-A653 PolarHBondContact OG-O 3.46Å
582	T	85.1	Confident	78.1	Confident	69 Å²	69	40.7 Å²	40.7	42%	0.423	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-1.5	176.2	48.3	0	0	0	0	113	P628 A631 W652	T582-P628 VanDerWaalsContact O-CA 3.31Å; T582-P628 WeakPolarHBondContact O-CA 3.22Å; T582-P628 WeakPolarHBondContact O-CB 3.43Å; T582-A631 WeakPolarHBondContact O-CB 3.48Å; T582-W652 WeakPolarHBondContact O-CH2 3.37Å; T582-W652 VanDerWaalsContact O-CZ3 3.22Å; T582-W652 WeakPolarHBondContact O-CZ3 3.29Å
583	T	87.9	Confident	78.5	Confident	39 Å²	39	41.9 Å²	41.9	24%	0.239	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	-26	-175.9	48.9	0	0	0	0	113.8	F625 P628	T583-F625 PolarHBondContact O-N 2.77Å; T583-P628 HydrophobicContact CG2-CB 3.87Å; T583-P628 HydrophobicContact CG2-CG 4.4Å
584	V	90.1	Very high	79.5	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117.5	-173.8	-171.1	0	0	0	0	111	S581 I622 I623 E624 A653 F658	S581-V584 WeakPolarHBondContact OG-CB 3.43Å; S581-V584 PolarHBondContact OG-N 3.05Å; S581-V584 PolarHBondContact OG-O 2.92Å; V584-I622 HydrophobicContact CG1-CG2 3.42Å; V584-I622 VanDerWaalsContact CG1-CG2 3.42Å; V584-I623 WeakPolarHBondContact CA-O 3.34Å; V584-E624 HydrophobicContact CG2-CB 4.21Å; V584-E624 HydrophobicContact CG2-CG 4.2Å; V584-A653 HydrophobicContact CB-CB 4.1Å; V584-A653 HydrophobicContact CG1-CB 3.84Å; V584-A653 WeakPolarHBondContact O-CB 2.98Å; V584-A653 PolarHBondContact O-N 2.81Å; V584-F658 HydrophobicContact CG1-CE2 4.36Å; V584-F658 HydrophobicContact CG2-CE2 4.05Å
585	I	90	Very high	80.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.5	179.1	-59	177.1	0	0	0	109.1	I623 F625 A631 A634 F635 L650 W652	I585-I623 PolarHBondContact N-O 3.09Å; I585-I623 PolarHBondContact O-N 3.49Å; I585-F625 HydrophobicContact CD1-CD2 4.25Å; I585-F625 HydrophobicContact CD1-CE2 3.95Å; I585-A631 HydrophobicContact CD1-CB 4.38Å; I585-A634 HydrophobicContact CD1-CB 4.4Å; I585-F635 HydrophobicContact CD1-CB 4.02Å; I585-F635 HydrophobicContact CD1-CD2 4.35Å; I585-F635 HydrophobicContact CG1-CD2 4.47Å; I585-F635 HydrophobicContact CG2-CD2 4.35Å; I585-L650 HydrophobicContact CG2-CB 4.08Å; I585-L650 HydrophobicContact CG2-CD1 4.38Å; I585-L650 HydrophobicContact CG2-CD2 4.11Å; I585-L650 HydrophobicContact CG2-CG 4.42Å; I585-W652 HydrophobicContact CD1-CH2 4.35Å; I585-W652 HydrophobicContact CD1-CZ3 4.29Å; I585-W652 HydrophobicContact CG1-CE3 3.98Å; I585-W652 HydrophobicContact CG1-CH2 4.25Å; I585-W652 HydrophobicContact CG1-CZ3 3.72Å
586	L	88.4	Confident	81.8	Confident	7 Å²	7	37.7 Å²	37.7	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	112.9	168.9	176.8	62.5	0	0	0	108.5	F573 K588 I622 E651 A653	F573-L586 HydrophobicContact CE1-CD2 4.17Å; L586-K588 HydrophobicContact CG-CG 4.24Å; L586-I622 HydrophobicContact CD1-CG1 3.96Å; L586-E651 PolarHBondContact N-O 2.92Å; L586-E651 PolarHBondContact O-N 3.35Å; L586-A653 HydrophobicContact CB-CB 4.46Å
587	V	89.5	Confident	83.5	Confident	0 Å²	0	38 Å²	38	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.9	174.4	-167.6	0	0	0	0	108.6	L590 F603 T620 A621 I623 L648 L650	V587-L590 HydrophobicContact CG1-CD1 4.16Å; V587-L590 HydrophobicContact CG1-CD2 3.87Å; V587-L590 HydrophobicContact CG1-CG 3.96Å; V587-F603 HydrophobicContact CG2-CE1 4.38Å; V587-F603 HydrophobicContact CG2-CE2 4.13Å; V587-F603 HydrophobicContact CG2-CZ 3.64Å; V587-T620 CarbonylContact O-C 3.48Å; V587-T620 VanDerWaalsContact O-CA 3.22Å; V587-T620 WeakPolarHBondContact O-CA 3.43Å; V587-A621 HydrophobicContact CB-CB 4.15Å; V587-A621 HydrophobicContact CG2-CB 4.38Å; V587-A621 PolarHBondContact N-O 2.73Å; V587-A621 PolarHBondContact O-N 3.15Å; V587-I623 HydrophobicContact CG2-CD1 3.75Å; V587-I623 HydrophobicContact CG2-CG1 4.12Å; V587-L648 HydrophobicContact CG1-CD2 4.27Å; V587-L650 HydrophobicContact CB-CD2 4.14Å; V587-L650 HydrophobicContact CG1-CD2 3.86Å; V587-L650 HydrophobicContact CG2-CD2 3.96Å
588	K	85.9	Confident	85.4	Confident	22 Å²	22	36.3 Å²	36.3	10%	0.096	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	160.5	178	-67.7	172.9	175.1	170.7	0	110.2	W510 L586 L590 T620 Y649 E651	W510-K588 PolarHBondContact O-NZ 3.02Å; L586-K588 HydrophobicContact CG-CG 4.24Å; K588-L590 VanDerWaalsContact C-N 3.34Å; K588-T620 HydrophobicContact CG-CG2 4.2Å; K588-Y649 PolarHBondContact N-O 2.76Å; K588-Y649 PolarHBondContact O-N 3.02Å; K588-Y649 VanDerWaalsContact O-N 3.09Å; K588-E651 IonicContact NZ-OE2 2.69Å; K588-E651 PolarHBondContact NZ-OE2 3.09Å
589	N	85.6	Confident	86.6	Confident	42 Å²	42	34.9 Å²	34.9	23%	0.225	21%	0.211	C	C	.	.			trans	63.7	41.6	178	-161.2	55.2	0	0	0	111.6	L619 V646 P647 Y649	N589-L619 PolarHBondContact N-O 2.72Å; N589-V646 WeakPolarHBondContact ND2-CG1 3.49Å; N589-V646 WeakPolarHBondContact O-CG1 3.45Å; N589-P647 PolarHBondContact ND2-O 3.26Å; N589-Y649 HydrophobicContact CB-CD2 3.44Å; N589-Y649 VanDerWaalsContact CB-CD2 3.44Å; N589-Y649 HydrophobicContact CB-CE2 3.7Å; N589-Y649 HydrophobicContact CB-CG 4.08Å; N589-Y649 WeakPolarHBondContact ND2-CE2 3.17Å
590	L	87.7	Confident	87.4	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-74	145.5	165.1	-68.3	171	0	0	0	109.4	V587 K588 L599 L614 G618 L619 A621 F643 L648	V587-L590 HydrophobicContact CG1-CD1 4.16Å; V587-L590 HydrophobicContact CG1-CD2 3.87Å; V587-L590 HydrophobicContact CG1-CG 3.96Å; K588-L590 VanDerWaalsContact C-N 3.34Å; L590-L599 HydrophobicContact CD1-CD1 4.08Å; L590-L599 HydrophobicContact CD1-CD2 4.22Å; L590-L599 HydrophobicContact CD2-CD2 3.79Å; L590-L614 HydrophobicContact CD1-CD1 4.1Å; L590-G618 VanDerWaalsContact CB-O 3.27Å; L590-G618 WeakPolarHBondContact CB-O 3.06Å; L590-G618 VanDerWaalsContact CD1-O 3.24Å; L590-G618 WeakPolarHBondContact CD1-O 3.31Å; L590-L619 PolarHBondContact N-O 3.21Å; L590-A621 HydrophobicContact CD1-CB 3.95Å; L590-F643 HydrophobicContact CD2-CD1 3.93Å; L590-F643 HydrophobicContact CD2-CE1 3.93Å; L590-L648 HydrophobicContact CD2-CD2 3.61Å
591	P	84.3	Confident	87.9	Confident	12 Å²	12	37.8 Å²	37.8	8%	0.078	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-65.9	164.3	168.2	24.4	-27.2	0	0	0	111.7	V594 F643 V646	P591-V594 HydrophobicContact CB-CG2 4.44Å; P591-V594 HydrophobicContact CG-CG2 3.61Å; P591-V594 VanDerWaalsContact O-CG2 3.3Å; P591-V594 WeakPolarHBondContact O-CG2 3.44Å; P591-F643 HydrophobicContact CG-CD1 4.35Å; P591-V646 HydrophobicContact CB-CG2 4.04Å; P591-V646 HydrophobicContact CG-CG2 4.4Å
592	A	81.1	Confident	88.2	Confident	31 Å²	31	39.2 Å²	39.2	26%	0.256	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	158.8	167.9	0	0	0	0	0	111	D522 E526 V594	D522-A592 HydrophobicContact CB-CB 4.35Å; E526-A592 HydrophobicContact CB-CB 4.48Å; E526-A592 WeakPolarHBondContact OE2-CB 3.4Å; A592-V594 VanDerWaalsContact C-N 3.28Å; A592-V594 PolarHBondContact O-N 2.83Å
593	G	80.1	Confident	88.6	Confident	41 Å²	41	35.9 Å²	35.9	42%	0.423	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	-1.8	179.4	0	0	0	0	0	118.1	E526	E526-G593 WeakPolarHBondContact OE1-CA 3.15Å; E526-G593 PolarHBondContact OE1-N 3.4Å; E526-G593 PolarHBondContact OE2-N 3.04Å
594	V	87.6	Confident	88.6	Confident	14 Å²	14	37.1 Å²	37.1	9%	0.085	22%	0.216	C	C	.	.			trans	-65.3	140	-178	173.7	0	0	0	0	112.1	P591 A592 L599 L614 F643	P591-V594 HydrophobicContact CB-CG2 4.44Å; P591-V594 HydrophobicContact CG-CG2 3.61Å; P591-V594 VanDerWaalsContact O-CG2 3.3Å; P591-V594 WeakPolarHBondContact O-CG2 3.44Å; A592-V594 VanDerWaalsContact C-N 3.28Å; A592-V594 PolarHBondContact O-N 2.83Å; V594-L599 HydrophobicContact CG1-CD1 4.31Å; V594-L599 HydrophobicContact CG1-CD2 4.18Å; V594-L599 HydrophobicContact CG1-CG 3.99Å; V594-L614 WeakPolarHBondContact O-CD2 3.32Å; V594-F643 HydrophobicContact CG1-CE1 4.06Å; V594-F643 HydrophobicContact CG1-CZ 4.36Å; V594-F643 HydrophobicContact CG2-CE1 3.85Å
595	T	90.2	Very high	88.7	Confident	57 Å²	57	41.1 Å²	41.1	35%	0.35	24%	0.242	S	C	.	.			trans	-99.8	160.1	177.1	64.9	0	0	0	0	113	T597 E598 L599	T595-T597 VanDerWaalsContact C-N 3.27Å; T595-T597 WeakPolarHBondContact CB-OG1 3.17Å; T595-T597 PolarHBondContact O-N 2.82Å; T595-T597 PolarHBondContact OG1-OG1 3.06Å; T595-E598 WeakPolarHBondContact CB-OE2 3.11Å; T595-E598 PolarHBondContact N-OE2 2.69Å; T595-E598 VanDerWaalsContact OG1-CD 3.26Å; T595-E598 VanDerWaalsContact OG1-CG 3.26Å; T595-E598 WeakPolarHBondContact OG1-CG 3.41Å; T595-E598 PolarHBondContact OG1-N 3.39Å; T595-E598 PolarHBondContact OG1-OE2 3.17Å; T595-L599 PolarHBondContact O-N 2.84Å
596	T	90.2	Very high	88.5	Confident	60 Å²	60	42.3 Å²	42.3	37%	0.368	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-35.5	171.5	48.5	0	0	0	0	112	L599 E600 L614	T596-L599 WeakPolarHBondContact O-CB 3.16Å; T596-L599 PolarHBondContact O-N 3.29Å; T596-E600 WeakPolarHBondContact O-CG 3.21Å; T596-E600 PolarHBondContact O-N 2.88Å; T596-L614 HydrophobicContact CG2-CB 3.65Å; T596-L614 HydrophobicContact CG2-CD2 4.04Å
597	T	91.3	Very high	88.4	Confident	79 Å²	79	42.2 Å²	42.2	49%	0.485	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-42.1	178.9	33.6	0	0	0	0	112.9	T595 L599 E600 E601	T595-T597 VanDerWaalsContact C-N 3.27Å; T595-T597 WeakPolarHBondContact CB-OG1 3.17Å; T595-T597 PolarHBondContact O-N 2.82Å; T595-T597 PolarHBondContact OG1-OG1 3.06Å; T597-L599 VanDerWaalsContact C-N 3.29Å; T597-L599 PolarHBondContact O-N 3.46Å; T597-E600 PolarHBondContact O-N 2.69Å; T597-E601 WeakPolarHBondContact O-CG 3.48Å; T597-E601 PolarHBondContact O-N 3.45Å
598	E	92.1	Very high	88.4	Confident	64 Å²	64	44.6 Å²	44.6	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-32.7	175.8	-70.3	159.4	133.4	0	0	112.1	T595 L602 F643 H644	T595-E598 WeakPolarHBondContact CB-OE2 3.11Å; T595-E598 PolarHBondContact N-OE2 2.69Å; T595-E598 VanDerWaalsContact OG1-CD 3.26Å; T595-E598 VanDerWaalsContact OG1-CG 3.26Å; T595-E598 WeakPolarHBondContact OG1-CG 3.41Å; T595-E598 PolarHBondContact OG1-N 3.39Å; T595-E598 PolarHBondContact OG1-OE2 3.17Å; E598-L602 VanDerWaalsContact O-CB 3.31Å; E598-L602 WeakPolarHBondContact O-CB 3.33Å; E598-L602 PolarHBondContact O-N 2.97Å; E598-F643 HydrophobicContact CB-CZ 4.26Å; E598-H644 IonicContact OE1-CE1 3.71Å
599	L	91.1	Very high	88.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-71.8	-37.6	173.3	-64.1	176.6	0	0	0	111.9	L590 V594 T595 T596 T597 L602 F603 L614 A621 I623 F643	L590-L599 HydrophobicContact CD1-CD1 4.08Å; L590-L599 HydrophobicContact CD1-CD2 4.22Å; L590-L599 HydrophobicContact CD2-CD2 3.79Å; V594-L599 HydrophobicContact CG1-CD1 4.31Å; V594-L599 HydrophobicContact CG1-CD2 4.18Å; V594-L599 HydrophobicContact CG1-CG 3.99Å; T595-L599 PolarHBondContact O-N 2.84Å; T596-L599 WeakPolarHBondContact O-CB 3.16Å; T596-L599 PolarHBondContact O-N 3.29Å; T597-L599 VanDerWaalsContact C-N 3.29Å; T597-L599 PolarHBondContact O-N 3.46Å; L599-L602 PolarHBondContact O-N 3.37Å; L599-F603 HydrophobicContact CD2-CE2 4.49Å; L599-F603 WeakPolarHBondContact O-CB 3.48Å; L599-F603 WeakPolarHBondContact O-CD2 3.11Å; L599-F603 PolarHBondContact O-N 3Å; L599-L614 HydrophobicContact CD1-CD1 3.95Å; L599-L614 HydrophobicContact CD1-CD2 4.15Å; L599-L614 HydrophobicContact CD1-CG 4.49Å; L599-A621 HydrophobicContact CD1-CB 3.71Å; L599-I623 HydrophobicContact CB-CD1 4.49Å; L599-F643 HydrophobicContact CD2-CE1 4.46Å
600	E	92	Very high	88.6	Confident	87 Å²	87	44.1 Å²	44.1	41%	0.407	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-43.5	173.4	-74.2	173.7	-169.9	0	0	111.4	T596 T597 L602 F603 S604 L609 V612	T596-E600 WeakPolarHBondContact O-CG 3.21Å; T596-E600 PolarHBondContact O-N 2.88Å; T597-E600 PolarHBondContact O-N 2.69Å; E600-L602 VanDerWaalsContact C-N 3.33Å; E600-L602 PolarHBondContact O-N 2.89Å; E600-F603 PolarHBondContact O-N 3.5Å; E600-S604 WeakPolarHBondContact O-CB 3.16Å; E600-S604 PolarHBondContact O-N 3.2Å; E600-S604 PolarHBondContact O-OG 2.91Å; E600-L609 HydrophobicContact CB-CD1 4.41Å; E600-L609 HydrophobicContact CG-CD1 4.17Å; E600-V612 HydrophobicContact CG-CB 4.49Å; E600-V612 HydrophobicContact CG-CG2 3.95Å
601	E	91.7	Very high	88.6	Confident	147 Å²	147	46.3 Å²	46.3	69%	0.687	27%	0.274	S	S	*	.	H	α-helix	trans	-63.1	-35.3	173.5	-73.6	-175.5	-176.6	0	0	112.9	T597 P605	T597-E601 WeakPolarHBondContact O-CG 3.48Å; T597-E601 PolarHBondContact O-N 3.45Å; E601-P605 WeakPolarHBondContact O-CD 3.39Å; E601-P605 WeakPolarHBondContact O-CG 3.3Å
602	L	90.7	Very high	89	Confident	43 Å²	43	47 Å²	47	23%	0.225	28%	0.278	C	S	.	.	H	α-helix	trans	-74.2	-39.9	178.2	-176.5	67.1	0	0	0	113.3	E598 L599 E600 L638 F643 L648	E598-L602 VanDerWaalsContact O-CB 3.31Å; E598-L602 WeakPolarHBondContact O-CB 3.33Å; E598-L602 PolarHBondContact O-N 2.97Å; L599-L602 PolarHBondContact O-N 3.37Å; E600-L602 VanDerWaalsContact C-N 3.33Å; E600-L602 PolarHBondContact O-N 2.89Å; L602-L638 HydrophobicContact CD1-CD2 3.85Å; L602-L638 HydrophobicContact CD2-CD1 4.46Å; L602-L638 HydrophobicContact CD2-CD2 4.46Å; L602-L638 HydrophobicContact CG-CD1 4.11Å; L602-L638 HydrophobicContact CG-CD2 4.08Å; L602-F643 HydrophobicContact CD1-CD2 4.48Å; L602-F643 HydrophobicContact CD2-CD2 3.77Å; L602-F643 HydrophobicContact CD2-CE2 3.97Å; L602-F643 HydrophobicContact CD2-CG 4.3Å; L602-L648 HydrophobicContact CD2-CD1 3.63Å
603	F	92.4	Very high	89.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-95.1	-26.2	-173.3	-76.9	-101.5	0	0	0	113.7	V587 L599 E600 P605 H606 G607 L609 I623 F625 A634 L638 L650	V587-F603 HydrophobicContact CG2-CE1 4.38Å; V587-F603 HydrophobicContact CG2-CE2 4.13Å; V587-F603 HydrophobicContact CG2-CZ 3.64Å; L599-F603 HydrophobicContact CD2-CE2 4.49Å; L599-F603 WeakPolarHBondContact O-CB 3.48Å; L599-F603 WeakPolarHBondContact O-CD2 3.11Å; L599-F603 PolarHBondContact O-N 3Å; E600-F603 PolarHBondContact O-N 3.5Å; F603-P605 VanDerWaalsContact C-CD 3.43Å; F603-H606 WeakPolarHBondContact O-CB 3.5Å; F603-H606 PolarHBondContact O-N 2.87Å; F603-G607 PolarHBondContact O-N 3.23Å; F603-L609 HydrophobicContact CB-CD1 4.11Å; F603-L609 HydrophobicContact CB-CD2 3.99Å; F603-I623 HydrophobicContact CB-CD1 4.4Å; F603-I623 HydrophobicContact CD1-CD1 3.97Å; F603-I623 HydrophobicContact CD1-CG2 4.48Å; F603-I623 HydrophobicContact CD2-CD1 3.46Å; F603-I623 VanDerWaalsContact CD2-CD1 3.46Å; F603-I623 HydrophobicContact CE1-CD1 4.04Å; F603-I623 HydrophobicContact CE2-CD1 3.53Å; F603-I623 HydrophobicContact CG-CD1 3.69Å; F603-I623 HydrophobicContact CZ-CD1 3.84Å; F603-F625 HydrophobicContact CB-CZ 4.15Å; F603-F625 AromaticContact CD1-CE2 3.92Å; F603-F625 HydrophobicContact CD1-CE2 3.92Å; F603-F625 AromaticContact CD1-CZ 3.88Å; F603-F625 HydrophobicContact CD1-CZ 3.88Å; F603-A634 HydrophobicContact CD1-CB 4.4Å; F603-L638 HydrophobicContact CD1-CD1 3.59Å; F603-L638 HydrophobicContact CD2-CD1 4.01Å; F603-L638 HydrophobicContact CE1-CD1 3.51Å; F603-L638 HydrophobicContact CE2-CD1 3.94Å; F603-L638 HydrophobicContact CG-CD1 3.86Å; F603-L638 HydrophobicContact CZ-CD1 3.69Å; F603-L650 HydrophobicContact CE1-CD1 4.46Å; F603-L650 HydrophobicContact CZ-CD2 4.05Å
604	S	89.5	Confident	89.9	Confident	65 Å²	65	45.5 Å²	45.5	46%	0.455	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-62.2	-31.2	179.1	61.9	0	0	0	0	116.1	E600 H606 G607	E600-S604 WeakPolarHBondContact O-CB 3.16Å; E600-S604 PolarHBondContact O-N 3.2Å; E600-S604 PolarHBondContact O-OG 2.91Å; S604-H606 PolarHBondContact O-N 3.4Å; S604-H606 VanDerWaalsContact O-N 3.09Å; S604-G607 PolarHBondContact O-N 3.27Å
605	P	90.6	Very high	90	Very high	91 Å²	91	45 Å²	45	59%	0.591	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-66	-11.4	172.5	-20.5	34.1	0	0	0	113.2	E601 F603	E601-P605 WeakPolarHBondContact O-CD 3.39Å; E601-P605 WeakPolarHBondContact O-CG 3.3Å; F603-P605 VanDerWaalsContact C-CD 3.43Å
606	H	87.3	Confident	89.7	Confident	25 Å²	25	46.6 Å²	46.6	12%	0.116	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-103.4	-17.7	178.6	-61.5	-32.8	0	0	0	113.8	F603 S604 R633 A634	F603-H606 WeakPolarHBondContact O-CB 3.5Å; F603-H606 PolarHBondContact O-N 2.87Å; S604-H606 PolarHBondContact O-N 3.4Å; S604-H606 VanDerWaalsContact O-N 3.09Å; H606-R633 PolarHBondContact O-NE 3.39Å; H606-R633 PolarHBondContact O-NH2 2.7Å; H606-A634 HydrophobicContact CB-CB 3.63Å
607	G	86.1	Confident	89.1	Confident	5 Å²	5	44.3 Å²	44.3	5%	0.052	25%	0.251	C	S	.	.	S	Bend	trans	172.3	172.5	176.4	0	0	0	0	0	114.8	F603 S604 E630	F603-G607 PolarHBondContact O-N 3.23Å; S604-G607 PolarHBondContact O-N 3.27Å; G607-E630 WeakPolarHBondContact CA-OE2 3.41Å
608	S	88.5	Confident	88.7	Confident	50 Å²	50	40.8 Å²	40.8	35%	0.35	23%	0.229	S	C	.	.			trans	-79.3	119.8	178.1	-58.2	0	0	0	0	111	K434 L626 E630	K434-S608 PolarHBondContact NZ-OG 2.89Å; K434-S608 VanDerWaalsContact NZ-OG 3.15Å; S608-L626 PolarHBondContact O-N 3.03Å; S608-E630 PolarHBondContact N-OE2 3.25Å
609	L	91	Very high	88.2	Confident	41 Å²	41	37.9 Å²	37.9	22%	0.215	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	145.4	-176.1	-50	-177.7	0	0	0	111.6	E600 F603 V612 I623 F625	E600-L609 HydrophobicContact CB-CD1 4.41Å; E600-L609 HydrophobicContact CG-CD1 4.17Å; F603-L609 HydrophobicContact CB-CD1 4.11Å; F603-L609 HydrophobicContact CB-CD2 3.99Å; L609-V612 HydrophobicContact CD1-CG2 4.05Å; L609-I623 HydrophobicContact CD2-CG2 4Å; L609-F625 HydrophobicContact CD2-CD1 3.86Å; L609-F625 HydrophobicContact CD2-CD2 4.32Å; L609-F625 HydrophobicContact CD2-CE1 3.47Å; L609-F625 VanDerWaalsContact CD2-CE1 3.47Å; L609-F625 HydrophobicContact CD2-CE2 3.97Å; L609-F625 HydrophobicContact CD2-CG 4.26Å; L609-F625 HydrophobicContact CD2-CZ 3.53Å
610	G	85.8	Confident	88.1	Confident	13 Å²	13	38.4 Å²	38.4	13%	0.134	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-54.2	-178.1	0	0	0	0	0	113.5	E624 K662	G610-E624 PolarHBondContact N-O 3.34Å; G610-K662 PolarHBondContact O-NZ 3.06Å
611	R	87.8	Confident	88	Confident	48 Å²	48	34.3 Å²	34.3	18%	0.181	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	133.2	174.9	-75.1	179.7	-81.8	-164	-3.1	109.5	E624 F658 A660	R611-E624 HydrophobicContact CB-CB 4.14Å; R611-E624 WeakPolarHBondContact CG-OE2 3.48Å; R611-E624 IonicContact CZ-OE1 2.75Å; R611-E624 IonicContact CZ-OE2 3.55Å; R611-E624 PolarHBondContact N-O 3.35Å; R611-E624 IonicContact NE-OE1 2.73Å; R611-E624 PolarHBondContact NE-OE1 3.09Å; R611-E624 IonicContact NE-OE2 3.14Å; R611-E624 PolarHBondContact NE-OE2 3.42Å; R611-E624 IonicContact NH2-OE1 3.08Å; R611-E624 PolarHBondContact NH2-OE1 3.07Å; R611-E624 IonicContact NH2-OE2 2.69Å; R611-E624 PolarHBondContact NH2-OE2 3.44Å; R611-E624 PolarHBondContact O-N 3.18Å; R611-F658 VanDerWaalsContact NH2-CD2 3.33Å; R611-A660 PolarHBondContact NH1-O 3.21Å
612	V	91.5	Very high	87.9	Confident	26 Å²	26	27.6 Å²	27.6	16%	0.158	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.4	171.6	176.6	0	0	0	0	107.6	E600 L609 I623	E600-V612 HydrophobicContact CG-CB 4.49Å; E600-V612 HydrophobicContact CG-CG2 3.95Å; L609-V612 HydrophobicContact CD1-CG2 4.05Å; V612-I623 HydrophobicContact CG1-CG1 4.4Å; V612-I623 HydrophobicContact CG2-CG1 4.46Å; V612-I623 HydrophobicContact CG2-CG2 4.41Å
613	L	90.4	Very high	88	Confident	18 Å²	18	25.5 Å²	25.5	9%	0.094	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.2	179.9	-62.9	-176.9	0	0	0	110	F562 N566 V568 A621 I622 F658	F562-L613 HydrophobicContact CE1-CB 4.3Å; N566-L613 HydrophobicContact CB-CD1 3.86Å; N566-L613 HydrophobicContact CB-CD2 4.18Å; N566-L613 WeakPolarHBondContact OD1-CD2 3.35Å; V568-L613 HydrophobicContact CG2-CD1 3.93Å; L613-A621 CarbonylContact O-C 3.55Å; L613-A621 VanDerWaalsContact O-CA 3.28Å; L613-A621 WeakPolarHBondContact O-CA 3.26Å; L613-I622 HydrophobicContact CB-CB 4.32Å; L613-I622 PolarHBondContact N-O 2.92Å; L613-I622 PolarHBondContact O-N 3.18Å; L613-F658 HydrophobicContact CD1-CE1 3.77Å; L613-F658 HydrophobicContact CD1-CZ 4.45Å
614	L	91.3	Very high	88	Confident	22 Å²	22	27 Å²	27	12%	0.115	17%	0.165	C	C	.	.			trans	-117.8	113.2	175.4	-174.5	63.3	0	0	0	108.9	F562 L590 V594 T596 L599 G618 A621	F562-L614 WeakPolarHBondContact CZ-O 3.46Å; L590-L614 HydrophobicContact CD1-CD1 4.1Å; V594-L614 WeakPolarHBondContact O-CD2 3.32Å; T596-L614 HydrophobicContact CG2-CB 3.65Å; T596-L614 HydrophobicContact CG2-CD2 4.04Å; L599-L614 HydrophobicContact CD1-CD1 3.95Å; L599-L614 HydrophobicContact CD1-CD2 4.15Å; L599-L614 HydrophobicContact CD1-CG 4.49Å; L614-G618 WeakPolarHBondContact CD1-O 3.3Å; L614-A621 HydrophobicContact CD1-CB 3.94Å
615	P	89.1	Confident	88	Confident	3 Å²	3	24 Å²	24	2%	0.019	14%	0.144	C	C	.	.			trans	-63.2	153.4	170.1	-13.5	28.8	0	0	0	110.5	T559 F562 S617 G618 T620	T559-P615 HydrophobicContact CG2-CB 4.3Å; T559-P615 HydrophobicContact CG2-CG 3.92Å; F562-P615 HydrophobicContact CB-CB 4.34Å; F562-P615 HydrophobicContact CD1-CB 3.75Å; F562-P615 HydrophobicContact CD1-CG 3.8Å; F562-P615 HydrophobicContact CE1-CB 4.28Å; F562-P615 HydrophobicContact CE1-CG 4.15Å; F562-P615 HydrophobicContact CG-CB 4.08Å; P615-S617 PolarHBondContact O-N 3.03Å; P615-G618 PolarHBondContact O-N 3.18Å; P615-T620 WeakPolarHBondContact CD-O 3.47Å
616	P	83.2	Confident	87.9	Confident	91 Å²	91	24.8 Å²	24.8	59%	0.591	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.8	-173	25.6	-36.2	0	0	0	114.7	E558 G618	E558-P616 HydrophobicContact CG-CG 3.86Å; P616-G618 VanDerWaalsContact C-N 3.34Å
617	S	78.9	Confident	87.8	Confident	13 Å²	13	26.3 Å²	26.3	9%	0.091	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-3.3	175.1	59.2	0	0	0	0	114.9	T559 P615 L619	T559-S617 PolarHBondContact OG1-OG 3.13Å; P615-S617 PolarHBondContact O-N 3.03Å; S617-L619 WeakPolarHBondContact O-CG 3.31Å; S617-L619 PolarHBondContact O-N 2.8Å
618	G	81.1	Confident	87.8	Confident	4 Å²	4	27.3 Å²	27.3	4%	0.041	16%	0.155	C	C	.	.			trans	71.9	-29.2	174.5	0	0	0	0	0	117.5	L590 L614 P615 P616 T620	L590-G618 VanDerWaalsContact CB-O 3.27Å; L590-G618 WeakPolarHBondContact CB-O 3.06Å; L590-G618 VanDerWaalsContact CD1-O 3.24Å; L590-G618 WeakPolarHBondContact CD1-O 3.31Å; L614-G618 WeakPolarHBondContact CD1-O 3.3Å; P615-G618 PolarHBondContact O-N 3.18Å; P616-G618 VanDerWaalsContact C-N 3.34Å; G618-T620 VanDerWaalsContact C-N 3.31Å; G618-T620 PolarHBondContact O-N 2.69Å; G618-T620 VanDerWaalsContact O-N 3.1Å
