A0A077YZX6_TRITR Loading...

DDB1 and CUL4 associated factor 6

AlphaFold DB , UniProt , Accession A0A077YZX6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 487 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	60	Low	53.7	Low	35 Å²	35	71 Å²	71	17%	0.172	33%	0.331	C	S	.	.				0	135.5	0	-81.2	-157	-79	0	0	108.6	W396 H424 L443 W455 A456 F485	M1-W396 HydrophobicContact CE-CH2 3.54Å; M1-W396 HydrophobicContact CE-CZ2 4.42Å; M1-W396 HydrophobicContact CE-CZ3 3.97Å; M1-W396 HydrophobicContact CG-CH2 4.44Å; M1-W396 HydrophobicContact SD-CH2 3.43Å; M1-W396 WeakPolarHBondContact SD-CH2 3.38Å; M1-W396 HydrophobicContact SD-CZ2 3.92Å; M1-W396 HydrophobicContact SD-CZ3 4.43Å; M1-H424 WeakPolarHBondContact CE-CD2 3.48Å; M1-H424 WeakPolarHBondContact CE-NE2 3.48Å; M1-L443 HydrophobicContact CE-CD2 4.47Å; M1-W455 HydrophobicContact CB-CE3 4.16Å; M1-W455 HydrophobicContact CE-CB 4.38Å; M1-W455 HydrophobicContact SD-CB 3.68Å; M1-A456 CarbonylContact C-O 3.49Å; M1-A456 WeakPolarHBondContact CA-O 3.44Å; M1-F485 HydrophobicContact CG-CD1 3.61Å; M1-F485 HydrophobicContact CG-CE1 3.9Å; M1-F485 HydrophobicContact CG-CG 4.48Å; M1-F485 HydrophobicContact SD-CE1 4.35Å
2	R	62.1	Low	53	Low	94 Å²	94	81.9 Å²	81.9	36%	0.355	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	134	171.8	-173.4	169.6	177.8	177.9	18.7	110.1	F4 W455 A456 V458 E460 V462	R2-F4 HydrophobicContact CB-CD2 4.48Å; R2-F4 HydrophobicContact CB-CE2 3.71Å; R2-F4 HydrophobicContact CB-CZ 4.05Å; R2-F4 HydrophobicContact CG-CD2 4.26Å; R2-F4 HydrophobicContact CG-CE1 4.19Å; R2-F4 HydrophobicContact CG-CE2 3.64Å; R2-F4 HydrophobicContact CG-CZ 3.62Å; R2-F4 WeakPolarHBondContact O-CD2 3.2Å; R2-W455 VanDerWaalsContact O-CA 3.32Å; R2-W455 WeakPolarHBondContact O-CA 3.34Å; R2-A456 PolarHBondContact N-O 3.03Å; R2-A456 PolarHBondContact O-N 3.11Å; R2-A456 VanDerWaalsContact O-N 3.07Å; R2-V458 HydrophobicContact CB-CG2 3.81Å; R2-E460 VanDerWaalsContact CZ-O 3.28Å; R2-E460 PolarHBondContact NH1-O 3.18Å; R2-V462 PolarHBondContact NH1-O 3.32Å
3	K	63.8	Low	52.9	Low	86 Å²	86	81.5 Å²	81.5	37%	0.374	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128	176.5	172.8	175.2	152.8	175.9	0	109.9	E425 G426 K453 W455	K3-E425 PolarHBondContact NZ-O 3Å; K3-G426 PolarHBondContact NZ-O 3.45Å; K3-K453 HydrophobicContact CD-CD 4.08Å; K3-K453 VanDerWaalsContact CE-CD 3.43Å; K3-K453 VanDerWaalsContact CE-CE 3.42Å; K3-K453 HydrophobicContact CG-CB 4.38Å; K3-K453 HydrophobicContact CG-CG 4.49Å; K3-W455 HydrophobicContact CB-CD2 4.27Å; K3-W455 HydrophobicContact CB-CE3 3.87Å; K3-W455 HydrophobicContact CB-CH2 3.81Å; K3-W455 HydrophobicContact CB-CZ2 4.16Å; K3-W455 HydrophobicContact CB-CZ3 3.66Å; K3-W455 HydrophobicContact CD-CH2 3.5Å; K3-W455 HydrophobicContact CD-CZ2 3.62Å; K3-W455 HydrophobicContact CD-CZ3 4.22Å; K3-W455 HydrophobicContact CG-CH2 3.95Å; K3-W455 HydrophobicContact CG-CZ2 3.91Å; K3-W455 HydrophobicContact CG-CZ3 4.31Å
4	F	60.8	Low	53.1	Low	36 Å²	36	81.6 Å²	81.6	16%	0.158	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.2	174.1	-58.6	-93.8	0	0	0	108.2	R2 C6 K453 V454 A456 V458 L464	R2-F4 HydrophobicContact CB-CD2 4.48Å; R2-F4 HydrophobicContact CB-CE2 3.71Å; R2-F4 HydrophobicContact CB-CZ 4.05Å; R2-F4 HydrophobicContact CG-CD2 4.26Å; R2-F4 HydrophobicContact CG-CE1 4.19Å; R2-F4 HydrophobicContact CG-CE2 3.64Å; R2-F4 HydrophobicContact CG-CZ 3.62Å; R2-F4 WeakPolarHBondContact O-CD2 3.2Å; F4-C6 PolarHBondContact O-N 3.01Å; F4-K453 CarbonylContact O-C 3.59Å; F4-K453 WeakPolarHBondContact O-CA 3.36Å; F4-V454 PolarHBondContact N-O 3.12Å; F4-V454 PolarHBondContact O-N 2.87Å; F4-A456 HydrophobicContact CE2-CB 4.33Å; F4-V458 HydrophobicContact CE2-CG2 3.76Å; F4-V458 HydrophobicContact CZ-CG2 3.69Å; F4-L464 HydrophobicContact CB-CD1 3.31Å; F4-L464 HydrophobicContact CB-CG 4.41Å; F4-L464 HydrophobicContact CD1-CB 4.3Å; F4-L464 HydrophobicContact CD1-CD1 3.6Å; F4-L464 HydrophobicContact CD1-CG 3.91Å; F4-L464 HydrophobicContact CD2-CD1 3.3Å; F4-L464 HydrophobicContact CD2-CD2 4.37Å; F4-L464 HydrophobicContact CD2-CG 3.53Å; F4-L464 HydrophobicContact CE1-CB 4.14Å; F4-L464 HydrophobicContact CE1-CD1 4.14Å; F4-L464 HydrophobicContact CE1-CG 3.91Å; F4-L464 HydrophobicContact CE2-CD1 3.89Å; F4-L464 HydrophobicContact CE2-CD2 4.34Å; F4-L464 HydrophobicContact CE2-CG 3.54Å; F4-L464 HydrophobicContact CG-CD1 3.11Å; F4-L464 HydrophobicContact CG-CG 3.7Å; F4-L464 HydrophobicContact CZ-CB 4.25Å; F4-L464 HydrophobicContact CZ-CD1 4.25Å; F4-L464 HydrophobicContact CZ-CG 3.71Å
5	S	59.9	Low	53.8	Low	56 Å²	56	87.4 Å²	87.4	39%	0.392	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	112.4	177.4	171.5	0	0	0	0	109.1	R7 N451	S5-R7 PolarHBondContact O-N 3.26Å; S5-N451 PolarHBondContact OG-ND2 3.3Å
6	C	57	Low	55	Low	6 Å²	6	82.9 Å²	82.9	4%	0.041	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	104.8	165.6	-153.9	0	0	0	0	107.9	F4 L8 T42 V452 V454	F4-C6 PolarHBondContact O-N 3.01Å; C6-L8 PolarHBondContact O-N 3.05Å; C6-L8 VanDerWaalsContact O-N 3.08Å; C6-T42 WeakPolarHBondContact SG-CG2 3.48Å; C6-V452 CarbonylContact C-O 3.37Å; C6-V452 WeakPolarHBondContact CA-O 3.34Å; C6-V452 WeakPolarHBondContact CB-O 3.47Å; C6-V452 PolarHBondContact N-O 3.28Å; C6-V452 PolarHBondContact O-N 2.97Å; C6-V454 HydrophobicContact CB-CG2 4.48Å
7	R	53.4	Low	56.5	Low	188 Å²	188	81.4 Å²	81.4	71%	0.709	39%	0.386	S	S	*	.			trans	-68.1	112.5	173.2	-78.1	-172.9	-180	179.2	0.7	107.7	S5	S5-R7 PolarHBondContact O-N 3.26Å
8	L	50.8	Low	58.1	Low	13 Å²	13	76.9 Å²	76.9	7%	0.068	37%	0.365	C	S	.	.			trans	-59.9	136.8	153.7	-63.3	173.6	0	0	0	105.9	C6 A10 V18 S32 V452	C6-L8 PolarHBondContact O-N 3.05Å; C6-L8 VanDerWaalsContact O-N 3.08Å; L8-A10 PolarHBondContact O-N 3.29Å; L8-V18 HydrophobicContact CD1-CB 4.49Å; L8-V18 HydrophobicContact CD1-CG1 4.26Å; L8-V18 HydrophobicContact CD1-CG2 3.4Å; L8-S32 WeakPolarHBondContact CD2-OG 3.12Å; L8-V452 HydrophobicContact CD1-CG2 3.73Å; L8-V452 HydrophobicContact CD2-CG2 4.38Å; L8-V452 HydrophobicContact CG-CG2 4.08Å
9	K	42.5	Very low	59.6	Low	115 Å²	115	73.8 Å²	73.8	50%	0.5	35%	0.351	S	S	.	.			trans	-67.5	59.5	165.2	-83.1	177.4	177	162.6	0	108.3	L11 D51	K9-L11 VanDerWaalsContact C-N 3.3Å; K9-L11 PolarHBondContact O-N 3.39Å; K9-D51 IonicContact NZ-OD1 3.48Å; K9-D51 PolarHBondContact NZ-OD1 2.79Å; K9-D51 VanDerWaalsContact NZ-OD1 3.12Å
10	A	41.7	Very low	61.1	Low	27 Å²	27	70.4 Å²	70.4	22%	0.223	34%	0.335	C	S	.	.			trans	-69.8	97.6	163.9	0	0	0	0	0	105.2	L8 F12 I16	L8-A10 PolarHBondContact O-N 3.29Å; A10-F12 PolarHBondContact O-N 3.48Å; A10-F12 VanDerWaalsContact O-N 3.11Å; A10-I16 HydrophobicContact CB-CD1 4.38Å
11	L	38.4	Very low	62.7	Low	125 Å²	125	67.1 Å²	67.1	65%	0.654	32%	0.32	S	S	*	.			trans	-56.3	116	-179.4	-77.3	156.3	0	0	0	108.9	K9 N13	K9-L11 VanDerWaalsContact C-N 3.3Å; K9-L11 PolarHBondContact O-N 3.39Å; L11-N13 VanDerWaalsContact C-N 3.31Å; L11-N13 PolarHBondContact O-N 3.33Å
12	F	45.2	Very low	64.3	Low	202 Å²	202	66.3 Å²	66.3	89%	0.886	32%	0.317	S	S	*	.	S	Bend	trans	62.7	-6.1	157.1	-72.3	-85.6	0	0	0	121.2	A10	A10-F12 PolarHBondContact O-N 3.48Å; A10-F12 VanDerWaalsContact O-N 3.11Å
13	N	51.5	Low	65.8	Low	76 Å²	76	62.7 Å²	62.7	41%	0.406	30%	0.303	S	S	.	.			trans	-120.2	108.3	-179.5	-167.7	-17.8	0	0	0	113.2	L11 F15 I16	L11-N13 VanDerWaalsContact C-N 3.31Å; L11-N13 PolarHBondContact O-N 3.33Å; N13-F15 PolarHBondContact O-N 2.67Å; N13-F15 WeakPolarHBondContact OD1-CB 3.5Å; N13-F15 WeakPolarHBondContact OD1-CD2 3.15Å; N13-F15 PolarHBondContact OD1-N 3.48Å; N13-I16 HydrophobicContact CB-CD1 3.71Å; N13-I16 HydrophobicContact CB-CG1 3.9Å; N13-I16 WeakPolarHBondContact O-CG1 3.45Å; N13-I16 PolarHBondContact O-N 2.85Å
14	P	56.7	Low	67.2	Low	83 Å²	83	58.7 Å²	58.7	54%	0.539	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.7	-179	29.9	-35.7	0	0	0	114.1
15	F	63.7	Low	68.5	Low	169 Å²	169	61.8 Å²	61.8	74%	0.741	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	3.4	179.5	-55.5	-68.6	0	0	0	114	N13	N13-F15 PolarHBondContact O-N 2.67Å; N13-F15 WeakPolarHBondContact OD1-CB 3.5Å; N13-F15 WeakPolarHBondContact OD1-CD2 3.15Å; N13-F15 PolarHBondContact OD1-N 3.48Å
16	I	71.9	Confident	69.7	Low	16 Å²	16	61.7 Å²	61.7	8%	0.082	30%	0.296	C	S	.	.			trans	-78.3	125.5	178.7	-63.1	166.7	0	0	0	109.6	A10 N13 D36 H450	A10-I16 HydrophobicContact CB-CD1 4.38Å; N13-I16 HydrophobicContact CB-CD1 3.71Å; N13-I16 HydrophobicContact CB-CG1 3.9Å; N13-I16 WeakPolarHBondContact O-CG1 3.45Å; N13-I16 PolarHBondContact O-N 2.85Å; I16-D36 HydrophobicContact CD1-CB 3.83Å; I16-D36 HydrophobicContact CG1-CB 4.14Å; I16-D36 HydrophobicContact CG2-CB 4.09Å; I16-H450 WeakPolarHBondContact O-CA 3.19Å; I16-H450 WeakPolarHBondContact O-CB 3.33Å
17	Q	81.3	Confident	71.1	Confident	56 Å²	56	61.5 Å²	61.5	26%	0.262	30%	0.295	S	S	.	.			trans	-97.1	148.8	178.6	-54.2	-179.3	28.8	0	0	111.2	S34 D35 I448	Q17-S34 WeakPolarHBondContact O-CA 3.2Å; Q17-S34 VanDerWaalsContact O-CB 3.28Å; Q17-S34 WeakPolarHBondContact O-CB 3.13Å; Q17-D35 PolarHBondContact O-N 2.71Å; Q17-D35 VanDerWaalsContact O-N 3.09Å; Q17-I448 HydrophobicContact CG-CG2 4.3Å
18	V	84.5	Confident	72.6	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	106.7	173.8	-176.9	0	0	0	0	108.8	L8 I21 S446 V452	L8-V18 HydrophobicContact CD1-CB 4.49Å; L8-V18 HydrophobicContact CD1-CG1 4.26Å; L8-V18 HydrophobicContact CD1-CG2 3.4Å; V18-I21 HydrophobicContact CG1-CG1 4.26Å; V18-S446 PolarHBondContact O-OG 3.36Å; V18-V452 HydrophobicContact CG1-CG2 4.02Å
19	N	86.5	Confident	74.4	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-17.8	-171.1	-66.1	-37.5	0	0	0	114.4	G33 D35 I62 I63 C433	N19-G33 PolarHBondContact N-O 2.99Å; N19-D35 PolarHBondContact ND2-OD1 2.78Å; N19-I62 VanDerWaalsContact ND2-CG2 3.25Å; N19-I62 WeakPolarHBondContact ND2-CG2 3.31Å; N19-I63 WeakPolarHBondContact CB-O 3.42Å; N19-I63 PolarHBondContact ND2-O 3.13Å; N19-C433 PolarHBondContact O-SG 3.25Å
20	T	91.1	Very high	76.7	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	138.7	-175	-174.5	0	0	0	0	109.8	S32 G33 I63 A66	T20-S32 VanDerWaalsContact O-CA 3.27Å; T20-S32 WeakPolarHBondContact O-CA 3.01Å; T20-G33 PolarHBondContact O-N 3.17Å; T20-G33 VanDerWaalsContact O-N 3.15Å; T20-I63 HydrophobicContact CG2-CG2 4.3Å; T20-A66 HydrophobicContact CG2-CB 3.71Å; T20-A66 PolarHBondContact OG1-N 3.36Å; T20-A66 PolarHBondContact OG1-O 3.32Å
21	I	93.2	Very high	79.2	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.015	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	140.7	171.3	-65.1	171.5	0	0	0	107.6	V18 I30 L31 C433 Q435 A444 S445 S446 V452	V18-I21 HydrophobicContact CG1-CG1 4.26Å; I21-I30 HydrophobicContact CG2-CG2 3.55Å; I21-L31 CarbonylContact C-O 3.57Å; I21-L31 WeakPolarHBondContact CA-O 3.01Å; I21-C433 HydrophobicContact CB-CB 4.49Å; I21-C433 HydrophobicContact CD1-CB 4.09Å; I21-C433 HydrophobicContact CG1-CB 4.34Å; I21-Q435 HydrophobicContact CB-CG 4.01Å; I21-Q435 HydrophobicContact CG2-CB 4.08Å; I21-Q435 HydrophobicContact CG2-CG 4.05Å; I21-Q435 WeakPolarHBondContact O-CG 3.49Å; I21-A444 HydrophobicContact CG2-CB 4.06Å; I21-S445 VanDerWaalsContact CD1-C 3.44Å; I21-S446 VanDerWaalsContact CD1-CB 3.48Å; I21-S446 WeakPolarHBondContact CD1-OG 3.44Å; I21-V452 HydrophobicContact CD1-CG1 3.86Å; I21-V452 HydrophobicContact CD1-CG2 4.01Å; I21-V452 HydrophobicContact CG1-CG2 4.17Å