619	L	83.4	Confident	87.6	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.016	14%	0.141	C	C	.	.	S	Bend	trans	-64.5	-21	-163.1	-57.5	-170.9	0	0	0	117.3	L515 A519 A523 I555 N589 L590 S617	L515-L619 HydrophobicContact CD1-CD1 4.15Å; L515-L619 HydrophobicContact CD2-CB 4.05Å; L515-L619 HydrophobicContact CD2-CD1 4.1Å; A519-L619 HydrophobicContact CB-CD1 3.99Å; A519-L619 HydrophobicContact CB-CD2 3.96Å; A519-L619 WeakPolarHBondContact O-CD1 3.29Å; A523-L619 HydrophobicContact CB-CD1 4.06Å; A523-L619 HydrophobicContact CB-CD2 4.05Å; A523-L619 HydrophobicContact CB-CG 4.16Å; I555-L619 HydrophobicContact CG2-CD1 4.43Å; N589-L619 PolarHBondContact N-O 2.72Å; L590-L619 PolarHBondContact N-O 3.21Å; S617-L619 WeakPolarHBondContact O-CG 3.31Å; S617-L619 PolarHBondContact O-N 2.8Å
620	T	87.3	Confident	87.4	Confident	12 Å²	12	23.4 Å²	23.4	7%	0.074	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	142.4	-177.6	59.4	0	0	0	0	110.6	L515 V587 K588 P615 G618	L515-T620 HydrophobicContact CD2-CG2 3.94Å; V587-T620 CarbonylContact O-C 3.48Å; V587-T620 VanDerWaalsContact O-CA 3.22Å; V587-T620 WeakPolarHBondContact O-CA 3.43Å; K588-T620 HydrophobicContact CG-CG2 4.2Å; P615-T620 WeakPolarHBondContact CD-O 3.47Å; G618-T620 VanDerWaalsContact C-N 3.31Å; G618-T620 PolarHBondContact O-N 2.69Å; G618-T620 VanDerWaalsContact O-N 3.1Å
621	A	90.1	Very high	87.6	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.008	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	152.7	176.5	0	0	0	0	0	112.1	V587 L590 L599 L613 L614	V587-A621 HydrophobicContact CB-CB 4.15Å; V587-A621 HydrophobicContact CG2-CB 4.38Å; V587-A621 PolarHBondContact N-O 2.73Å; V587-A621 PolarHBondContact O-N 3.15Å; L590-A621 HydrophobicContact CD1-CB 3.95Å; L599-A621 HydrophobicContact CD1-CB 3.71Å; L613-A621 CarbonylContact O-C 3.55Å; L613-A621 VanDerWaalsContact O-CA 3.28Å; L613-A621 WeakPolarHBondContact O-CA 3.26Å; L614-A621 HydrophobicContact CD1-CB 3.94Å
622	I	90.8	Very high	87.5	Confident	5 Å²	5	22.6 Å²	22.6	3%	0.026	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122.2	169.3	-58.4	178.6	0	0	0	108.1	L563 V568 F573 V584 L586 L613 V657 F658	L563-I622 HydrophobicContact CD2-CD1 3.58Å; L563-I622 HydrophobicContact CD2-CG1 4.46Å; V568-I622 HydrophobicContact CG1-CD1 4.24Å; V568-I622 HydrophobicContact CG2-CD1 4.44Å; F573-I622 HydrophobicContact CZ-CD1 3.99Å; V584-I622 HydrophobicContact CG1-CG2 3.42Å; V584-I622 VanDerWaalsContact CG1-CG2 3.42Å; L586-I622 HydrophobicContact CD1-CG1 3.96Å; L613-I622 HydrophobicContact CB-CB 4.32Å; L613-I622 PolarHBondContact N-O 2.92Å; L613-I622 PolarHBondContact O-N 3.18Å; I622-V657 HydrophobicContact CD1-CG1 4.44Å; I622-F658 HydrophobicContact CG2-CZ 4.05Å
623	I	91.9	Very high	87.2	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	113.1	-179.9	-59.9	-178.6	0	0	0	108.7	V584 I585 V587 L599 F603 L609 V612 F625	V584-I623 WeakPolarHBondContact CA-O 3.34Å; I585-I623 PolarHBondContact N-O 3.09Å; I585-I623 PolarHBondContact O-N 3.49Å; V587-I623 HydrophobicContact CG2-CD1 3.75Å; V587-I623 HydrophobicContact CG2-CG1 4.12Å; L599-I623 HydrophobicContact CB-CD1 4.49Å; F603-I623 HydrophobicContact CB-CD1 4.4Å; F603-I623 HydrophobicContact CD1-CD1 3.97Å; F603-I623 HydrophobicContact CD1-CG2 4.48Å; F603-I623 HydrophobicContact CD2-CD1 3.46Å; F603-I623 VanDerWaalsContact CD2-CD1 3.46Å; F603-I623 HydrophobicContact CE1-CD1 4.04Å; F603-I623 HydrophobicContact CE2-CD1 3.53Å; F603-I623 HydrophobicContact CG-CD1 3.69Å; F603-I623 HydrophobicContact CZ-CD1 3.84Å; L609-I623 HydrophobicContact CD2-CG2 4Å; V612-I623 HydrophobicContact CG1-CG1 4.4Å; V612-I623 HydrophobicContact CG2-CG1 4.46Å; V612-I623 HydrophobicContact CG2-CG2 4.41Å; I623-F625 HydrophobicContact CG2-CD2 4.15Å; I623-F625 HydrophobicContact CG2-CE2 3.85Å
624	E	91.5	Very high	87.2	Confident	30 Å²	30	23.9 Å²	23.9	14%	0.14	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.5	170.2	176.5	-178.5	-107.6	0	0	109.1	V584 G610 R611 F658	V584-E624 HydrophobicContact CG2-CB 4.21Å; V584-E624 HydrophobicContact CG2-CG 4.2Å; G610-E624 PolarHBondContact N-O 3.34Å; R611-E624 HydrophobicContact CB-CB 4.14Å; R611-E624 WeakPolarHBondContact CG-OE2 3.48Å; R611-E624 IonicContact CZ-OE1 2.75Å; R611-E624 IonicContact CZ-OE2 3.55Å; R611-E624 PolarHBondContact N-O 3.35Å; R611-E624 IonicContact NE-OE1 2.73Å; R611-E624 PolarHBondContact NE-OE1 3.09Å; R611-E624 IonicContact NE-OE2 3.14Å; R611-E624 PolarHBondContact NE-OE2 3.42Å; R611-E624 IonicContact NH2-OE1 3.08Å; R611-E624 PolarHBondContact NH2-OE1 3.07Å; R611-E624 IonicContact NH2-OE2 2.69Å; R611-E624 PolarHBondContact NH2-OE2 3.44Å; R611-E624 PolarHBondContact O-N 3.18Å; E624-F658 HydrophobicContact CB-CE2 4.27Å; E624-F658 WeakPolarHBondContact OE1-CE2 3.44Å
625	F	91.4	Very high	87.1	Confident	3 Å²	3	23.6 Å²	23.6	1%	0.013	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	148.2	165.6	-80.2	-99.6	0	0	0	110.4	T583 I585 F603 L609 I623 E627 E630 A631 A634	T583-F625 PolarHBondContact O-N 2.77Å; I585-F625 HydrophobicContact CD1-CD2 4.25Å; I585-F625 HydrophobicContact CD1-CE2 3.95Å; F603-F625 HydrophobicContact CB-CZ 4.15Å; F603-F625 AromaticContact CD1-CE2 3.92Å; F603-F625 HydrophobicContact CD1-CE2 3.92Å; F603-F625 AromaticContact CD1-CZ 3.88Å; F603-F625 HydrophobicContact CD1-CZ 3.88Å; L609-F625 HydrophobicContact CD2-CD1 3.86Å; L609-F625 HydrophobicContact CD2-CD2 4.32Å; L609-F625 HydrophobicContact CD2-CE1 3.47Å; L609-F625 VanDerWaalsContact CD2-CE1 3.47Å; L609-F625 HydrophobicContact CD2-CE2 3.97Å; L609-F625 HydrophobicContact CD2-CG 4.26Å; L609-F625 HydrophobicContact CD2-CZ 3.53Å; I623-F625 HydrophobicContact CG2-CD2 4.15Å; I623-F625 HydrophobicContact CG2-CE2 3.85Å; F625-E627 VanDerWaalsContact C-N 3.27Å; F625-E627 PolarHBondContact O-N 2.9Å; F625-E630 HydrophobicContact CD1-CB 4.19Å; F625-A631 HydrophobicContact CB-CB 3.83Å; F625-A631 HydrophobicContact CD2-CB 3.9Å; F625-A631 HydrophobicContact CG-CB 3.86Å; F625-A634 HydrophobicContact CE1-CB 4.08Å; F625-A634 HydrophobicContact CE2-CB 3.94Å; F625-A634 HydrophobicContact CZ-CB 3.43Å; F625-A634 VanDerWaalsContact CZ-CB 3.43Å
626	L	88	Confident	87	Confident	107 Å²	107	26.1 Å²	26.1	56%	0.56	15%	0.145	S	C	*	.	S	Bend	trans	-67.7	-29.3	170.9	-72.9	160.2	0	0	0	112.3	S608	S608-L626 PolarHBondContact O-N 3.03Å
627	E	85.4	Confident	87.1	Confident	58 Å²	58	28.7 Å²	28.7	27%	0.271	14%	0.143	S	C	.	.			trans	-126.5	123.4	-171	-81.7	-70.2	172.8	0	0	112	I429 F625 T629 E630 A631	I429-E627 WeakPolarHBondContact CD1-OE2 3.5Å; F625-E627 VanDerWaalsContact C-N 3.27Å; F625-E627 PolarHBondContact O-N 2.9Å; E627-T629 PolarHBondContact O-N 2.83Å; E627-E630 HydrophobicContact CB-CB 4.09Å; E627-E630 HydrophobicContact CB-CG 3.68Å; E627-E630 PolarHBondContact O-N 2.94Å; E627-E630 VanDerWaalsContact O-N 3.12Å; E627-A631 PolarHBondContact O-N 3.06Å
628	P	86.1	Confident	87.6	Confident	25 Å²	25	28.6 Å²	28.6	16%	0.162	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-28.4	-176.7	26	-34.2	0	0	0	112.6	T582 T583 E630 A631 K632	T582-P628 VanDerWaalsContact O-CA 3.31Å; T582-P628 WeakPolarHBondContact O-CA 3.22Å; T582-P628 WeakPolarHBondContact O-CB 3.43Å; T583-P628 HydrophobicContact CG2-CB 3.87Å; T583-P628 HydrophobicContact CG2-CG 4.4Å; P628-E630 VanDerWaalsContact C-N 3.3Å; P628-E630 PolarHBondContact O-N 3.31Å; P628-A631 PolarHBondContact O-N 3.32Å; P628-K632 WeakPolarHBondContact O-CB 3.11Å; P628-K632 WeakPolarHBondContact O-CD 3.42Å; P628-K632 WeakPolarHBondContact O-CG 3.21Å; P628-K632 PolarHBondContact O-N 2.86Å
629	T	83.1	Confident	87.8	Confident	9 Å²	9	28.5 Å²	28.5	6%	0.055	14%	0.14	C	C	.	.	H	α-helix	trans	-72.1	-27.1	178.2	69.5	0	0	0	0	112.3	F427 I429 E627 R633	F427-T629 HydrophobicContact CB-CG2 4.36Å; F427-T629 WeakPolarHBondContact O-CG2 3.49Å; I429-T629 HydrophobicContact CD1-CG2 4.35Å; E627-T629 PolarHBondContact O-N 2.83Å; T629-R633 WeakPolarHBondContact O-CB 3.37Å; T629-R633 PolarHBondContact O-N 2.86Å
630	E	87.8	Confident	87.8	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-82.6	-37.4	174.9	-52.5	-156.4	128.9	0	0	111.2	N431 K434 G607 S608 F625 E627 P628 R633 A634	N431-E630 PolarHBondContact OD1-OE1 2.86Å; K434-E630 IonicContact NZ-OE1 3.72Å; K434-E630 PolarHBondContact NZ-OE1 3.05Å; K434-E630 IonicContact NZ-OE2 3.51Å; K434-E630 PolarHBondContact NZ-OE2 3.42Å; G607-E630 WeakPolarHBondContact CA-OE2 3.41Å; S608-E630 PolarHBondContact N-OE2 3.25Å; F625-E630 HydrophobicContact CD1-CB 4.19Å; E627-E630 HydrophobicContact CB-CB 4.09Å; E627-E630 HydrophobicContact CB-CG 3.68Å; E627-E630 PolarHBondContact O-N 2.94Å; E627-E630 VanDerWaalsContact O-N 3.12Å; P628-E630 VanDerWaalsContact C-N 3.3Å; P628-E630 PolarHBondContact O-N 3.31Å; E630-R633 VanDerWaalsContact CG-NH2 3.33Å; E630-R633 WeakPolarHBondContact O-CB 3.3Å; E630-R633 PolarHBondContact O-N 3.06Å; E630-R633 IonicContact OE1-CZ 3.34Å; E630-R633 IonicContact OE1-NH1 2.76Å; E630-R633 IonicContact OE1-NH2 3.83Å; E630-R633 PolarHBondContact OE1-NH2 3.44Å; E630-A634 WeakPolarHBondContact O-CB 3.35Å; E630-A634 PolarHBondContact O-N 2.86Å
631	A	89.3	Confident	87.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.3	-49.3	168.8	0	0	0	0	0	111.8	T582 I585 F625 E627 P628 R633 A634 F635 W652	T582-A631 WeakPolarHBondContact O-CB 3.48Å; I585-A631 HydrophobicContact CD1-CB 4.38Å; F625-A631 HydrophobicContact CB-CB 3.83Å; F625-A631 HydrophobicContact CD2-CB 3.9Å; F625-A631 HydrophobicContact CG-CB 3.86Å; E627-A631 PolarHBondContact O-N 3.06Å; P628-A631 PolarHBondContact O-N 3.32Å; A631-R633 PolarHBondContact O-N 3.42Å; A631-A634 PolarHBondContact O-N 2.92Å; A631-A634 VanDerWaalsContact O-N 3.16Å; A631-F635 WeakPolarHBondContact O-CB 3.37Å; A631-F635 PolarHBondContact O-N 3.31Å; A631-W652 HydrophobicContact CB-CH2 3.64Å; A631-W652 HydrophobicContact CB-CZ3 3.81Å
632	K	85.9	Confident	87.6	Confident	43 Å²	43	39.7 Å²	39.7	19%	0.187	19%	0.19	C	C	.	.	H	α-helix	trans	-54.8	-41.7	176.3	-72.8	164.2	-170.2	173	0	110.9	E409 I425 P628 A636 W652	E409-K632 IonicContact OE1-NZ 3.71Å; E409-K632 PolarHBondContact OE1-NZ 3.48Å; E409-K632 IonicContact OE2-NZ 3.75Å; E409-K632 PolarHBondContact OE2-NZ 3.46Å; I425-K632 PolarHBondContact O-NZ 3.06Å; P628-K632 WeakPolarHBondContact O-CB 3.11Å; P628-K632 WeakPolarHBondContact O-CD 3.42Å; P628-K632 WeakPolarHBondContact O-CG 3.21Å; P628-K632 PolarHBondContact O-N 2.86Å; K632-A636 WeakPolarHBondContact O-CB 3.29Å; K632-A636 PolarHBondContact O-N 3.13Å; K632-A636 VanDerWaalsContact O-N 3.11Å; K632-W652 HydrophobicContact CG-CH2 4.29Å; K632-W652 HydrophobicContact CG-CZ2 4.29Å
633	R	86.2	Confident	87.4	Confident	72 Å²	72	40.5 Å²	40.5	27%	0.272	19%	0.193	S	C	.	.	H	α-helix	trans	-68.4	-42	177.2	177.8	174.4	67.7	-146	14	113.1	H606 T629 E630 A631 R637	H606-R633 PolarHBondContact O-NE 3.39Å; H606-R633 PolarHBondContact O-NH2 2.7Å; T629-R633 WeakPolarHBondContact O-CB 3.37Å; T629-R633 PolarHBondContact O-N 2.86Å; E630-R633 VanDerWaalsContact CG-NH2 3.33Å; E630-R633 WeakPolarHBondContact O-CB 3.3Å; E630-R633 PolarHBondContact O-N 3.06Å; E630-R633 IonicContact OE1-CZ 3.34Å; E630-R633 IonicContact OE1-NH1 2.76Å; E630-R633 IonicContact OE1-NH2 3.83Å; E630-R633 PolarHBondContact OE1-NH2 3.44Å; A631-R633 PolarHBondContact O-N 3.42Å; R633-R637 WeakPolarHBondContact O-CG 3.4Å; R633-R637 PolarHBondContact O-N 2.78Å
634	A	90	Very high	87.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-49.4	175.3	0	0	0	0	0	111.1	I585 F603 H606 F625 E630 A631 A636 R637 L638	I585-A634 HydrophobicContact CD1-CB 4.4Å; F603-A634 HydrophobicContact CD1-CB 4.4Å; H606-A634 HydrophobicContact CB-CB 3.63Å; F625-A634 HydrophobicContact CE1-CB 4.08Å; F625-A634 HydrophobicContact CE2-CB 3.94Å; F625-A634 HydrophobicContact CZ-CB 3.43Å; F625-A634 VanDerWaalsContact CZ-CB 3.43Å; E630-A634 WeakPolarHBondContact O-CB 3.35Å; E630-A634 PolarHBondContact O-N 2.86Å; A631-A634 PolarHBondContact O-N 2.92Å; A631-A634 VanDerWaalsContact O-N 3.16Å; A634-A636 PolarHBondContact O-N 3.44Å; A634-R637 PolarHBondContact O-N 3.42Å; A634-L638 WeakPolarHBondContact O-CB 3.49Å; A634-L638 PolarHBondContact O-N 2.88Å
635	F	89.3	Confident	86.8	Confident	16 Å²	16	50.5 Å²	50.5	7%	0.07	24%	0.24	C	C	.	.	H	α-helix	trans	-55.6	-50.6	178.4	-170.6	-85.5	0	0	0	111.9	I585 A631 R637 A639 L650 W652	I585-F635 HydrophobicContact CD1-CB 4.02Å; I585-F635 HydrophobicContact CD1-CD2 4.35Å; I585-F635 HydrophobicContact CG1-CD2 4.47Å; I585-F635 HydrophobicContact CG2-CD2 4.35Å; A631-F635 WeakPolarHBondContact O-CB 3.37Å; A631-F635 PolarHBondContact O-N 3.31Å; F635-R637 VanDerWaalsContact C-N 3.29Å; F635-R637 PolarHBondContact O-N 2.85Å; F635-A639 WeakPolarHBondContact O-CB 3.36Å; F635-A639 PolarHBondContact O-N 3.31Å; F635-L650 HydrophobicContact CD2-CB 3.81Å; F635-L650 HydrophobicContact CD2-CD1 4.45Å; F635-L650 HydrophobicContact CE2-CB 3.67Å; F635-L650 WeakPolarHBondContact CE2-O 3.23Å; F635-L650 HydrophobicContact CZ-CB 4.43Å; F635-W652 HydrophobicContact CB-CH2 4.34Å; F635-W652 HydrophobicContact CB-CZ2 3.74Å; F635-W652 HydrophobicContact CD1-CZ2 4.47Å; F635-W652 AromaticContact CD1-NE1 3.81Å; F635-W652 HydrophobicContact CD2-CD2 4.23Å; F635-W652 AromaticContact CD2-CE2 3.72Å; F635-W652 HydrophobicContact CD2-CG 4.48Å; F635-W652 HydrophobicContact CD2-CZ2 4.09Å; F635-W652 AromaticContact CD2-NE1 3.63Å; F635-W652 AromaticContact CE1-NE1 3.81Å; F635-W652 AromaticContact CE2-CD1 3.73Å; F635-W652 HydrophobicContact CE2-CD2 4.45Å; F635-W652 HydrophobicContact CE2-CG 4.24Å; F635-W652 AromaticContact CE2-NE1 3.63Å; F635-W652 AromaticContact CG-CE2 3.84Å; F635-W652 AromaticContact CG-CZ2 3.86Å; F635-W652 HydrophobicContact CG-CZ2 3.86Å; F635-W652 AromaticContact CG-NE1 3.73Å; F635-W652 AromaticContact CZ-CD1 3.85Å; F635-W652 AromaticContact CZ-NE1 3.73Å
636	A	85.6	Confident	86.4	Confident	55 Å²	55	51.3 Å²	51.3	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-60.7	-35.5	-179.7	0	0	0	0	0	113.1	K501 K632 A634	K501-A636 WeakPolarHBondContact CE-O 3.07Å; K501-A636 PolarHBondContact NZ-O 3.44Å; K632-A636 WeakPolarHBondContact O-CB 3.29Å; K632-A636 PolarHBondContact O-N 3.13Å; K632-A636 VanDerWaalsContact O-N 3.11Å; A634-A636 PolarHBondContact O-N 3.44Å
637	R	86.8	Confident	86.3	Confident	146 Å²	146	48.6 Å²	48.6	55%	0.551	23%	0.234	S	C	*	.	H	α-helix	trans	-78.7	-57.8	178.2	-71.7	-179.5	171.6	-161.5	-7.7	112.1	K501 R633 A634 F635 A639	K501-R637 PolarHBondContact NZ-O 3.41Å; R633-R637 WeakPolarHBondContact O-CG 3.4Å; R633-R637 PolarHBondContact O-N 2.78Å; A634-R637 PolarHBondContact O-N 3.42Å; F635-R637 VanDerWaalsContact C-N 3.29Å; F635-R637 PolarHBondContact O-N 2.85Å; R637-A639 PolarHBondContact O-N 3.32Å
638	L	88.9	Confident	86.4	Confident	10 Å²	10	45.9 Å²	45.9	5%	0.052	22%	0.221	C	C	.	.	H	α-helix	trans	-79	-14.9	-170	-65.8	177.8	0	0	0	115	L602 F603 A634 Y640 S641 L650	L602-L638 HydrophobicContact CD1-CD2 3.85Å; L602-L638 HydrophobicContact CD2-CD1 4.46Å; L602-L638 HydrophobicContact CD2-CD2 4.46Å; L602-L638 HydrophobicContact CG-CD1 4.11Å; L602-L638 HydrophobicContact CG-CD2 4.08Å; F603-L638 HydrophobicContact CD1-CD1 3.59Å; F603-L638 HydrophobicContact CD2-CD1 4.01Å; F603-L638 HydrophobicContact CE1-CD1 3.51Å; F603-L638 HydrophobicContact CE2-CD1 3.94Å; F603-L638 HydrophobicContact CG-CD1 3.86Å; F603-L638 HydrophobicContact CZ-CD1 3.69Å; A634-L638 WeakPolarHBondContact O-CB 3.49Å; A634-L638 PolarHBondContact O-N 2.88Å; L638-Y640 PolarHBondContact O-N 3.31Å; L638-Y640 VanDerWaalsContact O-N 3.14Å; L638-S641 WeakPolarHBondContact CA-OG 3.46Å; L638-S641 PolarHBondContact O-N 2.91Å; L638-S641 PolarHBondContact O-OG 2.94Å; L638-L650 HydrophobicContact CB-CD1 3.71Å
639	A	85.6	Confident	86.5	Confident	2 Å²	2	49.1 Å²	49.1	2%	0.017	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	121.3	173.4	0	0	0	0	0	110.6	K501 F635 R637 S641 L650	K501-A639 VanDerWaalsContact CD-O 3.3Å; K501-A639 WeakPolarHBondContact CD-O 3.5Å; K501-A639 VanDerWaalsContact CE-O 3.24Å; K501-A639 WeakPolarHBondContact CE-O 3.31Å; K501-A639 PolarHBondContact NZ-O 2.84Å; F635-A639 WeakPolarHBondContact O-CB 3.36Å; F635-A639 PolarHBondContact O-N 3.31Å; R637-A639 PolarHBondContact O-N 3.32Å; A639-S641 PolarHBondContact O-N 3.03Å; A639-L650 HydrophobicContact CB-CD1 4.45Å
640	Y	82.9	Confident	86.7	Confident	63 Å²	63	49 Å²	49	25%	0.247	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	20.4	-171.7	-59.1	-86	0	0	0	115.9	N500 K501 S504 L638 L648 Y649	N500-Y640 VanDerWaalsContact C-CE2 3.41Å; N500-Y640 HydrophobicContact CB-CE1 3.97Å; N500-Y640 HydrophobicContact CB-CE2 4.05Å; N500-Y640 WeakPolarHBondContact O-CE2 3.31Å; K501-Y640 VanDerWaalsContact CA-CD2 3.46Å; K501-Y640 HydrophobicContact CB-CD2 3.77Å; K501-Y640 HydrophobicContact CB-CE2 4.37Å; K501-Y640 HydrophobicContact CG-CD2 4.23Å; S504-Y640 WeakPolarHBondContact OG-CE2 3.24Å; S504-Y640 PolarHBondContact OG-OH 3.48Å; L638-Y640 PolarHBondContact O-N 3.31Å; L638-Y640 VanDerWaalsContact O-N 3.14Å; Y640-L648 VanDerWaalsContact CA-O 3.31Å; Y640-L648 WeakPolarHBondContact CA-O 3.24Å; Y640-L648 PolarHBondContact N-O 2.84Å; Y640-Y649 AromaticContact CD1-CD1 3.83Å; Y640-Y649 HydrophobicContact CD1-CD1 3.83Å; Y640-Y649 AromaticContact CD1-CE1 3.72Å; Y640-Y649 HydrophobicContact CD1-CE1 3.72Å; Y640-Y649 AromaticContact CE1-CD1 3.49Å; Y640-Y649 HydrophobicContact CE1-CD1 3.49Å; Y640-Y649 VanDerWaalsContact CE1-CD1 3.49Å; Y640-Y649 AromaticContact CE1-CE1 3.41Å; Y640-Y649 HydrophobicContact CE1-CE1 3.41Å; Y640-Y649 VanDerWaalsContact CE1-CE1 3.41Å
641	S	86.9	Confident	86.6	Confident	33 Å²	33	50.1 Å²	50.1	23%	0.231	24%	0.235	C	C	.	.			trans	-69.7	147	162.9	62.4	0	0	0	0	110.1	L638 A639 L648	L638-S641 WeakPolarHBondContact CA-OG 3.46Å; L638-S641 PolarHBondContact O-N 2.91Å; L638-S641 PolarHBondContact O-OG 2.94Å; A639-S641 PolarHBondContact O-N 3.03Å; S641-L648 PolarHBondContact O-N 3.14Å
642	K	85.9	Confident	86.5	Confident	156 Å²	156	52.2 Å²	52.2	68%	0.678	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	124.1	173.6	-168.3	-168.1	-173.6	-127	0	109.4	H644	K642-H644 VanDerWaalsContact CE-O 3.23Å; K642-H644 WeakPolarHBondContact CE-O 3.3Å; K642-H644 PolarHBondContact NZ-O 3.48Å
643	F	87.5	Confident	86.5	Confident	21 Å²	21	50.2 Å²	50.2	9%	0.092	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.5	173.1	-177.7	-120.5	0	0	0	108.3	L590 P591 V594 E598 L599 L602 H645 V646 L648	L590-F643 HydrophobicContact CD2-CD1 3.93Å; L590-F643 HydrophobicContact CD2-CE1 3.93Å; P591-F643 HydrophobicContact CG-CD1 4.35Å; V594-F643 HydrophobicContact CG1-CE1 4.06Å; V594-F643 HydrophobicContact CG1-CZ 4.36Å; V594-F643 HydrophobicContact CG2-CE1 3.85Å; E598-F643 HydrophobicContact CB-CZ 4.26Å; L599-F643 HydrophobicContact CD2-CE1 4.46Å; L602-F643 HydrophobicContact CD1-CD2 4.48Å; L602-F643 HydrophobicContact CD2-CD2 3.77Å; L602-F643 HydrophobicContact CD2-CE2 3.97Å; L602-F643 HydrophobicContact CD2-CG 4.3Å; F643-H645 PolarHBondContact O-N 2.93Å; F643-V646 PolarHBondContact N-O 3.3Å; F643-V646 PolarHBondContact O-N 2.95Å; F643-V646 VanDerWaalsContact O-O 3.09Å; F643-L648 HydrophobicContact CB-CD1 3.88Å; F643-L648 HydrophobicContact CB-CD2 3.71Å; F643-L648 HydrophobicContact CB-CG 3.64Å; F643-L648 HydrophobicContact CD1-CD2 3.95Å; F643-L648 HydrophobicContact CG-CD1 4.35Å; F643-L648 HydrophobicContact CG-CD2 4.13Å; F643-L648 HydrophobicContact CG-CG 4.41Å
644	H	86.1	Confident	86.4	Confident	104 Å²	104	47.5 Å²	47.5	48%	0.481	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	-98.7	-161.7	-52.4	-102.2	0	0	0	112.4	E598 K642	E598-H644 IonicContact OE1-CE1 3.71Å; K642-H644 VanDerWaalsContact CE-O 3.23Å; K642-H644 WeakPolarHBondContact CE-O 3.3Å; K642-H644 PolarHBondContact NZ-O 3.48Å
645	H	83.3	Confident	85.9	Confident	137 Å²	137	51.6 Å²	51.6	63%	0.634	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-6.3	179.3	65.6	-86.6	0	0	0	114.4	F643	F643-H645 PolarHBondContact O-N 2.93Å
646	V	84.5	Confident	85.2	Confident	19 Å²	19	52.9 Å²	52.9	12%	0.115	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.9	-166.6	-171.6	0	0	0	0	111.4	N589 P591 F643	N589-V646 WeakPolarHBondContact ND2-CG1 3.49Å; N589-V646 WeakPolarHBondContact O-CG1 3.45Å; P591-V646 HydrophobicContact CB-CG2 4.04Å; P591-V646 HydrophobicContact CG-CG2 4.4Å; F643-V646 PolarHBondContact N-O 3.3Å; F643-V646 PolarHBondContact O-N 2.95Å; F643-V646 VanDerWaalsContact O-O 3.09Å
647	P	86.2	Confident	84.8	Confident	51 Å²	51	50.5 Å²	50.5	33%	0.331	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	129.9	171.9	30.9	-33.7	0	0	0	111.7	N589 Y649	N589-P647 PolarHBondContact ND2-O 3.26Å; P647-Y649 HydrophobicContact CB-CE1 4.16Å; P647-Y649 HydrophobicContact CG-CE1 3.96Å
648	L	87.6	Confident	84.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.229	C	C	.	.			trans	-72.7	132.8	176.4	-65.5	-178.8	0	0	0	112	V587 L590 L602 Y640 S641 F643	V587-L648 HydrophobicContact CG1-CD2 4.27Å; L590-L648 HydrophobicContact CD2-CD2 3.61Å; L602-L648 HydrophobicContact CD2-CD1 3.63Å; Y640-L648 VanDerWaalsContact CA-O 3.31Å; Y640-L648 WeakPolarHBondContact CA-O 3.24Å; Y640-L648 PolarHBondContact N-O 2.84Å; S641-L648 PolarHBondContact O-N 3.14Å; F643-L648 HydrophobicContact CB-CD1 3.88Å; F643-L648 HydrophobicContact CB-CD2 3.71Å; F643-L648 HydrophobicContact CB-CG 3.64Å; F643-L648 HydrophobicContact CD1-CD2 3.95Å; F643-L648 HydrophobicContact CG-CD1 4.35Å; F643-L648 HydrophobicContact CG-CD2 4.13Å; F643-L648 HydrophobicContact CG-CG 4.41Å
649	Y	86.6	Confident	83.7	Confident	94 Å²	94	49.8 Å²	49.8	37%	0.369	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	117.6	170.2	-54.3	-30.3	0	0	0	108.9	K588 N589 Y640 P647	K588-Y649 PolarHBondContact N-O 2.76Å; K588-Y649 PolarHBondContact O-N 3.02Å; K588-Y649 VanDerWaalsContact O-N 3.09Å; N589-Y649 HydrophobicContact CB-CD2 3.44Å; N589-Y649 VanDerWaalsContact CB-CD2 3.44Å; N589-Y649 HydrophobicContact CB-CE2 3.7Å; N589-Y649 HydrophobicContact CB-CG 4.08Å; N589-Y649 WeakPolarHBondContact ND2-CE2 3.17Å; Y640-Y649 AromaticContact CD1-CD1 3.83Å; Y640-Y649 HydrophobicContact CD1-CD1 3.83Å; Y640-Y649 AromaticContact CD1-CE1 3.72Å; Y640-Y649 HydrophobicContact CD1-CE1 3.72Å; Y640-Y649 AromaticContact CE1-CD1 3.49Å; Y640-Y649 HydrophobicContact CE1-CD1 3.49Å; Y640-Y649 VanDerWaalsContact CE1-CD1 3.49Å; Y640-Y649 AromaticContact CE1-CE1 3.41Å; Y640-Y649 HydrophobicContact CE1-CE1 3.41Å; Y640-Y649 VanDerWaalsContact CE1-CE1 3.41Å; P647-Y649 HydrophobicContact CB-CE1 4.16Å; P647-Y649 HydrophobicContact CG-CE1 3.96Å
650	L	87.8	Confident	82.5	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.3	178.6	-55.7	-173.4	0	0	0	110	I585 V587 F603 F635 L638 A639	I585-L650 HydrophobicContact CG2-CB 4.08Å; I585-L650 HydrophobicContact CG2-CD1 4.38Å; I585-L650 HydrophobicContact CG2-CD2 4.11Å; I585-L650 HydrophobicContact CG2-CG 4.42Å; V587-L650 HydrophobicContact CB-CD2 4.14Å; V587-L650 HydrophobicContact CG1-CD2 3.86Å; V587-L650 HydrophobicContact CG2-CD2 3.96Å; F603-L650 HydrophobicContact CE1-CD1 4.46Å; F603-L650 HydrophobicContact CZ-CD2 4.05Å; F635-L650 HydrophobicContact CD2-CB 3.81Å; F635-L650 HydrophobicContact CD2-CD1 4.45Å; F635-L650 HydrophobicContact CE2-CB 3.67Å; F635-L650 WeakPolarHBondContact CE2-O 3.23Å; F635-L650 HydrophobicContact CZ-CB 4.43Å; L638-L650 HydrophobicContact CB-CD1 3.71Å; A639-L650 HydrophobicContact CB-CD1 4.45Å
651	E	85.7	Confident	81.4	Confident	25 Å²	25	53.4 Å²	53.4	12%	0.117	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.5	173	-174.8	171.4	-170.8	0	0	109.7	W510 R580 L586 K588 A653	W510-E651 PolarHBondContact N-OE1 3.46Å; R580-E651 IonicContact CZ-OE1 3.15Å; R580-E651 IonicContact NE-OE1 3.61Å; R580-E651 IonicContact NH2-OE1 2.66Å; R580-E651 PolarHBondContact NH2-OE1 2.92Å; L586-E651 PolarHBondContact N-O 2.92Å; L586-E651 PolarHBondContact O-N 3.35Å; K588-E651 IonicContact NZ-OE2 2.69Å; K588-E651 PolarHBondContact NZ-OE2 3.09Å; E651-A653 PolarHBondContact O-N 2.9Å
652	W	87.3	Confident	80	Confident	44 Å²	44	57 Å²	57	17%	0.167	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124	171.8	-68.8	105.6	0	0	0	110.3	R580 S581 T582 I585 A631 K632 F635	R580-W652 HydrophobicContact CB-CB 4.06Å; R580-W652 WeakPolarHBondContact CD-O 3.5Å; R580-W652 HydrophobicContact CG-CB 4.4Å; R580-W652 PolarHBondContact NE-O 3.09Å; S581-W652 VanDerWaalsContact O-CE3 3.3Å; T582-W652 WeakPolarHBondContact O-CH2 3.37Å; T582-W652 VanDerWaalsContact O-CZ3 3.22Å; T582-W652 WeakPolarHBondContact O-CZ3 3.29Å; I585-W652 HydrophobicContact CD1-CH2 4.35Å; I585-W652 HydrophobicContact CD1-CZ3 4.29Å; I585-W652 HydrophobicContact CG1-CE3 3.98Å; I585-W652 HydrophobicContact CG1-CH2 4.25Å; I585-W652 HydrophobicContact CG1-CZ3 3.72Å; A631-W652 HydrophobicContact CB-CH2 3.64Å; A631-W652 HydrophobicContact CB-CZ3 3.81Å; K632-W652 HydrophobicContact CG-CH2 4.29Å; K632-W652 HydrophobicContact CG-CZ2 4.29Å; F635-W652 HydrophobicContact CB-CH2 4.34Å; F635-W652 HydrophobicContact CB-CZ2 3.74Å; F635-W652 HydrophobicContact CD1-CZ2 4.47Å; F635-W652 AromaticContact CD1-NE1 3.81Å; F635-W652 HydrophobicContact CD2-CD2 4.23Å; F635-W652 AromaticContact CD2-CE2 3.72Å; F635-W652 HydrophobicContact CD2-CG 4.48Å; F635-W652 HydrophobicContact CD2-CZ2 4.09Å; F635-W652 AromaticContact CD2-NE1 3.63Å; F635-W652 AromaticContact CE1-NE1 3.81Å; F635-W652 AromaticContact CE2-CD1 3.73Å; F635-W652 HydrophobicContact CE2-CD2 4.45Å; F635-W652 HydrophobicContact CE2-CG 4.24Å; F635-W652 AromaticContact CE2-NE1 3.63Å; F635-W652 AromaticContact CG-CE2 3.84Å; F635-W652 AromaticContact CG-CZ2 3.86Å; F635-W652 HydrophobicContact CG-CZ2 3.86Å; F635-W652 AromaticContact CG-NE1 3.73Å; F635-W652 AromaticContact CZ-CD1 3.85Å; F635-W652 AromaticContact CZ-NE1 3.73Å
653	A	86.2	Confident	78.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.008	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	155.2	179.6	0	0	0	0	0	110.9	F573 S581 V584 L586 E651 V657	F573-A653 HydrophobicContact CE1-CB 4.38Å; S581-A653 WeakPolarHBondContact CB-O 3.36Å; S581-A653 PolarHBondContact N-O 2.73Å; S581-A653 PolarHBondContact OG-O 3.46Å; V584-A653 HydrophobicContact CB-CB 4.1Å; V584-A653 HydrophobicContact CG1-CB 3.84Å; V584-A653 WeakPolarHBondContact O-CB 2.98Å; V584-A653 PolarHBondContact O-N 2.81Å; L586-A653 HydrophobicContact CB-CB 4.46Å; E651-A653 PolarHBondContact O-N 2.9Å; A653-V657 HydrophobicContact CB-CG2 3.77Å
654	P	83.1	Confident	75.7	Confident	15 Å²	15	61.5 Å²	61.5	10%	0.097	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	163	178.9	22.8	-31.1	0	0	0	112.8	F573 A578 V657	F573-P654 HydrophobicContact CD1-CG 4.13Å; F573-P654 HydrophobicContact CD2-CG 4.49Å; F573-P654 HydrophobicContact CE1-CG 4.23Å; F573-P654 HydrophobicContact CG-CG 4.28Å; F573-P654 HydrophobicContact CZ-CG 4.46Å; A578-P654 HydrophobicContact CB-CB 4.22Å; P654-V657 HydrophobicContact CG-CG2 3.79Å; P654-V657 WeakPolarHBondContact O-CG2 3.47Å
655	V	80.1	Confident	73.4	Confident	86 Å²	86	62.7 Å²	62.7	52%	0.521	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	143.6	163.5	177	0	0	0	0	108.5	V579	V579-V655 HydrophobicContact CB-CG2 4.13Å; V579-V655 HydrophobicContact CG1-CG2 3.91Å; V579-V655 PolarHBondContact O-N 3.16Å
656	G	74.6	Confident	71.1	Confident	44 Å²	44	63.9 Å²	63.9	45%	0.454	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	38.5	-176	0	0	0	0	0	113.6	S572	S572-G656 PolarHBondContact OG-O 2.89Å
657	V	77.6	Confident	68.7	Low	4 Å²	4	72.6 Å²	72.6	2%	0.024	41%	0.406	C	S	.	.			trans	-68.2	-43.4	169.9	164.1	0	0	0	0	111	V568 C569 F573 I622 A653 P654	V568-V657 CarbonylContact C-O 3.48Å; V568-V657 VanDerWaalsContact CA-O 3.26Å; V568-V657 WeakPolarHBondContact CA-O 3.31Å; V568-V657 HydrophobicContact CG1-CG1 3.96Å; V568-V657 HydrophobicContact CG2-CG1 4.5Å; C569-V657 PolarHBondContact N-O 3.37Å; F573-V657 HydrophobicContact CE2-CG1 4.26Å; F573-V657 HydrophobicContact CE2-CG2 4.1Å; F573-V657 HydrophobicContact CZ-CG1 4.07Å; F573-V657 HydrophobicContact CZ-CG2 3.77Å; I622-V657 HydrophobicContact CD1-CG1 4.44Å; A653-V657 HydrophobicContact CB-CG2 3.77Å; P654-V657 HydrophobicContact CG-CG2 3.79Å; P654-V657 WeakPolarHBondContact O-CG2 3.47Å
658	F	81.9	Confident	66.1	Low	33 Å²	33	77.8 Å²	77.8	15%	0.145	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-98.9	131	-179.2	-56.4	-65.2	0	0	0	110.6	V568 V584 R611 L613 I622 E624 A660	V568-F658 HydrophobicContact CG2-CD1 3.91Å; V568-F658 HydrophobicContact CG2-CE1 3.79Å; V584-F658 HydrophobicContact CG1-CE2 4.36Å; V584-F658 HydrophobicContact CG2-CE2 4.05Å; R611-F658 VanDerWaalsContact NH2-CD2 3.33Å; L613-F658 HydrophobicContact CD1-CE1 3.77Å; L613-F658 HydrophobicContact CD1-CZ 4.45Å; I622-F658 HydrophobicContact CG2-CZ 4.05Å; E624-F658 HydrophobicContact CB-CE2 4.27Å; E624-F658 WeakPolarHBondContact OE1-CE2 3.44Å; F658-A660 VanDerWaalsContact C-N 3.33Å
659	T	70.1	Confident	63.3	Low	108 Å²	108	86.2 Å²	86.2	66%	0.663	46%	0.463	S	S	*	.	S	Bend	trans	-82.9	-15.3	178.2	-38.7	0	0	0	0	111.9	S567	S567-T659 WeakPolarHBondContact O-CB 3.5Å; S567-T659 PolarHBondContact O-N 3.1Å; S567-T659 PolarHBondContact O-OG1 3.18Å
660	A	60.9	Low	60.4	Low	51 Å²	51	87.7 Å²	87.7	42%	0.421	48%	0.482	S	S	.	.	S	Bend	trans	-130.2	150.4	178.6	0	0	0	0	0	111.4	R611 F658	R611-A660 PolarHBondContact NH1-O 3.21Å; F658-A660 VanDerWaalsContact C-N 3.33Å
661	A	59.1	Low	57.5	Low	90 Å²	90	93.1 Å²	93.1	74%	0.744	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-58.6	167	166.2	0	0	0	0	0	111.2
662	K	57.1	Low	54.6	Low	108 Å²	108	99.7 Å²	99.7	47%	0.47	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-57.8	127.5	-175.4	-178	178	178.7	177	0	110.9	G610 E664	G610-K662 PolarHBondContact O-NZ 3.06Å; K662-E664 PolarHBondContact O-N 2.92Å
663	P	46.8	Very low	51.7	Low	91 Å²	91	107.4 Å²	107.4	59%	0.591	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-66.9	120.6	165.6	28.3	-32	0	0	0	108.4
664	E	38.2	Very low	48.8	Very low	182 Å²	182	114.8 Å²	114.8	85%	0.85	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-69.6	135.3	172.7	-61	-156.5	136.6	0	0	109.5	K662 D666	K662-E664 PolarHBondContact O-N 2.92Å; E664-D666 PolarHBondContact O-N 3.12Å; E664-D666 VanDerWaalsContact O-N 3.13Å
665	T	36.3	Very low	46	Very low	129 Å²	129	122.3 Å²	122.3	79%	0.791	65%	0.651	S	S	*	*			trans	-84.3	92.7	-173.3	50.8	0	0	0	0	110.5	K667	T665-K667 PolarHBondContact O-N 3.2Å
666	D	35.3	Very low	43.4	Very low	162 Å²	162	128 Å²	128	87%	0.866	67%	0.669	S	S	*	*			trans	-53.2	120.8	174.4	-100.6	-46.3	0	0	0	112.5	E664	E664-D666 PolarHBondContact O-N 3.12Å; E664-D666 VanDerWaalsContact O-N 3.13Å
667	K	34.3	Very low	40.9	Very low	201 Å²	201	134 Å²	134	87%	0.874	68%	0.682	S	S	*	*			trans	-138.2	104.5	156.1	-73.9	-167.9	177.2	177.7	0	108.8	T665	T665-K667 PolarHBondContact O-N 3.2Å
668	E	32.1	Very low	38.4	Very low	161 Å²	161	140.5 Å²	140.5	75%	0.752	71%	0.712	S	S	*	*			trans	-10.3	143.8	172.5	-36.9	-177.9	147.9	0	0	117.9
669	K	28.1	Very low	35.8	Very low	177 Å²	177	147 Å²	147	77%	0.77	74%	0.743	S	S	*	*			cis	-153.3	149.2	47.7	-80.3	178.8	179	172.6	0	116.2
670	T	25.3	Very low	33.6	Very low	125 Å²	125	150 Å²	150	77%	0.767	76%	0.755	S	S	*	*			trans	-34.3	133.9	160.8	54.7	0	0	0	0	116.9
671	V	27.6	Very low	31.9	Very low	118 Å²	118	156.8 Å²	156.8	72%	0.715	78%	0.778	S	S	*	*				165.3	100.5	108.5	163.9	0	0	0	0	110.2
672	N	25	Very low	30.4	Very low	164 Å²	164	160.5 Å²	160.5	88%	0.877	78%	0.78	S	S	*	*				176.7	127	121.8	-102.8	-29	0	0	0	110.1
673	K	27	Very low	28.9	Very low	206 Å²	206	163 Å²	163	90%	0.896	79%	0.793	S	S	*	*			trans	-130.2	87.8	179.6	-176.7	-177.3	-179.9	175.2	0	110.1
674	E	24.6	Very low	28	Very low	156 Å²	156	167.6 Å²	167.6	73%	0.729	81%	0.807	S	S	*	*			trans	-164.8	146.8	157.2	-121.1	-175.3	-129.7	0	0	113.2
675	K	25	Very low	27.4	Very low	172 Å²	172	168.2 Å²	168.2	75%	0.748	81%	0.81	S	S	*	*			trans	54.8	101.7	167.1	-55.2	-173.7	178.3	82.6	0	115.9
676	K	24.2	Very low	27	Very low	206 Å²	206	169 Å²	169	90%	0.896	81%	0.81	S	S	*	*				-145.6	155.5	74.2	-98.9	-174.8	169.9	-166	0	114.5
677	K	23.4	Very low	27.2	Very low	169 Å²	169	170.5 Å²	170.5	74%	0.735	81%	0.811	S	S	*	*			trans	-97.1	173.5	152.9	-74.4	-179	155.8	-158.2	0	108.8
678	E	25.2	Very low	27.5	Very low	141 Å²	141	166.2 Å²	166.2	66%	0.659	79%	0.794	S	S	*	*			trans	66.4	133.2	166	-65.5	118.5	-141.5	0	0	113.8
679	E	25.5	Very low	28.3	Very low	171 Å²	171	167.3 Å²	167.3	80%	0.799	80%	0.799	S	S	*	*			cis	-155.5	148.3	-0	-103.7	153.6	172.5	0	0	108
680	D	24.3	Very low	29.5	Very low	169 Å²	169	161.7 Å²	161.7	90%	0.904	79%	0.786	S	S	*	*			trans	165.9	99.6	139.9	-92.2	-17.8	0	0	0	109.8
681	E	26	Very low	31.2	Very low	194 Å²	194	159.7 Å²	159.7	91%	0.907	77%	0.773	S	S	*	*			trans	-109.8	116.9	162.7	-68.9	179.3	152.7	0	0	107.2
682	Q	26.4	Very low	33	Very low	168 Å²	168	158.8 Å²	158.8	79%	0.785	77%	0.77	S	S	*	*			trans	170.8	137.7	161.1	-101.3	-177.6	-36.7	0	0	108.2
683	E	27.1	Very low	35.3	Very low	160 Å²	160	152 Å²	152	75%	0.748	74%	0.739	S	S	*	*			cis	-158	110.4	-6.5	-142.9	160.7	-131.5	0	0	106.7
684	E	26.6	Very low	37.9	Very low	189 Å²	189	142.3 Å²	142.3	88%	0.883	70%	0.697	S	S	*	*			trans	-101.3	125.2	168.5	-72.6	-165.1	155.5	0	0	108.6	D686	E684-D686 PolarHBondContact O-N 3Å
685	E	26.7	Very low	40.9	Very low	195 Å²	195	136.3 Å²	136.3	91%	0.911	67%	0.671	S	S	*	*			trans	-76.7	91.1	178.5	-70.7	-169.1	126.3	0	0	110.8	E687	E685-E687 PolarHBondContact O-N 3.48Å; E685-E687 VanDerWaalsContact O-N 3.16Å
686	D	28.6	Very low	44	Very low	146 Å²	146	128.1 Å²	128.1	78%	0.781	64%	0.635	S	S	*	*			trans	-56.3	114	172.9	-96.9	-43.6	0	0	0	111.9	E684 E688	E684-D686 PolarHBondContact O-N 3Å; D686-E688 PolarHBondContact O-N 3.15Å
687	E	38.5	Very low	47.1	Very low	193 Å²	193	120.6 Å²	120.6	90%	0.902	60%	0.603	S	S	*	*			trans	-70	70.2	160.1	-79.4	-153.7	124.1	0	0	110	E685 E689	E685-E687 PolarHBondContact O-N 3.48Å; E685-E687 VanDerWaalsContact O-N 3.16Å; E687-E689 PolarHBondContact O-N 3.4Å
688	E	40.1	Very low	50.3	Low	111 Å²	111	112.5 Å²	112.5	52%	0.519	57%	0.568	S	S	.	*			trans	-48	114.4	176.1	-81.5	-169	132.6	0	0	110.9	D686 A690 K721 Q746	D686-E688 PolarHBondContact O-N 3.15Å; E688-A690 PolarHBondContact O-N 3.01Å; E688-K721 PolarHBondContact O-NZ 2.89Å; E688-K721 IonicContact OE2-NZ 2.65Å; E688-Q746 PolarHBondContact OE2-NE2 2.69Å
689	E	49.5	Very low	53.3	Low	184 Å²	184	110.1 Å²	110.1	86%	0.86	56%	0.555	S	S	*	*			trans	-52.3	137	178.2	-81	-151.9	148.3	0	0	110.9	E687 V691	E687-E689 PolarHBondContact O-N 3.4Å; E689-V691 PolarHBondContact O-N 3.41Å
690	A	54.1	Low	56.2	Low	58 Å²	58	106 Å²	106	48%	0.479	54%	0.538	S	S	.	.			trans	-68.1	88.6	-175.2	0	0	0	0	0	112.3	E688	E688-A690 PolarHBondContact O-N 3.01Å
691	V	60.2	Low	59.3	Low	83 Å²	83	98.1 Å²	98.1	50%	0.503	50%	0.496	S	S	.	.			trans	-47.3	123.1	-177.7	-175.2	0	0	0	0	110.9	E689 G693 S694 V748	E689-V691 PolarHBondContact O-N 3.41Å; V691-G693 PolarHBondContact O-N 2.92Å; V691-G693 VanDerWaalsContact O-N 3.13Å; V691-S694 WeakPolarHBondContact O-CB 3.11Å; V691-S694 PolarHBondContact O-N 3.11Å; V691-S694 VanDerWaalsContact O-N 3.07Å; V691-S694 PolarHBondContact O-OG 3.38Å; V691-V748 HydrophobicContact CB-CG2 4.26Å; V691-V748 HydrophobicContact CG1-CG2 3.77Å
692	P	65.6	Low	62.1	Low	99 Å²	99	90.4 Å²	90.4	64%	0.643	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	117.4	-174	24.2	-33.7	0	0	0	111
693	G	71.9	Confident	64.9	Low	22 Å²	22	88.6 Å²	88.6	23%	0.227	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	114.9	-12.1	-174.8	0	0	0	0	0	114.7	V691 T695	V691-G693 PolarHBondContact O-N 2.92Å; V691-G693 VanDerWaalsContact O-N 3.13Å; G693-T695 VanDerWaalsContact C-N 3.31Å; G693-T695 PolarHBondContact O-N 3.31Å
694	S	82.9	Confident	67.5	Low	3 Å²	3	85 Å²	85	2%	0.021	44%	0.444	C	S	.	.			trans	-69.4	-23.3	174.5	56.5	0	0	0	0	114.3	V691 Y745	V691-S694 WeakPolarHBondContact O-CB 3.11Å; V691-S694 PolarHBondContact O-N 3.11Å; V691-S694 VanDerWaalsContact O-N 3.07Å; V691-S694 PolarHBondContact O-OG 3.38Å; S694-Y745 PolarHBondContact O-N 2.61Å; S694-Y745 VanDerWaalsContact O-N 3.08Å
695	T	88.3	Confident	70.2	Confident	29 Å²	29	76.4 Å²	76.4	18%	0.178	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.6	-177.2	-47.8	0	0	0	0	112.5	G693 F742 Q744 S773	G693-T695 VanDerWaalsContact C-N 3.31Å; G693-T695 PolarHBondContact O-N 3.31Å; T695-F742 HydrophobicContact CG2-CB 4.42Å; T695-Q744 HydrophobicContact CG2-CB 4.4Å; T695-S773 WeakPolarHBondContact O-CB 3.46Å; T695-S773 PolarHBondContact O-N 2.78Å
696	L	88.8	Confident	73	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	154.4	170	-56.9	-176.9	0	0	0	111.6	F714 F742 V743 Y745 A751 A754 V770 K771 I772	L696-F714 HydrophobicContact CD1-CE1 4.48Å; L696-F742 VanDerWaalsContact O-CA 3.29Å; L696-F742 WeakPolarHBondContact O-CA 3.01Å; L696-V743 PolarHBondContact N-O 3.16Å; L696-V743 PolarHBondContact O-N 3.12Å; L696-Y745 HydrophobicContact CD1-CD2 4.35Å; L696-Y745 HydrophobicContact CD1-CE2 3.8Å; L696-Y745 HydrophobicContact CG-CE2 4.44Å; L696-A751 HydrophobicContact CD1-CB 4.47Å; L696-A751 HydrophobicContact CD2-CB 4.04Å; L696-A751 HydrophobicContact CG-CB 4.13Å; L696-A754 HydrophobicContact CD1-CB 3.82Å; L696-V770 HydrophobicContact CB-CG1 4.1Å; L696-V770 HydrophobicContact CD1-CG1 3.67Å; L696-V770 HydrophobicContact CG-CG1 4.32Å; L696-K771 CarbonylContact C-O 3.57Å; L696-K771 WeakPolarHBondContact CA-O 3.46Å; L696-I772 HydrophobicContact CD2-CG1 4.13Å
697	F	89.9	Confident	75.8	Confident	48 Å²	48	66.1 Å²	66.1	21%	0.211	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.5	176.1	167.9	-125.5	0	0	0	108	K699 Y740 F742 K771	F697-K699 HydrophobicContact CE1-CD 3.8Å; F697-K699 HydrophobicContact CE1-CG 3.8Å; F697-K699 HydrophobicContact CE2-CG 4.39Å; F697-K699 HydrophobicContact CZ-CD 4.09Å; F697-K699 HydrophobicContact CZ-CG 3.69Å; F697-Y740 HydrophobicContact CD2-CD2 4.4Å; F697-Y740 AromaticContact CE2-CD2 3.6Å; F697-Y740 HydrophobicContact CE2-CD2 3.6Å; F697-Y740 HydrophobicContact CE2-CE2 4.24Å; F697-Y740 AromaticContact CE2-CG 3.99Å; F697-Y740 HydrophobicContact CE2-CG 3.99Å; F697-F742 HydrophobicContact CB-CD1 4.01Å; F697-F742 HydrophobicContact CB-CE1 3.96Å; F697-F742 AromaticContact CD2-CD1 3.91Å; F697-F742 HydrophobicContact CD2-CD1 3.91Å; F697-F742 AromaticContact CD2-CE1 3.37Å; F697-F742 HydrophobicContact CD2-CE1 3.37Å; F697-F742 AromaticContact CD2-CZ 3.8Å; F697-F742 HydrophobicContact CD2-CZ 3.8Å; F697-F742 HydrophobicContact CE2-CE1 4.16Å; F697-F742 HydrophobicContact CE2-CZ 4.15Å; F697-F742 HydrophobicContact CG-CD1 4.41Å; F697-F742 AromaticContact CG-CE1 3.97Å; F697-F742 HydrophobicContact CG-CE1 3.97Å; F697-K771 PolarHBondContact N-O 2.64Å; F697-K771 PolarHBondContact O-N 3.01Å
698	I	90.3	Very high	78.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.6	-171.2	-58.1	162.8	0	0	0	107.8	L710 F714 Y740 G741 V743 L768 E769	I698-L710 HydrophobicContact CD1-CD1 4.12Å; I698-L710 HydrophobicContact CD1-CD2 4.05Å; I698-L710 HydrophobicContact CD1-CG 4.25Å; I698-F714 HydrophobicContact CD1-CD1 4.11Å; I698-F714 HydrophobicContact CD1-CD2 4.4Å; I698-F714 HydrophobicContact CD1-CE1 3.5Å; I698-F714 HydrophobicContact CD1-CE2 3.83Å; I698-F714 HydrophobicContact CD1-CZ 3.36Å; I698-F714 HydrophobicContact CG1-CE1 4Å; I698-F714 HydrophobicContact CG1-CZ 3.82Å; I698-Y740 CarbonylContact O-C 3.42Å; I698-Y740 WeakPolarHBondContact O-CA 3.44Å; I698-Y740 WeakPolarHBondContact O-CB 3.2Å; I698-G741 PolarHBondContact N-O 3.42Å; I698-G741 PolarHBondContact O-N 2.92Å; I698-V743 HydrophobicContact CD1-CB 4.01Å; I698-V743 HydrophobicContact CD1-CG2 3.48Å; I698-V743 VanDerWaalsContact CD1-CG2 3.48Å; I698-L768 HydrophobicContact CG2-CB 4.32Å; I698-L768 HydrophobicContact CG2-CD1 4.11Å; I698-L768 HydrophobicContact CG2-CD2 4.22Å; I698-L768 HydrophobicContact CG2-CG 4.46Å; I698-E769 CarbonylContact C-O 3.54Å; I698-E769 WeakPolarHBondContact CA-O 3.28Å
699	K	88.4	Confident	80.2	Confident	90 Å²	90	62.8 Å²	62.8	39%	0.391	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	161.3	-179.5	-95.3	177.2	159.6	-170.9	0	111	F697 L701 E769	F697-K699 HydrophobicContact CE1-CD 3.8Å; F697-K699 HydrophobicContact CE1-CG 3.8Å; F697-K699 HydrophobicContact CE2-CG 4.39Å; F697-K699 HydrophobicContact CZ-CD 4.09Å; F697-K699 HydrophobicContact CZ-CG 3.69Å; K699-L701 VanDerWaalsContact C-N 3.29Å; K699-L701 PolarHBondContact O-N 2.83Å; K699-E769 HydrophobicContact CB-CB 3.66Å; K699-E769 PolarHBondContact N-O 3.1Å; K699-E769 PolarHBondContact O-N 3.48Å
700	N	86.9	Confident	82	Confident	85 Å²	85	54 Å²	54	46%	0.455	30%	0.298	S	S	.	.	S	Bend	trans	59.8	40.1	179.3	-161.9	49.5	0	0	0	112.4	G739 H766 Q767	N700-G739 PolarHBondContact N-O 3.42Å; N700-H766 WeakPolarHBondContact O-CB 3.44Å; N700-Q767 WeakPolarHBondContact CB-O 3.48Å; N700-Q767 PolarHBondContact ND2-O 3.17Å
701	L	88	Confident	83.6	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	30%	0.296	C	S	.	.			trans	-80.9	137.5	171.8	-171	70.8	0	0	0	109.1	K699 T705 L710 I725 G739 L768	K699-L701 VanDerWaalsContact C-N 3.29Å; K699-L701 PolarHBondContact O-N 2.83Å; L701-T705 HydrophobicContact CD1-CG2 3.87Å; L701-T705 HydrophobicContact CG-CG2 4.45Å; L701-L710 HydrophobicContact CD1-CD1 3.95Å; L701-L710 HydrophobicContact CD2-CD2 4.07Å; L701-I725 HydrophobicContact CD2-CD1 3.52Å; L701-I725 HydrophobicContact CD2-CG1 3.66Å; L701-I725 HydrophobicContact CD2-CG2 4.29Å; L701-G739 PolarHBondContact N-O 3.33Å; L701-G739 VanDerWaalsContact O-CA 3.27Å; L701-G739 WeakPolarHBondContact O-CA 3.37Å; L701-L768 HydrophobicContact CB-CD2 4.35Å; L701-L768 HydrophobicContact CD1-CD2 3.76Å
702	N	85.7	Confident	84.9	Confident	33 Å²	33	57 Å²	57	18%	0.176	30%	0.297	C	S	.	.			trans	-62.9	143.2	174.6	-168.4	-19.3	0	0	0	110.4	S704 T705 D764	N702-S704 PolarHBondContact O-N 3.34Å; N702-S704 PolarHBondContact OD1-N 3.34Å; N702-S704 PolarHBondContact OD1-OG 3.33Å; N702-T705 PolarHBondContact O-N 3.14Å; N702-T705 VanDerWaalsContact O-N 3.16Å; N702-D764 HydrophobicContact CB-CB 3.87Å; N702-D764 PolarHBondContact ND2-O 3.47Å
703	F	85	Confident	85.8	Confident	129 Å²	129	53.5 Å²	53.5	57%	0.566	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.6	-178.6	-60.9	-70.6	0	0	0	113.8	S737	F703-S737 WeakPolarHBondContact CD1-O 3.38Å
704	S	81.1	Confident	86.6	Confident	86 Å²	86	52.4 Å²	52.4	60%	0.601	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-10.1	176.7	57	0	0	0	0	115.1	N702	N702-S704 PolarHBondContact O-N 3.34Å; N702-S704 PolarHBondContact OD1-N 3.34Å; N702-S704 PolarHBondContact OD1-OG 3.33Å
705	T	83	Confident	86.8	Confident	8 Å²	8	55.2 Å²	55.2	5%	0.049	28%	0.281	C	S	.	.			trans	-72.7	133.6	-177.4	-52.7	0	0	0	0	111	L701 N702 K709 I725 V763 D764	L701-T705 HydrophobicContact CD1-CG2 3.87Å; L701-T705 HydrophobicContact CG-CG2 4.45Å; N702-T705 PolarHBondContact O-N 3.14Å; N702-T705 VanDerWaalsContact O-N 3.16Å; T705-K709 HydrophobicContact CG2-CB 4.37Å; T705-K709 HydrophobicContact CG2-CD 4.44Å; T705-I725 WeakPolarHBondContact O-CD1 3.5Å; T705-V763 HydrophobicContact CG2-CG1 4.27Å; T705-D764 PolarHBondContact OG1-OD2 3.25Å
706	T	86.1	Confident	86.7	Confident	69 Å²	69	60.2 Å²	60.2	42%	0.423	30%	0.3	S	S	.	.			trans	-90.1	160.3	179.7	60.1	0	0	0	0	112.7	E708 K709 L710	T706-E708 VanDerWaalsContact C-N 3.29Å; T706-E708 PolarHBondContact O-N 3.34Å; T706-K709 PolarHBondContact O-N 2.71Å; T706-K709 PolarHBondContact OG1-N 3.35Å; T706-L710 PolarHBondContact O-N 3.05Å; T706-L710 VanDerWaalsContact O-N 3.11Å
707	E	87.2	Confident	86.3	Confident	55 Å²	55	60.5 Å²	60.5	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-62.5	-36.2	176	-79	143.9	165	0	0	112.3	L710 Q711 C723 I725 K727	E707-L710 PolarHBondContact O-N 2.89Å; E707-Q711 WeakPolarHBondContact O-CB 3.46Å; E707-Q711 PolarHBondContact O-N 3.23Å; E707-C723 PolarHBondContact O-SG 3.25Å; E707-I725 HydrophobicContact CG-CB 3.98Å; E707-I725 HydrophobicContact CG-CD1 3.87Å; E707-I725 HydrophobicContact CG-CG1 3.67Å; E707-I725 PolarHBondContact OE1-N 3.33Å; E707-K727 VanDerWaalsContact OE1-CE 3.27Å; E707-K727 WeakPolarHBondContact OE1-CE 3.37Å; E707-K727 IonicContact OE1-NZ 3.47Å; E707-K727 PolarHBondContact OE1-NZ 3.34Å; E707-K727 IonicContact OE2-NZ 2.76Å; E707-K727 PolarHBondContact OE2-NZ 3.01Å
708	E	86.3	Confident	86.1	Confident	152 Å²	152	59.2 Å²	59.2	71%	0.71	30%	0.303	S	S	*	.	H	α-helix	trans	-59.1	-49.7	175	-62	161.4	175.6	0	0	111.7	T706 L710 Q711 E712	T706-E708 VanDerWaalsContact C-N 3.29Å; T706-E708 PolarHBondContact O-N 3.34Å; E708-L710 VanDerWaalsContact C-N 3.31Å; E708-L710 PolarHBondContact O-N 3.09Å; E708-Q711 WeakPolarHBondContact O-CB 3.48Å; E708-Q711 PolarHBondContact O-N 3.43Å; E708-E712 PolarHBondContact O-N 3.02Å
709	K	85.4	Confident	85.9	Confident	82 Å²	82	64.1 Å²	64.1	36%	0.357	33%	0.333	S	S	.	.	H	α-helix	trans	-66.7	-35.2	179.7	-168.6	174	-172.2	179.6	0	111.8	T705 T706 I713 D764	T705-K709 HydrophobicContact CG2-CB 4.37Å; T705-K709 HydrophobicContact CG2-CD 4.44Å; T706-K709 PolarHBondContact O-N 2.71Å; T706-K709 PolarHBondContact OG1-N 3.35Å; K709-I713 HydrophobicContact CG-CD1 4.44Å; K709-I713 WeakPolarHBondContact O-CD1 3.16Å; K709-I713 WeakPolarHBondContact O-CG1 3.45Å; K709-I713 PolarHBondContact O-N 3.17Å; K709-D764 IonicContact NZ-OD1 3.77Å; K709-D764 PolarHBondContact NZ-OD1 3.2Å; K709-D764 IonicContact NZ-OD2 3.68Å; K709-D764 PolarHBondContact NZ-OD2 3.43Å