22	C	94.8	Very high	81.7	Confident	17 Å²	17	43.8 Å²	43.8	12%	0.115	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	125.4	171.8	-175.7	0	0	0	0	109.4	L31 A66 F68	C22-L31 PolarHBondContact N-O 3.17Å; C22-L31 PolarHBondContact O-N 3.31Å; C22-A66 WeakPolarHBondContact CB-O 3.21Å; C22-F68 WeakPolarHBondContact O-CE2 3.38Å
23	W	93.4	Very high	83.9	Confident	19 Å²	19	34.1 Å²	34.1	7%	0.072	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	144.7	168.4	-74	100.9	0	0	0	110.4	G27 H29 I30 P44 F45 F68 Q435 P436 H437 I442 A444	W23-G27 WeakPolarHBondContact CZ3-O 3.27Å; W23-H29 WeakPolarHBondContact CA-O 3.18Å; W23-I30 HydrophobicContact CD2-CD1 4.48Å; W23-I30 HydrophobicContact CD2-CG1 3.87Å; W23-I30 HydrophobicContact CE3-CD1 4.33Å; W23-I30 HydrophobicContact CE3-CG1 3.57Å; W23-I30 HydrophobicContact CH2-CD1 3.59Å; W23-I30 HydrophobicContact CH2-CG1 3.76Å; W23-I30 HydrophobicContact CZ2-CD1 3.72Å; W23-I30 HydrophobicContact CZ2-CG1 4.02Å; W23-I30 HydrophobicContact CZ3-CD1 3.91Å; W23-I30 HydrophobicContact CZ3-CG1 3.51Å; W23-P44 HydrophobicContact CH2-CG 3.71Å; W23-P44 HydrophobicContact CZ3-CG 3.74Å; W23-F45 HydrophobicContact CH2-CZ 4.28Å; W23-F45 HydrophobicContact CZ3-CE2 4.14Å; W23-F45 HydrophobicContact CZ3-CZ 4.28Å; W23-F68 WeakPolarHBondContact O-CD2 3.45Å; W23-Q435 PolarHBondContact NE1-O 3.09Å; W23-P436 VanDerWaalsContact CD1-O 3.28Å; W23-H437 AromaticContact CE3-CD2 3.91Å; W23-H437 AromaticContact CH2-CD2 3.8Å; W23-H437 HydrophobicContact CZ2-CB 4.18Å; W23-H437 AromaticContact CZ3-CD2 3.69Å; W23-I442 HydrophobicContact CH2-CG2 4.16Å; W23-I442 HydrophobicContact CZ2-CG2 3.95Å; W23-A444 HydrophobicContact CZ2-CB 3.81Å
24	S	92.5	Very high	85.5	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.007	15%	0.154	C	C	.	.			trans	-62	155.8	163.5	56.4	0	0	0	0	110.6	D26 G27 H28 H29 S74	S24-D26 WeakPolarHBondContact CB-OD1 3.24Å; S24-D26 PolarHBondContact O-N 3.21Å; S24-D26 PolarHBondContact OG-OD1 3.36Å; S24-G27 WeakPolarHBondContact O-CA 3.46Å; S24-G27 PolarHBondContact O-N 2.73Å; S24-G27 PolarHBondContact OG-N 3.09Å; S24-H28 PolarHBondContact OG-N 3.35Å; S24-H28 VanDerWaalsContact OG-N 3.15Å; S24-H29 PolarHBondContact N-O 3.23Å; S24-H29 PolarHBondContact OG-N 3.48Å; S24-H29 PolarHBondContact OG-O 3.22Å; S24-S74 VanDerWaalsContact CB-OG 3.3Å; S24-S74 WeakPolarHBondContact CB-OG 3.25Å
25	E	88.2	Confident	86.9	Confident	101 Å²	101	29 Å²	29	47%	0.472	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.3	-177.6	-172.9	174.3	-170.8	0	0	112.4	G27 K71 F439	E25-G27 VanDerWaalsContact C-N 3.34Å; E25-K71 PolarHBondContact OE2-N 3.04Å; E25-F439 VanDerWaalsContact O-CE2 3.23Å; E25-F439 WeakPolarHBondContact O-CE2 3.39Å; E25-F439 VanDerWaalsContact O-CZ 3.25Å; E25-F439 WeakPolarHBondContact O-CZ 3.15Å
26	D	84.7	Confident	87.9	Confident	55 Å²	55	23.3 Å²	23.3	29%	0.294	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-10.8	174.1	56.8	21.4	0	0	0	113.8	S24 H28	S24-D26 WeakPolarHBondContact CB-OD1 3.24Å; S24-D26 PolarHBondContact O-N 3.21Å; S24-D26 PolarHBondContact OG-OD1 3.36Å; D26-H28 VanDerWaalsContact C-N 3.3Å; D26-H28 PolarHBondContact O-N 3.16Å; D26-H28 IonicContact OD1-CD2 3.84Å; D26-H28 PolarHBondContact OD1-N 2.99Å; D26-H28 IonicContact OD2-CD2 3.38Å
27	G	87.4	Confident	88.8	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.01	13%	0.131	C	C	.	.	S	Bend	trans	76.8	4.5	-177.9	0	0	0	0	0	115.4	W23 S24 E25 F45 H437	W23-G27 WeakPolarHBondContact CZ3-O 3.27Å; S24-G27 WeakPolarHBondContact O-CA 3.46Å; S24-G27 PolarHBondContact O-N 2.73Å; S24-G27 PolarHBondContact OG-N 3.09Å; E25-G27 VanDerWaalsContact C-N 3.34Å; G27-F45 WeakPolarHBondContact O-CE2 3.2Å; G27-H437 WeakPolarHBondContact CA-NE2 3.26Å; G27-H437 PolarHBondContact O-NE2 3.48Å; G27-H437 VanDerWaalsContact O-NE2 3.07Å
28	H	84.3	Confident	89.3	Confident	64 Å²	64	26.5 Å²	26.5	30%	0.296	13%	0.128	S	C	.	.	S	Bend	trans	-80.1	-26.5	-177.4	-72.8	-56.4	0	0	0	114.6	S24 D26 P44	S24-H28 PolarHBondContact OG-N 3.35Å; S24-H28 VanDerWaalsContact OG-N 3.15Å; D26-H28 VanDerWaalsContact C-N 3.3Å; D26-H28 PolarHBondContact O-N 3.16Å; D26-H28 IonicContact OD1-CD2 3.84Å; D26-H28 PolarHBondContact OD1-N 2.99Å; D26-H28 IonicContact OD2-CD2 3.38Å; H28-P44 WeakPolarHBondContact O-CD 3.33Å
29	H	88.3	Confident	89.6	Confident	28 Å²	28	26.4 Å²	26.4	13%	0.13	13%	0.128	C	C	.	.			trans	-129.9	152.4	-172.7	-60.8	-51.6	0	0	0	111.8	W23 S24 I41 T42 F68 V320	W23-H29 WeakPolarHBondContact CA-O 3.18Å; S24-H29 PolarHBondContact N-O 3.23Å; S24-H29 PolarHBondContact OG-N 3.48Å; S24-H29 PolarHBondContact OG-O 3.22Å; H29-I41 HydrophobicContact CB-CG2 4.02Å; H29-T42 CarbonylContact C-O 3.39Å; H29-T42 WeakPolarHBondContact CA-O 3.14Å; H29-F68 HydrophobicContact CB-CZ 4.48Å; H29-V320 WeakPolarHBondContact NE2-CG2 3.49Å
30	I	91.5	Very high	89.8	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.01	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.8	172.8	-60.6	175.8	0	0	0	108	I21 W23 I41 T42 P44 A444 V452 V454	I21-I30 HydrophobicContact CG2-CG2 3.55Å; W23-I30 HydrophobicContact CD2-CD1 4.48Å; W23-I30 HydrophobicContact CD2-CG1 3.87Å; W23-I30 HydrophobicContact CE3-CD1 4.33Å; W23-I30 HydrophobicContact CE3-CG1 3.57Å; W23-I30 HydrophobicContact CH2-CD1 3.59Å; W23-I30 HydrophobicContact CH2-CG1 3.76Å; W23-I30 HydrophobicContact CZ2-CD1 3.72Å; W23-I30 HydrophobicContact CZ2-CG1 4.02Å; W23-I30 HydrophobicContact CZ3-CD1 3.91Å; W23-I30 HydrophobicContact CZ3-CG1 3.51Å; I30-I41 CarbonylContact O-C 3.6Å; I30-I41 WeakPolarHBondContact O-CA 3.47Å; I30-T42 PolarHBondContact N-O 3.35Å; I30-T42 PolarHBondContact O-N 3.17Å; I30-P44 HydrophobicContact CD1-CB 4.25Å; I30-P44 HydrophobicContact CD1-CG 4.01Å; I30-P44 HydrophobicContact CG1-CG 4.3Å; I30-A444 HydrophobicContact CD1-CB 3.97Å; I30-V452 HydrophobicContact CD1-CG1 4.41Å; I30-V454 HydrophobicContact CD1-CG2 4.01Å
31	L	93.8	Very high	89.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132.3	163.2	177.6	65.4	0	0	0	108.6	I21 C22 L39 S40 I41 A66 F68 A77	I21-L31 CarbonylContact C-O 3.57Å; I21-L31 WeakPolarHBondContact CA-O 3.01Å; C22-L31 PolarHBondContact N-O 3.17Å; C22-L31 PolarHBondContact O-N 3.31Å; L31-L39 HydrophobicContact CD1-CB 4.4Å; L31-L39 HydrophobicContact CD1-CD2 4.31Å; L31-S40 WeakPolarHBondContact CA-O 3.4Å; L31-I41 HydrophobicContact CD1-CG1 4.13Å; L31-A66 HydrophobicContact CD2-CB 3.91Å; L31-A66 HydrophobicContact CG-CB 4.27Å; L31-F68 HydrophobicContact CB-CD2 3.97Å; L31-F68 HydrophobicContact CB-CE1 4.39Å; L31-F68 HydrophobicContact CB-CE2 3.34Å; L31-F68 HydrophobicContact CB-CZ 3.59Å; L31-A77 HydrophobicContact CD2-CB 3.59Å
32	S	92.2	Very high	89.4	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.014	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	151.5	175.3	56.5	0	0	0	0	110.7	L8 T20 L39 S40	L8-S32 WeakPolarHBondContact CD2-OG 3.12Å; T20-S32 VanDerWaalsContact O-CA 3.27Å; T20-S32 WeakPolarHBondContact O-CA 3.01Å; S32-L39 WeakPolarHBondContact O-CA 3.39Å; S32-L39 WeakPolarHBondContact O-CD2 3.46Å; S32-S40 PolarHBondContact N-O 2.95Å; S32-S40 PolarHBondContact O-N 2.89Å; S32-S40 PolarHBondContact OG-O 3.46Å
33	G	91	Very high	88.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	139	177.7	0	0	0	0	0	111.7	N19 T20	N19-G33 PolarHBondContact N-O 2.99Å; T20-G33 PolarHBondContact O-N 3.17Å; T20-G33 VanDerWaalsContact O-N 3.15Å
34	S	85.5	Confident	88.2	Confident	6 Å²	6	28.3 Å²	28.3	4%	0.042	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	165.2	-170.6	42.1	0	0	0	0	113.8	Q17 D36 R37 M38	Q17-S34 WeakPolarHBondContact O-CA 3.2Å; Q17-S34 VanDerWaalsContact O-CB 3.28Å; Q17-S34 WeakPolarHBondContact O-CB 3.13Å; S34-D36 VanDerWaalsContact CB-OD1 3.25Å; S34-D36 WeakPolarHBondContact CB-OD1 3.33Å; S34-D36 PolarHBondContact O-N 2.6Å; S34-D36 PolarHBondContact OG-OD1 3.02Å; S34-R37 PolarHBondContact O-N 3.06Å; S34-R37 VanDerWaalsContact O-N 3.15Å; S34-M38 PolarHBondContact N-O 2.7Å; S34-M38 PolarHBondContact OG-O 3.31Å
35	D	84.4	Confident	87.4	Confident	45 Å²	45	31 Å²	31	24%	0.241	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.7	179.8	-82.2	-15.8	0	0	0	114	Q17 N19 R37 I62	Q17-D35 PolarHBondContact O-N 2.71Å; Q17-D35 VanDerWaalsContact O-N 3.09Å; N19-D35 PolarHBondContact ND2-OD1 2.78Å; D35-R37 PolarHBondContact O-N 2.84Å; D35-R37 VanDerWaalsContact O-N 3.15Å; D35-I62 WeakPolarHBondContact OD1-CG2 3.46Å
36	D	85.9	Confident	86.3	Confident	50 Å²	50	28.4 Å²	28.4	27%	0.267	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	7.7	176.8	70.5	-13.5	0	0	0	113.5	I16 S34 M38	I16-D36 HydrophobicContact CD1-CB 3.83Å; I16-D36 HydrophobicContact CG1-CB 4.14Å; I16-D36 HydrophobicContact CG2-CB 4.09Å; S34-D36 VanDerWaalsContact CB-OD1 3.25Å; S34-D36 WeakPolarHBondContact CB-OD1 3.33Å; S34-D36 PolarHBondContact O-N 2.6Å; S34-D36 PolarHBondContact OG-OD1 3.02Å; D36-M38 PolarHBondContact O-N 2.81Å; D36-M38 WeakPolarHBondContact OD1-CB 3.37Å; D36-M38 WeakPolarHBondContact OD1-CG 3.49Å; D36-M38 PolarHBondContact OD1-N 3.48Å; D36-M38 WeakPolarHBondContact OD2-CG 3.34Å
37	R	90.1	Very high	84.9	Confident	99 Å²	99	26.4 Å²	26.4	37%	0.374	14%	0.142	S	C	.	.	S	Bend	trans	70.1	21.5	176.1	-38.5	171.6	-170.7	-172	-2	112.5	S34 D35 S57 H59 E60 G61	S34-R37 PolarHBondContact O-N 3.06Å; S34-R37 VanDerWaalsContact O-N 3.15Å; D35-R37 PolarHBondContact O-N 2.84Å; D35-R37 VanDerWaalsContact O-N 3.15Å; R37-S57 WeakPolarHBondContact O-CB 3.48Å; R37-S57 PolarHBondContact O-N 3.35Å; R37-S57 VanDerWaalsContact O-N 3.08Å; R37-S57 PolarHBondContact O-OG 2.66Å; R37-H59 VanDerWaalsContact CD-O 3.3Å; R37-H59 WeakPolarHBondContact CD-O 3.03Å; R37-E60 PolarHBondContact NH1-O 3.1Å; R37-E60 PolarHBondContact NH2-O 2.91Å; R37-G61 WeakPolarHBondContact CG-O 3.23Å
38	M	91.2	Very high	83.3	Confident	39 Å²	39	30.3 Å²	30.3	19%	0.192	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	144.4	175.2	-56.4	-59.1	-74.2	0	0	110.7	S34 D36 T54 F55 R56 I63	S34-M38 PolarHBondContact N-O 2.7Å; S34-M38 PolarHBondContact OG-O 3.31Å; D36-M38 PolarHBondContact O-N 2.81Å; D36-M38 WeakPolarHBondContact OD1-CB 3.37Å; D36-M38 WeakPolarHBondContact OD1-CG 3.49Å; D36-M38 PolarHBondContact OD1-N 3.48Å; D36-M38 WeakPolarHBondContact OD2-CG 3.34Å; M38-T54 HydrophobicContact CB-CG2 3.85Å; M38-T54 HydrophobicContact CE-CG2 3.76Å; M38-T54 HydrophobicContact CG-CG2 4.34Å; M38-F55 WeakPolarHBondContact CE-O 3.38Å; M38-R56 HydrophobicContact SD-CB 4.24Å; M38-I63 WeakPolarHBondContact O-CD1 3.26Å