710	L	86.8	Confident	85.8	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-39.1	174.1	-167.3	60	0	0	0	111.4	I698 L701 T706 E707 E708 I713 F714 I725 V743 L768	I698-L710 HydrophobicContact CD1-CD1 4.12Å; I698-L710 HydrophobicContact CD1-CD2 4.05Å; I698-L710 HydrophobicContact CD1-CG 4.25Å; L701-L710 HydrophobicContact CD1-CD1 3.95Å; L701-L710 HydrophobicContact CD2-CD2 4.07Å; T706-L710 PolarHBondContact O-N 3.05Å; T706-L710 VanDerWaalsContact O-N 3.11Å; E707-L710 PolarHBondContact O-N 2.89Å; E708-L710 VanDerWaalsContact C-N 3.31Å; E708-L710 PolarHBondContact O-N 3.09Å; L710-I713 PolarHBondContact O-N 2.73Å; L710-F714 HydrophobicContact CD1-CD2 3.94Å; L710-F714 HydrophobicContact CD1-CE2 3.71Å; L710-F714 HydrophobicContact CG-CD2 4.4Å; L710-F714 VanDerWaalsContact O-CD2 3.3Å; L710-F714 WeakPolarHBondContact O-CD2 3.49Å; L710-F714 PolarHBondContact O-N 3.5Å; L710-F714 VanDerWaalsContact O-N 3.1Å; L710-I725 HydrophobicContact CD2-CD1 4.46Å; L710-I725 HydrophobicContact CD2-CG1 4.09Å; L710-V743 HydrophobicContact CD2-CG2 4.46Å; L710-V743 HydrophobicContact CG-CG2 4.42Å; L710-L768 HydrophobicContact CD1-CD1 4.32Å
711	Q	87.9	Confident	85.7	Confident	94 Å²	94	60.9 Å²	60.9	44%	0.439	32%	0.316	S	S	.	.	H	α-helix	trans	-65.6	-40	175	-173.3	175.4	-2.1	0	0	112.2	E707 E708 I713 F714 S715 C723	E707-Q711 WeakPolarHBondContact O-CB 3.46Å; E707-Q711 PolarHBondContact O-N 3.23Å; E708-Q711 WeakPolarHBondContact O-CB 3.48Å; E708-Q711 PolarHBondContact O-N 3.43Å; Q711-I713 VanDerWaalsContact C-N 3.3Å; Q711-I713 PolarHBondContact O-N 2.92Å; Q711-F714 PolarHBondContact O-N 3.02Å; Q711-S715 VanDerWaalsContact O-CB 3.3Å; Q711-S715 WeakPolarHBondContact O-CB 3.47Å; Q711-S715 PolarHBondContact O-N 2.97Å; Q711-S715 PolarHBondContact O-OG 2.99Å; Q711-C723 HydrophobicContact CB-CB 4.25Å
712	E	86.5	Confident	85.5	Confident	110 Å²	110	63.3 Å²	63.3	51%	0.514	33%	0.334	S	S	.	.	H	α-helix	trans	-64.7	-31.1	176.5	-163.8	-128.7	121.8	0	0	113.2	E708 S715 K716	E708-E712 PolarHBondContact O-N 3.02Å; E712-S715 PolarHBondContact O-OG 2.96Å; E712-S715 VanDerWaalsContact O-OG 3.13Å; E712-K716 WeakPolarHBondContact O-CE 3.35Å; E712-K716 IonicContact OE1-NZ 2.61Å; E712-K716 PolarHBondContact OE1-NZ 2.88Å
713	I	86.2	Confident	85.6	Confident	25 Å²	25	63 Å²	63	13%	0.128	33%	0.334	C	S	.	.	H	α-helix	trans	-78.3	-40.4	177.2	-67.2	167.6	0	0	0	110.8	K709 L710 Q711 L758 V763	K709-I713 HydrophobicContact CG-CD1 4.44Å; K709-I713 WeakPolarHBondContact O-CD1 3.16Å; K709-I713 WeakPolarHBondContact O-CG1 3.45Å; K709-I713 PolarHBondContact O-N 3.17Å; L710-I713 PolarHBondContact O-N 2.73Å; Q711-I713 VanDerWaalsContact C-N 3.3Å; Q711-I713 PolarHBondContact O-N 2.92Å; I713-L758 HydrophobicContact CG2-CD2 4.25Å; I713-V763 HydrophobicContact CD1-CB 4.32Å; I713-V763 HydrophobicContact CD1-CG1 3.6Å; I713-V763 HydrophobicContact CD1-CG2 3.69Å
714	F	88	Confident	85.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-81.1	-28.8	-176.1	-81.7	-113.1	0	0	0	112.9	L696 I698 L710 Q711 K716 C717 V720 V743 Y745 L758 L768 V770	L696-F714 HydrophobicContact CD1-CE1 4.48Å; I698-F714 HydrophobicContact CD1-CD1 4.11Å; I698-F714 HydrophobicContact CD1-CD2 4.4Å; I698-F714 HydrophobicContact CD1-CE1 3.5Å; I698-F714 HydrophobicContact CD1-CE2 3.83Å; I698-F714 HydrophobicContact CD1-CZ 3.36Å; I698-F714 HydrophobicContact CG1-CE1 4Å; I698-F714 HydrophobicContact CG1-CZ 3.82Å; L710-F714 HydrophobicContact CD1-CD2 3.94Å; L710-F714 HydrophobicContact CD1-CE2 3.71Å; L710-F714 HydrophobicContact CG-CD2 4.4Å; L710-F714 VanDerWaalsContact O-CD2 3.3Å; L710-F714 WeakPolarHBondContact O-CD2 3.49Å; L710-F714 PolarHBondContact O-N 3.5Å; L710-F714 VanDerWaalsContact O-N 3.1Å; Q711-F714 PolarHBondContact O-N 3.02Å; F714-K716 PolarHBondContact O-N 3.04Å; F714-K716 VanDerWaalsContact O-N 3.09Å; F714-C717 PolarHBondContact O-N 2.84Å; F714-V720 HydrophobicContact CB-CG2 4.23Å; F714-V743 HydrophobicContact CB-CG1 4.09Å; F714-V743 HydrophobicContact CD1-CB 4.09Å; F714-V743 HydrophobicContact CD1-CG1 3.85Å; F714-V743 HydrophobicContact CD1-CG2 4.15Å; F714-V743 HydrophobicContact CG-CG1 4.24Å; F714-V743 HydrophobicContact CG-CG2 4.25Å; F714-Y745 WeakPolarHBondContact CB-OH 3.4Å; F714-Y745 HydrophobicContact CD1-CE2 4.26Å; F714-Y745 VanDerWaalsContact CD1-OH 3.27Å; F714-Y745 WeakPolarHBondContact CD1-OH 3.5Å; F714-Y745 PolarHBondContact O-OH 3.22Å; F714-L758 HydrophobicContact CB-CD1 4.39Å; F714-L758 HydrophobicContact CD1-CD1 3.79Å; F714-L758 HydrophobicContact CD2-CD1 3.83Å; F714-L758 HydrophobicContact CE1-CD1 3.84Å; F714-L758 HydrophobicContact CE2-CD1 3.9Å; F714-L758 HydrophobicContact CG-CD1 3.76Å; F714-L758 HydrophobicContact CZ-CB 4.28Å; F714-L758 HydrophobicContact CZ-CD1 3.88Å; F714-L768 HydrophobicContact CE2-CD1 4.13Å; F714-V770 HydrophobicContact CE1-CG1 4.48Å; F714-V770 HydrophobicContact CE1-CG2 4.44Å; F714-V770 HydrophobicContact CZ-CG2 4.04Å
715	S	87.3	Confident	86	Confident	62 Å²	62	56 Å²	56	43%	0.434	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.2	174.7	66.3	0	0	0	0	113.8	Q711 E712 C717 G718	Q711-S715 VanDerWaalsContact O-CB 3.3Å; Q711-S715 WeakPolarHBondContact O-CB 3.47Å; Q711-S715 PolarHBondContact O-N 2.97Å; Q711-S715 PolarHBondContact O-OG 2.99Å; E712-S715 PolarHBondContact O-OG 2.96Å; E712-S715 VanDerWaalsContact O-OG 3.13Å; S715-C717 PolarHBondContact O-N 3.45Å; S715-G718 WeakPolarHBondContact CA-O 3.37Å; S715-G718 PolarHBondContact O-N 3.5Å
716	K	85.6	Confident	86.1	Confident	133 Å²	133	56.5 Å²	56.5	58%	0.578	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-21	177	-65.4	166.6	-173.8	161.7	0	113	E712 F714	E712-K716 WeakPolarHBondContact O-CE 3.35Å; E712-K716 IonicContact OE1-NZ 2.61Å; E712-K716 PolarHBondContact OE1-NZ 2.88Å; F714-K716 PolarHBondContact O-N 3.04Å; F714-K716 VanDerWaalsContact O-N 3.09Å
717	C	81.9	Confident	86.2	Confident	7 Å²	7	58 Å²	58	5%	0.047	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-30.7	175.9	-69.2	0	0	0	0	113.4	F714 S715 Y745 K753 A754	F714-C717 PolarHBondContact O-N 2.84Å; S715-C717 PolarHBondContact O-N 3.45Å; C717-Y745 HydrophobicContact CB-CE1 4.43Å; C717-K753 WeakPolarHBondContact O-CD 3.44Å; C717-K753 WeakPolarHBondContact O-CE 3.49Å; C717-K753 PolarHBondContact O-NZ 3.38Å; C717-A754 HydrophobicContact CB-CB 3.69Å
718	G	83.8	Confident	85.9	Confident	21 Å²	21	61.7 Å²	61.7	22%	0.216	32%	0.32	C	S	.	.	S	Bend	trans	172.1	177.2	177.3	0	0	0	0	0	112.1	S715 V720 Y745	S715-G718 WeakPolarHBondContact CA-O 3.37Å; S715-G718 PolarHBondContact O-N 3.5Å; G718-V720 PolarHBondContact O-N 2.58Å; G718-Y745 WeakPolarHBondContact O-CE1 3.23Å
719	T	86.8	Confident	85.7	Confident	102 Å²	102	63.4 Å²	63.4	63%	0.626	32%	0.32	S	S	*	.			trans	-71.5	126.2	-179.3	32.3	0	0	0	0	111.9	Y745 Q746	T719-Y745 WeakPolarHBondContact O-CD1 3.33Å; T719-Q746 PolarHBondContact O-N 3.33Å; T719-Q746 VanDerWaalsContact O-N 3.12Å
720	V	86.1	Confident	85.2	Confident	22 Å²	22	64 Å²	64	13%	0.133	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.1	-176	171	0	0	0	0	109.5	F714 G718 S722 C723 V743 Q744 Y745	F714-V720 HydrophobicContact CB-CG2 4.23Å; G718-V720 PolarHBondContact O-N 2.58Å; V720-S722 VanDerWaalsContact CG1-O 3.27Å; V720-S722 WeakPolarHBondContact CG1-O 3.33Å; V720-C723 HydrophobicContact CG1-CB 4.3Å; V720-V743 HydrophobicContact CG1-CG1 3.93Å; V720-V743 HydrophobicContact CG2-CG1 3.94Å; V720-Q744 CarbonylContact C-O 3.56Å; V720-Q744 WeakPolarHBondContact CA-O 3.34Å; V720-Y745 HydrophobicContact CG2-CD1 4.02Å; V720-Y745 HydrophobicContact CG2-CE1 3.69Å
721	K	85	Confident	84.4	Confident	85 Å²	85	73.9 Å²	73.9	37%	0.37	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-34.6	175.7	-164.4	174	-168.4	166.9	0	111.6	E688 Q744	E688-K721 PolarHBondContact O-NZ 2.89Å; E688-K721 IonicContact OE2-NZ 2.65Å; K721-Q744 HydrophobicContact CB-CG 4.35Å; K721-Q744 PolarHBondContact N-O 2.71Å
722	S	83.4	Confident	83.5	Confident	55 Å²	55	74 Å²	74	39%	0.385	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	149.8	172.7	70	0	0	0	0	113.5	V720 V743 Q744	V720-S722 VanDerWaalsContact CG1-O 3.27Å; V720-S722 WeakPolarHBondContact CG1-O 3.33Å; S722-V743 CarbonylContact O-C 3.55Å; S722-V743 WeakPolarHBondContact O-CA 3.23Å; S722-Q744 PolarHBondContact N-O 3.1Å; S722-Q744 PolarHBondContact O-N 3.16Å; S722-Q744 VanDerWaalsContact OG-CB 3.32Å; S722-Q744 WeakPolarHBondContact OG-CB 3.26Å; S722-Q744 PolarHBondContact OG-OE1 2.73Å; S722-Q744 VanDerWaalsContact OG-OE1 3.07Å
723	C	87.6	Confident	82.7	Confident	26 Å²	26	70.8 Å²	70.8	18%	0.176	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.6	173.4	177.9	0	0	0	0	109	E707 Q711 V720 V743	E707-C723 PolarHBondContact O-SG 3.25Å; Q711-C723 HydrophobicContact CB-CB 4.25Å; V720-C723 HydrophobicContact CG1-CB 4.3Å; C723-V743 HydrophobicContact CB-CG2 4.22Å
724	S	86.1	Confident	82.1	Confident	60 Å²	60	75.6 Å²	75.6	42%	0.42	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	129.6	-178.4	-178.7	0	0	0	0	112.3	G741 F742	S724-G741 CarbonylContact O-C 3.59Å; S724-G741 WeakPolarHBondContact O-CA 3.37Å; S724-F742 PolarHBondContact N-O 3.26Å; S724-F742 PolarHBondContact O-N 3.04Å
725	I	88.6	Confident	81.7	Confident	7 Å²	7	79.8 Å²	79.8	4%	0.036	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.1	173.6	-66.9	172	0	0	0	108.4	L701 T705 E707 L710 K727 S737	L701-I725 HydrophobicContact CD2-CD1 3.52Å; L701-I725 HydrophobicContact CD2-CG1 3.66Å; L701-I725 HydrophobicContact CD2-CG2 4.29Å; T705-I725 WeakPolarHBondContact O-CD1 3.5Å; E707-I725 HydrophobicContact CG-CB 3.98Å; E707-I725 HydrophobicContact CG-CD1 3.87Å; E707-I725 HydrophobicContact CG-CG1 3.67Å; E707-I725 PolarHBondContact OE1-N 3.33Å; L710-I725 HydrophobicContact CD2-CD1 4.46Å; L710-I725 HydrophobicContact CD2-CG1 4.09Å; I725-K727 HydrophobicContact CG2-CG 4.27Å; I725-K727 PolarHBondContact O-N 3.04Å; I725-S737 WeakPolarHBondContact CG2-OG 3.4Å
726	S	86.9	Confident	81.4	Confident	20 Å²	20	82.5 Å²	82.5	14%	0.14	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	114.6	176.7	-71.9	0	0	0	0	110.1	M738 Y740	S726-M738 VanDerWaalsContact O-CB 3.29Å; S726-M738 WeakPolarHBondContact O-CB 3.4Å; S726-M738 WeakPolarHBondContact O-CG 3.36Å; S726-M738 PolarHBondContact O-N 2.96Å; S726-Y740 PolarHBondContact N-O 3.09Å; S726-Y740 WeakPolarHBondContact OG-CE2 3.34Å
727	K	86.4	Confident	81.3	Confident	100 Å²	100	77 Å²	77	44%	0.435	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.5	-178.7	-56.8	159	-162.8	167.5	0	110	E707 I725 V735 L736	E707-K727 VanDerWaalsContact OE1-CE 3.27Å; E707-K727 WeakPolarHBondContact OE1-CE 3.37Å; E707-K727 IonicContact OE1-NZ 3.47Å; E707-K727 PolarHBondContact OE1-NZ 3.34Å; E707-K727 IonicContact OE2-NZ 2.76Å; E707-K727 PolarHBondContact OE2-NZ 3.01Å; I725-K727 HydrophobicContact CG2-CG 4.27Å; I725-K727 PolarHBondContact O-N 3.04Å; K727-V735 HydrophobicContact CB-CG1 3.53Å; K727-V735 HydrophobicContact CD-CG1 4.16Å; K727-V735 HydrophobicContact CG-CG1 4.31Å; K727-L736 CarbonylContact C-O 3.48Å; K727-L736 VanDerWaalsContact CA-O 3.25Å; K727-L736 WeakPolarHBondContact CA-O 3.39Å
728	K	82.3	Confident	81.4	Confident	132 Å²	132	80.7 Å²	80.7	57%	0.574	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	132	-179.4	-176.4	-178.1	176.3	-169.9	0	110.1	L736 M738	K728-L736 PolarHBondContact N-O 2.79Å; K728-L736 PolarHBondContact O-N 3.17Å; K728-M738 HydrophobicContact CB-CG 3.84Å; K728-M738 HydrophobicContact CB-SD 3.9Å
729	R	82.4	Confident	81.3	Confident	188 Å²	188	80.1 Å²	80.1	71%	0.709	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.8	169.7	-167.3	-178.7	-69.3	172.8	-0.3	109.8	G733 N734 V735	R729-G733 WeakPolarHBondContact CG-O 3.36Å; R729-N734 WeakPolarHBondContact CA-O 3.22Å; R729-V735 HydrophobicContact CB-CG2 4.5Å; R729-V735 HydrophobicContact CG-CG2 4.48Å
730	D	74.3	Confident	81.4	Confident	95 Å²	95	78.4 Å²	78.4	51%	0.508	41%	0.41	S	S	.	.			trans	-88.9	170.2	171.5	-171.1	32.8	0	0	0	111.8	S732 G733 N734	D730-S732 PolarHBondContact O-N 3.31Å; D730-S732 VanDerWaalsContact O-N 3.14Å; D730-G733 PolarHBondContact O-N 2.83Å; D730-N734 PolarHBondContact N-O 3.11Å
731	K	70.3	Confident	81.6	Confident	208 Å²	208	77.3 Å²	77.3	90%	0.904	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.6	179.8	-65.7	-179.9	-179.1	176.6	0	113.3	G733	K731-G733 VanDerWaalsContact C-N 3.26Å; K731-G733 PolarHBondContact O-N 3.43Å
732	S	68	Low	81.9	Confident	96 Å²	96	74.8 Å²	74.8	67%	0.671	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	12.6	176.7	-51.3	0	0	0	0	114	D730 N734	D730-S732 PolarHBondContact O-N 3.31Å; D730-S732 VanDerWaalsContact O-N 3.14Å; S732-N734 PolarHBondContact O-N 3.15Å; S732-N734 VanDerWaalsContact O-N 3.12Å
733	G	69.2	Low	82.2	Confident	42 Å²	42	72.1 Å²	72.1	43%	0.433	38%	0.375	S	S	.	.	S	Bend	trans	81.6	-22	176.9	0	0	0	0	0	115.6	R729 D730 K731	R729-G733 WeakPolarHBondContact CG-O 3.36Å; D730-G733 PolarHBondContact O-N 2.83Å; K731-G733 VanDerWaalsContact C-N 3.26Å; K731-G733 PolarHBondContact O-N 3.43Å
734	N	74.3	Confident	82.3	Confident	126 Å²	126	72.5 Å²	72.5	67%	0.674	37%	0.374	S	S	*	.			trans	-61.3	146	177.6	-68.7	-16.7	0	0	0	112.4	R729 D730 S732	R729-N734 WeakPolarHBondContact CA-O 3.22Å; D730-N734 PolarHBondContact N-O 3.11Å; S732-N734 PolarHBondContact O-N 3.15Å; S732-N734 VanDerWaalsContact O-N 3.12Å
735	V	79.8	Confident	82.5	Confident	89 Å²	89	69.7 Å²	69.7	54%	0.539	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	108.3	-174.8	174.6	0	0	0	0	109.2	K727 R729	K727-V735 HydrophobicContact CB-CG1 3.53Å; K727-V735 HydrophobicContact CD-CG1 4.16Å; K727-V735 HydrophobicContact CG-CG1 4.31Å; R729-V735 HydrophobicContact CB-CG2 4.5Å; R729-V735 HydrophobicContact CG-CG2 4.48Å
736	L	80.6	Confident	82.4	Confident	119 Å²	119	72.8 Å²	72.8	62%	0.623	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.8	-175.5	-156	76.6	0	0	0	111	K727 K728	K727-L736 CarbonylContact C-O 3.48Å; K727-L736 VanDerWaalsContact CA-O 3.25Å; K727-L736 WeakPolarHBondContact CA-O 3.39Å; K728-L736 PolarHBondContact N-O 2.79Å; K728-L736 PolarHBondContact O-N 3.17Å
737	S	84.6	Confident	82.3	Confident	16 Å²	16	75.2 Å²	75.2	11%	0.112	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	144.6	170.4	177.5	0	0	0	0	111	F703 I725 G739	F703-S737 WeakPolarHBondContact CD1-O 3.38Å; I725-S737 WeakPolarHBondContact CG2-OG 3.4Å; S737-G739 PolarHBondContact OG-N 3.27Å
738	M	82.9	Confident	82.4	Confident	85 Å²	85	72.5 Å²	72.5	42%	0.419	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	7.9	172.8	-63.4	-166.7	68	0	0	113.4	S726 K728 Y740	S726-M738 VanDerWaalsContact O-CB 3.29Å; S726-M738 WeakPolarHBondContact O-CB 3.4Å; S726-M738 WeakPolarHBondContact O-CG 3.36Å; S726-M738 PolarHBondContact O-N 2.96Å; K728-M738 HydrophobicContact CB-CG 3.84Å; K728-M738 HydrophobicContact CB-SD 3.9Å; M738-Y740 VanDerWaalsContact C-N 3.27Å; M738-Y740 HydrophobicContact CB-CD1 3.84Å; M738-Y740 HydrophobicContact CB-CE1 3.55Å; M738-Y740 HydrophobicContact CE-CE1 4.06Å; M738-Y740 HydrophobicContact CG-CE1 4.46Å; M738-Y740 WeakPolarHBondContact O-CD1 2.97Å; M738-Y740 PolarHBondContact O-N 3.29Å; M738-Y740 HydrophobicContact SD-CE1 4.21Å
739	G	82.1	Confident	82.6	Confident	10 Å²	10	73.7 Å²	73.7	10%	0.103	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	71.4	18.9	-179.9	0	0	0	0	0	114.4	N700 L701 S737	N700-G739 PolarHBondContact N-O 3.42Å; L701-G739 PolarHBondContact N-O 3.33Å; L701-G739 VanDerWaalsContact O-CA 3.27Å; L701-G739 WeakPolarHBondContact O-CA 3.37Å; S737-G739 PolarHBondContact OG-N 3.27Å
740	Y	89.1	Confident	82.8	Confident	65 Å²	65	65.1 Å²	65.1	26%	0.255	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155.6	174	70.1	-100.3	0	0	0	112.2	F697 I698 S726 M738 F742	F697-Y740 HydrophobicContact CD2-CD2 4.4Å; F697-Y740 AromaticContact CE2-CD2 3.6Å; F697-Y740 HydrophobicContact CE2-CD2 3.6Å; F697-Y740 HydrophobicContact CE2-CE2 4.24Å; F697-Y740 AromaticContact CE2-CG 3.99Å; F697-Y740 HydrophobicContact CE2-CG 3.99Å; I698-Y740 CarbonylContact O-C 3.42Å; I698-Y740 WeakPolarHBondContact O-CA 3.44Å; I698-Y740 WeakPolarHBondContact O-CB 3.2Å; S726-Y740 PolarHBondContact N-O 3.09Å; S726-Y740 WeakPolarHBondContact OG-CE2 3.34Å; M738-Y740 VanDerWaalsContact C-N 3.27Å; M738-Y740 HydrophobicContact CB-CD1 3.84Å; M738-Y740 HydrophobicContact CB-CE1 3.55Å; M738-Y740 HydrophobicContact CE-CE1 4.06Å; M738-Y740 HydrophobicContact CG-CE1 4.46Å; M738-Y740 WeakPolarHBondContact O-CD1 2.97Å; M738-Y740 PolarHBondContact O-N 3.29Å; M738-Y740 HydrophobicContact SD-CE1 4.21Å; Y740-F742 HydrophobicContact CD2-CE2 4.39Å; Y740-F742 HydrophobicContact CE2-CE2 4.15Å; Y740-F742 HydrophobicContact CE2-CZ 4.37Å
741	G	89.6	Confident	83.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	-178.7	-180	0	0	0	0	0	113.3	I698 S724	I698-G741 PolarHBondContact N-O 3.42Å; I698-G741 PolarHBondContact O-N 2.92Å; S724-G741 CarbonylContact O-C 3.59Å; S724-G741 WeakPolarHBondContact O-CA 3.37Å
742	F	91.7	Very high	84.2	Confident	31 Å²	31	55.3 Å²	55.3	14%	0.136	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.9	176.1	-59	-82.5	0	0	0	109.5	T695 L696 F697 S724 Y740 S773	T695-F742 HydrophobicContact CG2-CB 4.42Å; L696-F742 VanDerWaalsContact O-CA 3.29Å; L696-F742 WeakPolarHBondContact O-CA 3.01Å; F697-F742 HydrophobicContact CB-CD1 4.01Å; F697-F742 HydrophobicContact CB-CE1 3.96Å; F697-F742 AromaticContact CD2-CD1 3.91Å; F697-F742 HydrophobicContact CD2-CD1 3.91Å; F697-F742 AromaticContact CD2-CE1 3.37Å; F697-F742 HydrophobicContact CD2-CE1 3.37Å; F697-F742 AromaticContact CD2-CZ 3.8Å; F697-F742 HydrophobicContact CD2-CZ 3.8Å; F697-F742 HydrophobicContact CE2-CE1 4.16Å; F697-F742 HydrophobicContact CE2-CZ 4.15Å; F697-F742 HydrophobicContact CG-CD1 4.41Å; F697-F742 AromaticContact CG-CE1 3.97Å; F697-F742 HydrophobicContact CG-CE1 3.97Å; S724-F742 PolarHBondContact N-O 3.26Å; S724-F742 PolarHBondContact O-N 3.04Å; Y740-F742 HydrophobicContact CD2-CE2 4.39Å; Y740-F742 HydrophobicContact CE2-CE2 4.15Å; Y740-F742 HydrophobicContact CE2-CZ 4.37Å; F742-S773 WeakPolarHBondContact CE1-OG 3.34Å
743	V	90.1	Very high	85.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.5	174.1	167.7	0	0	0	0	108.2	L696 I698 L710 F714 V720 S722 C723 Y745	L696-V743 PolarHBondContact N-O 3.16Å; L696-V743 PolarHBondContact O-N 3.12Å; I698-V743 HydrophobicContact CD1-CB 4.01Å; I698-V743 HydrophobicContact CD1-CG2 3.48Å; I698-V743 VanDerWaalsContact CD1-CG2 3.48Å; L710-V743 HydrophobicContact CD2-CG2 4.46Å; L710-V743 HydrophobicContact CG-CG2 4.42Å; F714-V743 HydrophobicContact CB-CG1 4.09Å; F714-V743 HydrophobicContact CD1-CB 4.09Å; F714-V743 HydrophobicContact CD1-CG1 3.85Å; F714-V743 HydrophobicContact CD1-CG2 4.15Å; F714-V743 HydrophobicContact CG-CG1 4.24Å; F714-V743 HydrophobicContact CG-CG2 4.25Å; V720-V743 HydrophobicContact CG1-CG1 3.93Å; V720-V743 HydrophobicContact CG2-CG1 3.94Å; S722-V743 CarbonylContact O-C 3.55Å; S722-V743 WeakPolarHBondContact O-CA 3.23Å; C723-V743 HydrophobicContact CB-CG2 4.22Å; V743-Y745 HydrophobicContact CG1-CD2 4.3Å; V743-Y745 HydrophobicContact CG1-CE2 3.88Å
744	Q	89.7	Confident	86	Confident	33 Å²	33	52.8 Å²	52.8	15%	0.154	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.7	176.5	-174.3	-179.4	6.1	0	0	109.2	T695 V720 K721 S722	T695-Q744 HydrophobicContact CG2-CB 4.4Å; V720-Q744 CarbonylContact C-O 3.56Å; V720-Q744 WeakPolarHBondContact CA-O 3.34Å; K721-Q744 HydrophobicContact CB-CG 4.35Å; K721-Q744 PolarHBondContact N-O 2.71Å; S722-Q744 PolarHBondContact N-O 3.1Å; S722-Q744 PolarHBondContact O-N 3.16Å; S722-Q744 VanDerWaalsContact OG-CB 3.32Å; S722-Q744 WeakPolarHBondContact OG-CB 3.26Å; S722-Q744 PolarHBondContact OG-OE1 2.73Å; S722-Q744 VanDerWaalsContact OG-OE1 3.07Å
745	Y	89.8	Confident	86.7	Confident	1 Å²	1	49.2 Å²	49.2	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	158.6	169.5	-71.4	-86.9	0	0	0	110.6	S694 L696 F714 C717 G718 T719 V720 V743 T747 A750 A751 A754	S694-Y745 PolarHBondContact O-N 2.61Å; S694-Y745 VanDerWaalsContact O-N 3.08Å; L696-Y745 HydrophobicContact CD1-CD2 4.35Å; L696-Y745 HydrophobicContact CD1-CE2 3.8Å; L696-Y745 HydrophobicContact CG-CE2 4.44Å; F714-Y745 WeakPolarHBondContact CB-OH 3.4Å; F714-Y745 HydrophobicContact CD1-CE2 4.26Å; F714-Y745 VanDerWaalsContact CD1-OH 3.27Å; F714-Y745 WeakPolarHBondContact CD1-OH 3.5Å; F714-Y745 PolarHBondContact O-OH 3.22Å; C717-Y745 HydrophobicContact CB-CE1 4.43Å; G718-Y745 WeakPolarHBondContact O-CE1 3.23Å; T719-Y745 WeakPolarHBondContact O-CD1 3.33Å; V720-Y745 HydrophobicContact CG2-CD1 4.02Å; V720-Y745 HydrophobicContact CG2-CE1 3.69Å; V743-Y745 HydrophobicContact CG1-CD2 4.3Å; V743-Y745 HydrophobicContact CG1-CE2 3.88Å; Y745-T747 VanDerWaalsContact C-N 3.31Å; Y745-T747 WeakPolarHBondContact CB-O 3.36Å; Y745-A750 HydrophobicContact CD1-CB 3.61Å; Y745-A750 HydrophobicContact CE1-CB 4.31Å; Y745-A750 HydrophobicContact CG-CB 3.85Å; Y745-A751 HydrophobicContact CD2-CB 3.86Å; Y745-A751 HydrophobicContact CG-CB 4.47Å; Y745-A754 HydrophobicContact CE2-CB 3.63Å; Y745-A754 WeakPolarHBondContact OH-CB 3.31Å
746	Q	86.2	Confident	87	Confident	72 Å²	72	54 Å²	54	34%	0.336	26%	0.26	S	S	.	.	S	Bend	trans	-63.5	-41	169.2	-156.5	77.2	15.4	0	0	110.8	E688 T719	E688-Q746 PolarHBondContact OE2-NE2 2.69Å; T719-Q746 PolarHBondContact O-N 3.33Å; T719-Q746 VanDerWaalsContact O-N 3.12Å
747	T	85.6	Confident	87.2	Confident	72 Å²	72	54 Å²	54	44%	0.442	26%	0.256	S	S	.	.	S	Bend	trans	-112	144	-177	70.5	0	0	0	0	112.9	Y745 E749 A750 A751	Y745-T747 VanDerWaalsContact C-N 3.31Å; Y745-T747 WeakPolarHBondContact CB-O 3.36Å; T747-E749 PolarHBondContact O-N 2.57Å; T747-A750 PolarHBondContact O-N 3.23Å; T747-A750 WeakPolarHBondContact OG1-CB 3.22Å; T747-A750 PolarHBondContact OG1-N 2.74Å; T747-A751 PolarHBondContact O-N 3.3Å
748	V	87.2	Confident	87.2	Confident	43 Å²	43	54 Å²	54	26%	0.261	26%	0.255	S	S	.	.	H	α-helix	trans	-63.4	-31.2	174.7	-177.4	0	0	0	0	111.2	V691 A751 Q752	V691-V748 HydrophobicContact CB-CG2 4.26Å; V691-V748 HydrophobicContact CG1-CG2 3.77Å; V748-A751 WeakPolarHBondContact O-CB 3.27Å; V748-A751 PolarHBondContact O-N 2.76Å; V748-Q752 WeakPolarHBondContact O-CG 3.46Å; V748-Q752 PolarHBondContact O-N 3Å