39	L	92.6	Very high	81.6	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.7	163.4	-72.9	172.4	0	0	0	108	L31 S32 T54 F55 I63 A66 H89	L31-L39 HydrophobicContact CD1-CB 4.4Å; L31-L39 HydrophobicContact CD1-CD2 4.31Å; S32-L39 WeakPolarHBondContact O-CA 3.39Å; S32-L39 WeakPolarHBondContact O-CD2 3.46Å; L39-T54 WeakPolarHBondContact O-CA 3.27Å; L39-F55 HydrophobicContact CB-CD1 4.39Å; L39-F55 HydrophobicContact CB-CD2 4.5Å; L39-F55 HydrophobicContact CB-CE1 3.78Å; L39-F55 HydrophobicContact CB-CE2 3.91Å; L39-F55 HydrophobicContact CB-CZ 3.51Å; L39-F55 HydrophobicContact CD1-CE2 4Å; L39-F55 HydrophobicContact CD1-CZ 3.92Å; L39-F55 HydrophobicContact CG-CZ 4.37Å; L39-F55 PolarHBondContact N-O 3.36Å; L39-F55 WeakPolarHBondContact O-CD1 3.49Å; L39-F55 PolarHBondContact O-N 3.41Å; L39-I63 HydrophobicContact CD2-CD1 3.88Å; L39-I63 HydrophobicContact CD2-CG2 4.45Å; L39-I63 HydrophobicContact CG-CD1 4.01Å; L39-A66 HydrophobicContact CD2-CB 3.79Å; L39-H89 WeakPolarHBondContact CD1-NE2 3.15Å
40	S	90.6	Very high	80	Confident	3 Å²	3	35 Å²	35	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	132.3	178	-61.6	0	0	0	0	110.6	L31 S32 V53 T54	L31-S40 WeakPolarHBondContact CA-O 3.4Å; S32-S40 PolarHBondContact N-O 2.95Å; S32-S40 PolarHBondContact O-N 2.89Å; S32-S40 PolarHBondContact OG-O 3.46Å; S40-V53 CarbonylContact C-O 3.44Å; S40-V53 VanDerWaalsContact CA-O 3.3Å; S40-V53 WeakPolarHBondContact CA-O 3.45Å; S40-T54 WeakPolarHBondContact OG-CB 3.31Å; S40-T54 VanDerWaalsContact OG-CG2 3.28Å; S40-T54 WeakPolarHBondContact OG-CG2 3.41Å; S40-T54 PolarHBondContact OG-OG1 3.48Å
41	I	90.2	Very high	78.7	Confident	27 Å²	27	38.1 Å²	38.1	14%	0.138	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125	169.8	-56.8	166.5	0	0	0	107.5	H29 I30 L31 A52 V53 F55 L91	H29-I41 HydrophobicContact CB-CG2 4.02Å; I30-I41 CarbonylContact O-C 3.6Å; I30-I41 WeakPolarHBondContact O-CA 3.47Å; L31-I41 HydrophobicContact CD1-CG1 4.13Å; I41-A52 CarbonylContact O-C 3.47Å; I41-A52 WeakPolarHBondContact O-CA 3.46Å; I41-V53 PolarHBondContact N-O 3.47Å; I41-V53 PolarHBondContact O-N 3.4Å; I41-F55 HydrophobicContact CD1-CE1 4.18Å; I41-F55 HydrophobicContact CG1-CE1 4.23Å; I41-L91 HydrophobicContact CD1-CB 3.84Å; I41-L91 HydrophobicContact CD1-CD1 3.71Å; I41-L91 HydrophobicContact CD1-CD2 4.01Å; I41-L91 HydrophobicContact CD1-CG 4.04Å; I41-L91 HydrophobicContact CG1-CD1 4.49Å
42	T	85.9	Confident	78	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	132.8	-173.7	-52.5	0	0	0	0	110.5	C6 H29 I30 P44 A52	C6-T42 WeakPolarHBondContact SG-CG2 3.48Å; H29-T42 CarbonylContact C-O 3.39Å; H29-T42 WeakPolarHBondContact CA-O 3.14Å; I30-T42 PolarHBondContact N-O 3.35Å; I30-T42 PolarHBondContact O-N 3.17Å; T42-P44 WeakPolarHBondContact O-CD 3.35Å; T42-A52 HydrophobicContact CG2-CB 4.12Å; T42-A52 WeakPolarHBondContact OG1-CB 3.2Å
43	D	84.1	Confident	77.7	Confident	60 Å²	60	39.1 Å²	39.1	32%	0.321	22%	0.218	S	C	.	.			trans	-90.6	110	164.7	-179.7	-9.5	0	0	0	108.7	F45 G46	D43-F45 VanDerWaalsContact C-N 3.26Å; D43-F45 PolarHBondContact O-N 3.37Å; D43-F45 WeakPolarHBondContact OD1-CA 3.33Å; D43-F45 WeakPolarHBondContact OD1-CB 3.31Å; D43-F45 PolarHBondContact OD1-N 2.83Å; D43-G46 PolarHBondContact OD1-N 2.79Å; D43-G46 VanDerWaalsContact OD1-N 3.14Å
44	P	77.2	Confident	77.5	Confident	6 Å²	6	41 Å²	41	4%	0.039	23%	0.23	C	C	.	.	S	Bend	trans	-77	-10.1	179.5	32.1	-33.1	0	0	0	113.6	W23 H28 I30 T42 V454	W23-P44 HydrophobicContact CH2-CG 3.71Å; W23-P44 HydrophobicContact CZ3-CG 3.74Å; H28-P44 WeakPolarHBondContact O-CD 3.33Å; I30-P44 HydrophobicContact CD1-CB 4.25Å; I30-P44 HydrophobicContact CD1-CG 4.01Å; I30-P44 HydrophobicContact CG1-CG 4.3Å; T42-P44 WeakPolarHBondContact O-CD 3.35Å; P44-V454 HydrophobicContact CB-CG2 3.83Å
45	F	76.7	Confident	77.7	Confident	58 Å²	58	41.3 Å²	41.3	25%	0.254	23%	0.231	S	C	.	.	S	Bend	trans	-100.3	-21.2	-176	-51	-71.9	0	0	0	113.1	W23 G27 D43 G47 I442	W23-F45 HydrophobicContact CH2-CZ 4.28Å; W23-F45 HydrophobicContact CZ3-CE2 4.14Å; W23-F45 HydrophobicContact CZ3-CZ 4.28Å; G27-F45 WeakPolarHBondContact O-CE2 3.2Å; D43-F45 VanDerWaalsContact C-N 3.26Å; D43-F45 PolarHBondContact O-N 3.37Å; D43-F45 WeakPolarHBondContact OD1-CA 3.33Å; D43-F45 WeakPolarHBondContact OD1-CB 3.31Å; D43-F45 PolarHBondContact OD1-N 2.83Å; F45-G47 VanDerWaalsContact C-N 3.27Å; F45-G47 PolarHBondContact O-N 2.62Å; F45-I442 HydrophobicContact CE1-CD1 3.68Å; F45-I442 HydrophobicContact CZ-CD1 4.05Å
46	G	64.5	Low	78	Confident	47 Å²	47	45.2 Å²	45.2	49%	0.485	24%	0.242	S	C	.	.	S	Bend	trans	-68.2	10.3	-171	0	0	0	0	0	119.2	D43	D43-G46 PolarHBondContact OD1-N 2.79Å; D43-G46 VanDerWaalsContact OD1-N 3.14Å
47	G	55.8	Low	78.3	Confident	12 Å²	12	42.8 Å²	42.8	12%	0.124	23%	0.229	C	C	.	.			trans	77.1	-156.2	175.4	0	0	0	0	0	115.8	F45 N49 H50	F45-G47 VanDerWaalsContact C-N 3.27Å; F45-G47 PolarHBondContact O-N 2.62Å; G47-N49 PolarHBondContact O-N 3.44Å; G47-H50 PolarHBondContact O-CD2 3.17Å; G47-H50 VanDerWaalsContact O-CD2 3.31Å; G47-H50 PolarHBondContact O-CE1 3.45Å; G47-H50 VanDerWaalsContact O-CE1 3.26Å; G47-H50 PolarHBondContact O-ND1 2.71Å; G47-H50 PolarHBondContact O-NE2 3.14Å
48	S	52.8	Low	78.4	Confident	84 Å²	84	42.1 Å²	42.1	59%	0.587	23%	0.227	S	C	*	.	S	Bend	trans	-70	-23.7	-169.1	38.5	0	0	0	0	115.6	H50 R465	S48-H50 PolarHBondContact O-N 2.88Å; S48-R465 VanDerWaalsContact CB-NH2 3.31Å
49	N	49.3	Very low	78.5	Confident	118 Å²	118	40.4 Å²	40.4	63%	0.631	22%	0.218	S	C	*	.			trans	-86.4	60.5	172.7	-81	2.5	0	0	0	109.3	G47 D51	G47-N49 PolarHBondContact O-N 3.44Å; N49-D51 PolarHBondContact O-N 3.35Å
50	H	54.9	Low	78.2	Confident	73 Å²	73	46.5 Å²	46.5	34%	0.338	25%	0.247	S	C	.	.			trans	-59.8	76.6	168.4	-64.9	-75.4	0	0	0	109.5	G47 S48 A52	G47-H50 PolarHBondContact O-CD2 3.17Å; G47-H50 VanDerWaalsContact O-CD2 3.31Å; G47-H50 PolarHBondContact O-CE1 3.45Å; G47-H50 VanDerWaalsContact O-CE1 3.26Å; G47-H50 PolarHBondContact O-ND1 2.71Å; G47-H50 PolarHBondContact O-NE2 3.14Å; S48-H50 PolarHBondContact O-N 2.88Å; H50-A52 PolarHBondContact O-N 2.72Å
51	D	65	Low	78	Confident	66 Å²	66	46.9 Å²	46.9	35%	0.353	25%	0.251	S	S	.	.			trans	-82.6	71	168.1	-71.9	-38.7	0	0	0	106.9	K9 N49 V53 M324	K9-D51 IonicContact NZ-OD1 3.48Å; K9-D51 PolarHBondContact NZ-OD1 2.79Å; K9-D51 VanDerWaalsContact NZ-OD1 3.12Å; N49-D51 PolarHBondContact O-N 3.35Å; D51-V53 PolarHBondContact O-N 3.22Å; D51-M324 HydrophobicContact CB-CE 3.8Å; D51-M324 HydrophobicContact CB-SD 3.93Å; D51-M324 VanDerWaalsContact OD2-CE 3.26Å; D51-M324 WeakPolarHBondContact OD2-CE 3.46Å
52	A	78.1	Confident	77.8	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.033	26%	0.261	C	S	.	.			trans	-53.6	112.9	155.9	0	0	0	0	0	106.6	I41 T42 H50 T54	I41-A52 CarbonylContact O-C 3.47Å; I41-A52 WeakPolarHBondContact O-CA 3.46Å; T42-A52 HydrophobicContact CG2-CB 4.12Å; T42-A52 WeakPolarHBondContact OG1-CB 3.2Å; H50-A52 PolarHBondContact O-N 2.72Å; A52-T54 PolarHBondContact O-N 3.29Å
53	V	85.3	Confident	78.1	Confident	19 Å²	19	48.5 Å²	48.5	12%	0.115	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	107.6	176.5	-178.9	0	0	0	0	106.3	S40 I41 D51 L94 L323 L327	S40-V53 CarbonylContact C-O 3.44Å; S40-V53 VanDerWaalsContact CA-O 3.3Å; S40-V53 WeakPolarHBondContact CA-O 3.45Å; I41-V53 PolarHBondContact N-O 3.47Å; I41-V53 PolarHBondContact O-N 3.4Å; D51-V53 PolarHBondContact O-N 3.22Å; V53-L94 HydrophobicContact CG1-CD1 3.42Å; V53-L94 VanDerWaalsContact CG1-CD1 3.42Å; V53-L323 HydrophobicContact CG1-CD2 4.41Å; V53-L323 HydrophobicContact CG2-CD2 3.93Å; V53-L327 HydrophobicContact CG1-CD1 3.98Å; V53-L327 HydrophobicContact CG2-CD1 3.97Å
54	T	87.8	Confident	78.4	Confident	39 Å²	39	48 Å²	48	24%	0.239	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126	-178.1	-57.7	0	0	0	0	108.7	M38 L39 S40 A52	M38-T54 HydrophobicContact CB-CG2 3.85Å; M38-T54 HydrophobicContact CE-CG2 3.76Å; M38-T54 HydrophobicContact CG-CG2 4.34Å; L39-T54 WeakPolarHBondContact O-CA 3.27Å; S40-T54 WeakPolarHBondContact OG-CB 3.31Å; S40-T54 VanDerWaalsContact OG-CG2 3.28Å; S40-T54 WeakPolarHBondContact OG-CG2 3.41Å; S40-T54 PolarHBondContact OG-OG1 3.48Å; A52-T54 PolarHBondContact O-N 3.29Å
55	F	89.9	Confident	79.2	Confident	14 Å²	14	47.8 Å²	47.8	6%	0.061	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.7	-174.5	63.9	-82.9	0	0	0	111	M38 L39 I41 S57 L91 L94	M38-F55 WeakPolarHBondContact CE-O 3.38Å; L39-F55 HydrophobicContact CB-CD1 4.39Å; L39-F55 HydrophobicContact CB-CD2 4.5Å; L39-F55 HydrophobicContact CB-CE1 3.78Å; L39-F55 HydrophobicContact CB-CE2 3.91Å; L39-F55 HydrophobicContact CB-CZ 3.51Å; L39-F55 HydrophobicContact CD1-CE2 4Å; L39-F55 HydrophobicContact CD1-CZ 3.92Å; L39-F55 HydrophobicContact CG-CZ 4.37Å; L39-F55 PolarHBondContact N-O 3.36Å; L39-F55 WeakPolarHBondContact O-CD1 3.49Å; L39-F55 PolarHBondContact O-N 3.41Å; I41-F55 HydrophobicContact CD1-CE1 4.18Å; I41-F55 HydrophobicContact CG1-CE1 4.23Å; F55-S57 PolarHBondContact O-N 2.68Å; F55-L91 HydrophobicContact CE1-CD2 4.45Å; F55-L91 HydrophobicContact CZ-CD2 3.85Å; F55-L94 HydrophobicContact CB-CB 4.08Å; F55-L94 HydrophobicContact CB-CD1 4.09Å; F55-L94 HydrophobicContact CD1-CD1 3.86Å; F55-L94 HydrophobicContact CD1-CD2 3.83Å; F55-L94 HydrophobicContact CD1-CG 4.35Å; F55-L94 HydrophobicContact CD2-CB 4.31Å; F55-L94 HydrophobicContact CD2-CD2 3.98Å; F55-L94 HydrophobicContact CE1-CD2 3.82Å; F55-L94 HydrophobicContact CE2-CD2 3.97Å; F55-L94 HydrophobicContact CG-CB 4.14Å; F55-L94 HydrophobicContact CG-CD1 4.03Å; F55-L94 HydrophobicContact CG-CD2 3.91Å; F55-L94 HydrophobicContact CG-CG 4.25Å; F55-L94 HydrophobicContact CZ-CD2 3.89Å
56	R	91.3	Very high	80.1	Confident	126 Å²	126	45.1 Å²	45.1	48%	0.475	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	125	179.3	-171.7	178.3	-179.2	92.4	-3.7	108.8	M38 Y58	M38-R56 HydrophobicContact SD-CB 4.24Å; R56-Y58 VanDerWaalsContact O-CD2 3.31Å; R56-Y58 WeakPolarHBondContact O-CD2 3.09Å; R56-Y58 PolarHBondContact O-N 3.23Å
57	S	91.7	Very high	81.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.			trans	-78.4	-6.4	-178.1	72.7	0	0	0	0	114.3	R37 F55 H59 I63 I87 H89	R37-S57 WeakPolarHBondContact O-CB 3.48Å; R37-S57 PolarHBondContact O-N 3.35Å; R37-S57 VanDerWaalsContact O-N 3.08Å; R37-S57 PolarHBondContact O-OG 2.66Å; F55-S57 PolarHBondContact O-N 2.68Å; S57-H59 PolarHBondContact O-N 3.02Å; S57-H59 VanDerWaalsContact O-N 3.09Å; S57-H59 WeakPolarHBondContact OG-CB 3.03Å; S57-H59 PolarHBondContact OG-CD2 3.2Å; S57-H59 PolarHBondContact OG-N 2.97Å; S57-I63 WeakPolarHBondContact OG-CD1 3.43Å; S57-I87 VanDerWaalsContact O-CD1 3.23Å; S57-I87 WeakPolarHBondContact O-CD1 3.44Å; S57-H89 PolarHBondContact O-CE1 2.85Å; S57-H89 VanDerWaalsContact O-CE1 3.25Å