749	E	87.1	Confident	87.4	Confident	156 Å²	156	53 Å²	53	73%	0.729	25%	0.25	S	C	*	.	H	α-helix	trans	-64.5	-42.2	175.7	-60.1	-168.7	164.2	0	0	112.6	T747 A751 Q752 K753	T747-E749 PolarHBondContact O-N 2.57Å; E749-A751 VanDerWaalsContact C-N 3.33Å; E749-A751 PolarHBondContact O-N 3.09Å; E749-Q752 PolarHBondContact O-N 3.32Å; E749-K753 WeakPolarHBondContact O-CB 3.35Å; E749-K753 PolarHBondContact O-N 2.99Å
750	A	86.7	Confident	87.5	Confident	9 Å²	9	57.4 Å²	57.4	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-39.4	175.1	0	0	0	0	0	111.4	Y745 T747 K753 A754	Y745-A750 HydrophobicContact CD1-CB 3.61Å; Y745-A750 HydrophobicContact CE1-CB 4.31Å; Y745-A750 HydrophobicContact CG-CB 3.85Å; T747-A750 PolarHBondContact O-N 3.23Å; T747-A750 WeakPolarHBondContact OG1-CB 3.22Å; T747-A750 PolarHBondContact OG1-N 2.74Å; A750-K753 PolarHBondContact O-N 3.37Å; A750-A754 WeakPolarHBondContact O-CB 3.06Å; A750-A754 PolarHBondContact O-N 2.81Å
751	A	86.8	Confident	87.3	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-44.2	172.7	0	0	0	0	0	112.3	L696 Y745 T747 V748 E749 K753 A754 L755	L696-A751 HydrophobicContact CD1-CB 4.47Å; L696-A751 HydrophobicContact CD2-CB 4.04Å; L696-A751 HydrophobicContact CG-CB 4.13Å; Y745-A751 HydrophobicContact CD2-CB 3.86Å; Y745-A751 HydrophobicContact CG-CB 4.47Å; T747-A751 PolarHBondContact O-N 3.3Å; V748-A751 WeakPolarHBondContact O-CB 3.27Å; V748-A751 PolarHBondContact O-N 2.76Å; E749-A751 VanDerWaalsContact C-N 3.33Å; E749-A751 PolarHBondContact O-N 3.09Å; A751-K753 VanDerWaalsContact C-N 3.34Å; A751-K753 PolarHBondContact O-N 3.21Å; A751-A754 PolarHBondContact O-N 2.88Å; A751-L755 WeakPolarHBondContact O-CB 3.38Å; A751-L755 PolarHBondContact O-N 3.13Å
752	Q	87.3	Confident	86.9	Confident	95 Å²	95	63 Å²	63	44%	0.444	30%	0.302	S	S	.	.	H	α-helix	trans	-69.8	-26.9	175.7	-70.7	-177.2	9.9	0	0	113.9	V748 E749 R756	V748-Q752 WeakPolarHBondContact O-CG 3.46Å; V748-Q752 PolarHBondContact O-N 3Å; E749-Q752 PolarHBondContact O-N 3.32Å; Q752-R756 WeakPolarHBondContact O-CG 3.44Å; Q752-R756 PolarHBondContact O-N 2.84Å; Q752-R756 PolarHBondContact O-NE 3.15Å
753	K	87	Confident	86.4	Confident	86 Å²	86	62 Å²	62	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-72.9	-47.9	172.9	177.7	179	164.6	-154.8	0	110.5	C717 E749 A750 A751 L755 R756 Q757	C717-K753 WeakPolarHBondContact O-CD 3.44Å; C717-K753 WeakPolarHBondContact O-CE 3.49Å; C717-K753 PolarHBondContact O-NZ 3.38Å; E749-K753 WeakPolarHBondContact O-CB 3.35Å; E749-K753 PolarHBondContact O-N 2.99Å; A750-K753 PolarHBondContact O-N 3.37Å; A751-K753 VanDerWaalsContact C-N 3.34Å; A751-K753 PolarHBondContact O-N 3.21Å; K753-L755 VanDerWaalsContact C-N 3.35Å; K753-L755 PolarHBondContact O-N 3.39Å; K753-R756 PolarHBondContact O-N 3.45Å; K753-Q757 VanDerWaalsContact CG-OE1 3.29Å; K753-Q757 WeakPolarHBondContact O-CG 3.16Å; K753-Q757 PolarHBondContact O-N 3.22Å
754	A	87.8	Confident	85.9	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-41.9	175.1	0	0	0	0	0	112.8	L696 C717 Y745 A750 A751 R756 Q757 L758	L696-A754 HydrophobicContact CD1-CB 3.82Å; C717-A754 HydrophobicContact CB-CB 3.69Å; Y745-A754 HydrophobicContact CE2-CB 3.63Å; Y745-A754 WeakPolarHBondContact OH-CB 3.31Å; A750-A754 WeakPolarHBondContact O-CB 3.06Å; A750-A754 PolarHBondContact O-N 2.81Å; A751-A754 PolarHBondContact O-N 2.88Å; A754-R756 PolarHBondContact O-N 3.01Å; A754-Q757 PolarHBondContact O-N 3.42Å; A754-L758 HydrophobicContact CB-CD1 4.29Å; A754-L758 WeakPolarHBondContact O-CB 3.09Å; A754-L758 PolarHBondContact O-N 2.96Å
755	L	88.3	Confident	85.5	Confident	51 Å²	51	70.2 Å²	70.2	27%	0.267	34%	0.343	S	S	.	.	H	α-helix	trans	-58.8	-28.5	173.9	-175.6	66.6	0	0	0	113.2	A751 K753 Q759 V770 I772	A751-L755 WeakPolarHBondContact O-CB 3.38Å; A751-L755 PolarHBondContact O-N 3.13Å; K753-L755 VanDerWaalsContact C-N 3.35Å; K753-L755 PolarHBondContact O-N 3.39Å; L755-Q759 WeakPolarHBondContact O-CB 3.19Å; L755-V770 HydrophobicContact CD1-CB 4.18Å; L755-V770 HydrophobicContact CD1-CG1 3.97Å; L755-V770 WeakPolarHBondContact CD1-O 3.16Å; L755-I772 HydrophobicContact CD2-CD1 4.04Å; L755-I772 HydrophobicContact CD2-CG1 3.87Å
756	R	86.6	Confident	85.1	Confident	188 Å²	188	72.9 Å²	72.9	71%	0.709	36%	0.356	S	S	*	.	H	α-helix	trans	-90.8	-24.6	177.4	-74	178.7	-74.8	179.5	-2.7	113.9	Q752 K753 A754	Q752-R756 WeakPolarHBondContact O-CG 3.44Å; Q752-R756 PolarHBondContact O-N 2.84Å; Q752-R756 PolarHBondContact O-NE 3.15Å; K753-R756 PolarHBondContact O-N 3.45Å; A754-R756 PolarHBondContact O-N 3.01Å
757	Q	85.2	Confident	85.1	Confident	119 Å²	119	74.6 Å²	74.6	56%	0.556	36%	0.364	S	S	*	.	H	α-helix	trans	-105	-26.1	-172.7	-68.1	-172.7	-44	0	0	114.6	K753 A754	K753-Q757 VanDerWaalsContact CG-OE1 3.29Å; K753-Q757 WeakPolarHBondContact O-CG 3.16Å; K753-Q757 PolarHBondContact O-N 3.22Å; A754-Q757 PolarHBondContact O-N 3.42Å
758	L	84.6	Confident	85.2	Confident	17 Å²	17	71.2 Å²	71.2	9%	0.089	34%	0.343	C	S	.	.	S	Bend	trans	-109.5	0.6	-175.8	-58.6	177.6	0	0	0	113.6	I713 F714 A754 H760 C761	I713-L758 HydrophobicContact CG2-CD2 4.25Å; F714-L758 HydrophobicContact CB-CD1 4.39Å; F714-L758 HydrophobicContact CD1-CD1 3.79Å; F714-L758 HydrophobicContact CD2-CD1 3.83Å; F714-L758 HydrophobicContact CE1-CD1 3.84Å; F714-L758 HydrophobicContact CE2-CD1 3.9Å; F714-L758 HydrophobicContact CG-CD1 3.76Å; F714-L758 HydrophobicContact CZ-CB 4.28Å; F714-L758 HydrophobicContact CZ-CD1 3.88Å; A754-L758 HydrophobicContact CB-CD1 4.29Å; A754-L758 WeakPolarHBondContact O-CB 3.09Å; A754-L758 PolarHBondContact O-N 2.96Å; L758-H760 PolarHBondContact O-N 2.85Å; L758-C761 VanDerWaalsContact O-CB 3.23Å; L758-C761 WeakPolarHBondContact O-CB 3.41Å; L758-C761 PolarHBondContact O-N 3.49Å
759	Q	86.4	Confident	85.2	Confident	64 Å²	64	72.1 Å²	72.1	30%	0.299	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	126.8	175.3	179.2	61.4	10.6	0	0	110.8	L755 C761 V770	L755-Q759 WeakPolarHBondContact O-CB 3.19Å; Q759-C761 PolarHBondContact O-N 3.45Å; Q759-V770 PolarHBondContact OE1-O 2.86Å; Q759-V770 VanDerWaalsContact OE1-O 3.09Å
760	H	85.9	Confident	85.4	Confident	102 Å²	102	64.9 Å²	64.9	47%	0.472	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	17.4	-173.1	-53.2	-62.2	0	0	0	115.5	L758 L768	L758-H760 PolarHBondContact O-N 2.85Å; H760-L768 VanDerWaalsContact CA-O 3.27Å; H760-L768 WeakPolarHBondContact CA-O 3.49Å; H760-L768 PolarHBondContact N-O 2.9Å
761	C	84.3	Confident	85.5	Confident	46 Å²	46	68.8 Å²	68.8	31%	0.311	33%	0.326	S	S	.	.			trans	-62.4	137.5	171.2	-172.6	0	0	0	0	110.7	L758 Q759 Q767 L768	L758-C761 VanDerWaalsContact O-CB 3.23Å; L758-C761 WeakPolarHBondContact O-CB 3.41Å; L758-C761 PolarHBondContact O-N 3.49Å; Q759-C761 PolarHBondContact O-N 3.45Å; C761-Q767 WeakPolarHBondContact O-CA 3.27Å; C761-L768 PolarHBondContact O-N 2.86Å
762	M	81.8	Confident	85.5	Confident	138 Å²	138	72.9 Å²	72.9	68%	0.68	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.7	178	-64.4	-163.8	-53.4	0	0	111.1	H766 Q767	M762-H766 WeakPolarHBondContact CA-O 3.4Å; M762-Q767 HydrophobicContact CG-CG 3.75Å; M762-Q767 HydrophobicContact SD-CG 4.47Å
763	V	81.2	Confident	85.1	Confident	8 Å²	8	69 Å²	69	5%	0.048	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	121.2	177.1	-175.9	0	0	0	0	108.1	T705 I713 D765 H766 L768	T705-V763 HydrophobicContact CG2-CG1 4.27Å; I713-V763 HydrophobicContact CD1-CB 4.32Å; I713-V763 HydrophobicContact CD1-CG1 3.6Å; I713-V763 HydrophobicContact CD1-CG2 3.69Å; V763-D765 VanDerWaalsContact C-N 3.32Å; V763-D765 PolarHBondContact O-N 3.46Å; V763-H766 PolarHBondContact N-O 3.22Å; V763-H766 PolarHBondContact O-N 3.38Å; V763-L768 HydrophobicContact CB-CD1 4.19Å; V763-L768 HydrophobicContact CB-CD2 4.42Å; V763-L768 HydrophobicContact CB-CG 4.25Å; V763-L768 HydrophobicContact CG2-CD1 3.61Å; V763-L768 HydrophobicContact CG2-CG 3.97Å
764	D	78.9	Confident	84.3	Confident	44 Å²	44	70.2 Å²	70.2	24%	0.235	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	53.6	-178.3	-57.6	-31.9	0	0	0	112.1	N702 T705 K709 H766	N702-D764 HydrophobicContact CB-CB 3.87Å; N702-D764 PolarHBondContact ND2-O 3.47Å; T705-D764 PolarHBondContact OG1-OD2 3.25Å; K709-D764 IonicContact NZ-OD1 3.77Å; K709-D764 PolarHBondContact NZ-OD1 3.2Å; K709-D764 IonicContact NZ-OD2 3.68Å; K709-D764 PolarHBondContact NZ-OD2 3.43Å; D764-H766 PolarHBondContact O-N 3.12Å; D764-H766 VanDerWaalsContact O-N 3.09Å; D764-H766 PolarHBondContact O-ND1 3.3Å
765	D	80.6	Confident	83.1	Confident	163 Å²	163	77.3 Å²	77.3	87%	0.872	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	10.6	-177.7	-54.8	-39.3	0	0	0	116.4	V763	V763-D765 VanDerWaalsContact C-N 3.32Å; V763-D765 PolarHBondContact O-N 3.46Å
766	H	81.6	Confident	81.6	Confident	57 Å²	57	77.4 Å²	77.4	26%	0.264	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	136.2	177	-66.2	60.7	0	0	0	111.7	N700 M762 V763 D764	N700-H766 WeakPolarHBondContact O-CB 3.44Å; M762-H766 WeakPolarHBondContact CA-O 3.4Å; V763-H766 PolarHBondContact N-O 3.22Å; V763-H766 PolarHBondContact O-N 3.38Å; D764-H766 PolarHBondContact O-N 3.12Å; D764-H766 VanDerWaalsContact O-N 3.09Å; D764-H766 PolarHBondContact O-ND1 3.3Å
767	Q	86.8	Confident	79.9	Confident	107 Å²	107	71.6 Å²	71.6	50%	0.5	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	119.1	173.9	-72.7	176.6	7.6	0	0	110.7	N700 C761 M762	N700-Q767 WeakPolarHBondContact CB-O 3.48Å; N700-Q767 PolarHBondContact ND2-O 3.17Å; C761-Q767 WeakPolarHBondContact O-CA 3.27Å; M762-Q767 HydrophobicContact CG-CG 3.75Å; M762-Q767 HydrophobicContact SD-CG 4.47Å
768	L	87.8	Confident	78.3	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.005	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-75.4	132	-177.4	-58.7	-173.2	0	0	0	112.5	I698 L701 L710 F714 H760 C761 V763	I698-L768 HydrophobicContact CG2-CB 4.32Å; I698-L768 HydrophobicContact CG2-CD1 4.11Å; I698-L768 HydrophobicContact CG2-CD2 4.22Å; I698-L768 HydrophobicContact CG2-CG 4.46Å; L701-L768 HydrophobicContact CB-CD2 4.35Å; L701-L768 HydrophobicContact CD1-CD2 3.76Å; L710-L768 HydrophobicContact CD1-CD1 4.32Å; F714-L768 HydrophobicContact CE2-CD1 4.13Å; H760-L768 VanDerWaalsContact CA-O 3.27Å; H760-L768 WeakPolarHBondContact CA-O 3.49Å; H760-L768 PolarHBondContact N-O 2.9Å; C761-L768 PolarHBondContact O-N 2.86Å; V763-L768 HydrophobicContact CB-CD1 4.19Å; V763-L768 HydrophobicContact CB-CD2 4.42Å; V763-L768 HydrophobicContact CB-CG 4.25Å; V763-L768 HydrophobicContact CG2-CD1 3.61Å; V763-L768 HydrophobicContact CG2-CG 3.97Å
769	E	87.2	Confident	76.6	Confident	63 Å²	63	76.8 Å²	76.8	29%	0.294	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.5	165.4	-95.8	-165	-168.2	0	0	109.7	I698 K699 K771	I698-E769 CarbonylContact C-O 3.54Å; I698-E769 WeakPolarHBondContact CA-O 3.28Å; K699-E769 HydrophobicContact CB-CB 3.66Å; K699-E769 PolarHBondContact N-O 3.1Å; K699-E769 PolarHBondContact O-N 3.48Å; E769-K771 IonicContact OE1-NZ 3.83Å; E769-K771 IonicContact OE2-NZ 2.73Å; E769-K771 PolarHBondContact OE2-NZ 2.65Å
770	V	90.4	Very high	74.6	Confident	3 Å²	3	75.8 Å²	75.8	2%	0.018	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.2	177.6	-170.7	0	0	0	0	109.7	L696 F714 L755 Q759	L696-V770 HydrophobicContact CB-CG1 4.1Å; L696-V770 HydrophobicContact CD1-CG1 3.67Å; L696-V770 HydrophobicContact CG-CG1 4.32Å; F714-V770 HydrophobicContact CE1-CG1 4.48Å; F714-V770 HydrophobicContact CE1-CG2 4.44Å; F714-V770 HydrophobicContact CZ-CG2 4.04Å; L755-V770 HydrophobicContact CD1-CB 4.18Å; L755-V770 HydrophobicContact CD1-CG1 3.97Å; L755-V770 WeakPolarHBondContact CD1-O 3.16Å; Q759-V770 PolarHBondContact OE1-O 2.86Å; Q759-V770 VanDerWaalsContact OE1-O 3.09Å
771	K	88.3	Confident	72.6	Confident	92 Å²	92	76.4 Å²	76.4	40%	0.4	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.4	178.8	-71.4	173	177.4	153.9	0	109.9	L696 F697 E769	L696-K771 CarbonylContact C-O 3.57Å; L696-K771 WeakPolarHBondContact CA-O 3.46Å; F697-K771 PolarHBondContact N-O 2.64Å; F697-K771 PolarHBondContact O-N 3.01Å; E769-K771 IonicContact OE1-NZ 3.83Å; E769-K771 IonicContact OE2-NZ 2.73Å; E769-K771 PolarHBondContact OE2-NZ 2.65Å
772	I	87.6	Confident	70.7	Confident	87 Å²	87	79.8 Å²	79.8	45%	0.446	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	139.6	175.1	-57.3	178.4	0	0	0	109.1	L696 L755	L696-I772 HydrophobicContact CD2-CG1 4.13Å; L755-I772 HydrophobicContact CD2-CD1 4.04Å; L755-I772 HydrophobicContact CD2-CG1 3.87Å
773	S	79.4	Confident	68.9	Low	14 Å²	14	78.1 Å²	78.1	10%	0.098	41%	0.408	C	S	.	.			trans	-92.8	110.1	-171.6	-171.3	0	0	0	0	113.1	T695 F742 R775	T695-S773 WeakPolarHBondContact O-CB 3.46Å; T695-S773 PolarHBondContact O-N 2.78Å; F742-S773 WeakPolarHBondContact CE1-OG 3.34Å; S773-R775 PolarHBondContact O-N 2.77Å; S773-R775 VanDerWaalsContact O-N 3.13Å; S773-R775 WeakPolarHBondContact OG-CB 3.46Å; S773-R775 PolarHBondContact OG-N 2.97Å
774	E	70.3	Confident	67.2	Low	111 Å²	111	87 Å²	87	52%	0.519	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	3.8	170.3	-59.7	177.2	174.4	0	0	114.1	A776 T777 R778	E774-A776 VanDerWaalsContact C-N 3.29Å; E774-A776 PolarHBondContact O-N 3.24Å; E774-T777 PolarHBondContact O-N 3.44Å; E774-T777 PolarHBondContact O-OG1 3.16Å; E774-T777 VanDerWaalsContact O-OG1 3.04Å; E774-R778 HydrophobicContact CB-CG 4.47Å; E774-R778 WeakPolarHBondContact O-CB 3.47Å; E774-R778 PolarHBondContact O-N 2.69Å; E774-R778 IonicContact OE2-CZ 3.94Å; E774-R778 IonicContact OE2-NE 2.61Å; E774-R778 IonicContact OE2-NH1 2.68Å; E774-R778 PolarHBondContact OE2-NH1 3.03Å
775	R	62	Low	65.3	Low	148 Å²	148	93.7 Å²	93.7	56%	0.558	47%	0.468	S	S	*	.	H	α-helix	trans	-62.6	-35.7	-175.2	178.3	172.4	-94.5	-130.3	-2.4	112.2	S773 T779	S773-R775 PolarHBondContact O-N 2.77Å; S773-R775 VanDerWaalsContact O-N 3.13Å; S773-R775 WeakPolarHBondContact OG-CB 3.46Å; S773-R775 PolarHBondContact OG-N 2.97Å; R775-T779 WeakPolarHBondContact O-CB 3.24Å; R775-T779 PolarHBondContact O-N 3.46Å; R775-T779 PolarHBondContact O-OG1 2.87Å
776	A	56.5	Low	63.1	Low	54 Å²	54	95.9 Å²	95.9	45%	0.446	47%	0.47	S	S	.	.	H	α-helix	trans	-62.6	-49.6	176.7	0	0	0	0	0	111.7	E774	E774-A776 VanDerWaalsContact C-N 3.29Å; E774-A776 PolarHBondContact O-N 3.24Å
777	T	51.6	Low	61	Low	66 Å²	66	102 Å²	102	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-70	-49.2	-178.1	52.9	0	0	0	0	112.3	E774 T779 A780 E781	E774-T777 PolarHBondContact O-N 3.44Å; E774-T777 PolarHBondContact O-OG1 3.16Å; E774-T777 VanDerWaalsContact O-OG1 3.04Å; T777-T779 VanDerWaalsContact C-N 3.28Å; T777-T779 PolarHBondContact O-N 3.17Å; T777-A780 PolarHBondContact O-N 2.75Å; T777-E781 WeakPolarHBondContact O-CG 3.37Å; T777-E781 PolarHBondContact O-N 3.08Å
778	R	50.5	Low	58.8	Low	153 Å²	153	104.1 Å²	104.1	58%	0.577	51%	0.505	S	S	*	.	H	α-helix	trans	-60.7	-33.4	-177.2	-80.1	176.7	124.8	138.1	-3.5	113.7	E774 E781 V782	E774-R778 HydrophobicContact CB-CG 4.47Å; E774-R778 WeakPolarHBondContact O-CB 3.47Å; E774-R778 PolarHBondContact O-N 2.69Å; E774-R778 IonicContact OE2-CZ 3.94Å; E774-R778 IonicContact OE2-NE 2.61Å; E774-R778 IonicContact OE2-NH1 2.68Å; E774-R778 PolarHBondContact OE2-NH1 3.03Å; R778-E781 PolarHBondContact O-N 3.17Å; R778-V782 WeakPolarHBondContact O-CG2 3.35Å; R778-V782 PolarHBondContact O-N 3.23Å; R778-V782 VanDerWaalsContact O-N 3.08Å
779	T	49	Very low	56.6	Low	91 Å²	91	108.5 Å²	108.5	56%	0.558	54%	0.541	S	S	*	.	H	α-helix	trans	-73.3	-33.3	-178.8	-46.9	0	0	0	0	111.5	R775 T777 S783	R775-T779 WeakPolarHBondContact O-CB 3.24Å; R775-T779 PolarHBondContact O-N 3.46Å; R775-T779 PolarHBondContact O-OG1 2.87Å; T777-T779 VanDerWaalsContact C-N 3.28Å; T777-T779 PolarHBondContact O-N 3.17Å; T779-S783 PolarHBondContact O-OG 3.02Å
780	A	45.7	Very low	55	Low	44 Å²	44	114.4 Å²	114.4	36%	0.364	57%	0.569	S	S	.	*	H	α-helix	trans	-72.2	-38.5	169.6	0	0	0	0	0	112.8	T777 R784	T777-A780 PolarHBondContact O-N 2.75Å; A780-R784 WeakPolarHBondContact O-CG 3.42Å
781	E	44.1	Very low	53.7	Low	115 Å²	115	119.2 Å²	119.2	54%	0.537	59%	0.59	S	S	.	*	H	α-helix	trans	-72.2	-42.4	-176.2	-76.1	-173.2	168.1	0	0	114.6	T777 R778 S783 R784	T777-E781 WeakPolarHBondContact O-CG 3.37Å; T777-E781 PolarHBondContact O-N 3.08Å; R778-E781 PolarHBondContact O-N 3.17Å; E781-S783 PolarHBondContact O-N 2.94Å; E781-R784 PolarHBondContact O-N 2.85Å
782	V	44.3	Very low	52.6	Low	117 Å²	117	124 Å²	124	71%	0.709	61%	0.611	S	S	*	*	H	α-helix	trans	-60.3	-38.9	179	171.7	0	0	0	0	110.3	R778 R784 K785	R778-V782 WeakPolarHBondContact O-CG2 3.35Å; R778-V782 PolarHBondContact O-N 3.23Å; R778-V782 VanDerWaalsContact O-N 3.08Å; V782-R784 PolarHBondContact O-N 2.91Å; V782-K785 PolarHBondContact O-N 2.89Å
783	S	43.7	Very low	51.7	Low	103 Å²	103	123.4 Å²	123.4	72%	0.72	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-18.6	176.9	-51.9	0	0	0	0	114	T779 E781	T779-S783 PolarHBondContact O-OG 3.02Å; E781-S783 PolarHBondContact O-N 2.94Å
784	R	44.5	Very low	51.1	Low	195 Å²	195	125.5 Å²	125.5	74%	0.736	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-8.8	-177.9	-72.1	172.7	177.9	-174.6	-0.5	114.1	A780 E781 V782 K786 K787	A780-R784 WeakPolarHBondContact O-CG 3.42Å; E781-R784 PolarHBondContact O-N 2.85Å; V782-R784 PolarHBondContact O-N 2.91Å; R784-K786 VanDerWaalsContact C-N 3.29Å; R784-K786 PolarHBondContact O-N 3.3Å; R784-K787 PolarHBondContact O-N 2.84Å
785	K	38.8	Very low	51.6	Low	184 Å²	184	121 Å²	121	80%	0.8	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	54.4	-173.4	-85.7	-174.9	174.1	172.1	0	116.3	V782	V782-K785 PolarHBondContact O-N 2.89Å
786	K	34.8	Very low	52.9	Low	209 Å²	209	114.7 Å²	114.7	91%	0.909	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.5	13	144.3	-138.1	-174	178.5	-178.7	0	116.8	R784	R784-K786 VanDerWaalsContact C-N 3.29Å; R784-K786 PolarHBondContact O-N 3.3Å
787	K	38.4	Very low	54.5	Low	185 Å²	185	115 Å²	115	80%	0.804	57%	0.572	S	S	*	*	S	Bend	trans	-77.4	128.1	160.7	-137.5	175	-176	-176.6	0	107.2	R784 A789	R784-K787 PolarHBondContact O-N 2.84Å; K787-A789 PolarHBondContact O-N 2.8Å; K787-A789 VanDerWaalsContact O-N 3.16Å
788	Q	40.1	Very low	56.4	Low	152 Å²	152	111.9 Å²	111.9	71%	0.71	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-60.9	119	169.9	-83.2	175.2	-93.4	0	0	107.5	E790 E872	Q788-E790 PolarHBondContact O-N 2.87Å; Q788-E872 PolarHBondContact NE2-OE1 3.12Å
789	A	41.3	Very low	58.4	Low	92 Å²	92	105 Å²	105	76%	0.76	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-65.4	128	166.9	0	0	0	0	0	107.9	K787 K791	K787-A789 PolarHBondContact O-N 2.8Å; K787-A789 VanDerWaalsContact O-N 3.16Å; A789-K791 PolarHBondContact O-N 3.11Å; A789-K791 VanDerWaalsContact O-N 3.1Å
790	E	53.8	Low	60.4	Low	188 Å²	188	100.7 Å²	100.7	88%	0.879	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-60.1	116.5	-179.5	-63.9	-175.1	166.5	0	0	109.8	Q788 K792	Q788-E790 PolarHBondContact O-N 2.87Å; E790-K792 PolarHBondContact O-N 3.25Å; E790-K792 VanDerWaalsContact O-N 3.09Å
791	K	62.8	Low	62.6	Low	103 Å²	103	103.1 Å²	103.1	45%	0.448	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-61.6	116	174.8	-77.2	-175.2	171.2	-175.3	0	108.4	A789 W873 D875	A789-K791 PolarHBondContact O-N 3.11Å; A789-K791 VanDerWaalsContact O-N 3.1Å; K791-W873 VanDerWaalsContact O-CD1 3.23Å; K791-D875 IonicContact NZ-OD1 2.62Å; K791-D875 PolarHBondContact NZ-OD1 3Å; K791-D875 IonicContact NZ-OD2 2.69Å; K791-D875 PolarHBondContact NZ-OD2 2.79Å
792	K	65	Low	64.8	Low	193 Å²	193	101.4 Å²	101.4	84%	0.839	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-55.6	144.3	172.6	-65.3	-177	178	-178.6	0	109.7	E790 T794	E790-K792 PolarHBondContact O-N 3.25Å; E790-K792 VanDerWaalsContact O-N 3.09Å; K792-T794 PolarHBondContact O-N 2.93Å; K792-T794 VanDerWaalsContact O-N 3.09Å
793	Q	69.1	Low	67	Low	74 Å²	74	96 Å²	96	35%	0.346	46%	0.462	S	S	.	.			trans	-51	114.5	-171.6	179.9	176.2	9.4	0	0	112.7	G795 K848 W873	Q793-G795 PolarHBondContact NE2-O 3.09Å; Q793-G795 VanDerWaalsContact NE2-O 3.17Å; Q793-K848 PolarHBondContact NE2-O 3.34Å; Q793-W873 HydrophobicContact CB-CD2 4.25Å; Q793-W873 HydrophobicContact CB-CZ2 4.13Å; Q793-W873 HydrophobicContact CG-CD2 4.02Å; Q793-W873 HydrophobicContact CG-CE3 3.92Å; Q793-W873 HydrophobicContact CG-CH2 3.72Å; Q793-W873 HydrophobicContact CG-CZ2 3.82Å; Q793-W873 HydrophobicContact CG-CZ3 3.77Å
794	T	67.3	Low	69.3	Low	58 Å²	58	91 Å²	91	36%	0.356	43%	0.428	S	S	.	.			trans	-87.2	-31.2	-178.8	49.6	0	0	0	0	113.5	K792 A874	K792-T794 PolarHBondContact O-N 2.93Å; K792-T794 VanDerWaalsContact O-N 3.09Å; T794-A874 PolarHBondContact OG1-O 2.83Å
795	G	80.4	Confident	71.4	Confident	16 Å²	16	86.9 Å²	86.9	17%	0.165	42%	0.415	C	S	.	.	S	Bend	trans	-171.5	-155	-172.4	0	0	0	0	0	115.5	Q793 W873	Q793-G795 PolarHBondContact NE2-O 3.09Å; Q793-G795 VanDerWaalsContact NE2-O 3.17Å; G795-W873 WeakPolarHBondContact O-CZ3 3.46Å
796	S	88.6	Confident	73.8	Confident	17 Å²	17	84.8 Å²	84.8	12%	0.119	41%	0.408	C	S	.	.	S	Bend	trans	-94.4	-5.1	175.2	-53.9	0	0	0	0	113.8	F845 K848 A851	S796-F845 WeakPolarHBondContact CB-O 3.42Å; S796-F845 PolarHBondContact O-N 3.04Å; S796-F845 VanDerWaalsContact O-N 3.13Å; S796-K848 VanDerWaalsContact OG-CG 3.3Å; S796-K848 WeakPolarHBondContact OG-CG 3.28Å; S796-A851 WeakPolarHBondContact O-CB 3.33Å
797	K	90.4	Very high	76.4	Confident	60 Å²	60	75 Å²	75	26%	0.261	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.1	-174	-170.9	-168.7	-62.5	164.3	0	111.1	F842 V843 D844 A874	K797-F842 HydrophobicContact CD-CD1 4.18Å; K797-V843 CarbonylContact C-O 3.51Å; K797-V843 WeakPolarHBondContact CA-O 3.12Å; K797-D844 HydrophobicContact CB-CB 4.39Å; K797-D844 HydrophobicContact CG-CB 4.27Å; K797-A874 HydrophobicContact CB-CB 4.1Å; K797-A874 HydrophobicContact CD-CB 3.78Å; K797-A874 HydrophobicContact CG-CB 3.87Å; K797-A874 WeakPolarHBondContact O-CB 3.39Å; K797-A874 PolarHBondContact O-N 2.69Å; K797-A874 VanDerWaalsContact O-N 3.12Å
798	I	91.6	Very high	78.9	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	136.5	175.1	-54.3	178.8	0	0	0	108.7	V800 F816 F842 V843 F845 A851 A854 F855 L871 W873	I798-V800 HydrophobicContact CG2-CG2 4.24Å; I798-F816 HydrophobicContact CD1-CE1 4.37Å; I798-F842 WeakPolarHBondContact O-CA 3.46Å; I798-V843 PolarHBondContact N-O 2.76Å; I798-V843 PolarHBondContact O-N 3.17Å; I798-F845 HydrophobicContact CD1-CD2 4.39Å; I798-F845 HydrophobicContact CD1-CE2 3.89Å; I798-A851 WeakPolarHBondContact CD1-O 3.46Å; I798-A854 HydrophobicContact CD1-CB 4.28Å; I798-F855 HydrophobicContact CD1-CB 4.14Å; I798-F855 HydrophobicContact CD1-CD2 4.41Å; I798-F855 HydrophobicContact CG2-CD2 4.35Å; I798-L871 HydrophobicContact CG2-CB 4.13Å; I798-L871 HydrophobicContact CG2-CD2 4.07Å; I798-L871 HydrophobicContact CG2-CG 4.03Å; I798-W873 HydrophobicContact CG1-CE3 4.5Å; I798-W873 HydrophobicContact CG1-CZ3 4.2Å