58	Y	92.6	Very high	83.6	Confident	85 Å²	85	44.4 Å²	44.4	33%	0.333	22%	0.222	S	C	.	.			trans	62	5.9	-171	-68.5	-91	0	0	0	115.7	R56 E95 M96 P97	R56-Y58 VanDerWaalsContact O-CD2 3.31Å; R56-Y58 WeakPolarHBondContact O-CD2 3.09Å; R56-Y58 PolarHBondContact O-N 3.23Å; Y58-E95 WeakPolarHBondContact CE2-O 3.32Å; Y58-E95 VanDerWaalsContact CZ-O 3.28Å; Y58-E95 PolarHBondContact OH-O 3.45Å; Y58-M96 HydrophobicContact CE1-SD 4.17Å; Y58-M96 PolarHBondContact OH-SD 2.84Å; Y58-M96 VanDerWaalsContact OH-SD 3.41Å; Y58-P97 HydrophobicContact CD2-CG 4.21Å; Y58-P97 HydrophobicContact CG-CG 4.12Å
59	H	91.8	Very high	85.6	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.009	19%	0.194	C	C	.	.			trans	-66.4	143.5	167.2	-75.3	-78.1	0	0	0	110.8	R37 S57 G61 I63 S79	R37-H59 VanDerWaalsContact CD-O 3.3Å; R37-H59 WeakPolarHBondContact CD-O 3.03Å; S57-H59 PolarHBondContact O-N 3.02Å; S57-H59 VanDerWaalsContact O-N 3.09Å; S57-H59 WeakPolarHBondContact OG-CB 3.03Å; S57-H59 PolarHBondContact OG-CD2 3.2Å; S57-H59 PolarHBondContact OG-N 2.97Å; H59-G61 VanDerWaalsContact C-N 3.31Å; H59-I63 HydrophobicContact CB-CG1 4.24Å; H59-S79 PolarHBondContact NE2-OG 3.01Å
60	E	86.9	Confident	87.6	Confident	129 Å²	129	35.7 Å²	35.7	60%	0.603	17%	0.169	S	C	*	.	S	Bend	trans	-88.8	-0.3	175.9	-73.4	-178.3	-174.5	0	0	113.1	R37 R83	R37-E60 PolarHBondContact NH1-O 3.1Å; R37-E60 PolarHBondContact NH2-O 2.91Å; E60-R83 HydrophobicContact CB-CG 3.89Å
61	G	86.5	Confident	89.2	Confident	11 Å²	11	37.5 Å²	37.5	11%	0.113	18%	0.176	C	C	.	.	S	Bend	trans	-162.3	-160.1	177.5	0	0	0	0	0	111.3	R37 H59 I63	R37-G61 WeakPolarHBondContact CG-O 3.23Å; H59-G61 VanDerWaalsContact C-N 3.31Å; G61-I63 PolarHBondContact O-N 2.93Å
62	I	86.7	Confident	90.2	Very high	65 Å²	65	35.1 Å²	35.1	33%	0.333	16%	0.164	S	C	.	.			trans	-57.2	133.5	-173.6	-63.7	165.1	0	0	0	111.4	N19 D35 F64 G81 A82	N19-I62 VanDerWaalsContact ND2-CG2 3.25Å; N19-I62 WeakPolarHBondContact ND2-CG2 3.31Å; D35-I62 WeakPolarHBondContact OD1-CG2 3.46Å; I62-F64 HydrophobicContact CB-CE1 4.18Å; I62-F64 HydrophobicContact CB-CZ 4.01Å; I62-F64 HydrophobicContact CG2-CD1 3.89Å; I62-F64 HydrophobicContact CG2-CE1 3.55Å; I62-F64 HydrophobicContact CG2-CZ 3.91Å; I62-G81 CarbonylContact O-C 3.58Å; I62-G81 WeakPolarHBondContact O-CA 3.05Å; I62-A82 PolarHBondContact O-N 3.09Å
63	I	90.5	Very high	90.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	123	168.6	-53.5	174	0	0	0	107.8	N19 T20 M38 L39 S57 H59 G61	N19-I63 WeakPolarHBondContact CB-O 3.42Å; N19-I63 PolarHBondContact ND2-O 3.13Å; T20-I63 HydrophobicContact CG2-CG2 4.3Å; M38-I63 WeakPolarHBondContact O-CD1 3.26Å; L39-I63 HydrophobicContact CD2-CD1 3.88Å; L39-I63 HydrophobicContact CD2-CG2 4.45Å; L39-I63 HydrophobicContact CG-CD1 4.01Å; S57-I63 WeakPolarHBondContact OG-CD1 3.43Å; H59-I63 HydrophobicContact CB-CG1 4.24Å; G61-I63 PolarHBondContact O-N 2.93Å
64	F	90.3	Very high	91	Very high	51 Å²	51	40.3 Å²	40.3	22%	0.224	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-32.2	179.3	-66.7	-60.4	0	0	0	112.6	I62 C80 A82 V110 K111	I62-F64 HydrophobicContact CB-CE1 4.18Å; I62-F64 HydrophobicContact CB-CZ 4.01Å; I62-F64 HydrophobicContact CG2-CD1 3.89Å; I62-F64 HydrophobicContact CG2-CE1 3.55Å; I62-F64 HydrophobicContact CG2-CZ 3.91Å; F64-C80 PolarHBondContact N-O 3.02Å; F64-A82 HydrophobicContact CE2-CB 4.32Å; F64-V110 WeakPolarHBondContact CD2-O 3.32Å; F64-K111 WeakPolarHBondContact CB-O 3.42Å; F64-K111 HydrophobicContact CD2-CD 4.24Å; F64-K111 HydrophobicContact CG-CD 4.35Å
65	C	94.5	Very high	91.1	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	140.1	-179	-172	0	0	0	0	110.4	S79 C80 Q112	C65-S79 CarbonylContact O-C 3.58Å; C65-S79 VanDerWaalsContact O-CA 3.23Å; C65-S79 WeakPolarHBondContact O-CA 3.47Å; C65-C80 PolarHBondContact N-O 2.8Å; C65-C80 PolarHBondContact O-N 3.42Å; C65-Q112 PolarHBondContact SG-OE1 3.21Å; C65-Q112 VanDerWaalsContact SG-OE1 3.39Å
66	A	96.6	Very high	91.3	Very high	1 Å²	1	42 Å²	42	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	133.8	170.5	0	0	0	0	0	109.6	T20 C22 L31 L39 V78	T20-A66 HydrophobicContact CG2-CB 3.71Å; T20-A66 PolarHBondContact OG1-N 3.36Å; T20-A66 PolarHBondContact OG1-O 3.32Å; C22-A66 WeakPolarHBondContact CB-O 3.21Å; L31-A66 HydrophobicContact CD2-CB 3.91Å; L31-A66 HydrophobicContact CG-CB 4.27Å; L39-A66 HydrophobicContact CD2-CB 3.79Å; A66-V78 CarbonylContact C-O 3.51Å; A66-V78 WeakPolarHBondContact CA-O 3.44Å
67	K	97.3	Very high	91.6	Very high	31 Å²	31	36 Å²	36	14%	0.135	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141.4	-178.5	-70	-175	177.4	-76.5	0	110.7	A77 V78 L113 V115	K67-A77 CarbonylContact O-C 3.54Å; K67-A77 VanDerWaalsContact O-CA 3.29Å; K67-A77 WeakPolarHBondContact O-CA 3.35Å; K67-A77 WeakPolarHBondContact O-CB 3.26Å; K67-V78 PolarHBondContact N-O 2.86Å; K67-V78 PolarHBondContact O-N 3.34Å; K67-L113 WeakPolarHBondContact CD-O 3.23Å; K67-L113 WeakPolarHBondContact CE-O 3.45Å; K67-V115 HydrophobicContact CB-CG1 4.2Å; K67-V115 HydrophobicContact CD-CG1 4.45Å; K67-V115 HydrophobicContact CD-CG2 4.44Å
68	F	96.1	Very high	91.9	Very high	13 Å²	13	36 Å²	36	6%	0.057	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	144.2	164.8	-71.8	-78.7	0	0	0	110.2	C22 W23 H29 L31 L91	C22-F68 WeakPolarHBondContact O-CE2 3.38Å; W23-F68 WeakPolarHBondContact O-CD2 3.45Å; H29-F68 HydrophobicContact CB-CZ 4.48Å; L31-F68 HydrophobicContact CB-CD2 3.97Å; L31-F68 HydrophobicContact CB-CE1 4.39Å; L31-F68 HydrophobicContact CB-CE2 3.34Å; L31-F68 HydrophobicContact CB-CZ 3.59Å; F68-L91 HydrophobicContact CD1-CD1 3.83Å; F68-L91 HydrophobicContact CE1-CD1 3.42Å; F68-L91 VanDerWaalsContact CE1-CD1 3.42Å; F68-L91 HydrophobicContact CZ-CD1 4.49Å
69	L	94.8	Very high	92.1	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-79.3	126.7	168.5	-71.8	-180	0	0	0	109.4	T72 Q76 V78 L88 V115 T137	L69-T72 HydrophobicContact CB-CG2 3.69Å; L69-T72 PolarHBondContact O-OG1 3.06Å; L69-Q76 HydrophobicContact CB-CB 4.24Å; L69-Q76 HydrophobicContact CD1-CB 3.99Å; L69-Q76 HydrophobicContact CG-CB 4.44Å; L69-Q76 PolarHBondContact N-O 3.06Å; L69-V78 HydrophobicContact CD2-CB 4.46Å; L69-V78 HydrophobicContact CD2-CG1 4.06Å; L69-L88 HydrophobicContact CD1-CD1 3.5Å; L69-L88 VanDerWaalsContact CD1-CD1 3.5Å; L69-V115 HydrophobicContact CD2-CG1 3.92Å; L69-T137 HydrophobicContact CD1-CG2 4.4Å
70	P	90.3	Very high	92.2	Very high	17 Å²	17	32 Å²	32	11%	0.11	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	151.9	-179.8	-24.8	35.1	0	0	0	111.8	T72 V115 P120	P70-T72 PolarHBondContact O-N 3.13Å; P70-T72 VanDerWaalsContact O-N 3.09Å; P70-V115 HydrophobicContact CG-CB 4.17Å; P70-V115 HydrophobicContact CG-CG2 3.79Å; P70-P120 WeakPolarHBondContact O-CB 3.36Å
71	K	88.4	Confident	92.4	Very high	111 Å²	111	25.8 Å²	25.8	48%	0.483	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	23.8	175.1	-53.8	-175	-177.2	179.6	0	115.2	E25 P117 N118	E25-K71 PolarHBondContact OE2-N 3.04Å; K71-P117 WeakPolarHBondContact CE-O 3.43Å; K71-N118 PolarHBondContact NZ-OD1 2.68Å
72	T	88	Confident	92.4	Very high	16 Å²	16	26 Å²	26	10%	0.098	13%	0.134	C	C	.	.	S	Bend	trans	-103.6	10.1	173.3	66.6	0	0	0	0	112.7	L69 P70 S74 T75 Q76 P120	L69-T72 HydrophobicContact CB-CG2 3.69Å; L69-T72 PolarHBondContact O-OG1 3.06Å; P70-T72 PolarHBondContact O-N 3.13Å; P70-T72 VanDerWaalsContact O-N 3.09Å; T72-S74 PolarHBondContact O-N 2.87Å; T72-T75 WeakPolarHBondContact O-CB 3.37Å; T72-T75 WeakPolarHBondContact O-CG2 3.47Å; T72-T75 PolarHBondContact O-N 2.92Å; T72-T75 VanDerWaalsContact O-N 3.1Å; T72-T75 PolarHBondContact O-OG1 3.11Å; T72-Q76 HydrophobicContact CG2-CB 4.14Å; T72-Q76 HydrophobicContact CG2-CG 4.42Å; T72-Q76 PolarHBondContact OG1-N 3Å; T72-P120 HydrophobicContact CG2-CB 4.09Å
73	N	88.5	Confident	92.4	Very high	114 Å²	114	28.6 Å²	28.6	61%	0.61	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	38.6	-170.2	-56.9	-37.5	0	0	0	111.9	T75	N73-T75 HydrophobicContact CB-CG2 4.48Å; N73-T75 PolarHBondContact O-N 2.91Å; N73-T75 VanDerWaalsContact O-N 3.08Å
74	S	89.8	Confident	92.3	Very high	19 Å²	19	28.6 Å²	28.6	13%	0.133	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	22.4	-179.8	-44.8	0	0	0	0	113.9	S24 T72 L91	S24-S74 VanDerWaalsContact CB-OG 3.3Å; S24-S74 WeakPolarHBondContact CB-OG 3.25Å; T72-S74 PolarHBondContact O-N 2.87Å; S74-L91 WeakPolarHBondContact O-CD1 3.46Å
75	T	91.3	Very high	92.4	Very high	38 Å²	38	26.6 Å²	26.6	23%	0.233	13%	0.131	C	C	.	.			trans	-91.4	-11.8	-180	63.1	0	0	0	0	113.4	T72 N73 L91 N92	T72-T75 WeakPolarHBondContact O-CB 3.37Å; T72-T75 WeakPolarHBondContact O-CG2 3.47Å; T72-T75 PolarHBondContact O-N 2.92Å; T72-T75 VanDerWaalsContact O-N 3.1Å; T72-T75 PolarHBondContact O-OG1 3.11Å; N73-T75 HydrophobicContact CB-CG2 4.48Å; N73-T75 PolarHBondContact O-N 2.91Å; N73-T75 VanDerWaalsContact O-N 3.08Å; T75-L91 WeakPolarHBondContact O-CB 3.11Å; T75-L91 PolarHBondContact O-N 3.11Å; T75-N92 WeakPolarHBondContact CB-ND2 3.35Å; T75-N92 WeakPolarHBondContact CG2-ND2 3.46Å
76	Q	94.4	Very high	92.4	Very high	51 Å²	51	26.6 Å²	26.6	24%	0.238	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.3	178.3	-61.2	-168.7	-30.9	0	0	111.4	L69 T72 H89	L69-Q76 HydrophobicContact CB-CB 4.24Å; L69-Q76 HydrophobicContact CD1-CB 3.99Å; L69-Q76 HydrophobicContact CG-CB 4.44Å; L69-Q76 PolarHBondContact N-O 3.06Å; T72-Q76 HydrophobicContact CG2-CB 4.14Å; T72-Q76 HydrophobicContact CG2-CG 4.42Å; T72-Q76 PolarHBondContact OG1-N 3Å; Q76-H89 WeakPolarHBondContact CA-O 3.47Å
77	A	96.6	Very high	92.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	153.6	172.5	0	0	0	0	0	110.9	L31 K67 H89 L91	L31-A77 HydrophobicContact CD2-CB 3.59Å; K67-A77 CarbonylContact O-C 3.54Å; K67-A77 VanDerWaalsContact O-CA 3.29Å; K67-A77 WeakPolarHBondContact O-CA 3.35Å; K67-A77 WeakPolarHBondContact O-CB 3.26Å; A77-H89 PolarHBondContact N-O 3.07Å; A77-H89 PolarHBondContact O-N 3.38Å; A77-L91 HydrophobicContact CB-CD1 3.98Å; A77-L91 HydrophobicContact CB-CD2 4.12Å; A77-L91 HydrophobicContact CB-CG 4.35Å
78	V	97.3	Very high	92.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.7	170	63.7	0	0	0	0	108.9	A66 K67 L69 I87 L113 V115 F123	A66-V78 CarbonylContact C-O 3.51Å; A66-V78 WeakPolarHBondContact CA-O 3.44Å; K67-V78 PolarHBondContact N-O 2.86Å; K67-V78 PolarHBondContact O-N 3.34Å; L69-V78 HydrophobicContact CD2-CB 4.46Å; L69-V78 HydrophobicContact CD2-CG1 4.06Å; V78-I87 WeakPolarHBondContact CA-O 3.47Å; V78-L113 HydrophobicContact CB-CD1 4.17Å; V78-L113 HydrophobicContact CG1-CD1 3.73Å; V78-L113 HydrophobicContact CG2-CD1 3.68Å; V78-V115 HydrophobicContact CG1-CG1 4.07Å; V78-F123 HydrophobicContact CG2-CD1 4.21Å; V78-F123 HydrophobicContact CG2-CD2 4.17Å; V78-F123 HydrophobicContact CG2-CE1 3.9Å; V78-F123 HydrophobicContact CG2-CE2 3.84Å; V78-F123 HydrophobicContact CG2-CG 4.33Å; V78-F123 HydrophobicContact CG2-CZ 3.69Å
79	S	97.6	Very high	92.2	Very high	1 Å²	1	25 Å²	25	1%	0.007	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	149.5	177.2	59.4	0	0	0	0	110.6	H59 C65 A86 I87 H89	H59-S79 PolarHBondContact NE2-OG 3.01Å; C65-S79 CarbonylContact O-C 3.58Å; C65-S79 VanDerWaalsContact O-CA 3.23Å; C65-S79 WeakPolarHBondContact O-CA 3.47Å; S79-A86 CarbonylContact O-C 3.51Å; S79-A86 WeakPolarHBondContact O-CA 3.05Å; S79-I87 PolarHBondContact N-O 3.31Å; S79-I87 PolarHBondContact O-N 2.91Å; S79-H89 PolarHBondContact OG-CD2 3.3Å; S79-H89 PolarHBondContact OG-NE2 2.84Å
80	C	95	Very high	92.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.9	174.8	78	0	0	0	0	111.3	F64 C65 A86 V110 L113	F64-C80 PolarHBondContact N-O 3.02Å; C65-C80 PolarHBondContact N-O 2.8Å; C65-C80 PolarHBondContact O-N 3.42Å; C80-A86 HydrophobicContact CB-CB 4.18Å; C80-V110 HydrophobicContact CB-CB 3.82Å; C80-V110 HydrophobicContact CB-CG1 3.62Å; C80-V110 PolarHBondContact SG-O 2.85Å; C80-L113 HydrophobicContact CB-CD1 3.87Å; C80-L113 HydrophobicContact CB-CD2 3.86Å; C80-L113 HydrophobicContact CB-CG 3.83Å
81	G	89.6	Confident	92.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	-157.2	-172.1	0	0	0	0	0	114.4	I62 I85 S109 V110	I62-G81 CarbonylContact O-C 3.58Å; I62-G81 WeakPolarHBondContact O-CA 3.05Å; G81-I85 PolarHBondContact N-O 2.91Å; G81-S109 CarbonylContact O-C 3.57Å; G81-S109 WeakPolarHBondContact O-CA 3.46Å; G81-V110 PolarHBondContact O-N 3.28Å
82	A	86.8	Confident	92.4	Very high	15 Å²	15	24.1 Å²	24.1	12%	0.124	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-59.3	168.5	168.6	0	0	0	0	0	111.6	I62 F64 G84	I62-A82 PolarHBondContact O-N 3.09Å; F64-A82 HydrophobicContact CE2-CB 4.32Å; A82-G84 PolarHBondContact O-N 3.44Å
83	R	87.4	Confident	92.5	Very high	119 Å²	119	29.3 Å²	29.3	45%	0.449	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	14.3	-179.9	-54.9	-74.8	105.7	156.1	-0.1	115.3	E60 I85 Q102 P106 C108	E60-R83 HydrophobicContact CB-CG 3.89Å; R83-I85 PolarHBondContact O-N 3.21Å; R83-Q102 PolarHBondContact O-NE2 2.91Å; R83-Q102 VanDerWaalsContact O-NE2 3.14Å; R83-P106 WeakPolarHBondContact CA-O 3.27Å; R83-P106 WeakPolarHBondContact CD-O 3.12Å; R83-P106 PolarHBondContact NE-O 2.99Å; R83-P106 WeakPolarHBondContact O-CA 3.42Å; R83-C108 CarbonylContact C-O 3.48Å; R83-C108 WeakPolarHBondContact CA-O 3.15Å; R83-C108 PolarHBondContact N-O 3.48Å
84	G	87.7	Confident	92.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	19.8	170.6	0	0	0	0	0	114.8	A82 L103 C104 C108	A82-G84 PolarHBondContact O-N 3.44Å; G84-L103 WeakPolarHBondContact O-CA 3.33Å; G84-L103 WeakPolarHBondContact O-CB 3.47Å; G84-L103 PolarHBondContact O-N 2.78Å; G84-C104 WeakPolarHBondContact CA-SG 3.16Å; G84-C104 PolarHBondContact O-N 2.69Å; G84-C108 PolarHBondContact N-O 3.2Å
85	I	91.8	Very high	92.4	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.051	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	153.6	-176.1	62.1	174.4	0	0	0	112.9	G81 R83 I87 V100 Y101	G81-I85 PolarHBondContact N-O 2.91Å; R83-I85 PolarHBondContact O-N 3.21Å; I85-I87 HydrophobicContact CD1-CD1 4.03Å; I85-I87 HydrophobicContact CD1-CG1 4.32Å; I85-V100 HydrophobicContact CB-CG1 4.47Å; I85-V100 HydrophobicContact CG2-CG1 4.47Å; I85-Y101 VanDerWaalsContact CA-O 3.26Å; I85-Y101 WeakPolarHBondContact CA-O 3.5Å
86	A	94.7	Very high	92.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	149.5	160.1	0	0	0	0	0	109.4	S79 C80 Y101 L103 F123	S79-A86 CarbonylContact O-C 3.51Å; S79-A86 WeakPolarHBondContact O-CA 3.05Å; C80-A86 HydrophobicContact CB-CB 4.18Å; A86-Y101 PolarHBondContact N-O 3.43Å; A86-Y101 PolarHBondContact O-N 3.03Å; A86-L103 HydrophobicContact CB-CD1 3.59Å; A86-L103 HydrophobicContact CB-CG 4.24Å; A86-F123 HydrophobicContact CB-CE2 4.24Å; A86-F123 HydrophobicContact CB-CZ 4.44Å
87	I	95.7	Very high	92.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130.1	-175.8	-56	-179.7	0	0	0	108.9	S57 V78 S79 I85 H89 P97 K99 V100	S57-I87 VanDerWaalsContact O-CD1 3.23Å; S57-I87 WeakPolarHBondContact O-CD1 3.44Å; V78-I87 WeakPolarHBondContact CA-O 3.47Å; S79-I87 PolarHBondContact N-O 3.31Å; S79-I87 PolarHBondContact O-N 2.91Å; I85-I87 HydrophobicContact CD1-CD1 4.03Å; I85-I87 HydrophobicContact CD1-CG1 4.32Å; I87-H89 WeakPolarHBondContact CG2-CE1 3.2Å; I87-H89 PolarHBondContact O-CD2 2.82Å; I87-P97 HydrophobicContact CG2-CB 3.38Å; I87-P97 HydrophobicContact CG2-CG 4.31Å; I87-K99 WeakPolarHBondContact CA-O 3.39Å; I87-V100 HydrophobicContact CD1-CG2 4.43Å; I87-V100 HydrophobicContact CG1-CG1 4.24Å; I87-V100 HydrophobicContact CG1-CG2 4.21Å; I87-V100 HydrophobicContact CG2-CG2 4.34Å
88	L	96.2	Very high	91.9	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	127	169.8	175.8	66.6	0	0	0	109.7	L69 V98 K99 Y101 T137	L69-L88 HydrophobicContact CD1-CD1 3.5Å; L69-L88 VanDerWaalsContact CD1-CD1 3.5Å; L88-V98 HydrophobicContact CB-CB 4.46Å; L88-V98 HydrophobicContact CD2-CB 4.06Å; L88-V98 HydrophobicContact CD2-CG1 3.81Å; L88-V98 HydrophobicContact CG-CB 3.99Å; L88-V98 HydrophobicContact CG-CG1 4.3Å; L88-V98 PolarHBondContact O-N 3.28Å; L88-K99 HydrophobicContact CB-CB 4.41Å; L88-K99 PolarHBondContact N-O 2.7Å; L88-K99 PolarHBondContact O-N 3.09Å; L88-Y101 HydrophobicContact CB-CE2 3.87Å; L88-T137 HydrophobicContact CD1-CG2 4.26Å; L88-T137 HydrophobicContact CD2-CG2 3.9Å
89	H	95.4	Very high	91.7	Very high	6 Å²	6	41.5 Å²	41.5	3%	0.028	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.3	-177.2	-59.6	-77.8	0	0	0	110.8	L39 S57 Q76 A77 S79 I87 L91	L39-H89 WeakPolarHBondContact CD1-NE2 3.15Å; S57-H89 PolarHBondContact O-CE1 2.85Å; S57-H89 VanDerWaalsContact O-CE1 3.25Å; Q76-H89 WeakPolarHBondContact CA-O 3.47Å; A77-H89 PolarHBondContact N-O 3.07Å; A77-H89 PolarHBondContact O-N 3.38Å; S79-H89 PolarHBondContact OG-CD2 3.3Å; S79-H89 PolarHBondContact OG-NE2 2.84Å; I87-H89 WeakPolarHBondContact CG2-CE1 3.2Å; I87-H89 PolarHBondContact O-CD2 2.82Å; H89-L91 HydrophobicContact CB-CD2 3.84Å
90	D	94.1	Very high	91.4	Very high	34 Å²	34	44.8 Å²	44.8	18%	0.182	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	113.9	161	-178.9	-8.4	0	0	0	107.4	N92 H93 V98	D90-N92 PolarHBondContact O-N 2.97Å; D90-N92 WeakPolarHBondContact OD1-CB 3.47Å; D90-N92 PolarHBondContact OD1-N 3.02Å; D90-N92 PolarHBondContact OD1-ND2 2.75Å; D90-H93 HydrophobicContact CB-CB 4.41Å; D90-H93 CarbonylContact O-C 3.55Å; D90-H93 VanDerWaalsContact O-C 3.27Å; D90-H93 PolarHBondContact O-N 3.37Å; D90-H93 VanDerWaalsContact O-O 3.13Å; D90-H93 IonicContact OD1-ND1 3.44Å; D90-H93 IonicContact OD2-CE1 2.7Å; D90-H93 IonicContact OD2-CG 3.96Å; D90-H93 IonicContact OD2-ND1 3.36Å; D90-H93 PolarHBondContact OD2-ND1 3.42Å; D90-V98 HydrophobicContact CB-CG2 3.52Å
91	L	92.3	Very high	91.3	Very high	9 Å²	9	45 Å²	45	5%	0.047	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-7.1	-174.6	-53	-175.5	0	0	0	112.6	I41 F55 F68 S74 T75 A77 H89 L94	I41-L91 HydrophobicContact CD1-CB 3.84Å; I41-L91 HydrophobicContact CD1-CD1 3.71Å; I41-L91 HydrophobicContact CD1-CD2 4.01Å; I41-L91 HydrophobicContact CD1-CG 4.04Å; I41-L91 HydrophobicContact CG1-CD1 4.49Å; F55-L91 HydrophobicContact CE1-CD2 4.45Å; F55-L91 HydrophobicContact CZ-CD2 3.85Å; F68-L91 HydrophobicContact CD1-CD1 3.83Å; F68-L91 HydrophobicContact CE1-CD1 3.42Å; F68-L91 VanDerWaalsContact CE1-CD1 3.42Å; F68-L91 HydrophobicContact CZ-CD1 4.49Å; S74-L91 WeakPolarHBondContact O-CD1 3.46Å; T75-L91 WeakPolarHBondContact O-CB 3.11Å; T75-L91 PolarHBondContact O-N 3.11Å; A77-L91 HydrophobicContact CB-CD1 3.98Å; A77-L91 HydrophobicContact CB-CD2 4.12Å; A77-L91 HydrophobicContact CB-CG 4.35Å; H89-L91 HydrophobicContact CB-CD2 3.84Å; L91-L94 HydrophobicContact CD2-CD2 4.37Å
92	N	90.5	Very high	91.4	Very high	70 Å²	70	47.9 Å²	47.9	37%	0.374	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-19.3	167.1	-57.9	-61.2	0	0	0	112.7	T75 D90	T75-N92 WeakPolarHBondContact CB-ND2 3.35Å; T75-N92 WeakPolarHBondContact CG2-ND2 3.46Å; D90-N92 PolarHBondContact O-N 2.97Å; D90-N92 WeakPolarHBondContact OD1-CB 3.47Å; D90-N92 PolarHBondContact OD1-N 3.02Å; D90-N92 PolarHBondContact OD1-ND2 2.75Å
93	H	90.6	Very high	91.4	Very high	125 Å²	125	47.1 Å²	47.1	58%	0.579	23%	0.233	S	C	*	.			trans	-133.1	79.9	-174.3	-57.3	96.8	0	0	0	110.1	D90 E95	D90-H93 HydrophobicContact CB-CB 4.41Å; D90-H93 CarbonylContact O-C 3.55Å; D90-H93 VanDerWaalsContact O-C 3.27Å; D90-H93 PolarHBondContact O-N 3.37Å; D90-H93 VanDerWaalsContact O-O 3.13Å; D90-H93 IonicContact OD1-ND1 3.44Å; D90-H93 IonicContact OD2-CE1 2.7Å; D90-H93 IonicContact OD2-CG 3.96Å; D90-H93 IonicContact OD2-ND1 3.36Å; D90-H93 PolarHBondContact OD2-ND1 3.42Å; H93-E95 VanDerWaalsContact C-N 3.28Å; H93-E95 PolarHBondContact O-N 3.03Å
94	L	89	Confident	91.4	Very high	38 Å²	38	41.5 Å²	41.5	20%	0.199	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-4.5	-170.3	-55.8	178.2	0	0	0	114.7	V53 F55 L91	V53-L94 HydrophobicContact CG1-CD1 3.42Å; V53-L94 VanDerWaalsContact CG1-CD1 3.42Å; F55-L94 HydrophobicContact CB-CB 4.08Å; F55-L94 HydrophobicContact CB-CD1 4.09Å; F55-L94 HydrophobicContact CD1-CD1 3.86Å; F55-L94 HydrophobicContact CD1-CD2 3.83Å; F55-L94 HydrophobicContact CD1-CG 4.35Å; F55-L94 HydrophobicContact CD2-CB 4.31Å; F55-L94 HydrophobicContact CD2-CD2 3.98Å; F55-L94 HydrophobicContact CE1-CD2 3.82Å; F55-L94 HydrophobicContact CE2-CD2 3.97Å; F55-L94 HydrophobicContact CG-CB 4.14Å; F55-L94 HydrophobicContact CG-CD1 4.03Å; F55-L94 HydrophobicContact CG-CD2 3.91Å; F55-L94 HydrophobicContact CG-CG 4.25Å; F55-L94 HydrophobicContact CZ-CD2 3.89Å; L91-L94 HydrophobicContact CD2-CD2 4.37Å
95	E	86.9	Confident	91.3	Very high	168 Å²	168	46.3 Å²	46.3	79%	0.785	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-39.7	-177.3	-67	179.3	-177.2	0	0	111.5	Y58 H93	Y58-E95 WeakPolarHBondContact CE2-O 3.32Å; Y58-E95 VanDerWaalsContact CZ-O 3.28Å; Y58-E95 PolarHBondContact OH-O 3.45Å; H93-E95 VanDerWaalsContact C-N 3.28Å; H93-E95 PolarHBondContact O-N 3.03Å
96	M	89	Confident	90.9	Very high	128 Å²	128	49.3 Å²	49.3	63%	0.631	25%	0.254	S	S	*	.	S	Bend	trans	-143.4	147.5	-176.1	-65.7	-64.7	-75.8	0	0	110.6	Y58	Y58-M96 HydrophobicContact CE1-SD 4.17Å; Y58-M96 PolarHBondContact OH-SD 2.84Å; Y58-M96 VanDerWaalsContact OH-SD 3.41Å
97	P	90.8	Very high	90.4	Very high	25 Å²	25	53.5 Å²	53.5	16%	0.162	28%	0.284	C	S	.	.			trans	-68.5	147.7	173.8	30.2	-32.8	0	0	0	110.3	Y58 I87 K99 V100	Y58-P97 HydrophobicContact CD2-CG 4.21Å; Y58-P97 HydrophobicContact CG-CG 4.12Å; I87-P97 HydrophobicContact CG2-CB 3.38Å; I87-P97 HydrophobicContact CG2-CG 4.31Å; P97-K99 VanDerWaalsContact C-N 3.32Å; P97-V100 HydrophobicContact CB-CG2 4.38Å; P97-V100 HydrophobicContact CG-CG2 3.9Å
98	V	91.5	Very high	89.8	Confident	80 Å²	80	54.7 Å²	54.7	49%	0.485	29%	0.291	S	S	.	.	S	Bend	trans	-64.2	-43.3	174.3	177	0	0	0	0	109.9	L88 D90	L88-V98 HydrophobicContact CB-CB 4.46Å; L88-V98 HydrophobicContact CD2-CB 4.06Å; L88-V98 HydrophobicContact CD2-CG1 3.81Å; L88-V98 HydrophobicContact CG-CB 3.99Å; L88-V98 HydrophobicContact CG-CG1 4.3Å; L88-V98 PolarHBondContact O-N 3.28Å; D90-V98 HydrophobicContact CB-CG2 3.52Å