799	L	91.8	Very high	81.3	Confident	9 Å²	9	65 Å²	65	5%	0.047	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	113.7	167.2	170.9	53.8	0	0	0	108.4	R801 F840 F842 E872 A874	L799-R801 HydrophobicContact CD1-CG 4.27Å; L799-R801 HydrophobicContact CG-CG 4.1Å; L799-F840 HydrophobicContact CD1-CB 4.15Å; L799-F840 HydrophobicContact CD1-CD2 4Å; L799-F840 HydrophobicContact CD1-CG 4.46Å; L799-F842 HydrophobicContact CB-CD1 4.4Å; L799-F842 HydrophobicContact CB-CE1 4.43Å; L799-F842 HydrophobicContact CD1-CD1 4.08Å; L799-F842 HydrophobicContact CD1-CE1 3.83Å; L799-F842 HydrophobicContact CD1-CZ 4.25Å; L799-F842 HydrophobicContact CD2-CE1 4.49Å; L799-F842 HydrophobicContact CG-CE1 4.47Å; L799-E872 PolarHBondContact N-O 3.02Å; L799-E872 PolarHBondContact O-N 2.96Å; L799-A874 HydrophobicContact CB-CB 4.37Å
800	V	92.3	Very high	83.7	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118.9	176.5	-169.5	0	0	0	0	108	I798 V803 F816 F840 A841 V843 L869 L871	I798-V800 HydrophobicContact CG2-CG2 4.24Å; V800-V803 HydrophobicContact CG1-CG2 4.09Å; V800-F816 HydrophobicContact CG1-CZ 4.4Å; V800-F816 HydrophobicContact CG2-CE1 4.07Å; V800-F816 HydrophobicContact CG2-CE2 4.01Å; V800-F816 HydrophobicContact CG2-CZ 3.43Å; V800-F816 VanDerWaalsContact CG2-CZ 3.43Å; V800-F840 CarbonylContact O-C 3.47Å; V800-F840 WeakPolarHBondContact O-CA 3.4Å; V800-F840 VanDerWaalsContact O-CB 3.31Å; V800-F840 WeakPolarHBondContact O-CB 3.42Å; V800-A841 HydrophobicContact CB-CB 4.41Å; V800-A841 PolarHBondContact N-O 3.29Å; V800-A841 PolarHBondContact O-N 3.07Å; V800-V843 HydrophobicContact CG2-CG2 4.06Å; V800-L869 HydrophobicContact CG1-CB 4.18Å; V800-L869 HydrophobicContact CG1-CD1 4.29Å; V800-L869 HydrophobicContact CG1-CD2 4.15Å; V800-L869 HydrophobicContact CG1-CG 4.44Å; V800-L871 HydrophobicContact CG1-CD1 4.47Å
801	R	90.9	Very high	85.5	Confident	95 Å²	95	62.1 Å²	62.1	36%	0.358	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	169.8	174.9	-59	-170.1	-171.9	130.1	12.1	111.3	L799 V803 F840 V870 E872	L799-R801 HydrophobicContact CD1-CG 4.27Å; L799-R801 HydrophobicContact CG-CG 4.1Å; R801-V803 VanDerWaalsContact C-N 3.28Å; R801-V803 PolarHBondContact O-N 3.21Å; R801-F840 HydrophobicContact CG-CB 4.22Å; R801-V870 HydrophobicContact CB-CB 4.25Å; R801-V870 PolarHBondContact N-O 3.45Å; R801-V870 PolarHBondContact O-N 2.88Å; R801-E872 IonicContact CZ-OE1 3.94Å; R801-E872 IonicContact CZ-OE2 3.57Å; R801-E872 IonicContact NH1-OE1 3.83Å; R801-E872 PolarHBondContact NH1-OE1 3.22Å; R801-E872 IonicContact NH1-OE2 2.72Å; R801-E872 PolarHBondContact NH1-OE2 2.78Å; R801-E872 IonicContact NH2-OE1 2.67Å; R801-E872 IonicContact NH2-OE2 2.65Å; R801-E872 PolarHBondContact NH2-OE2 3.37Å
802	N	90.8	Very high	86.9	Confident	78 Å²	78	57.4 Å²	57.4	42%	0.417	27%	0.273	S	S	.	.	S	Bend	trans	61.8	30.6	-176.6	-162.2	41.7	0	0	0	114.2	G839 R868 V870	N802-G839 PolarHBondContact N-O 2.92Å; N802-R868 PolarHBondContact ND2-O 2.9Å; N802-V870 HydrophobicContact CB-CG2 4.29Å
803	V	91.3	Very high	88.2	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.018	25%	0.252	C	S	.	.			trans	-64.8	129.7	176	-177.3	0	0	0	0	109.4	V800 R801 A807 I812 L827 H837 G839 A841 L869	V800-V803 HydrophobicContact CG1-CG2 4.09Å; R801-V803 VanDerWaalsContact C-N 3.28Å; R801-V803 PolarHBondContact O-N 3.21Å; V803-A807 HydrophobicContact CG1-CB 3.93Å; V803-I812 HydrophobicContact CG1-CD1 3.74Å; V803-I812 HydrophobicContact CG2-CD1 4.48Å; V803-L827 HydrophobicContact CG1-CD1 4.34Å; V803-H837 PolarHBondContact O-CE1 3.46Å; V803-G839 PolarHBondContact N-O 3.36Å; V803-A841 HydrophobicContact CG2-CB 4.44Å; V803-L869 HydrophobicContact CG2-CD2 4.49Å
804	P	90.6	Very high	89.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.248	C	C	.	.			trans	-65.3	136.7	177.5	-13.1	24.7	0	0	0	111.6	Q806 A807 H837 L864 Y865 R867	P804-Q806 PolarHBondContact O-N 3.34Å; P804-A807 WeakPolarHBondContact O-CB 3.42Å; P804-A807 PolarHBondContact O-N 2.88Å; P804-H837 VanDerWaalsContact C-CE1 3.5Å; P804-H837 PolarHBondContact O-CE1 2.95Å; P804-H837 PolarHBondContact O-NE2 3.13Å; P804-L864 HydrophobicContact CG-CB 4.14Å; P804-L864 HydrophobicContact CG-CG 4.4Å; P804-L864 WeakPolarHBondContact CG-O 3Å; P804-Y865 HydrophobicContact CB-CD2 4.12Å; P804-Y865 HydrophobicContact CB-CG 4.5Å; P804-Y865 HydrophobicContact CG-CD2 4.11Å; P804-R867 HydrophobicContact CG-CB 4.16Å; P804-R867 HydrophobicContact CG-CG 4.33Å
805	F	89.3	Confident	90.4	Very high	107 Å²	107	49.8 Å²	49.8	47%	0.469	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-11.1	-174.9	-60.4	-60	0	0	0	116.3	H837	F805-H837 VanDerWaalsContact CA-CE1 3.48Å; F805-H837 WeakPolarHBondContact CA-CE1 3.49Å; F805-H837 AromaticContact CD1-CE1 3.93Å; F805-H837 AromaticContact CD1-ND1 3.84Å; F805-H837 WeakPolarHBondContact CD1-O 3.42Å; F805-H837 WeakPolarHBondContact CE1-O 3.45Å
806	Q	88.5	Confident	91	Very high	140 Å²	140	49.1 Å²	49.1	65%	0.654	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-22.4	173.8	-70	156.5	-45.3	0	0	112.7	P804 Y865	P804-Q806 PolarHBondContact O-N 3.34Å; Q806-Y865 HydrophobicContact CB-CD2 4.4Å; Q806-Y865 HydrophobicContact CB-CE2 4.34Å
807	A	90.6	Very high	91.1	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.033	24%	0.24	C	C	.	.			trans	-72.6	136.6	-170.6	0	0	0	0	0	112.9	V803 P804 H837 L864 Y865	V803-A807 HydrophobicContact CG1-CB 3.93Å; P804-A807 WeakPolarHBondContact O-CB 3.42Å; P804-A807 PolarHBondContact O-N 2.88Å; A807-H837 PolarHBondContact O-CD2 3.44Å; A807-H837 VanDerWaalsContact O-CD2 3.28Å; A807-H837 PolarHBondContact O-NE2 3.34Å; A807-L864 HydrophobicContact CB-CD2 3.74Å; A807-Y865 HydrophobicContact CB-CD2 4.29Å; A807-Y865 HydrophobicContact CB-CE2 4.08Å
808	T	90.8	Very high	91	Very high	64 Å²	64	52.4 Å²	52.4	39%	0.393	25%	0.251	S	S	.	.			trans	-95.5	165.5	-176.6	68.6	0	0	0	0	113	R810 E811 I812	T808-R810 PolarHBondContact O-N 3.09Å; T808-R810 PolarHBondContact OG1-N 2.83Å; T808-E811 VanDerWaalsContact CB-OE2 3.31Å; T808-E811 WeakPolarHBondContact CB-OE2 3.39Å; T808-E811 WeakPolarHBondContact CG2-OE2 3.39Å; T808-E811 PolarHBondContact N-OE2 3.27Å; T808-E811 PolarHBondContact O-N 3.46Å; T808-E811 VanDerWaalsContact OG1-CD 3.31Å; T808-E811 WeakPolarHBondContact OG1-CG 3.37Å; T808-E811 PolarHBondContact OG1-N 2.79Å; T808-E811 PolarHBondContact OG1-OE2 2.94Å; T808-I812 WeakPolarHBondContact O-CG1 3.46Å; T808-I812 PolarHBondContact O-N 3.17Å
809	V	90.9	Very high	90.9	Very high	64 Å²	64	53.8 Å²	53.8	39%	0.388	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-31.9	170.5	-179.8	0	0	0	0	111.6	R813 V825 L827	V809-R813 WeakPolarHBondContact O-CB 3.49Å; V809-R813 PolarHBondContact O-N 2.73Å; V809-V825 HydrophobicContact CG1-CG1 4.34Å; V809-L827 HydrophobicContact CG2-CB 3.72Å; V809-L827 HydrophobicContact CG2-CD2 3.79Å; V809-L827 HydrophobicContact CG2-CG 4.39Å
810	R	90.6	Very high	90.9	Very high	203 Å²	203	54.3 Å²	54.3	77%	0.766	26%	0.264	S	S	*	.	H	α-helix	trans	-64	-48.3	178.7	-71.2	178.8	62.5	-176.7	-3.2	110.3	T808 R813 E814	T808-R810 PolarHBondContact O-N 3.09Å; T808-R810 PolarHBondContact OG1-N 2.83Å; R810-R813 CarbonylContact O-C 3.49Å; R810-R813 WeakPolarHBondContact O-CB 3.32Å; R810-R813 PolarHBondContact O-N 2.66Å; R810-R813 VanDerWaalsContact O-N 3.17Å; R810-E814 WeakPolarHBondContact O-CB 3.28Å; R810-E814 PolarHBondContact O-N 2.92Å
811	E	91.4	Very high	90.9	Very high	16 Å²	16	60.4 Å²	60.4	8%	0.075	29%	0.293	C	S	.	.	H	α-helix	trans	-69.3	-38.8	-176.3	-69.6	161.5	133.2	0	0	112.8	S543 V546 T808 R813 E814 L815 Y865	S543-E811 WeakPolarHBondContact CB-OE1 3.31Å; S543-E811 PolarHBondContact OG-OE1 3.43Å; V546-E811 HydrophobicContact CG2-CB 3.58Å; V546-E811 HydrophobicContact CG2-CG 3.88Å; V546-E811 WeakPolarHBondContact CG2-O 3.5Å; T808-E811 VanDerWaalsContact CB-OE2 3.31Å; T808-E811 WeakPolarHBondContact CB-OE2 3.39Å; T808-E811 WeakPolarHBondContact CG2-OE2 3.39Å; T808-E811 PolarHBondContact N-OE2 3.27Å; T808-E811 PolarHBondContact O-N 3.46Å; T808-E811 VanDerWaalsContact OG1-CD 3.31Å; T808-E811 WeakPolarHBondContact OG1-CG 3.37Å; T808-E811 PolarHBondContact OG1-N 2.79Å; T808-E811 PolarHBondContact OG1-OE2 2.94Å; E811-R813 VanDerWaalsContact C-N 3.29Å; E811-R813 PolarHBondContact O-N 2.81Å; E811-E814 PolarHBondContact O-N 3.43Å; E811-L815 VanDerWaalsContact O-CB 3.24Å; E811-L815 WeakPolarHBondContact O-CB 3.37Å; E811-L815 PolarHBondContact O-N 3.04Å; E811-Y865 PolarHBondContact OE1-OH 3.29Å
812	I	92.4	Very high	91	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-67.5	-33.3	173.7	-60	172.1	0	0	0	110.7	V803 T808 F816 V825 L827 A841 V843	V803-I812 HydrophobicContact CG1-CD1 3.74Å; V803-I812 HydrophobicContact CG2-CD1 4.48Å; T808-I812 WeakPolarHBondContact O-CG1 3.46Å; T808-I812 PolarHBondContact O-N 3.17Å; I812-F816 HydrophobicContact CG2-CD2 4.25Å; I812-F816 HydrophobicContact CG2-CE2 4.42Å; I812-F816 VanDerWaalsContact O-CD2 3.3Å; I812-F816 WeakPolarHBondContact O-CD2 3.47Å; I812-F816 PolarHBondContact O-N 3.17Å; I812-V825 HydrophobicContact CB-CG1 4.3Å; I812-V825 HydrophobicContact CG2-CG1 3.9Å; I812-L827 HydrophobicContact CD1-CD1 3.72Å; I812-L827 HydrophobicContact CD1-CD2 3.85Å; I812-L827 HydrophobicContact CD1-CG 4.32Å; I812-A841 HydrophobicContact CD1-CB 4Å; I812-A841 HydrophobicContact CG2-CB 4.23Å; I812-V843 HydrophobicContact CG2-CG2 4.03Å
813	R	92.9	Very high	91.1	Very high	105 Å²	105	58.1 Å²	58.1	40%	0.396	28%	0.283	S	S	.	.	H	α-helix	trans	-66.3	-49.8	171.2	176.6	179.9	-72.4	-82.1	6.9	110.6	V809 R810 E811 F816 C817 L822 V825	V809-R813 WeakPolarHBondContact O-CB 3.49Å; V809-R813 PolarHBondContact O-N 2.73Å; R810-R813 CarbonylContact O-C 3.49Å; R810-R813 WeakPolarHBondContact O-CB 3.32Å; R810-R813 PolarHBondContact O-N 2.66Å; R810-R813 VanDerWaalsContact O-N 3.17Å; E811-R813 VanDerWaalsContact C-N 3.29Å; E811-R813 PolarHBondContact O-N 2.81Å; R813-F816 PolarHBondContact O-N 2.84Å; R813-C817 WeakPolarHBondContact O-CB 3.41Å; R813-C817 PolarHBondContact O-N 2.69Å; R813-L822 HydrophobicContact CG-CD1 4.1Å; R813-L822 WeakPolarHBondContact O-CD1 3.46Å; R813-V825 HydrophobicContact CB-CG2 4.07Å; R813-V825 HydrophobicContact CG-CG2 4.39Å
814	E	91.6	Very high	91.1	Very high	59 Å²	59	60.7 Å²	60.7	28%	0.276	30%	0.299	S	S	.	.	H	α-helix	trans	-56.8	-52.6	-179.2	-165.5	-178.1	155	0	0	111.6	G542 S543 V546 R810 E811 F816 C817	G542-E814 WeakPolarHBondContact CA-OE1 3.47Å; S543-E814 PolarHBondContact N-OE1 2.79Å; S543-E814 PolarHBondContact N-OE2 3.06Å; V546-E814 HydrophobicContact CB-CG 4.45Å; V546-E814 HydrophobicContact CG1-CB 4.1Å; V546-E814 HydrophobicContact CG1-CG 3.86Å; V546-E814 HydrophobicContact CG2-CB 4.38Å; R810-E814 WeakPolarHBondContact O-CB 3.28Å; R810-E814 PolarHBondContact O-N 2.92Å; E811-E814 PolarHBondContact O-N 3.43Å; E814-F816 VanDerWaalsContact C-N 3.29Å; E814-F816 PolarHBondContact O-N 2.82Å; E814-C817 PolarHBondContact O-N 2.93Å
815	L	91.4	Very high	91.2	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-57.6	-34.9	179	179.2	60.7	0	0	0	114	V546 A549 L550 E811 T818 F819 L858 T862 L869	V546-L815 HydrophobicContact CG1-CB 3.96Å; V546-L815 HydrophobicContact CG1-CD1 4.4Å; V546-L815 HydrophobicContact CG2-CB 4.5Å; A549-L815 HydrophobicContact CB-CD1 4.15Å; L550-L815 HydrophobicContact CD2-CD1 3.78Å; L550-L815 HydrophobicContact CG-CD1 3.89Å; E811-L815 VanDerWaalsContact O-CB 3.24Å; E811-L815 WeakPolarHBondContact O-CB 3.37Å; E811-L815 PolarHBondContact O-N 3.04Å; L815-T818 PolarHBondContact O-OG1 3.41Å; L815-F819 WeakPolarHBondContact O-CE2 3.48Å; L815-L858 HydrophobicContact CD1-CD2 4.21Å; L815-T862 HydrophobicContact CD1-CG2 4.47Å; L815-L869 HydrophobicContact CD2-CD1 3.71Å
816	F	92	Very high	91.2	Very high	1 Å²	1	63.7 Å²	63.7	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-94.4	-20.5	-178.9	-78.7	-102.4	0	0	0	113.3	I798 V800 I812 R813 E814 T818 F819 L822 V843 F845 A854 L858 L871	I798-F816 HydrophobicContact CD1-CE1 4.37Å; V800-F816 HydrophobicContact CG1-CZ 4.4Å; V800-F816 HydrophobicContact CG2-CE1 4.07Å; V800-F816 HydrophobicContact CG2-CE2 4.01Å; V800-F816 HydrophobicContact CG2-CZ 3.43Å; V800-F816 VanDerWaalsContact CG2-CZ 3.43Å; I812-F816 HydrophobicContact CG2-CD2 4.25Å; I812-F816 HydrophobicContact CG2-CE2 4.42Å; I812-F816 VanDerWaalsContact O-CD2 3.3Å; I812-F816 WeakPolarHBondContact O-CD2 3.47Å; I812-F816 PolarHBondContact O-N 3.17Å; R813-F816 PolarHBondContact O-N 2.84Å; E814-F816 VanDerWaalsContact C-N 3.29Å; E814-F816 PolarHBondContact O-N 2.82Å; F816-T818 VanDerWaalsContact C-N 3.32Å; F816-T818 PolarHBondContact O-N 3.45Å; F816-F819 PolarHBondContact O-N 3.1Å; F816-L822 HydrophobicContact CB-CD1 3.91Å; F816-L822 HydrophobicContact CB-CD2 4.27Å; F816-V843 HydrophobicContact CB-CG1 3.96Å; F816-V843 HydrophobicContact CD1-CB 4.33Å; F816-V843 HydrophobicContact CD1-CG1 3.9Å; F816-V843 HydrophobicContact CD1-CG2 4.25Å; F816-V843 HydrophobicContact CD2-CG2 4.3Å; F816-V843 HydrophobicContact CE1-CG2 4.46Å; F816-V843 HydrophobicContact CG-CG1 4.02Å; F816-V843 HydrophobicContact CG-CG2 4.17Å; F816-F845 HydrophobicContact CB-CZ 4.13Å; F816-F845 HydrophobicContact CD1-CE2 4.02Å; F816-F845 AromaticContact CD1-CZ 3.97Å; F816-F845 HydrophobicContact CD1-CZ 3.97Å; F816-A854 HydrophobicContact CD1-CB 4.34Å; F816-L858 HydrophobicContact CD1-CD1 3.75Å; F816-L858 HydrophobicContact CD2-CD1 4.27Å; F816-L858 HydrophobicContact CE1-CD1 3.47Å; F816-L858 VanDerWaalsContact CE1-CD1 3.47Å; F816-L858 HydrophobicContact CE2-CD1 4.01Å; F816-L858 HydrophobicContact CG-CD1 4.15Å; F816-L858 HydrophobicContact CZ-CD1 3.6Å; F816-L871 HydrophobicContact CE1-CD2 4.08Å; F816-L871 HydrophobicContact CZ-CD2 4.2Å; F816-L871 HydrophobicContact CZ-CG 4.49Å
817	C	91.1	Very high	91.3	Very high	68 Å²	68	58.1 Å²	58.1	46%	0.459	28%	0.283	S	S	.	.	H	α-helix	trans	-70.6	-27	-178.2	-165.7	0	0	0	0	112.6	R813 E814 F819 G820 L822	R813-C817 WeakPolarHBondContact O-CB 3.41Å; R813-C817 PolarHBondContact O-N 2.69Å; E814-C817 PolarHBondContact O-N 2.93Å; C817-F819 PolarHBondContact O-N 3.13Å; C817-G820 PolarHBondContact O-N 3.19Å; C817-G820 VanDerWaalsContact O-N 3.16Å; C817-L822 HydrophobicContact CB-CD1 4.1Å
818	T	89	Confident	91.3	Very high	78 Å²	78	59.2 Å²	59.2	48%	0.479	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.4	173.3	54.8	0	0	0	0	113.6	L550 L815 F816	L550-T818 HydrophobicContact CD1-CG2 3.83Å; L550-T818 HydrophobicContact CD2-CG2 4.2Å; L815-T818 PolarHBondContact O-OG1 3.41Å; F816-T818 VanDerWaalsContact C-N 3.32Å; F816-T818 PolarHBondContact O-N 3.45Å
819	F	89.8	Confident	91.1	Very high	29 Å²	29	62.9 Å²	62.9	13%	0.127	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-14	179	-60.9	-81.5	0	0	0	113.7	L550 L815 F816 C817 F845 K853 A854 A857 L858	L550-F819 HydrophobicContact CD2-CE2 4.07Å; L550-F819 HydrophobicContact CD2-CZ 4.37Å; L815-F819 WeakPolarHBondContact O-CE2 3.48Å; F816-F819 PolarHBondContact O-N 3.1Å; C817-F819 PolarHBondContact O-N 3.13Å; F819-F845 HydrophobicContact CB-CE1 4.43Å; F819-K853 HydrophobicContact CD1-CD 4.49Å; F819-K853 HydrophobicContact CD1-CG 4.28Å; F819-A854 HydrophobicContact CB-CB 3.61Å; F819-A854 HydrophobicContact CD2-CB 4.26Å; F819-A854 HydrophobicContact CG-CB 3.9Å; F819-A857 HydrophobicContact CD1-CB 4.29Å; F819-A857 HydrophobicContact CE1-CB 3.46Å; F819-A857 VanDerWaalsContact CE1-CB 3.46Å; F819-A857 HydrophobicContact CZ-CB 3.89Å; F819-L858 HydrophobicContact CD2-CD1 4.03Å; F819-L858 HydrophobicContact CD2-CG 4.46Å; F819-L858 HydrophobicContact CE2-CD1 3.76Å; F819-L858 HydrophobicContact CE2-CD2 3.76Å; F819-L858 HydrophobicContact CE2-CG 3.8Å; F819-L858 HydrophobicContact CZ-CD1 4.46Å; F819-L858 HydrophobicContact CZ-CD2 3.95Å; F819-L858 HydrophobicContact CZ-CG 4.03Å
820	G	90.8	Very high	90.7	Very high	20 Å²	20	66 Å²	66	21%	0.206	31%	0.308	C	S	.	.	S	Bend	trans	149.2	178.3	175.4	0	0	0	0	0	113.4	C817	C817-G820 PolarHBondContact O-N 3.19Å; C817-G820 VanDerWaalsContact O-N 3.16Å
821	E	92.4	Very high	89.7	Confident	130 Å²	130	61.5 Å²	61.5	61%	0.607	31%	0.314	S	S	*	.			trans	-69.5	138.6	-170.1	-67.1	-176	-171	0	0	114	F845 L846	E821-F845 CarbonylContact O-C 3.55Å; E821-F845 WeakPolarHBondContact O-CA 3.37Å; E821-L846 HydrophobicContact CB-CB 3.99Å; E821-L846 HydrophobicContact CB-CD2 4.31Å; E821-L846 PolarHBondContact O-N 3.12Å; E821-L846 VanDerWaalsContact OE2-CD2 3.22Å; E821-L846 WeakPolarHBondContact OE2-CD2 3.37Å
822	L	93.4	Very high	88.2	Confident	21 Å²	21	63.7 Å²	63.7	11%	0.11	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	110.1	-173.4	-62.5	-178	0	0	0	112.1	R813 F816 C817 V825 V843 F845	R813-L822 HydrophobicContact CG-CD1 4.1Å; R813-L822 WeakPolarHBondContact O-CD1 3.46Å; F816-L822 HydrophobicContact CB-CD1 3.91Å; F816-L822 HydrophobicContact CB-CD2 4.27Å; C817-L822 HydrophobicContact CB-CD1 4.1Å; L822-V825 HydrophobicContact CB-CG2 4.42Å; L822-V825 HydrophobicContact CD1-CG2 3.81Å; L822-V843 HydrophobicContact CD1-CG1 4.41Å; L822-V843 HydrophobicContact CD2-CG1 3.51Å; L822-F845 HydrophobicContact CD2-CD1 3.55Å; L822-F845 HydrophobicContact CD2-CD2 4.01Å; L822-F845 HydrophobicContact CD2-CE1 3.4Å; L822-F845 HydrophobicContact CD2-CE2 3.86Å; L822-F845 HydrophobicContact CD2-CG 3.87Å; L822-F845 HydrophobicContact CD2-CZ 3.56Å; L822-F845 HydrophobicContact CG-CE1 4.5Å
823	K	91.6	Very high	86.6	Confident	104 Å²	104	67.6 Å²	67.6	45%	0.452	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	-55.2	172.5	-63.7	168.6	179.3	163.3	0	110.8	D844 F845 L846	K823-D844 WeakPolarHBondContact CB-O 3.5Å; K823-D844 VanDerWaalsContact CD-OD2 3.26Å; K823-D844 WeakPolarHBondContact CD-OD2 3.45Å; K823-D844 PolarHBondContact N-O 2.78Å; K823-D844 IonicContact NZ-OD2 3.25Å; K823-F845 VanDerWaalsContact CD-O 3.3Å; K823-F845 WeakPolarHBondContact CD-O 3.07Å; K823-F845 WeakPolarHBondContact CE-O 3.22Å; K823-F845 PolarHBondContact NZ-O 3.24Å; K823-L846 WeakPolarHBondContact CE-O 3.26Å; K823-L846 HydrophobicContact CG-CD1 4.23Å
824	T	91.3	Very high	85.2	Confident	57 Å²	57	65.6 Å²	65.6	35%	0.35	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	145.5	-179.2	69.3	0	0	0	0	112.1	D844	T824-D844 PolarHBondContact N-O 2.88Å; T824-D844 PolarHBondContact O-N 3.03Å
825	V	92.9	Very high	84	Confident	14 Å²	14	64.8 Å²	64.8	9%	0.085	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.8	166.9	-178.5	0	0	0	0	106.8	V809 I812 R813 L822 F842 V843	V809-V825 HydrophobicContact CG1-CG1 4.34Å; I812-V825 HydrophobicContact CB-CG1 4.3Å; I812-V825 HydrophobicContact CG2-CG1 3.9Å; R813-V825 HydrophobicContact CB-CG2 4.07Å; R813-V825 HydrophobicContact CG-CG2 4.39Å; L822-V825 HydrophobicContact CB-CG2 4.42Å; L822-V825 HydrophobicContact CD1-CG2 3.81Å; V825-F842 WeakPolarHBondContact CA-O 3.45Å; V825-V843 HydrophobicContact CG1-CG2 4.47Å
826	R	89.8	Confident	83.4	Confident	156 Å²	156	68.6 Å²	68.6	59%	0.589	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.2	-178.2	-70.3	-176.1	172.6	-170.8	-1.8	110.3	A841 F842	R826-A841 CarbonylContact O-C 3.54Å; R826-A841 VanDerWaalsContact O-CA 3.3Å; R826-A841 WeakPolarHBondContact O-CA 3.38Å; R826-F842 PolarHBondContact N-O 3.06Å; R826-F842 PolarHBondContact O-N 2.7Å
827	L	91.3	Very high	83.3	Confident	22 Å²	22	69.1 Å²	69.1	12%	0.115	41%	0.409	C	S	.	.			trans	-121.1	90.3	-178.3	-176	59.1	0	0	0	109	V803 V809 I812 K829 H837 A841	V803-L827 HydrophobicContact CG1-CD1 4.34Å; V809-L827 HydrophobicContact CG2-CB 3.72Å; V809-L827 HydrophobicContact CG2-CD2 3.79Å; V809-L827 HydrophobicContact CG2-CG 4.39Å; I812-L827 HydrophobicContact CD1-CD1 3.72Å; I812-L827 HydrophobicContact CD1-CD2 3.85Å; I812-L827 HydrophobicContact CD1-CG 4.32Å; L827-K829 PolarHBondContact O-N 2.93Å; L827-H837 HydrophobicContact CD1-CB 3.78Å; L827-H837 HydrophobicContact CD2-CB 4.3Å; L827-H837 HydrophobicContact CG-CB 3.65Å; L827-A841 HydrophobicContact CD1-CB 3.92Å
828	P	89.4	Confident	83	Confident	28 Å²	28	72.2 Å²	72.2	18%	0.182	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-64.5	123.1	-170.5	-25.4	37.1	0	0	0	112.9	H837 R838 F840 F842	P828-H837 CarbonylContact O-C 3.46Å; P828-H837 WeakPolarHBondContact O-CA 3.18Å; P828-R838 WeakPolarHBondContact O-CG 3.39Å; P828-R838 PolarHBondContact O-N 2.79Å; P828-F840 WeakPolarHBondContact CD-O 3.41Å; P828-F840 HydrophobicContact CG-CD2 4.5Å; P828-F840 HydrophobicContact CG-CE2 3.9Å; P828-F840 HydrophobicContact CG-CZ 4.41Å; P828-F842 HydrophobicContact CG-CE2 4.42Å
829	K	86.8	Confident	83	Confident	141 Å²	141	69 Å²	69	61%	0.613	39%	0.394	S	S	*	.	B	Isolated β-bridge	trans	-76	154.5	173.8	-67.2	-169.3	173.1	-146.5	0	112.4	L827 G835	L827-K829 PolarHBondContact O-N 2.93Å; K829-G835 VanDerWaalsContact CD-O 3.23Å; K829-G835 WeakPolarHBondContact CD-O 3.45Å; K829-G835 WeakPolarHBondContact CE-O 3.5Å; K829-G835 PolarHBondContact NZ-O 3.41Å
830	K	81.9	Confident	83.1	Confident	129 Å²	129	69.7 Å²	69.7	56%	0.561	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-72.2	133.2	172.5	-169.8	-177.6	179.8	-172.9	0	108.6	A832 N836 R838	K830-A832 HydrophobicContact CG-CB 4.41Å; K830-A832 PolarHBondContact O-N 3.29Å; K830-N836 PolarHBondContact N-O 3.25Å; K830-R838 HydrophobicContact CB-CG 4.49Å
831	A	69.6	Low	83.2	Confident	108 Å²	108	68.7 Å²	68.7	89%	0.893	39%	0.387	S	S	*	.	S	Bend	trans	-75.3	24.4	-174.9	0	0	0	0	0	114.8
832	A	60	Low	83.2	Confident	62 Å²	62	63.3 Å²	63.3	51%	0.512	36%	0.362	S	S	.	.	S	Bend	trans	-140.2	70.9	-167.8	0	0	0	0	0	111.6	K830 S834	K830-A832 HydrophobicContact CG-CB 4.41Å; K830-A832 PolarHBondContact O-N 3.29Å; A832-S834 PolarHBondContact O-N 3.48Å
833	G	60.1	Low	83.2	Confident	87 Å²	87	62.3 Å²	62.3	90%	0.897	36%	0.357	S	S	*	.	S	Bend	trans	69.6	-59.1	168.9	0	0	0	0	0	116.1	G835	G833-G835 PolarHBondContact O-N 3.27Å
834	S	63.1	Low	83.3	Confident	62 Å²	62	58.9 Å²	58.9	43%	0.434	34%	0.343	S	S	.	.			trans	-60.8	119	177.3	174.9	0	0	0	0	110.5	A832 N836	A832-S834 PolarHBondContact O-N 3.48Å; S834-N836 PolarHBondContact O-N 3.21Å
835	G	66.8	Low	83.4	Confident	42 Å²	42	56.1 Å²	56.1	43%	0.433	33%	0.326	S	S	.	.			trans	-67.5	6.7	-175.7	0	0	0	0	0	115.9	K829 G833	K829-G835 VanDerWaalsContact CD-O 3.23Å; K829-G835 WeakPolarHBondContact CD-O 3.45Å; K829-G835 WeakPolarHBondContact CE-O 3.5Å; K829-G835 PolarHBondContact NZ-O 3.41Å; G833-G835 PolarHBondContact O-N 3.27Å