99	K	92.1	Very high	89.4	Confident	39 Å²	39	55.8 Å²	55.8	17%	0.17	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	139.2	179.8	-169.3	163	174.1	-169.1	0	111.5	I87 L88 P97 Y101 L139	I87-K99 WeakPolarHBondContact CA-O 3.39Å; L88-K99 HydrophobicContact CB-CB 4.41Å; L88-K99 PolarHBondContact N-O 2.7Å; L88-K99 PolarHBondContact O-N 3.09Å; P97-K99 VanDerWaalsContact C-N 3.32Å; K99-Y101 HydrophobicContact CB-CE2 4.04Å; K99-Y101 HydrophobicContact CD-CD1 4.33Å; K99-Y101 HydrophobicContact CD-CE1 3.62Å; K99-Y101 HydrophobicContact CD-CE2 4.33Å; K99-Y101 VanDerWaalsContact CE-CE1 3.48Å; K99-Y101 HydrophobicContact CG-CD1 4.44Å; K99-Y101 HydrophobicContact CG-CD2 4.45Å; K99-Y101 HydrophobicContact CG-CE1 4.06Å; K99-Y101 HydrophobicContact CG-CE2 4.03Å; K99-L139 PolarHBondContact NZ-O 3.44Å
100	V	92.5	Very high	89.1	Confident	70 Å²	70	55.5 Å²	55.5	42%	0.424	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.4	168.5	-178.5	0	0	0	0	107.7	I85 I87 P97	I85-V100 HydrophobicContact CB-CG1 4.47Å; I85-V100 HydrophobicContact CG2-CG1 4.47Å; I87-V100 HydrophobicContact CD1-CG2 4.43Å; I87-V100 HydrophobicContact CG1-CG1 4.24Å; I87-V100 HydrophobicContact CG1-CG2 4.21Å; I87-V100 HydrophobicContact CG2-CG2 4.34Å; P97-V100 HydrophobicContact CB-CG2 4.38Å; P97-V100 HydrophobicContact CG-CG2 3.9Å
101	Y	92.1	Very high	88.8	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.7	179.4	-58.3	-91	0	0	0	109.9	I85 A86 L88 K99 L103 F123 M135 T137 D147	I85-Y101 VanDerWaalsContact CA-O 3.26Å; I85-Y101 WeakPolarHBondContact CA-O 3.5Å; A86-Y101 PolarHBondContact N-O 3.43Å; A86-Y101 PolarHBondContact O-N 3.03Å; L88-Y101 HydrophobicContact CB-CE2 3.87Å; K99-Y101 HydrophobicContact CB-CE2 4.04Å; K99-Y101 HydrophobicContact CD-CD1 4.33Å; K99-Y101 HydrophobicContact CD-CE1 3.62Å; K99-Y101 HydrophobicContact CD-CE2 4.33Å; K99-Y101 VanDerWaalsContact CE-CE1 3.48Å; K99-Y101 HydrophobicContact CG-CD1 4.44Å; K99-Y101 HydrophobicContact CG-CD2 4.45Å; K99-Y101 HydrophobicContact CG-CE1 4.06Å; K99-Y101 HydrophobicContact CG-CE2 4.03Å; Y101-L103 PolarHBondContact O-N 2.96Å; Y101-F123 HydrophobicContact CD2-CZ 4.2Å; Y101-F123 HydrophobicContact CE2-CE1 4.3Å; Y101-F123 HydrophobicContact CE2-CZ 4.15Å; Y101-M135 HydrophobicContact CD1-SD 4.34Å; Y101-T137 WeakPolarHBondContact OH-CA 3.46Å; Y101-D147 WeakPolarHBondContact CA-OD2 3.5Å; Y101-D147 HydrophobicContact CD1-CB 3.89Å
102	Q	91.6	Very high	88.9	Confident	60 Å²	60	58.8 Å²	58.8	28%	0.28	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	105.4	171.3	-168.6	66.9	54	0	0	108.9	R83 C104 K146 D147	R83-Q102 PolarHBondContact O-NE2 2.91Å; R83-Q102 VanDerWaalsContact O-NE2 3.14Å; Q102-C104 PolarHBondContact NE2-O 2.53Å; Q102-K146 CarbonylContact O-C 3.59Å; Q102-K146 WeakPolarHBondContact O-CA 3.44Å; Q102-D147 PolarHBondContact N-OD2 3.11Å; Q102-D147 PolarHBondContact O-N 3.34Å
103	L	88.4	Confident	89.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.293	C	S	.	.			trans	-95.4	-34.2	-171.5	-56.8	-171.4	0	0	0	112.9	G84 A86 Y101 V110 A125 R133 M135 D147	G84-L103 WeakPolarHBondContact O-CA 3.33Å; G84-L103 WeakPolarHBondContact O-CB 3.47Å; G84-L103 PolarHBondContact O-N 2.78Å; A86-L103 HydrophobicContact CB-CD1 3.59Å; A86-L103 HydrophobicContact CB-CG 4.24Å; Y101-L103 PolarHBondContact O-N 2.96Å; L103-V110 HydrophobicContact CB-CG2 4.23Å; L103-V110 HydrophobicContact CD1-CG1 4.36Å; L103-V110 HydrophobicContact CD1-CG2 4.1Å; L103-A125 HydrophobicContact CD1-CB 3.45Å; L103-A125 VanDerWaalsContact CD1-CB 3.45Å; L103-R133 WeakPolarHBondContact O-CD 3.05Å; L103-R133 PolarHBondContact O-NE 2.74Å; L103-M135 HydrophobicContact CD2-CE 3.46Å; L103-M135 VanDerWaalsContact CD2-CE 3.46Å; L103-M135 HydrophobicContact CD2-CG 4.33Å; L103-M135 HydrophobicContact CD2-SD 3.56Å; L103-M135 VanDerWaalsContact CD2-SD 3.56Å; L103-D147 HydrophobicContact CD2-CB 4.39Å
104	C	85.5	Confident	89.3	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.007	27%	0.266	C	S	.	.	S	Bend	trans	-148.1	-175.8	177.5	53.2	0	0	0	0	109.9	G84 Q102 C108 C127 D129	G84-C104 WeakPolarHBondContact CA-SG 3.16Å; G84-C104 PolarHBondContact O-N 2.69Å; Q102-C104 PolarHBondContact NE2-O 2.53Å; C104-C108 HydrophobicContact CB-CB 4.18Å; C104-C108 WeakPolarHBondContact SG-CB 3.42Å; C104-C127 HydrophobicContact CB-CB 4.21Å; C104-D129 HydrophobicContact CB-CB 4.2Å; C104-D129 WeakPolarHBondContact CB-OD1 3.08Å
105	Q	85.5	Confident	89.6	Confident	100 Å²	100	49 Å²	49	47%	0.467	26%	0.264	S	S	.	.			trans	-63.5	151.8	-178.5	-69.4	177.9	-13.7	0	0	111.8	S107 C108	Q105-S107 PolarHBondContact O-N 3.35Å; Q105-C108 VanDerWaalsContact O-CB 3.29Å; Q105-C108 WeakPolarHBondContact O-CB 3.5Å; Q105-C108 PolarHBondContact O-N 2.96Å
106	P	85	Confident	89.7	Confident	73 Å²	73	41.7 Å²	41.7	47%	0.474	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-16	177.8	-26.3	35.6	0	0	0	115.3	R83 C108	R83-P106 WeakPolarHBondContact CA-O 3.27Å; R83-P106 WeakPolarHBondContact CD-O 3.12Å; R83-P106 PolarHBondContact NE-O 2.99Å; R83-P106 WeakPolarHBondContact O-CA 3.42Å; P106-C108 VanDerWaalsContact C-N 3.27Å
107	S	82.8	Confident	89.6	Confident	89 Å²	89	37.3 Å²	37.3	62%	0.622	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-17.6	171.9	53.1	0	0	0	0	113.2	Q105	Q105-S107 PolarHBondContact O-N 3.35Å
108	C	84.4	Confident	89.3	Confident	24 Å²	24	40.4 Å²	40.4	16%	0.162	23%	0.226	C	C	.	.			trans	-92.1	173.8	-175.7	-61	0	0	0	0	112.4	R83 G84 C104 Q105 P106 P128	R83-C108 CarbonylContact C-O 3.48Å; R83-C108 WeakPolarHBondContact CA-O 3.15Å; R83-C108 PolarHBondContact N-O 3.48Å; G84-C108 PolarHBondContact N-O 3.2Å; C104-C108 HydrophobicContact CB-CB 4.18Å; C104-C108 WeakPolarHBondContact SG-CB 3.42Å; Q105-C108 VanDerWaalsContact O-CB 3.29Å; Q105-C108 WeakPolarHBondContact O-CB 3.5Å; Q105-C108 PolarHBondContact O-N 2.96Å; P106-C108 VanDerWaalsContact C-N 3.27Å; C108-P128 HydrophobicContact CB-CB 4.11Å; C108-P128 HydrophobicContact CB-CG 4.1Å
109	S	86.5	Confident	89.2	Confident	28 Å²	28	38.5 Å²	38.5	20%	0.196	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-142.3	116.8	-179.1	-68.5	0	0	0	0	110.8	G81 K111 P128	G81-S109 CarbonylContact O-C 3.57Å; G81-S109 WeakPolarHBondContact O-CA 3.46Å; S109-K111 PolarHBondContact O-N 3.36Å; S109-P128 WeakPolarHBondContact O-CD 3.36Å; S109-P128 WeakPolarHBondContact O-CG 3.08Å
110	V	90	Very high	89	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.222	C	C	.	.			trans	-75.6	121.2	177.9	-177.2	0	0	0	0	108.1	F64 C80 G81 L103 L113 A125 C126	F64-V110 WeakPolarHBondContact CD2-O 3.32Å; C80-V110 HydrophobicContact CB-CB 3.82Å; C80-V110 HydrophobicContact CB-CG1 3.62Å; C80-V110 PolarHBondContact SG-O 2.85Å; G81-V110 PolarHBondContact O-N 3.28Å; L103-V110 HydrophobicContact CB-CG2 4.23Å; L103-V110 HydrophobicContact CD1-CG1 4.36Å; L103-V110 HydrophobicContact CD1-CG2 4.1Å; V110-L113 HydrophobicContact CG1-CD2 4.37Å; V110-A125 HydrophobicContact CG1-CB 4.02Å; V110-C126 WeakPolarHBondContact CG1-O 3.3Å
111	K	88.7	Confident	88.8	Confident	68 Å²	68	36.5 Å²	36.5	30%	0.296	21%	0.209	S	C	.	.			trans	-89	-41.9	-167.6	-65.4	-57.7	-179.3	-175	0	114.1	F64 S109 C126	F64-K111 WeakPolarHBondContact CB-O 3.42Å; F64-K111 HydrophobicContact CD2-CD 4.24Å; F64-K111 HydrophobicContact CG-CD 4.35Å; S109-K111 PolarHBondContact O-N 3.36Å; K111-C126 PolarHBondContact N-O 3.13Å
112	Q	92.6	Very high	88.8	Confident	44 Å²	44	37.9 Å²	37.9	21%	0.206	22%	0.217	C	C	.	.			trans	-146.6	144.8	-173.7	-169.2	68.3	2.4	0	0	110.6	C65 C126 I161	C65-Q112 PolarHBondContact SG-OE1 3.21Å; C65-Q112 VanDerWaalsContact SG-OE1 3.39Å; Q112-C126 PolarHBondContact O-N 3.32Å; Q112-C126 VanDerWaalsContact O-N 3.15Å; Q112-I161 HydrophobicContact CB-CG2 4.05Å; Q112-I161 HydrophobicContact CG-CG2 3.91Å
113	L	95.4	Very high	88.9	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	146.8	171.2	-59.9	174.7	0	0	0	110.1	K67 V78 C80 V110 F123 L124 A125	K67-L113 WeakPolarHBondContact CD-O 3.23Å; K67-L113 WeakPolarHBondContact CE-O 3.45Å; V78-L113 HydrophobicContact CB-CD1 4.17Å; V78-L113 HydrophobicContact CG1-CD1 3.73Å; V78-L113 HydrophobicContact CG2-CD1 3.68Å; C80-L113 HydrophobicContact CB-CD1 3.87Å; C80-L113 HydrophobicContact CB-CD2 3.86Å; C80-L113 HydrophobicContact CB-CG 3.83Å; V110-L113 HydrophobicContact CG1-CD2 4.37Å; L113-F123 HydrophobicContact CD2-CD2 4.02Å; L113-F123 HydrophobicContact CD2-CE2 4.13Å; L113-L124 VanDerWaalsContact CA-O 3.3Å; L113-L124 WeakPolarHBondContact CA-O 3.42Å; L113-A125 HydrophobicContact CD2-CB 3.66Å
114	A	95.3	Very high	89	Confident	1 Å²	1	35 Å²	35	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	137.6	164.8	0	0	0	0	0	109.9	F123 L124 I161 V163	A114-F123 CarbonylContact O-C 3.5Å; A114-F123 VanDerWaalsContact O-CA 3.29Å; A114-F123 WeakPolarHBondContact O-CA 3.24Å; A114-F123 WeakPolarHBondContact O-CB 3.49Å; A114-L124 HydrophobicContact CB-CB 4.37Å; A114-L124 PolarHBondContact N-O 2.94Å; A114-L124 PolarHBondContact O-N 3.49Å; A114-I161 HydrophobicContact CB-CG1 4.15Å; A114-I161 HydrophobicContact CB-CG2 4.01Å; A114-V163 HydrophobicContact CB-CG2 3.85Å
115	V	94.4	Very high	89.4	Confident	26 Å²	26	35 Å²	35	16%	0.158	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	148.3	179.8	-64.1	0	0	0	0	109.5	K67 L69 P70 V78 P117 F123	K67-V115 HydrophobicContact CB-CG1 4.2Å; K67-V115 HydrophobicContact CD-CG1 4.45Å; K67-V115 HydrophobicContact CD-CG2 4.44Å; L69-V115 HydrophobicContact CD2-CG1 3.92Å; P70-V115 HydrophobicContact CG-CB 4.17Å; P70-V115 HydrophobicContact CG-CG2 3.79Å; V78-V115 HydrophobicContact CG1-CG1 4.07Å; V115-P117 WeakPolarHBondContact O-CD 3.49Å; V115-F123 HydrophobicContact CG1-CB 4.2Å
116	F	90.6	Very high	89.5	Confident	15 Å²	15	30.2 Å²	30.2	7%	0.066	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.8	178.7	-73.8	-92.9	0	0	0	110.6	N118 S119 L122 L124 L134 V163 L185	F116-N118 PolarHBondContact O-N 3.26Å; F116-S119 PolarHBondContact O-N 2.8Å; F116-S119 VanDerWaalsContact O-N 3.07Å; F116-L122 HydrophobicContact CB-CB 4.41Å; F116-L122 HydrophobicContact CD2-CB 3.53Å; F116-L122 HydrophobicContact CE2-CB 4.09Å; F116-L122 HydrophobicContact CG-CB 4.2Å; F116-L122 PolarHBondContact N-O 2.73Å; F116-L124 HydrophobicContact CE2-CD1 4.25Å; F116-L124 HydrophobicContact CE2-CD2 4Å; F116-L124 HydrophobicContact CE2-CG 3.71Å; F116-L124 HydrophobicContact CZ-CD1 3.99Å; F116-L124 HydrophobicContact CZ-CD2 4.11Å; F116-L124 HydrophobicContact CZ-CG 3.92Å; F116-L134 HydrophobicContact CE2-CD1 3.63Å; F116-L134 HydrophobicContact CZ-CD1 4.19Å; F116-V163 HydrophobicContact CD1-CG1 3.9Å; F116-V163 HydrophobicContact CE1-CG1 3.99Å; F116-V163 HydrophobicContact CE1-CG2 4.26Å; F116-V163 HydrophobicContact CZ-CG2 4.35Å; F116-L185 HydrophobicContact CE1-CD1 4Å; F116-L185 HydrophobicContact CZ-CD1 4.04Å
117	P	86.4	Confident	89.2	Confident	36 Å²	36	26.8 Å²	26.8	23%	0.234	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.1	-174.6	-26.1	33.7	0	0	0	114.9	K71 V115 T165	K71-P117 WeakPolarHBondContact CE-O 3.43Å; V115-P117 WeakPolarHBondContact O-CD 3.49Å; P117-T165 HydrophobicContact CG-CG2 4.03Å