836	N	79.3	Confident	83.4	Confident	81 Å²	81	59.9 Å²	59.9	43%	0.433	35%	0.345	S	S	.	.			trans	-75.3	150.5	-176.8	-65	21	0	0	0	111.6	K830 S834	K830-N836 PolarHBondContact N-O 3.25Å; S834-N836 PolarHBondContact O-N 3.21Å
837	H	88.3	Confident	83.5	Confident	12 Å²	12	55.2 Å²	55.2	6%	0.056	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-83.9	158.2	178.7	62.1	54.3	0	0	0	113.6	V803 P804 F805 A807 L827 P828 G839	V803-H837 PolarHBondContact O-CE1 3.46Å; P804-H837 VanDerWaalsContact C-CE1 3.5Å; P804-H837 PolarHBondContact O-CE1 2.95Å; P804-H837 PolarHBondContact O-NE2 3.13Å; F805-H837 VanDerWaalsContact CA-CE1 3.48Å; F805-H837 WeakPolarHBondContact CA-CE1 3.49Å; F805-H837 AromaticContact CD1-CE1 3.93Å; F805-H837 AromaticContact CD1-ND1 3.84Å; F805-H837 WeakPolarHBondContact CD1-O 3.42Å; F805-H837 WeakPolarHBondContact CE1-O 3.45Å; A807-H837 PolarHBondContact O-CD2 3.44Å; A807-H837 VanDerWaalsContact O-CD2 3.28Å; A807-H837 PolarHBondContact O-NE2 3.34Å; L827-H837 HydrophobicContact CD1-CB 3.78Å; L827-H837 HydrophobicContact CD2-CB 4.3Å; L827-H837 HydrophobicContact CG-CB 3.65Å; P828-H837 CarbonylContact O-C 3.46Å; P828-H837 WeakPolarHBondContact O-CA 3.18Å; H837-G839 PolarHBondContact ND1-N 3.35Å; H837-G839 PolarHBondContact O-N 3.3Å
838	R	85.6	Confident	83.5	Confident	133 Å²	133	60.5 Å²	60.5	50%	0.502	36%	0.356	S	S	.	.			trans	-72.6	6.2	-177.3	-61.1	-178.8	106.5	-169.5	5.9	114.8	P828 K830 F840	P828-R838 WeakPolarHBondContact O-CG 3.39Å; P828-R838 PolarHBondContact O-N 2.79Å; K830-R838 HydrophobicContact CB-CG 4.49Å; R838-F840 HydrophobicContact CB-CD1 3.96Å; R838-F840 HydrophobicContact CB-CE1 3.5Å; R838-F840 HydrophobicContact CB-CZ 4.22Å; R838-F840 WeakPolarHBondContact O-CD1 3.39Å
839	G	88	Confident	83.6	Confident	12 Å²	12	69.3 Å²	69.3	12%	0.124	39%	0.386	C	S	.	.	S	Bend	trans	87.1	12.1	174.7	0	0	0	0	0	114.3	N802 V803 H837	N802-G839 PolarHBondContact N-O 2.92Å; V803-G839 PolarHBondContact N-O 3.36Å; H837-G839 PolarHBondContact ND1-N 3.35Å; H837-G839 PolarHBondContact O-N 3.3Å
840	F	92.3	Very high	83.8	Confident	42 Å²	42	64.5 Å²	64.5	18%	0.184	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	154.2	175.4	64.3	-90.4	0	0	0	111.4	L799 V800 R801 P828 R838 F842	L799-F840 HydrophobicContact CD1-CB 4.15Å; L799-F840 HydrophobicContact CD1-CD2 4Å; L799-F840 HydrophobicContact CD1-CG 4.46Å; V800-F840 CarbonylContact O-C 3.47Å; V800-F840 WeakPolarHBondContact O-CA 3.4Å; V800-F840 VanDerWaalsContact O-CB 3.31Å; V800-F840 WeakPolarHBondContact O-CB 3.42Å; R801-F840 HydrophobicContact CG-CB 4.22Å; P828-F840 WeakPolarHBondContact CD-O 3.41Å; P828-F840 HydrophobicContact CG-CD2 4.5Å; P828-F840 HydrophobicContact CG-CE2 3.9Å; P828-F840 HydrophobicContact CG-CZ 4.41Å; R838-F840 HydrophobicContact CB-CD1 3.96Å; R838-F840 HydrophobicContact CB-CE1 3.5Å; R838-F840 HydrophobicContact CB-CZ 4.22Å; R838-F840 WeakPolarHBondContact O-CD1 3.39Å; F840-F842 HydrophobicContact CD2-CE2 4.16Å; F840-F842 HydrophobicContact CD2-CZ 4.47Å; F840-F842 AromaticContact CE2-CE2 3.83Å; F840-F842 HydrophobicContact CE2-CE2 3.83Å; F840-F842 HydrophobicContact CE2-CZ 4.2Å
841	A	92.8	Very high	84.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	155.2	177.9	0	0	0	0	0	110.9	V800 V803 I812 R826 L827	V800-A841 HydrophobicContact CB-CB 4.41Å; V800-A841 PolarHBondContact N-O 3.29Å; V800-A841 PolarHBondContact O-N 3.07Å; V803-A841 HydrophobicContact CG2-CB 4.44Å; I812-A841 HydrophobicContact CD1-CB 4Å; I812-A841 HydrophobicContact CG2-CB 4.23Å; R826-A841 CarbonylContact O-C 3.54Å; R826-A841 VanDerWaalsContact O-CA 3.3Å; R826-A841 WeakPolarHBondContact O-CA 3.38Å; L827-A841 HydrophobicContact CD1-CB 3.92Å
842	F	93.3	Very high	85.2	Confident	17 Å²	17	59.4 Å²	59.4	8%	0.075	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	132	166.2	-60.7	-83.1	0	0	0	109.3	K797 I798 L799 V825 R826 P828 F840 V880 L883	K797-F842 HydrophobicContact CD-CD1 4.18Å; I798-F842 WeakPolarHBondContact O-CA 3.46Å; L799-F842 HydrophobicContact CB-CD1 4.4Å; L799-F842 HydrophobicContact CB-CE1 4.43Å; L799-F842 HydrophobicContact CD1-CD1 4.08Å; L799-F842 HydrophobicContact CD1-CE1 3.83Å; L799-F842 HydrophobicContact CD1-CZ 4.25Å; L799-F842 HydrophobicContact CD2-CE1 4.49Å; L799-F842 HydrophobicContact CG-CE1 4.47Å; V825-F842 WeakPolarHBondContact CA-O 3.45Å; R826-F842 PolarHBondContact N-O 3.06Å; R826-F842 PolarHBondContact O-N 2.7Å; P828-F842 HydrophobicContact CG-CE2 4.42Å; F840-F842 HydrophobicContact CD2-CE2 4.16Å; F840-F842 HydrophobicContact CD2-CZ 4.47Å; F840-F842 AromaticContact CE2-CE2 3.83Å; F840-F842 HydrophobicContact CE2-CE2 3.83Å; F840-F842 HydrophobicContact CE2-CZ 4.2Å; F842-V880 HydrophobicContact CE2-CG2 4.34Å; F842-L883 HydrophobicContact CZ-CD2 4.35Å
843	V	93.8	Very high	86.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	119.7	176.4	-178.6	0	0	0	0	107.3	K797 I798 V800 I812 F816 L822 V825 F845	K797-V843 CarbonylContact C-O 3.51Å; K797-V843 WeakPolarHBondContact CA-O 3.12Å; I798-V843 PolarHBondContact N-O 2.76Å; I798-V843 PolarHBondContact O-N 3.17Å; V800-V843 HydrophobicContact CG2-CG2 4.06Å; I812-V843 HydrophobicContact CG2-CG2 4.03Å; F816-V843 HydrophobicContact CB-CG1 3.96Å; F816-V843 HydrophobicContact CD1-CB 4.33Å; F816-V843 HydrophobicContact CD1-CG1 3.9Å; F816-V843 HydrophobicContact CD1-CG2 4.25Å; F816-V843 HydrophobicContact CD2-CG2 4.3Å; F816-V843 HydrophobicContact CE1-CG2 4.46Å; F816-V843 HydrophobicContact CG-CG1 4.02Å; F816-V843 HydrophobicContact CG-CG2 4.17Å; L822-V843 HydrophobicContact CD1-CG1 4.41Å; L822-V843 HydrophobicContact CD2-CG1 3.51Å; V825-V843 HydrophobicContact CG1-CG2 4.47Å; V843-F845 HydrophobicContact CG1-CD2 4.15Å; V843-F845 HydrophobicContact CG1-CE2 3.7Å; V843-F845 HydrophobicContact CG1-CZ 4.3Å
844	D	93.1	Very high	88	Confident	31 Å²	31	58.2 Å²	58.2	17%	0.166	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	114.7	179	-173.1	35	0	0	0	110.1	K797 K823 T824	K797-D844 HydrophobicContact CB-CB 4.39Å; K797-D844 HydrophobicContact CG-CB 4.27Å; K823-D844 WeakPolarHBondContact CB-O 3.5Å; K823-D844 VanDerWaalsContact CD-OD2 3.26Å; K823-D844 WeakPolarHBondContact CD-OD2 3.45Å; K823-D844 PolarHBondContact N-O 2.78Å; K823-D844 IonicContact NZ-OD2 3.25Å; T824-D844 PolarHBondContact N-O 2.88Å; T824-D844 PolarHBondContact O-N 3.03Å
845	F	94.1	Very high	89.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	157.2	-178.6	-78.1	-95.2	0	0	0	112.4	S796 I798 F816 F819 E821 L822 K823 V843 T847 D850 A851 A854	S796-F845 WeakPolarHBondContact CB-O 3.42Å; S796-F845 PolarHBondContact O-N 3.04Å; S796-F845 VanDerWaalsContact O-N 3.13Å; I798-F845 HydrophobicContact CD1-CD2 4.39Å; I798-F845 HydrophobicContact CD1-CE2 3.89Å; F816-F845 HydrophobicContact CB-CZ 4.13Å; F816-F845 HydrophobicContact CD1-CE2 4.02Å; F816-F845 AromaticContact CD1-CZ 3.97Å; F816-F845 HydrophobicContact CD1-CZ 3.97Å; F819-F845 HydrophobicContact CB-CE1 4.43Å; E821-F845 CarbonylContact O-C 3.55Å; E821-F845 WeakPolarHBondContact O-CA 3.37Å; L822-F845 HydrophobicContact CD2-CD1 3.55Å; L822-F845 HydrophobicContact CD2-CD2 4.01Å; L822-F845 HydrophobicContact CD2-CE1 3.4Å; L822-F845 HydrophobicContact CD2-CE2 3.86Å; L822-F845 HydrophobicContact CD2-CG 3.87Å; L822-F845 HydrophobicContact CD2-CZ 3.56Å; L822-F845 HydrophobicContact CG-CE1 4.5Å; K823-F845 VanDerWaalsContact CD-O 3.3Å; K823-F845 WeakPolarHBondContact CD-O 3.07Å; K823-F845 WeakPolarHBondContact CE-O 3.22Å; K823-F845 PolarHBondContact NZ-O 3.24Å; V843-F845 HydrophobicContact CG1-CD2 4.15Å; V843-F845 HydrophobicContact CG1-CE2 3.7Å; V843-F845 HydrophobicContact CG1-CZ 4.3Å; F845-T847 WeakPolarHBondContact CB-O 3.43Å; F845-D850 HydrophobicContact CB-CB 4.43Å; F845-D850 HydrophobicContact CD1-CB 3.53Å; F845-D850 HydrophobicContact CE1-CB 4.11Å; F845-D850 HydrophobicContact CG-CB 4.23Å; F845-A851 HydrophobicContact CB-CB 4.03Å; F845-A851 HydrophobicContact CD2-CB 3.78Å; F845-A851 HydrophobicContact CG-CB 4.04Å; F845-A854 HydrophobicContact CE1-CB 4.17Å; F845-A854 HydrophobicContact CE2-CB 3.82Å; F845-A854 HydrophobicContact CZ-CB 3.37Å
846	L	92.7	Very high	90.2	Very high	93 Å²	93	57.9 Å²	57.9	49%	0.487	27%	0.272	S	S	.	.	S	Bend	trans	-60.3	-53.8	172.1	-171.5	59.2	0	0	0	110.5	E821 K823	E821-L846 HydrophobicContact CB-CB 3.99Å; E821-L846 HydrophobicContact CB-CD2 4.31Å; E821-L846 PolarHBondContact O-N 3.12Å; E821-L846 VanDerWaalsContact OE2-CD2 3.22Å; E821-L846 WeakPolarHBondContact OE2-CD2 3.37Å; K823-L846 WeakPolarHBondContact CE-O 3.26Å; K823-L846 HydrophobicContact CG-CD1 4.23Å
847	T	92.1	Very high	90.5	Very high	57 Å²	57	54.6 Å²	54.6	35%	0.35	26%	0.257	S	S	.	.	S	Bend	trans	-108.7	158.8	179.1	92.6	0	0	0	0	113.6	F845 R849 D850	F845-T847 WeakPolarHBondContact CB-O 3.43Å; T847-R849 PolarHBondContact O-N 3.04Å; T847-R849 PolarHBondContact OG1-N 2.78Å; T847-R849 VanDerWaalsContact OG1-N 3.13Å; T847-D850 VanDerWaalsContact CB-OD2 3.26Å; T847-D850 WeakPolarHBondContact CB-OD2 3.46Å; T847-D850 VanDerWaalsContact CG2-OD2 3.26Å; T847-D850 WeakPolarHBondContact CG2-OD2 3.32Å; T847-D850 PolarHBondContact N-OD2 3.3Å; T847-D850 PolarHBondContact OG1-N 2.89Å; T847-D850 PolarHBondContact OG1-OD1 2.93Å; T847-D850 PolarHBondContact OG1-OD2 2.95Å
848	K	90.5	Very high	90.3	Very high	133 Å²	133	54 Å²	54	58%	0.578	25%	0.254	S	S	*	.	H	α-helix	trans	-71.3	-16.8	172.3	-67.1	-177.2	-179.7	-176.2	0	113.2	Q793 S796 K852	Q793-K848 PolarHBondContact NE2-O 3.34Å; S796-K848 VanDerWaalsContact OG-CG 3.3Å; S796-K848 WeakPolarHBondContact OG-CG 3.28Å; K848-K852 PolarHBondContact O-N 2.59Å
849	R	91.1	Very high	90.1	Very high	214 Å²	214	49.1 Å²	49.1	81%	0.808	24%	0.24	S	C	*	.	H	α-helix	trans	-78	-46.6	-179.9	-65.7	179.3	179.3	160.4	-1.1	110.2	T847 A851 K852 K853	T847-R849 PolarHBondContact O-N 3.04Å; T847-R849 PolarHBondContact OG1-N 2.78Å; T847-R849 VanDerWaalsContact OG1-N 3.13Å; R849-A851 PolarHBondContact O-N 3.08Å; R849-K852 CarbonylContact O-C 3.38Å; R849-K852 WeakPolarHBondContact O-CA 3.3Å; R849-K852 WeakPolarHBondContact O-CB 3.45Å; R849-K852 PolarHBondContact O-N 2.93Å; R849-K853 PolarHBondContact O-N 3.31Å
850	D	92	Very high	89.2	Confident	39 Å²	39	52.1 Å²	52.1	21%	0.209	25%	0.25	C	S	.	.	H	α-helix	trans	-64.2	-43.4	-179.9	-43.8	-39.2	0	0	0	110.7	F845 T847 K852 K853 A854	F845-D850 HydrophobicContact CB-CB 4.43Å; F845-D850 HydrophobicContact CD1-CB 3.53Å; F845-D850 HydrophobicContact CE1-CB 4.11Å; F845-D850 HydrophobicContact CG-CB 4.23Å; T847-D850 VanDerWaalsContact CB-OD2 3.26Å; T847-D850 WeakPolarHBondContact CB-OD2 3.46Å; T847-D850 VanDerWaalsContact CG2-OD2 3.26Å; T847-D850 WeakPolarHBondContact CG2-OD2 3.32Å; T847-D850 PolarHBondContact N-OD2 3.3Å; T847-D850 PolarHBondContact OG1-N 2.89Å; T847-D850 PolarHBondContact OG1-OD1 2.93Å; T847-D850 PolarHBondContact OG1-OD2 2.95Å; D850-K852 VanDerWaalsContact C-N 3.26Å; D850-K852 PolarHBondContact O-N 3.33Å; D850-K853 WeakPolarHBondContact O-CB 3.47Å; D850-K853 PolarHBondContact O-N 3.4Å; D850-K853 VanDerWaalsContact O-N 3.15Å; D850-A854 WeakPolarHBondContact O-CB 3.47Å; D850-A854 PolarHBondContact O-N 3.43Å
851	A	90.6	Very high	88.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.1	-41.6	170.8	0	0	0	0	0	112.3	S796 I798 F845 R849 F855 W873	S796-A851 WeakPolarHBondContact O-CB 3.33Å; I798-A851 WeakPolarHBondContact CD1-O 3.46Å; F845-A851 HydrophobicContact CB-CB 4.03Å; F845-A851 HydrophobicContact CD2-CB 3.78Å; F845-A851 HydrophobicContact CG-CB 4.04Å; R849-A851 PolarHBondContact O-N 3.08Å; A851-F855 WeakPolarHBondContact O-CB 3.35Å; A851-F855 PolarHBondContact O-N 2.78Å; A851-W873 HydrophobicContact CB-CH2 4.12Å; A851-W873 HydrophobicContact CB-CZ3 3.97Å
852	K	90.6	Very high	87.7	Confident	130 Å²	130	50.4 Å²	50.4	57%	0.565	24%	0.243	S	C	*	.	H	α-helix	trans	-70.6	-37.4	178.3	-169.2	179.9	178.8	-176.9	0	112	K848 R849 D850 A856 W873	K848-K852 PolarHBondContact O-N 2.59Å; R849-K852 CarbonylContact O-C 3.38Å; R849-K852 WeakPolarHBondContact O-CA 3.3Å; R849-K852 WeakPolarHBondContact O-CB 3.45Å; R849-K852 PolarHBondContact O-N 2.93Å; D850-K852 VanDerWaalsContact C-N 3.26Å; D850-K852 PolarHBondContact O-N 3.33Å; K852-A856 WeakPolarHBondContact O-CB 3.31Å; K852-A856 PolarHBondContact O-N 3.07Å; K852-W873 HydrophobicContact CB-CH2 4.41Å
853	K	89.2	Confident	87.4	Confident	125 Å²	125	50.7 Å²	50.7	54%	0.543	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-51.3	174.1	-172.2	-169.8	175.2	-168.4	0	110.9	F819 R849 D850 F855 A856 A857	F819-K853 HydrophobicContact CD1-CD 4.49Å; F819-K853 HydrophobicContact CD1-CG 4.28Å; R849-K853 PolarHBondContact O-N 3.31Å; D850-K853 WeakPolarHBondContact O-CB 3.47Å; D850-K853 PolarHBondContact O-N 3.4Å; D850-K853 VanDerWaalsContact O-N 3.15Å; K853-F855 PolarHBondContact O-N 2.92Å; K853-A856 PolarHBondContact O-N 3.07Å; K853-A857 PolarHBondContact O-N 2.86Å; K853-A857 VanDerWaalsContact O-N 3.16Å
854	A	90.2	Very high	87.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-45.1	176.6	0	0	0	0	0	111.9	I798 F816 F819 F845 D850 L858	I798-A854 HydrophobicContact CD1-CB 4.28Å; F816-A854 HydrophobicContact CD1-CB 4.34Å; F819-A854 HydrophobicContact CB-CB 3.61Å; F819-A854 HydrophobicContact CD2-CB 4.26Å; F819-A854 HydrophobicContact CG-CB 3.9Å; F845-A854 HydrophobicContact CE1-CB 4.17Å; F845-A854 HydrophobicContact CE2-CB 3.82Å; F845-A854 HydrophobicContact CZ-CB 3.37Å; D850-A854 WeakPolarHBondContact O-CB 3.47Å; D850-A854 PolarHBondContact O-N 3.43Å; A854-L858 HydrophobicContact CB-CD1 4.48Å; A854-L858 VanDerWaalsContact O-CB 3.27Å; A854-L858 WeakPolarHBondContact O-CB 3.4Å; A854-L858 WeakPolarHBondContact O-CG 3.28Å; A854-L858 PolarHBondContact O-N 2.75Å
855	F	89.9	Confident	86.7	Confident	41 Å²	41	53.8 Å²	53.8	18%	0.18	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-48	177.1	-168.1	-83.1	0	0	0	111.6	I798 A851 K853 A857 C859 L871 W873	I798-F855 HydrophobicContact CD1-CB 4.14Å; I798-F855 HydrophobicContact CD1-CD2 4.41Å; I798-F855 HydrophobicContact CG2-CD2 4.35Å; A851-F855 WeakPolarHBondContact O-CB 3.35Å; A851-F855 PolarHBondContact O-N 2.78Å; K853-F855 PolarHBondContact O-N 2.92Å; F855-A857 PolarHBondContact O-N 3.47Å; F855-C859 HydrophobicContact CD1-CB 4.14Å; F855-C859 HydrophobicContact CE1-CB 3.98Å; F855-C859 HydrophobicContact CZ-CB 4.34Å; F855-C859 WeakPolarHBondContact O-CB 3.42Å; F855-C859 PolarHBondContact O-N 3.33Å; F855-L871 HydrophobicContact CD2-CB 4.03Å; F855-L871 HydrophobicContact CD2-CD2 4.35Å; F855-L871 HydrophobicContact CE2-CB 3.82Å; F855-W873 HydrophobicContact CB-CH2 4.02Å; F855-W873 HydrophobicContact CB-CZ2 3.69Å; F855-W873 HydrophobicContact CD1-CZ2 4.08Å; F855-W873 AromaticContact CD1-NE1 3.93Å; F855-W873 HydrophobicContact CD2-CD2 4.23Å; F855-W873 AromaticContact CD2-CE2 3.76Å; F855-W873 AromaticContact CD2-CZ2 3.93Å; F855-W873 HydrophobicContact CD2-CZ2 3.93Å; F855-W873 AromaticContact CD2-NE1 3.89Å; F855-W873 AromaticContact CE1-NE1 3.78Å; F855-W873 AromaticContact CE2-CD1 3.95Å; F855-W873 HydrophobicContact CE2-CD2 4.4Å; F855-W873 HydrophobicContact CE2-CG 4.34Å; F855-W873 AromaticContact CE2-NE1 3.74Å; F855-W873 AromaticContact CG-CE2 3.83Å; F855-W873 HydrophobicContact CG-CH2 4.33Å; F855-W873 AromaticContact CG-CZ2 3.62Å; F855-W873 HydrophobicContact CG-CZ2 3.62Å; F855-W873 AromaticContact CG-NE1 3.99Å; F855-W873 AromaticContact CZ-CD1 3.99Å; F855-W873 AromaticContact CZ-NE1 3.7Å
856	A	85.8	Confident	86	Confident	55 Å²	55	56.2 Å²	56.2	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-61.3	-42	-177.5	0	0	0	0	0	113.1	K852 K853 H860	K852-A856 WeakPolarHBondContact O-CB 3.31Å; K852-A856 PolarHBondContact O-N 3.07Å; K853-A856 PolarHBondContact O-N 3.07Å; A856-H860 PolarHBondContact O-CE1 2.94Å; A856-H860 PolarHBondContact O-ND1 3.21Å
857	A	83.9	Confident	85.7	Confident	13 Å²	13	56.5 Å²	56.5	11%	0.107	28%	0.275	C	S	.	.	H	α-helix	trans	-69.9	-58.2	175.8	0	0	0	0	0	111.6	T553 F819 K853 F855 C859	T553-A857 HydrophobicContact CG2-CB 4.28Å; F819-A857 HydrophobicContact CD1-CB 4.29Å; F819-A857 HydrophobicContact CE1-CB 3.46Å; F819-A857 VanDerWaalsContact CE1-CB 3.46Å; F819-A857 HydrophobicContact CZ-CB 3.89Å; K853-A857 PolarHBondContact O-N 2.86Å; K853-A857 VanDerWaalsContact O-N 3.16Å; F855-A857 PolarHBondContact O-N 3.47Å; A857-C859 PolarHBondContact O-N 2.75Å
858	L	85.8	Confident	85.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-78.1	-19.1	-166.5	-60.2	169.8	0	0	0	114.4	T553 L815 F816 F819 A854 H860 T862 L871	T553-L858 HydrophobicContact CG2-CD2 4.2Å; L815-L858 HydrophobicContact CD1-CD2 4.21Å; F816-L858 HydrophobicContact CD1-CD1 3.75Å; F816-L858 HydrophobicContact CD2-CD1 4.27Å; F816-L858 HydrophobicContact CE1-CD1 3.47Å; F816-L858 VanDerWaalsContact CE1-CD1 3.47Å; F816-L858 HydrophobicContact CE2-CD1 4.01Å; F816-L858 HydrophobicContact CG-CD1 4.15Å; F816-L858 HydrophobicContact CZ-CD1 3.6Å; F819-L858 HydrophobicContact CD2-CD1 4.03Å; F819-L858 HydrophobicContact CD2-CG 4.46Å; F819-L858 HydrophobicContact CE2-CD1 3.76Å; F819-L858 HydrophobicContact CE2-CD2 3.76Å; F819-L858 HydrophobicContact CE2-CG 3.8Å; F819-L858 HydrophobicContact CZ-CD1 4.46Å; F819-L858 HydrophobicContact CZ-CD2 3.95Å; F819-L858 HydrophobicContact CZ-CG 4.03Å; A854-L858 HydrophobicContact CB-CD1 4.48Å; A854-L858 VanDerWaalsContact O-CB 3.27Å; A854-L858 WeakPolarHBondContact O-CB 3.4Å; A854-L858 WeakPolarHBondContact O-CG 3.28Å; A854-L858 PolarHBondContact O-N 2.75Å; L858-H860 VanDerWaalsContact C-N 3.27Å; L858-H860 PolarHBondContact O-N 3.45Å; L858-T862 WeakPolarHBondContact CA-OG1 3.48Å; L858-T862 HydrophobicContact CD2-CG2 3.97Å; L858-T862 VanDerWaalsContact CD2-OG1 3.27Å; L858-T862 WeakPolarHBondContact CD2-OG1 3.5Å; L858-T862 PolarHBondContact O-OG1 2.71Å; L858-L871 HydrophobicContact CB-CD1 4.21Å; L858-L871 HydrophobicContact CB-CD2 3.67Å
859	C	80	Confident	85.3	Confident	30 Å²	30	51.6 Å²	51.6	20%	0.203	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-23.1	-176	-175.9	0	0	0	0	113.9	F855 A857 R868 L871	F855-C859 HydrophobicContact CD1-CB 4.14Å; F855-C859 HydrophobicContact CE1-CB 3.98Å; F855-C859 HydrophobicContact CZ-CB 4.34Å; F855-C859 WeakPolarHBondContact O-CB 3.42Å; F855-C859 PolarHBondContact O-N 3.33Å; A857-C859 PolarHBondContact O-N 2.75Å; C859-R868 PolarHBondContact O-NH2 2.79Å; C859-L871 HydrophobicContact CB-CB 4.45Å
860	H	69.8	Low	85.2	Confident	74 Å²	74	44 Å²	44	34%	0.343	22%	0.224	S	C	.	.	H	α-helix	trans	-83.7	-54.5	-169.5	-68.5	100.8	0	0	0	113.8	R560 A856 L858 R868	R560-H860 PolarHBondContact NH1-CD2 3.37Å; A856-H860 PolarHBondContact O-CE1 2.94Å; A856-H860 PolarHBondContact O-ND1 3.21Å; L858-H860 VanDerWaalsContact C-N 3.27Å; L858-H860 PolarHBondContact O-N 3.45Å; H860-R868 VanDerWaalsContact O-CZ 3.22Å; H860-R868 PolarHBondContact O-NE 2.82Å; H860-R868 PolarHBondContact O-NH2 2.91Å
861	S	71	Confident	85.2	Confident	5 Å²	5	42.6 Å²	42.6	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-151.2	13.7	-169	-60.1	0	0	0	0	116.4	H863	S861-H863 PolarHBondContact O-CE1 3.4Å; S861-H863 PolarHBondContact O-N 3.49Å; S861-H863 PolarHBondContact O-ND1 3.18Å
862	T	83.3	Confident	85.1	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.006	22%	0.223	C	C	.	.			trans	-67.6	122	179.6	-50.6	0	0	0	0	111.8	A549 T553 L815 L858 R868 L869	A549-T862 HydrophobicContact CB-CG2 4.05Å; T553-T862 WeakPolarHBondContact OG1-CB 3.42Å; T553-T862 WeakPolarHBondContact OG1-CG2 3.36Å; T553-T862 PolarHBondContact OG1-OG1 3.37Å; L815-T862 HydrophobicContact CD1-CG2 4.47Å; L858-T862 WeakPolarHBondContact CA-OG1 3.48Å; L858-T862 HydrophobicContact CD2-CG2 3.97Å; L858-T862 VanDerWaalsContact CD2-OG1 3.27Å; L858-T862 WeakPolarHBondContact CD2-OG1 3.5Å; L858-T862 PolarHBondContact O-OG1 2.71Å; T862-R868 WeakPolarHBondContact O-CA 3.47Å; T862-L869 HydrophobicContact CG2-CD1 4.24Å; T862-L869 PolarHBondContact O-N 3.02Å
863	H	85.9	Confident	85.1	Confident	23 Å²	23	38.9 Å²	38.9	11%	0.106	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.9	168.3	-55.2	77.7	0	0	0	110.3	F514 A549 E552 S861 R867 R868	F514-H863 AromaticContact CD2-CE1 3.51Å; F514-H863 AromaticContact CD2-ND1 3.84Å; F514-H863 AromaticContact CD2-NE2 3.65Å; F514-H863 AromaticContact CE2-CD2 3.96Å; A549-H863 WeakPolarHBondContact CB-O 3.33Å; E552-H863 IonicContact OE1-CE1 3.83Å; E552-H863 IonicContact OE1-CG 3.42Å; E552-H863 IonicContact OE1-ND1 2.72Å; E552-H863 PolarHBondContact OE1-ND1 3.34Å; E552-H863 WeakPolarHBondContact OE2-CB 3.29Å; E552-H863 IonicContact OE2-CG 3.53Å; E552-H863 PolarHBondContact OE2-N 2.8Å; E552-H863 IonicContact OE2-ND1 3.05Å; E552-H863 PolarHBondContact OE2-ND1 3.2Å; S861-H863 PolarHBondContact O-CE1 3.4Å; S861-H863 PolarHBondContact O-N 3.49Å; S861-H863 PolarHBondContact O-ND1 3.18Å; H863-R867 WeakPolarHBondContact CA-O 3.28Å; H863-R868 VanDerWaalsContact CD2-CA 3.41Å; H863-R868 WeakPolarHBondContact CD2-CA 3.47Å; H863-R868 PolarHBondContact CD2-N 3.1Å; H863-R868 WeakPolarHBondContact NE2-CB 3.43Å
864	L	87.3	Confident	84.8	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.8	168.4	-169.4	66.9	0	0	0	106.8	A545 A549 P804 A807 G866 R867 L869	A545-L864 HydrophobicContact CB-CD1 4.21Å; A549-L864 HydrophobicContact CB-CD1 4.15Å; P804-L864 HydrophobicContact CG-CB 4.14Å; P804-L864 HydrophobicContact CG-CG 4.4Å; P804-L864 WeakPolarHBondContact CG-O 3Å; A807-L864 HydrophobicContact CB-CD2 3.74Å; L864-G866 PolarHBondContact O-N 2.84Å; L864-G866 VanDerWaalsContact O-N 3.08Å; L864-R867 PolarHBondContact N-O 2.8Å; L864-R867 PolarHBondContact O-N 3.09Å; L864-L869 HydrophobicContact CB-CD2 4.26Å; L864-L869 HydrophobicContact CB-CG 4.45Å
865	Y	85.4	Confident	84.2	Confident	96 Å²	96	35.6 Å²	35.6	38%	0.376	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	43	42.8	-171.5	-60	-75.8	0	0	0	113.8	A545 P804 Q806 A807 E811 R867	A545-Y865 HydrophobicContact CB-CD1 4.25Å; A545-Y865 HydrophobicContact CB-CE1 3.68Å; A545-Y865 HydrophobicContact CB-CE2 4.06Å; P804-Y865 HydrophobicContact CB-CD2 4.12Å; P804-Y865 HydrophobicContact CB-CG 4.5Å; P804-Y865 HydrophobicContact CG-CD2 4.11Å; Q806-Y865 HydrophobicContact CB-CD2 4.4Å; Q806-Y865 HydrophobicContact CB-CE2 4.34Å; A807-Y865 HydrophobicContact CB-CD2 4.29Å; A807-Y865 HydrophobicContact CB-CE2 4.08Å; E811-Y865 PolarHBondContact OE1-OH 3.29Å; Y865-R867 VanDerWaalsContact C-N 3.29Å; Y865-R867 PolarHBondContact O-N 3.38Å