118	N	84.8	Confident	88.8	Confident	91 Å²	91	23.5 Å²	23.5	49%	0.487	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	2.6	179.4	-69.8	-41.3	0	0	0	114.4	K71 F116 Q168	K71-N118 PolarHBondContact NZ-OD1 2.68Å; F116-N118 PolarHBondContact O-N 3.26Å; N118-Q168 VanDerWaalsContact CG-NE2 3.3Å; N118-Q168 VanDerWaalsContact N-NE2 3.16Å; N118-Q168 VanDerWaalsContact ND2-CD 3.26Å; N118-Q168 PolarHBondContact ND2-NE2 3.01Å; N118-Q168 PolarHBondContact ND2-OE1 2.94Å
119	S	88.4	Confident	88.4	Confident	40 Å²	40	23.1 Å²	23.1	28%	0.28	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	86.3	-175.9	-57	0	0	0	0	109.5	F116 S121 L122	F116-S119 PolarHBondContact O-N 2.8Å; F116-S119 VanDerWaalsContact O-N 3.07Å; S119-S121 PolarHBondContact O-N 3.14Å; S119-L122 PolarHBondContact O-N 2.96Å
120	P	88.5	Confident	88	Confident	42 Å²	42	24.5 Å²	24.5	27%	0.273	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	-26	-175.3	22.1	-35	0	0	0	113.2	P70 T72	P70-P120 WeakPolarHBondContact O-CB 3.36Å; T72-P120 HydrophobicContact CG2-CB 4.09Å
121	S	88.9	Confident	87.5	Confident	24 Å²	24	25.2 Å²	25.2	17%	0.168	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-4	-177	-52.5	0	0	0	0	114.2	S119 D136 T137 R138	S119-S121 PolarHBondContact O-N 3.14Å; S121-D136 CarbonylContact O-C 3.53Å; S121-D136 VanDerWaalsContact O-CA 3.31Å; S121-D136 WeakPolarHBondContact O-CA 3.47Å; S121-T137 VanDerWaalsContact CA-OG1 3.28Å; S121-T137 WeakPolarHBondContact CA-OG1 3.22Å; S121-T137 WeakPolarHBondContact CB-OG1 3.13Å; S121-T137 PolarHBondContact O-N 2.72Å; S121-T137 PolarHBondContact O-OG1 3.25Å; S121-R138 WeakPolarHBondContact OG-CD 2.87Å
122	L	90.4	Very high	87.3	Confident	34 Å²	34	22 Å²	22	18%	0.178	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.3	-172.6	-61.1	-177.4	0	0	0	111.7	F116 S119 L134 M135 D136	F116-L122 HydrophobicContact CB-CB 4.41Å; F116-L122 HydrophobicContact CD2-CB 3.53Å; F116-L122 HydrophobicContact CE2-CB 4.09Å; F116-L122 HydrophobicContact CG-CB 4.2Å; F116-L122 PolarHBondContact N-O 2.73Å; S119-L122 PolarHBondContact O-N 2.96Å; L122-L134 HydrophobicContact CB-CD1 4.24Å; L122-L134 HydrophobicContact CD2-CD1 4.37Å; L122-M135 WeakPolarHBondContact CA-O 3.27Å; L122-D136 HydrophobicContact CD2-CB 3.64Å
123	F	93.8	Very high	86.9	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	154.1	167.8	68.8	-91.3	0	0	0	111.8	V78 A86 Y101 L113 A114 V115 M135 T137	V78-F123 HydrophobicContact CG2-CD1 4.21Å; V78-F123 HydrophobicContact CG2-CD2 4.17Å; V78-F123 HydrophobicContact CG2-CE1 3.9Å; V78-F123 HydrophobicContact CG2-CE2 3.84Å; V78-F123 HydrophobicContact CG2-CG 4.33Å; V78-F123 HydrophobicContact CG2-CZ 3.69Å; A86-F123 HydrophobicContact CB-CE2 4.24Å; A86-F123 HydrophobicContact CB-CZ 4.44Å; Y101-F123 HydrophobicContact CD2-CZ 4.2Å; Y101-F123 HydrophobicContact CE2-CE1 4.3Å; Y101-F123 HydrophobicContact CE2-CZ 4.15Å; L113-F123 HydrophobicContact CD2-CD2 4.02Å; L113-F123 HydrophobicContact CD2-CE2 4.13Å; A114-F123 CarbonylContact O-C 3.5Å; A114-F123 VanDerWaalsContact O-CA 3.29Å; A114-F123 WeakPolarHBondContact O-CA 3.24Å; A114-F123 WeakPolarHBondContact O-CB 3.49Å; V115-F123 HydrophobicContact CG1-CB 4.2Å; F123-M135 HydrophobicContact CD1-CB 3.72Å; F123-M135 HydrophobicContact CD1-CG 4.48Å; F123-M135 HydrophobicContact CD2-CB 3.99Å; F123-M135 HydrophobicContact CD2-CG 3.94Å; F123-M135 HydrophobicContact CE1-CB 3.35Å; F123-M135 HydrophobicContact CE1-CG 3.93Å; F123-M135 HydrophobicContact CE2-CB 3.66Å; F123-M135 HydrophobicContact CE2-CG 3.32Å; F123-M135 HydrophobicContact CG-CB 4.03Å; F123-M135 HydrophobicContact CG-CG 4.49Å; F123-M135 HydrophobicContact CZ-CB 3.33Å; F123-M135 HydrophobicContact CZ-CG 3.31Å; F123-M135 PolarHBondContact N-O 2.89Å; F123-M135 VanDerWaalsContact N-O 3.15Å; F123-M135 PolarHBondContact O-N 3.34Å; F123-T137 HydrophobicContact CD1-CG2 4.13Å; F123-T137 HydrophobicContact CE1-CG2 3.95Å
124	L	92	Very high	86.5	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	147	173.9	-60.3	178	0	0	0	110.3	L113 A114 F116 I132 R133 L134 L151 I161 V163 V171	L113-L124 VanDerWaalsContact CA-O 3.3Å; L113-L124 WeakPolarHBondContact CA-O 3.42Å; A114-L124 HydrophobicContact CB-CB 4.37Å; A114-L124 PolarHBondContact N-O 2.94Å; A114-L124 PolarHBondContact O-N 3.49Å; F116-L124 HydrophobicContact CE2-CD1 4.25Å; F116-L124 HydrophobicContact CE2-CD2 4Å; F116-L124 HydrophobicContact CE2-CG 3.71Å; F116-L124 HydrophobicContact CZ-CD1 3.99Å; F116-L124 HydrophobicContact CZ-CD2 4.11Å; F116-L124 HydrophobicContact CZ-CG 3.92Å; L124-I132 HydrophobicContact CB-CG2 4.39Å; L124-I132 HydrophobicContact CD2-CG2 4.45Å; L124-R133 WeakPolarHBondContact CA-O 3.1Å; L124-L134 HydrophobicContact CD2-CB 3.99Å; L124-L134 HydrophobicContact CD2-CD1 3.72Å; L124-L134 HydrophobicContact CD2-CG 4.48Å; L124-L151 HydrophobicContact CD2-CD1 3.51Å; L124-I161 HydrophobicContact CB-CD1 3.84Å; L124-I161 HydrophobicContact CD1-CD1 3.86Å; L124-I161 HydrophobicContact CG-CD1 4.49Å; L124-V163 HydrophobicContact CD1-CG2 3.79Å; L124-V171 HydrophobicContact CD1-CG1 4.05Å; L124-V171 HydrophobicContact CD1-CG2 3.91Å
125	A	92.3	Very high	86.1	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	128.8	174.5	0	0	0	0	0	111.5	L103 V110 L113 C127 R133	L103-A125 HydrophobicContact CD1-CB 3.45Å; L103-A125 VanDerWaalsContact CD1-CB 3.45Å; V110-A125 HydrophobicContact CG1-CB 4.02Å; L113-A125 HydrophobicContact CD2-CB 3.66Å; A125-C127 PolarHBondContact O-N 2.78Å; A125-R133 PolarHBondContact N-O 2.68Å; A125-R133 PolarHBondContact O-N 2.86Å; A125-R133 VanDerWaalsContact O-N 3.15Å
126	C	87.9	Confident	85.7	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	109.4	171.2	-76.5	0	0	0	0	110.5	V110 K111 Q112 A158 I161	V110-C126 WeakPolarHBondContact CG1-O 3.3Å; K111-C126 PolarHBondContact N-O 3.13Å; Q112-C126 PolarHBondContact O-N 3.32Å; Q112-C126 VanDerWaalsContact O-N 3.15Å; C126-A158 HydrophobicContact CB-CB 3.79Å; C126-A158 VanDerWaalsContact SG-CB 3.59Å; C126-I161 WeakPolarHBondContact SG-CB 3.43Å; C126-I161 WeakPolarHBondContact SG-CG2 3.37Å
127	C	80	Confident	85.6	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.6	-177.2	-55.1	0	0	0	0	110.3	C104 A125 D129 R130 V131	C104-C127 HydrophobicContact CB-CB 4.21Å; A125-C127 PolarHBondContact O-N 2.78Å; C127-D129 WeakPolarHBondContact CB-OD1 2.91Å; C127-D129 PolarHBondContact O-N 3.31Å; C127-D129 VanDerWaalsContact O-N 3.15Å; C127-R130 PolarHBondContact O-N 3.26Å; C127-V131 HydrophobicContact CB-CG2 4.14Å; C127-V131 WeakPolarHBondContact CB-O 3.49Å; C127-V131 PolarHBondContact N-O 3.04Å; C127-V131 VanDerWaalsContact N-O 3.08Å
128	P	73.1	Confident	85.5	Confident	21 Å²	21	29.9 Å²	29.9	14%	0.136	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-14.2	177.8	-29.4	38.8	0	0	0	115.2	C108 S109 R130 F157	C108-P128 HydrophobicContact CB-CB 4.11Å; C108-P128 HydrophobicContact CB-CG 4.1Å; S109-P128 WeakPolarHBondContact O-CD 3.36Å; S109-P128 WeakPolarHBondContact O-CG 3.08Å; P128-R130 PolarHBondContact O-N 3.43Å; P128-F157 HydrophobicContact CB-CD1 3.75Å; P128-F157 HydrophobicContact CB-CE1 4.04Å; P128-F157 WeakPolarHBondContact O-CD1 3.28Å; P128-F157 WeakPolarHBondContact O-CE1 3.49Å
129	D	75.6	Confident	85.2	Confident	16 Å²	16	30.7 Å²	30.7	9%	0.086	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	28.1	171.2	63.6	-24.2	0	0	0	112.5	C104 C127 V131 R133 K146 I354	C104-D129 HydrophobicContact CB-CB 4.2Å; C104-D129 WeakPolarHBondContact CB-OD1 3.08Å; C127-D129 WeakPolarHBondContact CB-OD1 2.91Å; C127-D129 PolarHBondContact O-N 3.31Å; C127-D129 VanDerWaalsContact O-N 3.15Å; D129-V131 PolarHBondContact O-N 2.71Å; D129-V131 WeakPolarHBondContact OD1-CG2 3.33Å; D129-R133 IonicContact OD2-NH2 2.91Å; D129-K146 IonicContact OD2-NZ 3.41Å; D129-K146 PolarHBondContact OD2-NZ 2.8Å; D129-I354 HydrophobicContact CB-CD1 4.1Å
130	R	78.9	Confident	84.4	Confident	57 Å²	57	38.3 Å²	38.3	22%	0.215	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	25.4	173.7	-58	-176.9	-176.6	168	0.8	114.4	C127 P128 G154 F155 D156 I354 D356	C127-R130 PolarHBondContact O-N 3.26Å; P128-R130 PolarHBondContact O-N 3.43Å; R130-G154 PolarHBondContact O-N 3.36Å; R130-F155 WeakPolarHBondContact CA-O 3.5Å; R130-F155 WeakPolarHBondContact CB-O 3.22Å; R130-F155 WeakPolarHBondContact CG-O 3.39Å; R130-D156 IonicContact NE-OD1 3.37Å; R130-I354 HydrophobicContact CB-CG2 4.49Å; R130-D356 PolarHBondContact NH1-O 3.34Å
131	V	79.3	Confident	83.3	Confident	15 Å²	15	39.7 Å²	39.7	9%	0.091	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.1	178.6	-61.3	0	0	0	0	111.9	C127 D129 R133 V150 I152 N153	C127-V131 HydrophobicContact CB-CG2 4.14Å; C127-V131 WeakPolarHBondContact CB-O 3.49Å; C127-V131 PolarHBondContact N-O 3.04Å; C127-V131 VanDerWaalsContact N-O 3.08Å; D129-V131 PolarHBondContact O-N 2.71Å; D129-V131 WeakPolarHBondContact OD1-CG2 3.33Å; V131-R133 HydrophobicContact CG2-CG 3.93Å; V131-V150 HydrophobicContact CB-CG1 4.14Å; V131-V150 HydrophobicContact CG1-CG1 3.94Å; V131-I152 WeakPolarHBondContact CA-O 3.08Å; V131-N153 HydrophobicContact CG1-CB 3.88Å
132	I	84.1	Confident	82	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.2	164.9	-58.2	173.1	0	0	0	106.8	L124 L151 I152 F155 I161 V173	L124-I132 HydrophobicContact CB-CG2 4.39Å; L124-I132 HydrophobicContact CD2-CG2 4.45Å; I132-L151 PolarHBondContact O-N 3Å; I132-I152 HydrophobicContact CB-CB 4.3Å; I132-I152 HydrophobicContact CB-CD1 4.43Å; I132-I152 HydrophobicContact CD1-CD1 4.1Å; I132-I152 PolarHBondContact N-O 2.61Å; I132-I152 PolarHBondContact O-N 2.95Å; I132-F155 HydrophobicContact CD1-CD2 3.73Å; I132-F155 HydrophobicContact CD1-CE2 3.87Å; I132-F155 HydrophobicContact CG1-CD2 4.35Å; I132-I161 HydrophobicContact CD1-CD1 4.24Å; I132-I161 HydrophobicContact CG2-CD1 3.72Å; I132-V173 HydrophobicContact CD1-CB 4.22Å; I132-V173 HydrophobicContact CD1-CG1 3.76Å; I132-V173 HydrophobicContact CD1-CG2 3.39Å
133	R	85.6	Confident	80.5	Confident	17 Å²	17	47.5 Å²	47.5	6%	0.064	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.4	-178	-57	178.3	168.9	-89.3	-13.8	111	L103 L124 A125 D129 V131 M135 D147 V149	L103-R133 WeakPolarHBondContact O-CD 3.05Å; L103-R133 PolarHBondContact O-NE 2.74Å; L124-R133 WeakPolarHBondContact CA-O 3.1Å; A125-R133 PolarHBondContact N-O 2.68Å; A125-R133 PolarHBondContact O-N 2.86Å; A125-R133 VanDerWaalsContact O-N 3.15Å; D129-R133 IonicContact OD2-NH2 2.91Å; V131-R133 HydrophobicContact CG2-CG 3.93Å; R133-M135 HydrophobicContact CB-CE 3.12Å; R133-M135 HydrophobicContact CG-CE 4.13Å; R133-D147 PolarHBondContact NH1-O 2.77Å; R133-D147 VanDerWaalsContact NH1-O 3.12Å; R133-V149 CarbonylContact C-O 3.27Å; R133-V149 VanDerWaalsContact CA-O 3.26Å; R133-V149 WeakPolarHBondContact CA-O 3.4Å