866	G	79.8	Confident	82.8	Confident	51 Å²	51	37.9 Å²	37.9	53%	0.526	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	11.5	-179.6	0	0	0	0	0	116.1	L864	L864-G866 PolarHBondContact O-N 2.84Å; L864-G866 VanDerWaalsContact O-N 3.08Å
867	R	85.1	Confident	81.4	Confident	98 Å²	98	42.9 Å²	42.9	37%	0.37	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.3	173.3	-52	-174.7	-176.2	-179.9	-0.7	111	P804 H863 L864 Y865 L869	P804-R867 HydrophobicContact CG-CB 4.16Å; P804-R867 HydrophobicContact CG-CG 4.33Å; H863-R867 WeakPolarHBondContact CA-O 3.28Å; L864-R867 PolarHBondContact N-O 2.8Å; L864-R867 PolarHBondContact O-N 3.09Å; Y865-R867 VanDerWaalsContact C-N 3.29Å; Y865-R867 PolarHBondContact O-N 3.38Å; R867-L869 PolarHBondContact O-N 3.14Å
868	R	85.8	Confident	79.9	Confident	83 Å²	83	43.3 Å²	43.3	31%	0.313	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	126.1	178.9	-163.4	-174.4	169.8	-81.8	13.9	110.1	N802 C859 H860 T862 H863	N802-R868 PolarHBondContact ND2-O 2.9Å; C859-R868 PolarHBondContact O-NH2 2.79Å; H860-R868 VanDerWaalsContact O-CZ 3.22Å; H860-R868 PolarHBondContact O-NE 2.82Å; H860-R868 PolarHBondContact O-NH2 2.91Å; T862-R868 WeakPolarHBondContact O-CA 3.47Å; H863-R868 VanDerWaalsContact CD2-CA 3.41Å; H863-R868 WeakPolarHBondContact CD2-CA 3.47Å; H863-R868 PolarHBondContact CD2-N 3.1Å; H863-R868 WeakPolarHBondContact NE2-CB 3.43Å
869	L	89.6	Confident	78.7	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	25%	0.251	C	S	.	.			trans	-69.7	146.5	170.8	-59.7	-178.9	0	0	0	109.8	V800 V803 L815 T862 L864 R867 L871	V800-L869 HydrophobicContact CG1-CB 4.18Å; V800-L869 HydrophobicContact CG1-CD1 4.29Å; V800-L869 HydrophobicContact CG1-CD2 4.15Å; V800-L869 HydrophobicContact CG1-CG 4.44Å; V803-L869 HydrophobicContact CG2-CD2 4.49Å; L815-L869 HydrophobicContact CD2-CD1 3.71Å; T862-L869 HydrophobicContact CG2-CD1 4.24Å; T862-L869 PolarHBondContact O-N 3.02Å; L864-L869 HydrophobicContact CB-CD2 4.26Å; L864-L869 HydrophobicContact CB-CG 4.45Å; R867-L869 PolarHBondContact O-N 3.14Å; L869-L871 HydrophobicContact CB-CD1 3.92Å
870	V	89.3	Confident	77.8	Confident	56 Å²	56	47.2 Å²	47.2	34%	0.339	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	104.4	176.9	176.5	0	0	0	0	108	R801 N802	R801-V870 HydrophobicContact CB-CB 4.25Å; R801-V870 PolarHBondContact N-O 3.45Å; R801-V870 PolarHBondContact O-N 2.88Å; N802-V870 HydrophobicContact CB-CG2 4.29Å
871	L	90.2	Very high	77.3	Confident	9 Å²	9	49.1 Å²	49.1	5%	0.047	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.7	-178.8	-76	71.5	0	0	0	110.2	I798 V800 F816 F855 L858 C859 L869	I798-L871 HydrophobicContact CG2-CB 4.13Å; I798-L871 HydrophobicContact CG2-CD2 4.07Å; I798-L871 HydrophobicContact CG2-CG 4.03Å; V800-L871 HydrophobicContact CG1-CD1 4.47Å; F816-L871 HydrophobicContact CE1-CD2 4.08Å; F816-L871 HydrophobicContact CZ-CD2 4.2Å; F816-L871 HydrophobicContact CZ-CG 4.49Å; F855-L871 HydrophobicContact CD2-CB 4.03Å; F855-L871 HydrophobicContact CD2-CD2 4.35Å; F855-L871 HydrophobicContact CE2-CB 3.82Å; L858-L871 HydrophobicContact CB-CD1 4.21Å; L858-L871 HydrophobicContact CB-CD2 3.67Å; C859-L871 HydrophobicContact CB-CB 4.45Å; L869-L871 HydrophobicContact CB-CD1 3.92Å
872	E	90.1	Very high	77	Confident	31 Å²	31	51 Å²	51	15%	0.145	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	150.9	166.8	-74.1	-172.7	-172.6	0	0	110	Q788 L799 R801 A874	Q788-E872 PolarHBondContact NE2-OE1 3.12Å; L799-E872 PolarHBondContact N-O 3.02Å; L799-E872 PolarHBondContact O-N 2.96Å; R801-E872 IonicContact CZ-OE1 3.94Å; R801-E872 IonicContact CZ-OE2 3.57Å; R801-E872 IonicContact NH1-OE1 3.83Å; R801-E872 PolarHBondContact NH1-OE1 3.22Å; R801-E872 IonicContact NH1-OE2 2.72Å; R801-E872 PolarHBondContact NH1-OE2 2.78Å; R801-E872 IonicContact NH2-OE1 2.67Å; R801-E872 IonicContact NH2-OE2 2.65Å; R801-E872 PolarHBondContact NH2-OE2 3.37Å; E872-A874 PolarHBondContact O-N 3.11Å
873	W	89.9	Confident	75.9	Confident	21 Å²	21	53.2 Å²	53.2	8%	0.08	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	128.8	165.9	-68	105.5	0	0	0	109.7	K791 Q793 G795 I798 A851 K852 F855	K791-W873 VanDerWaalsContact O-CD1 3.23Å; Q793-W873 HydrophobicContact CB-CD2 4.25Å; Q793-W873 HydrophobicContact CB-CZ2 4.13Å; Q793-W873 HydrophobicContact CG-CD2 4.02Å; Q793-W873 HydrophobicContact CG-CE3 3.92Å; Q793-W873 HydrophobicContact CG-CH2 3.72Å; Q793-W873 HydrophobicContact CG-CZ2 3.82Å; Q793-W873 HydrophobicContact CG-CZ3 3.77Å; G795-W873 WeakPolarHBondContact O-CZ3 3.46Å; I798-W873 HydrophobicContact CG1-CE3 4.5Å; I798-W873 HydrophobicContact CG1-CZ3 4.2Å; A851-W873 HydrophobicContact CB-CH2 4.12Å; A851-W873 HydrophobicContact CB-CZ3 3.97Å; K852-W873 HydrophobicContact CB-CH2 4.41Å; F855-W873 HydrophobicContact CB-CH2 4.02Å; F855-W873 HydrophobicContact CB-CZ2 3.69Å; F855-W873 HydrophobicContact CD1-CZ2 4.08Å; F855-W873 AromaticContact CD1-NE1 3.93Å; F855-W873 HydrophobicContact CD2-CD2 4.23Å; F855-W873 AromaticContact CD2-CE2 3.76Å; F855-W873 AromaticContact CD2-CZ2 3.93Å; F855-W873 HydrophobicContact CD2-CZ2 3.93Å; F855-W873 AromaticContact CD2-NE1 3.89Å; F855-W873 AromaticContact CE1-NE1 3.78Å; F855-W873 AromaticContact CE2-CD1 3.95Å; F855-W873 HydrophobicContact CE2-CD2 4.4Å; F855-W873 HydrophobicContact CE2-CG 4.34Å; F855-W873 AromaticContact CE2-NE1 3.74Å; F855-W873 AromaticContact CG-CE2 3.83Å; F855-W873 HydrophobicContact CG-CH2 4.33Å; F855-W873 AromaticContact CG-CZ2 3.62Å; F855-W873 HydrophobicContact CG-CZ2 3.62Å; F855-W873 AromaticContact CG-NE1 3.99Å; F855-W873 AromaticContact CZ-CD1 3.99Å; F855-W873 AromaticContact CZ-NE1 3.7Å
874	A	82.3	Confident	74.8	Confident	5 Å²	5	59.2 Å²	59.2	4%	0.041	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-75.8	136.4	177	0	0	0	0	0	110.3	T794 K797 L799 E872	T794-A874 PolarHBondContact OG1-O 2.83Å; K797-A874 HydrophobicContact CB-CB 4.1Å; K797-A874 HydrophobicContact CD-CB 3.78Å; K797-A874 HydrophobicContact CG-CB 3.87Å; K797-A874 WeakPolarHBondContact O-CB 3.39Å; K797-A874 PolarHBondContact O-N 2.69Å; K797-A874 VanDerWaalsContact O-N 3.12Å; L799-A874 HydrophobicContact CB-CB 4.37Å; E872-A874 PolarHBondContact O-N 3.11Å
875	D	78.7	Confident	73.6	Confident	51 Å²	51	64.6 Å²	64.6	27%	0.273	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-65	141.6	170.9	-67.1	-19.4	0	0	0	109.2	K791 E877 D878	K791-D875 IonicContact NZ-OD1 2.62Å; K791-D875 PolarHBondContact NZ-OD1 3Å; K791-D875 IonicContact NZ-OD2 2.69Å; K791-D875 PolarHBondContact NZ-OD2 2.79Å; D875-E877 PolarHBondContact O-N 2.87Å; D875-E877 VanDerWaalsContact O-N 3.13Å; D875-D878 HydrophobicContact CB-CB 4.3Å; D875-D878 PolarHBondContact O-N 2.81Å; D875-D878 VanDerWaalsContact O-N 3.16Å
876	A	60.7	Low	72.6	Confident	88 Å²	88	64.8 Å²	64.8	73%	0.727	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.1	-171.6	0	0	0	0	0	113.1
877	E	54.7	Low	71.5	Confident	161 Å²	161	65.2 Å²	65.2	75%	0.752	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-10.2	-176.4	-60.5	175.1	165.6	0	0	113.6	D875 T879 T882	D875-E877 PolarHBondContact O-N 2.87Å; D875-E877 VanDerWaalsContact O-N 3.13Å; E877-T879 PolarHBondContact O-N 3.04Å; E877-T879 PolarHBondContact O-OG1 3.15Å; E877-T882 PolarHBondContact O-OG1 3.47Å
878	D	54.4	Low	70.3	Confident	21 Å²	21	62.6 Å²	62.6	11%	0.112	33%	0.326	C	S	.	.			trans	-74.4	73.7	-175.4	-92.5	-1.7	0	0	0	112	D875 T882 K886	D875-D878 HydrophobicContact CB-CB 4.3Å; D875-D878 PolarHBondContact O-N 2.81Å; D875-D878 VanDerWaalsContact O-N 3.16Å; D878-T882 WeakPolarHBondContact CA-OG1 3.12Å; D878-K886 IonicContact OD1-NZ 2.96Å; D878-K886 PolarHBondContact OD1-NZ 2.92Å
879	T	60.5	Low	69	Low	75 Å²	75	63.8 Å²	63.8	46%	0.46	34%	0.336	S	S	.	.			trans	-79.1	155.4	165.2	-44.9	0	0	0	0	108.7	E877 E881 T882 L883	E877-T879 PolarHBondContact O-N 3.04Å; E877-T879 PolarHBondContact O-OG1 3.15Å; T879-E881 WeakPolarHBondContact CG2-OE2 3.14Å; T879-E881 PolarHBondContact O-N 2.74Å; T879-E881 VanDerWaalsContact O-N 3.1Å; T879-T882 PolarHBondContact N-OG1 3.13Å; T879-T882 PolarHBondContact O-N 3.38Å; T879-T882 PolarHBondContact O-OG1 3.46Å; T879-L883 PolarHBondContact O-N 3.36Å; T879-L883 VanDerWaalsContact O-N 3.17Å
880	V	60	Low	67.3	Low	38 Å²	38	71 Å²	71	23%	0.23	37%	0.369	C	S	.	.	H	α-helix	trans	-59.8	-30.9	-168.1	175.3	0	0	0	0	112.4	F842 R884	F842-V880 HydrophobicContact CE2-CG2 4.34Å; V880-R884 HydrophobicContact CG1-CG 4.39Å; V880-R884 WeakPolarHBondContact O-CB 3.42Å; V880-R884 WeakPolarHBondContact O-CG 3.26Å; V880-R884 PolarHBondContact O-N 3.27Å
881	E	59.9	Low	65.4	Low	114 Å²	114	76.2 Å²	76.2	53%	0.533	39%	0.387	S	S	.	.	H	α-helix	trans	-63.6	-49.3	174.1	-67.5	59.6	-129.7	0	0	111.1	T879 L883 R884 Q885	T879-E881 WeakPolarHBondContact CG2-OE2 3.14Å; T879-E881 PolarHBondContact O-N 2.74Å; T879-E881 VanDerWaalsContact O-N 3.1Å; E881-L883 PolarHBondContact O-N 2.59Å; E881-R884 CarbonylContact O-C 3.51Å; E881-R884 WeakPolarHBondContact O-CB 3.36Å; E881-R884 PolarHBondContact O-N 3.46Å; E881-Q885 WeakPolarHBondContact O-CB 3.49Å; E881-Q885 PolarHBondContact O-N 3.27Å
882	T	64.4	Low	63.5	Low	45 Å²	45	82.9 Å²	82.9	28%	0.276	42%	0.418	S	S	.	.	H	α-helix	trans	-65.6	-36.3	-179.3	66.7	0	0	0	0	112.3	E877 D878 T879 Q885 K886	E877-T882 PolarHBondContact O-OG1 3.47Å; D878-T882 WeakPolarHBondContact CA-OG1 3.12Å; T879-T882 PolarHBondContact N-OG1 3.13Å; T879-T882 PolarHBondContact O-N 3.38Å; T879-T882 PolarHBondContact O-OG1 3.46Å; T882-Q885 PolarHBondContact O-N 3.23Å; T882-K886 WeakPolarHBondContact O-CB 3.29Å; T882-K886 VanDerWaalsContact O-CG 3.31Å; T882-K886 WeakPolarHBondContact O-CG 3.36Å; T882-K886 PolarHBondContact O-N 3.3Å
883	L	59.6	Low	61.1	Low	47 Å²	47	84.3 Å²	84.3	25%	0.246	44%	0.44	C	S	.	.	H	α-helix	trans	-74.8	-34.3	175	-164.4	71.6	0	0	0	111.9	F842 T879 E881 Q885 T887	F842-L883 HydrophobicContact CZ-CD2 4.35Å; T879-L883 PolarHBondContact O-N 3.36Å; T879-L883 VanDerWaalsContact O-N 3.17Å; E881-L883 PolarHBondContact O-N 2.59Å; L883-Q885 VanDerWaalsContact C-N 3.3Å; L883-T887 WeakPolarHBondContact O-CB 3.47Å; L883-T887 PolarHBondContact O-N 2.81Å; L883-T887 PolarHBondContact O-OG1 3.19Å
884	R	62.7	Low	58.8	Low	148 Å²	148	91 Å²	91	56%	0.558	48%	0.478	S	S	*	.	H	α-helix	trans	-61.3	-41.4	168.2	-78	170.7	-175.7	-156.1	6.4	110.6	V880 E881 T887 A888	V880-R884 HydrophobicContact CG1-CG 4.39Å; V880-R884 WeakPolarHBondContact O-CB 3.42Å; V880-R884 WeakPolarHBondContact O-CG 3.26Å; V880-R884 PolarHBondContact O-N 3.27Å; E881-R884 CarbonylContact O-C 3.51Å; E881-R884 WeakPolarHBondContact O-CB 3.36Å; E881-R884 PolarHBondContact O-N 3.46Å; R884-T887 PolarHBondContact O-N 2.99Å; R884-A888 WeakPolarHBondContact O-CB 3.47Å; R884-A888 PolarHBondContact O-N 3.07Å
885	Q	62.5	Low	56.7	Low	114 Å²	114	98.1 Å²	98.1	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-53.9	178.9	178.9	175.1	-11.1	0	0	111.3	E881 T882 L883 T887 A888 E889	E881-Q885 WeakPolarHBondContact O-CB 3.49Å; E881-Q885 PolarHBondContact O-N 3.27Å; T882-Q885 PolarHBondContact O-N 3.23Å; L883-Q885 VanDerWaalsContact C-N 3.3Å; Q885-T887 PolarHBondContact O-N 2.96Å; Q885-T887 VanDerWaalsContact O-N 3.16Å; Q885-A888 CarbonylContact O-C 3.49Å; Q885-A888 PolarHBondContact O-N 3.42Å; Q885-E889 HydrophobicContact CG-CG 4.35Å; Q885-E889 WeakPolarHBondContact CG-OE1 3.38Å; Q885-E889 PolarHBondContact NE2-OE1 3.09Å; Q885-E889 WeakPolarHBondContact O-CB 3.34Å; Q885-E889 WeakPolarHBondContact O-CG 3.49Å; Q885-E889 PolarHBondContact O-N 3.48Å
886	K	64.9	Low	54.8	Low	100 Å²	100	101 Å²	101	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-53.3	-36.4	172.8	-70.8	167.9	-178.3	174.7	0	112.3	D878 T882 H890	D878-K886 IonicContact OD1-NZ 2.96Å; D878-K886 PolarHBondContact OD1-NZ 2.92Å; T882-K886 WeakPolarHBondContact O-CB 3.29Å; T882-K886 VanDerWaalsContact O-CG 3.31Å; T882-K886 WeakPolarHBondContact O-CG 3.36Å; T882-K886 PolarHBondContact O-N 3.3Å; K886-H890 WeakPolarHBondContact O-CB 3.33Å; K886-H890 PolarHBondContact O-N 3Å; K886-H890 VanDerWaalsContact O-N 3.16Å
887	T	56.3	Low	53.9	Low	60 Å²	60	107.2 Å²	107.2	37%	0.368	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-45	174.1	-53.1	0	0	0	0	111.9	L883 R884 Q885 E889 H890 F891	L883-T887 WeakPolarHBondContact O-CB 3.47Å; L883-T887 PolarHBondContact O-N 2.81Å; L883-T887 PolarHBondContact O-OG1 3.19Å; R884-T887 PolarHBondContact O-N 2.99Å; Q885-T887 PolarHBondContact O-N 2.96Å; Q885-T887 VanDerWaalsContact O-N 3.16Å; T887-E889 VanDerWaalsContact C-N 3.33Å; T887-E889 PolarHBondContact O-N 3.18Å; T887-H890 PolarHBondContact O-N 2.92Å; T887-H890 VanDerWaalsContact O-N 3.14Å; T887-F891 HydrophobicContact CG2-CD2 3.85Å; T887-F891 HydrophobicContact CG2-CE2 4.08Å; T887-F891 WeakPolarHBondContact O-CD2 3.45Å; T887-F891 PolarHBondContact O-N 3.48Å
888	A	59.5	Low	53.2	Low	44 Å²	44	108 Å²	108	36%	0.364	55%	0.547	S	S	.	.	H	α-helix	trans	-63.3	-39.9	177.6	0	0	0	0	0	111.5	R884 Q885 H890 F891 H892	R884-A888 WeakPolarHBondContact O-CB 3.47Å; R884-A888 PolarHBondContact O-N 3.07Å; Q885-A888 CarbonylContact O-C 3.49Å; Q885-A888 PolarHBondContact O-N 3.42Å; A888-H890 VanDerWaalsContact C-N 3.29Å; A888-H890 PolarHBondContact O-N 2.84Å; A888-F891 PolarHBondContact O-N 3.46Å; A888-H892 WeakPolarHBondContact O-CB 3.31Å; A888-H892 PolarHBondContact O-CD2 3.01Å; A888-H892 PolarHBondContact O-N 3.05Å
889	E	59.3	Low	52.6	Low	108 Å²	108	117.6 Å²	117.6	51%	0.505	58%	0.582	S	S	.	*	H	α-helix	trans	-62.6	-34.3	173	-70.9	166.5	179	0	0	111.8	Q885 T887 G893	Q885-E889 HydrophobicContact CG-CG 4.35Å; Q885-E889 WeakPolarHBondContact CG-OE1 3.38Å; Q885-E889 PolarHBondContact NE2-OE1 3.09Å; Q885-E889 WeakPolarHBondContact O-CB 3.34Å; Q885-E889 WeakPolarHBondContact O-CG 3.49Å; Q885-E889 PolarHBondContact O-N 3.48Å; T887-E889 VanDerWaalsContact C-N 3.33Å; T887-E889 PolarHBondContact O-N 3.18Å; E889-G893 WeakPolarHBondContact O-CA 3.48Å; E889-G893 PolarHBondContact O-N 3.17Å; E889-G893 VanDerWaalsContact O-N 3.12Å
890	H	53.7	Low	51.8	Low	156 Å²	156	124.5 Å²	124.5	72%	0.722	60%	0.6	S	S	*	*	H	α-helix	trans	-75.9	-26.9	174.3	-167.5	-54.6	0	0	0	113.5	K886 T887 A888	K886-H890 WeakPolarHBondContact O-CB 3.33Å; K886-H890 PolarHBondContact O-N 3Å; K886-H890 VanDerWaalsContact O-N 3.16Å; T887-H890 PolarHBondContact O-N 2.92Å; T887-H890 VanDerWaalsContact O-N 3.14Å; A888-H890 VanDerWaalsContact C-N 3.29Å; A888-H890 PolarHBondContact O-N 2.84Å
891	F	49.4	Very low	50.9	Low	164 Å²	164	131 Å²	131	72%	0.719	63%	0.625	S	S	*	*	H	α-helix	trans	-99.6	-18.1	-178.9	-85.1	-89.3	0	0	0	114.6	T887 A888	T887-F891 HydrophobicContact CG2-CD2 3.85Å; T887-F891 HydrophobicContact CG2-CE2 4.08Å; T887-F891 WeakPolarHBondContact O-CD2 3.45Å; T887-F891 PolarHBondContact O-N 3.48Å; A888-F891 PolarHBondContact O-N 3.46Å
892	H	50.8	Low	49.9	Very low	150 Å²	150	128.3 Å²	128.3	69%	0.694	62%	0.622	S	S	*	*	S	Bend	trans	-118	15.1	175.9	-58.4	-71.4	0	0	0	112.5	A888 D894	A888-H892 WeakPolarHBondContact O-CB 3.31Å; A888-H892 PolarHBondContact O-CD2 3.01Å; A888-H892 PolarHBondContact O-N 3.05Å; H892-D894 PolarHBondContact O-N 2.68Å
893	G	39.8	Very low	48.9	Very low	60 Å²	60	132.8 Å²	132.8	62%	0.619	64%	0.64	S	S	*	*			trans	-70.7	22.5	-170.6	0	0	0	0	0	117.3	E889	E889-G893 WeakPolarHBondContact O-CA 3.48Å; E889-G893 PolarHBondContact O-N 3.17Å; E889-G893 VanDerWaalsContact O-N 3.12Å
894	D	40.4	Very low	48.4	Very low	163 Å²	163	134.9 Å²	134.9	87%	0.872	65%	0.654	S	S	*	*			trans	-117.6	57.9	-179.2	-130.4	-15.4	0	0	0	111.7	H892	H892-D894 PolarHBondContact O-N 2.68Å
895	L	37.6	Very low	47.5	Very low	154 Å²	154	134.3 Å²	134.3	81%	0.806	66%	0.66	S	S	*	*	S	Bend	trans	-120.9	143.4	163.2	-77.3	175.9	0	0	0	110.1
896	P	40.6	Very low	46.8	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	67%	0.665	S	S	*	*			trans	-73.7	145.5	-154.8	26	-35.3	0	0	0	115	K898	P896-K898 VanDerWaalsContact C-N 3.34Å; P896-K898 PolarHBondContact O-N 2.84Å
897	K	41.3	Very low	46	Very low	218 Å²	218	132.7 Å²	132.7	95%	0.948	67%	0.665	S	S	*	*	S	Bend	trans	-63.3	79.4	178.4	-62.7	171.8	-177.3	170.8	0	112.7
898	K	40.4	Very low	45.9	Very low	177 Å²	177	134.2 Å²	134.2	77%	0.77	67%	0.67	S	S	*	*			trans	-116.4	-26.1	173.2	-97.7	-171	172.8	-174.5	0	116	P896 K901	P896-K898 VanDerWaalsContact C-N 3.34Å; P896-K898 PolarHBondContact O-N 2.84Å; K898-K901 PolarHBondContact O-N 2.97Å
899	R	41.6	Very low	45.1	Very low	224 Å²	224	137.3 Å²	137.3	85%	0.845	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-69	-35.4	-173.6	-65.1	-171.2	74.9	164.9	1.5	114.6	K901 A902	R899-K901 PolarHBondContact O-N 2.94Å; R899-A902 PolarHBondContact O-N 2.71Å
900	R	42.1	Very low	44.7	Very low	219 Å²	219	139 Å²	139	83%	0.826	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-63.6	3	177.6	-78.3	-168.8	177.5	-178	0.1	116.1	V904	R900-V904 WeakPolarHBondContact O-CG2 3.48Å
901	K	41.4	Very low	44.4	Very low	175 Å²	175	135.1 Å²	135.1	76%	0.761	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-105.3	-11.3	171.1	-118.8	-166.1	176.6	-162.1	0	114.2	K898 R899 M905	K898-K901 PolarHBondContact O-N 2.97Å; R899-K901 PolarHBondContact O-N 2.94Å; K901-M905 WeakPolarHBondContact O-CG 3.46Å
902	A	40.6	Very low	44.4	Very low	58 Å²	58	134.2 Å²	134.2	48%	0.479	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-54.2	172.6	0	0	0	0	0	110.1	R899 V904 M905 E906	R899-A902 PolarHBondContact O-N 2.71Å; A902-V904 PolarHBondContact O-N 2.71Å; A902-M905 WeakPolarHBondContact O-CA 3.46Å; A902-M905 WeakPolarHBondContact O-CB 3.33Å; A902-M905 PolarHBondContact O-N 3.15Å; A902-E906 PolarHBondContact O-N 3.14Å
903	E	42.7	Very low	44.3	Very low	138 Å²	138	134.4 Å²	134.4	65%	0.645	68%	0.679	S	S	*	*	H	α-helix	trans	-52.6	-30.9	179.2	-159.6	167.6	-135	0	0	113.7
904	V	49.4	Very low	44.8	Very low	91 Å²	91	137.1 Å²	137.1	55%	0.552	68%	0.684	S	S	*	*	H	α-helix	trans	-86.8	-24.3	176.3	178.9	0	0	0	0	112.9	R900 A902 I908	R900-V904 WeakPolarHBondContact O-CG2 3.48Å; A902-V904 PolarHBondContact O-N 2.71Å; V904-I908 HydrophobicContact CG1-CD1 4.29Å; V904-I908 VanDerWaalsContact O-CD1 3.23Å; V904-I908 WeakPolarHBondContact O-CD1 3.36Å; V904-I908 WeakPolarHBondContact O-CG1 3.31Å
905	M	43.4	Very low	44.8	Very low	137 Å²	137	137 Å²	137	68%	0.675	68%	0.684	S	S	*	*	H	α-helix	trans	-77.2	-38.6	171.7	-74.1	-85.4	-64.3	0	0	111.1	K901 A902 I908 L909	K901-M905 WeakPolarHBondContact O-CG 3.46Å; A902-M905 WeakPolarHBondContact O-CA 3.46Å; A902-M905 WeakPolarHBondContact O-CB 3.33Å; A902-M905 PolarHBondContact O-N 3.15Å; M905-I908 PolarHBondContact O-N 3.2Å; M905-L909 PolarHBondContact O-N 3.1Å
906	E	47.2	Very low	45.2	Very low	137 Å²	137	133.2 Å²	133.2	64%	0.64	68%	0.682	S	S	*	*	H	α-helix	trans	-64.4	-50.9	-176.3	-156.4	155.4	-153.1	0	0	110.9	A902 I908 L909 E910	A902-E906 PolarHBondContact O-N 3.14Å; E906-I908 PolarHBondContact O-N 3.2Å; E906-L909 WeakPolarHBondContact O-CB 3.21Å; E906-L909 PolarHBondContact O-N 3.1Å; E906-E910 PolarHBondContact O-N 2.71Å
907	G	49.3	Very low	45.1	Very low	43 Å²	43	131.4 Å²	131.4	44%	0.443	68%	0.683	S	S	.	*	H	α-helix	trans	-70.8	-10.3	173.5	0	0	0	0	0	115.6
908	I	53.2	Low	44.8	Very low	91 Å²	91	127.9 Å²	127.9	47%	0.467	68%	0.679	S	S	.	*	H	α-helix	trans	-83.7	-35.3	167.2	-73.5	172.3	0	0	0	110.1	V904 M905 E906 S911 M912	V904-I908 HydrophobicContact CG1-CD1 4.29Å; V904-I908 VanDerWaalsContact O-CD1 3.23Å; V904-I908 WeakPolarHBondContact O-CD1 3.36Å; V904-I908 WeakPolarHBondContact O-CG1 3.31Å; M905-I908 PolarHBondContact O-N 3.2Å; E906-I908 PolarHBondContact O-N 3.2Å; I908-S911 PolarHBondContact O-N 2.84Å; I908-S911 PolarHBondContact O-OG 2.96Å; I908-M912 HydrophobicContact CG2-SD 4.48Å; I908-M912 PolarHBondContact O-N 2.72Å
909	L	43.5	Very low	44.7	Very low	109 Å²	109	128.6 Å²	128.6	57%	0.571	69%	0.685	S	S	*	*	H	α-helix	trans	-66.8	-45.7	-180	-153.7	73.6	0	0	0	111.9	M905 E906 S911 M912 E913	M905-L909 PolarHBondContact O-N 3.1Å; E906-L909 WeakPolarHBondContact O-CB 3.21Å; E906-L909 PolarHBondContact O-N 3.1Å; L909-S911 PolarHBondContact O-N 3.35Å; L909-M912 PolarHBondContact O-N 2.77Å; L909-E913 PolarHBondContact O-N 2.94Å
910	E	49.9	Very low	44.6	Very low	145 Å²	145	130.4 Å²	130.4	68%	0.678	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-32.6	173.2	-72.7	-173.9	126.5	0	0	112.5	E906 M912 T914	E906-E910 PolarHBondContact O-N 2.71Å; E910-M912 VanDerWaalsContact C-N 3.25Å; E910-M912 PolarHBondContact O-N 3.26Å; E910-T914 PolarHBondContact O-OG1 3.31Å
911	S	47.8	Very low	44.7	Very low	74 Å²	74	126 Å²	126	52%	0.517	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.1	-7.2	177.7	77.1	0	0	0	0	114.7	I908 L909	I908-S911 PolarHBondContact O-N 2.84Å; I908-S911 PolarHBondContact O-OG 2.96Å; L909-S911 PolarHBondContact O-N 3.35Å
912	M	50.4	Low	44.9	Very low	144 Å²	144	123.4 Å²	123.4	71%	0.709	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-18.8	177.9	-66.3	-170.2	72.1	0	0	113.6	I908 L909 E910 T914	I908-M912 HydrophobicContact CG2-SD 4.48Å; I908-M912 PolarHBondContact O-N 2.72Å; L909-M912 PolarHBondContact O-N 2.77Å; E910-M912 VanDerWaalsContact C-N 3.25Å; E910-M912 PolarHBondContact O-N 3.26Å; M912-T914 VanDerWaalsContact C-N 3.35Å
913	E	48	Very low	45.2	Very low	155 Å²	155	127 Å²	127	72%	0.724	71%	0.705	S	S	*	*	S	Bend	trans	-85.5	-5.1	174.5	-65.9	-170.7	148.5	0	0	113.5	L909	L909-E913 PolarHBondContact O-N 2.94Å
914	T	49.5	Very low	45.3	Very low	117 Å²	117	126.4 Å²	126.4	72%	0.718	71%	0.708	S	S	*	*	S	Bend	trans	-101.1	-6.6	-172.7	38.1	0	0	0	0	115.7	E910 M912	E910-T914 PolarHBondContact O-OG1 3.31Å; M912-T914 VanDerWaalsContact C-N 3.35Å
915	D	41.2	Very low	45	Very low	161 Å²	161	128.6 Å²	128.6	86%	0.861	72%	0.718	S	S	*	*	S	Bend	trans	-115	33.1	-175.9	-157.8	30	0	0	0	112.5
916	G	45.9	Very low	45.1	Very low	74 Å²	74	128 Å²	128	76%	0.763	72%	0.721	S	S	*	*			trans	-139	42.1	-160.2	0	0	0	0	0	117.2
917	G	38	Very low	45	Very low	72 Å²	72	127.4 Å²	127.4	74%	0.742	73%	0.727	S	S	*	*			trans	166.9	80.4	167.4	0	0	0	0	0	119
918	V	35.6	Very low	44.7	Very low	145 Å²	145	133.8 Å²	133.8	88%	0.879	75%	0.749	S	S	*	*			trans	-142.6	78.3	153.3	-169.5	0	0	0	0	110.8
919	E	38.1	Very low	44	Very low	191 Å²	191	137.4 Å²	137.4	89%	0.893	77%	0.772	S	S	*	*			trans	-140.9	70	158.2	-83.1	-156.7	144.1	0	0	110.4
920	H	39.5	Very low	44	Very low	262 Å²	262	140 Å²	140	100%	1.213	79%	0.791	S	S	*	*				-176.2	0	124.2	-107	-59.5	0	0	0	114

Retrieved 920 of 920 residues in 202.8 ms (Link to these results)

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