134	L	86	Confident	79	Confident	38 Å²	38	54.7 Å²	54.7	20%	0.199	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.2	168.4	177.6	67.7	0	0	0	110	F116 L122 L124 G148 V149 L151	F116-L134 HydrophobicContact CE2-CD1 3.63Å; F116-L134 HydrophobicContact CZ-CD1 4.19Å; L122-L134 HydrophobicContact CB-CD1 4.24Å; L122-L134 HydrophobicContact CD2-CD1 4.37Å; L124-L134 HydrophobicContact CD2-CB 3.99Å; L124-L134 HydrophobicContact CD2-CD1 3.72Å; L124-L134 HydrophobicContact CD2-CG 4.48Å; L134-G148 WeakPolarHBondContact O-CA 3.45Å; L134-V149 PolarHBondContact N-O 3.09Å; L134-V149 PolarHBondContact O-N 3.27Å; L134-L151 HydrophobicContact CB-CD1 3.5Å; L134-L151 VanDerWaalsContact CB-CD1 3.5Å; L134-L151 HydrophobicContact CB-CD2 3.97Å; L134-L151 HydrophobicContact CB-CG 3.46Å; L134-L151 VanDerWaalsContact CB-CG 3.46Å; L134-L151 HydrophobicContact CD2-CD1 4.19Å; L134-L151 HydrophobicContact CD2-CD2 4.01Å; L134-L151 HydrophobicContact CD2-CG 4.35Å; L134-L151 HydrophobicContact CG-CD1 4.28Å
135	M	87.5	Confident	77.7	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	136.8	173.4	-58.2	-57.1	128.9	0	0	109.2	Y101 L103 L122 F123 R133 D147 G148	Y101-M135 HydrophobicContact CD1-SD 4.34Å; L103-M135 HydrophobicContact CD2-CE 3.46Å; L103-M135 VanDerWaalsContact CD2-CE 3.46Å; L103-M135 HydrophobicContact CD2-CG 4.33Å; L103-M135 HydrophobicContact CD2-SD 3.56Å; L103-M135 VanDerWaalsContact CD2-SD 3.56Å; L122-M135 WeakPolarHBondContact CA-O 3.27Å; F123-M135 HydrophobicContact CD1-CB 3.72Å; F123-M135 HydrophobicContact CD1-CG 4.48Å; F123-M135 HydrophobicContact CD2-CB 3.99Å; F123-M135 HydrophobicContact CD2-CG 3.94Å; F123-M135 HydrophobicContact CE1-CB 3.35Å; F123-M135 HydrophobicContact CE1-CG 3.93Å; F123-M135 HydrophobicContact CE2-CB 3.66Å; F123-M135 HydrophobicContact CE2-CG 3.32Å; F123-M135 HydrophobicContact CG-CB 4.03Å; F123-M135 HydrophobicContact CG-CG 4.49Å; F123-M135 HydrophobicContact CZ-CB 3.33Å; F123-M135 HydrophobicContact CZ-CG 3.31Å; F123-M135 PolarHBondContact N-O 2.89Å; F123-M135 VanDerWaalsContact N-O 3.15Å; F123-M135 PolarHBondContact O-N 3.34Å; R133-M135 HydrophobicContact CB-CE 3.12Å; R133-M135 HydrophobicContact CG-CE 4.13Å; M135-D147 HydrophobicContact SD-CB 4.34Å; M135-G148 WeakPolarHBondContact SD-CA 3.25Å
136	D	86.1	Confident	76.8	Confident	28 Å²	28	62 Å²	62	15%	0.15	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.1	164.1	-171.2	-31.9	0	0	0	108.3	S121 L122 R138 L139	S121-D136 CarbonylContact O-C 3.53Å; S121-D136 VanDerWaalsContact O-CA 3.31Å; S121-D136 WeakPolarHBondContact O-CA 3.47Å; L122-D136 HydrophobicContact CD2-CB 3.64Å; D136-R138 PolarHBondContact O-N 2.92Å; D136-R138 VanDerWaalsContact OD1-CB 3.29Å; D136-R138 WeakPolarHBondContact OD1-CB 3.48Å; D136-R138 WeakPolarHBondContact OD1-CG 3.48Å; D136-R138 IonicContact OD1-CZ 3.75Å; D136-R138 PolarHBondContact OD1-N 2.82Å; D136-R138 IonicContact OD1-NE 3.45Å; D136-R138 PolarHBondContact OD1-NE 3.06Å; D136-R138 IonicContact OD1-NH2 3.72Å; D136-R138 IonicContact OD2-CZ 3.45Å; D136-R138 IonicContact OD2-NE 3.91Å; D136-R138 PolarHBondContact OD2-NE 2.88Å; D136-R138 IonicContact OD2-NH2 2.69Å; D136-R138 PolarHBondContact OD2-NH2 2.88Å; D136-L139 HydrophobicContact CB-CD1 3.81Å; D136-L139 HydrophobicContact CB-CG 3.85Å; D136-L139 PolarHBondContact O-N 2.85Å
137	T	88.2	Confident	76.3	Confident	26 Å²	26	62.6 Å²	62.6	16%	0.16	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.5	-175.2	61.6	0	0	0	0	113.1	L69 L88 Y101 S121 F123	L69-T137 HydrophobicContact CD1-CG2 4.4Å; L88-T137 HydrophobicContact CD1-CG2 4.26Å; L88-T137 HydrophobicContact CD2-CG2 3.9Å; Y101-T137 WeakPolarHBondContact OH-CA 3.46Å; S121-T137 VanDerWaalsContact CA-OG1 3.28Å; S121-T137 WeakPolarHBondContact CA-OG1 3.22Å; S121-T137 WeakPolarHBondContact CB-OG1 3.13Å; S121-T137 PolarHBondContact O-N 2.72Å; S121-T137 PolarHBondContact O-OG1 3.25Å; F123-T137 HydrophobicContact CD1-CG2 4.13Å; F123-T137 HydrophobicContact CE1-CG2 3.95Å
138	R	84	Confident	75.8	Confident	175 Å²	175	63.5 Å²	63.5	66%	0.66	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-21.8	-179.6	-56.3	168.3	-64.2	176.3	3.7	112.5	S121 D136	S121-R138 WeakPolarHBondContact OG-CD 2.87Å; D136-R138 PolarHBondContact O-N 2.92Å; D136-R138 VanDerWaalsContact OD1-CB 3.29Å; D136-R138 WeakPolarHBondContact OD1-CB 3.48Å; D136-R138 WeakPolarHBondContact OD1-CG 3.48Å; D136-R138 IonicContact OD1-CZ 3.75Å; D136-R138 PolarHBondContact OD1-N 2.82Å; D136-R138 IonicContact OD1-NE 3.45Å; D136-R138 PolarHBondContact OD1-NE 3.06Å; D136-R138 IonicContact OD1-NH2 3.72Å; D136-R138 IonicContact OD2-CZ 3.45Å; D136-R138 IonicContact OD2-NE 3.91Å; D136-R138 PolarHBondContact OD2-NE 2.88Å; D136-R138 IonicContact OD2-NH2 2.69Å; D136-R138 PolarHBondContact OD2-NH2 2.88Å
139	L	78.7	Confident	76	Confident	108 Å²	108	65.9 Å²	65.9	57%	0.565	33%	0.327	S	S	*	.	S	Bend	trans	-77.4	132.4	-177.9	-62.6	-179.2	0	0	0	110.2	K99 D136	K99-L139 PolarHBondContact NZ-O 3.44Å; D136-L139 HydrophobicContact CB-CD1 3.81Å; D136-L139 HydrophobicContact CB-CG 3.85Å; D136-L139 PolarHBondContact O-N 2.85Å
140	K	72.2	Confident	76	Confident	200 Å²	200	67.4 Å²	67.4	87%	0.87	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-62.4	150.1	169.3	-68.1	-173.4	178	-177.2	0	109.4	S142	K140-S142 PolarHBondContact O-N 2.61Å
141	S	65	Low	75.6	Confident	71 Å²	71	66 Å²	66	50%	0.497	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-56.4	130	177.6	-172.9	0	0	0	0	108.7	D147	S141-D147 PolarHBondContact OG-OD1 2.85Å
142	S	61.3	Low	75.3	Confident	41 Å²	41	65.2 Å²	65.2	29%	0.287	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-77.1	154.9	177.3	64.7	0	0	0	0	109.2	K140 R144	K140-S142 PolarHBondContact O-N 2.61Å; S142-R144 PolarHBondContact O-N 2.71Å; S142-R144 WeakPolarHBondContact OG-CB 3.41Å; S142-R144 PolarHBondContact OG-NE 3.36Å
143	N	58.8	Low	74.8	Confident	181 Å²	181	67.1 Å²	67.1	97%	0.968	34%	0.339	S	S	*	.	S	Bend	trans	-63.1	10.1	171.3	-68.6	-13.5	0	0	0	114.3
144	R	61.7	Low	73.9	Confident	151 Å²	151	67.1 Å²	67.1	57%	0.57	34%	0.344	S	S	*	.	S	Bend	trans	-82.2	146.3	175.6	-61.8	-171.2	-75.1	-155.5	1	109.2	S142 K146 G148	S142-R144 PolarHBondContact O-N 2.71Å; S142-R144 WeakPolarHBondContact OG-CB 3.41Å; S142-R144 PolarHBondContact OG-NE 3.36Å; R144-K146 PolarHBondContact O-N 2.86Å; R144-K146 VanDerWaalsContact O-N 3.1Å; R144-G148 PolarHBondContact NH2-O 3.36Å
145	D	66.2	Low	73.1	Confident	108 Å²	108	65.4 Å²	65.4	58%	0.578	34%	0.335	S	S	*	.	S	Bend	trans	-56.9	-24.9	176	-171.2	40.2	0	0	0	113.2
146	K	73.1	Confident	72.2	Confident	45 Å²	45	66.6 Å²	66.6	20%	0.196	34%	0.342	C	S	.	.	S	Bend	trans	-126.5	136.9	179.1	-59.2	178.9	-179	-178.9	0	111.3	Q102 D129 R144	Q102-K146 CarbonylContact O-C 3.59Å; Q102-K146 WeakPolarHBondContact O-CA 3.44Å; D129-K146 IonicContact OD2-NZ 3.41Å; D129-K146 PolarHBondContact OD2-NZ 2.8Å; R144-K146 PolarHBondContact O-N 2.86Å; R144-K146 VanDerWaalsContact O-N 3.1Å
147	D	76.2	Confident	71.7	Confident	14 Å²	14	69.6 Å²	69.6	8%	0.075	35%	0.354	C	S	.	.			trans	-76	158.8	178	-70.8	-71.5	0	0	0	113	Y101 Q102 L103 R133 M135 S141	Y101-D147 WeakPolarHBondContact CA-OD2 3.5Å; Y101-D147 HydrophobicContact CD1-CB 3.89Å; Q102-D147 PolarHBondContact N-OD2 3.11Å; Q102-D147 PolarHBondContact O-N 3.34Å; L103-D147 HydrophobicContact CD2-CB 4.39Å; R133-D147 PolarHBondContact NH1-O 2.77Å; R133-D147 VanDerWaalsContact NH1-O 3.12Å; M135-D147 HydrophobicContact SD-CB 4.34Å; S141-D147 PolarHBondContact OG-OD1 2.85Å
148	G	71.3	Confident	71.5	Confident	19 Å²	19	68.5 Å²	68.5	20%	0.196	35%	0.347	C	S	.	.	S	Bend	trans	74	177.7	175.2	0	0	0	0	0	116.1	L134 M135 R144	L134-G148 WeakPolarHBondContact O-CA 3.45Å; M135-G148 WeakPolarHBondContact SD-CA 3.25Å; R144-G148 PolarHBondContact NH2-O 3.36Å
149	V	77.2	Confident	71.6	Confident	71 Å²	71	61.6 Å²	61.6	43%	0.43	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.9	179.7	-178.7	0	0	0	0	108.2	R133 L134 L151	R133-V149 CarbonylContact C-O 3.27Å; R133-V149 VanDerWaalsContact CA-O 3.26Å; R133-V149 WeakPolarHBondContact CA-O 3.4Å; L134-V149 PolarHBondContact N-O 3.09Å; L134-V149 PolarHBondContact O-N 3.27Å; V149-L151 HydrophobicContact CG1-CD2 4.47Å; V149-L151 PolarHBondContact O-N 3.36Å; V149-L151 VanDerWaalsContact O-N 3.11Å
150	V	74.4	Confident	72.3	Confident	47 Å²	47	56.6 Å²	56.6	29%	0.285	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	108.2	167.4	176.6	0	0	0	0	106.7	V131 N153	V131-V150 HydrophobicContact CB-CG1 4.14Å; V131-V150 HydrophobicContact CG1-CG1 3.94Å; V150-N153 HydrophobicContact CG1-CB 4.13Å
151	L	71.4	Confident	73.3	Confident	27 Å²	27	47.2 Å²	47.2	14%	0.141	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-49.7	176.6	-76	-173.3	0	0	0	110.6	L124 I132 L134 V149 L185 V188	L124-L151 HydrophobicContact CD2-CD1 3.51Å; I132-L151 PolarHBondContact O-N 3Å; L134-L151 HydrophobicContact CB-CD1 3.5Å; L134-L151 VanDerWaalsContact CB-CD1 3.5Å; L134-L151 HydrophobicContact CB-CD2 3.97Å; L134-L151 HydrophobicContact CB-CG 3.46Å; L134-L151 VanDerWaalsContact CB-CG 3.46Å; L134-L151 HydrophobicContact CD2-CD1 4.19Å; L134-L151 HydrophobicContact CD2-CD2 4.01Å; L134-L151 HydrophobicContact CD2-CG 4.35Å; L134-L151 HydrophobicContact CG-CD1 4.28Å; V149-L151 HydrophobicContact CG1-CD2 4.47Å; V149-L151 PolarHBondContact O-N 3.36Å; V149-L151 VanDerWaalsContact O-N 3.11Å; L151-L185 HydrophobicContact CD1-CD2 4.05Å; L151-V188 WeakPolarHBondContact O-CG1 3.33Å
152	I	71.7	Confident	74.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	130.1	-170	-52.3	153.1	0	0	0	107.7	V131 I132 F155 V183 L185 V188 S199	V131-I152 WeakPolarHBondContact CA-O 3.08Å; I132-I152 HydrophobicContact CB-CB 4.3Å; I132-I152 HydrophobicContact CB-CD1 4.43Å; I132-I152 HydrophobicContact CD1-CD1 4.1Å; I132-I152 PolarHBondContact N-O 2.61Å; I132-I152 PolarHBondContact O-N 2.95Å; I152-F155 HydrophobicContact CB-CE2 4.27Å; I152-F155 HydrophobicContact CG2-CD2 3.76Å; I152-F155 HydrophobicContact CG2-CE2 3.29Å; I152-F155 HydrophobicContact CG2-CZ 4.22Å; I152-V183 HydrophobicContact CD1-CB 4.14Å; I152-V183 HydrophobicContact CD1-CG1 3.56Å; I152-V183 HydrophobicContact CD1-CG2 4.24Å; I152-V183 HydrophobicContact CG1-CG1 4.14Å; I152-L185 HydrophobicContact CD1-CD2 4.26Å; I152-V188 HydrophobicContact CG1-CG2 4.09Å; I152-S199 WeakPolarHBondContact CG2-OG 3.27Å
153	N	73.7	Confident	76.3	Confident	40 Å²	40	43 Å²	43	21%	0.214	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.3	-178	66.7	-7.4	0	0	0	112.5	V131 V150 G196 S197 S199	V131-N153 HydrophobicContact CG1-CB 3.88Å; V150-N153 HydrophobicContact CG1-CB 4.13Å; N153-G196 WeakPolarHBondContact ND2-CA 3.33Å; N153-G196 PolarHBondContact ND2-N 3.2Å; N153-G196 VanDerWaalsContact ND2-N 3.2Å; N153-G196 PolarHBondContact ND2-O 3.07Å; N153-G196 PolarHBondContact OD1-O 2.9Å; N153-S197 PolarHBondContact OD1-O 2.89Å; N153-S199 PolarHBondContact N-OG 2.84Å; N153-S199 WeakPolarHBondContact O-CB 3.3Å; N153-S199 PolarHBondContact O-N 2.81Å; N153-S199 PolarHBondContact O-OG 2.89Å
154	G	67.4	Low	77.9	Confident	18 Å²	18	34.3 Å²	34.3	19%	0.186	18%	0.18	C	C	.	.			trans	110.6	-17.5	174.3	0	0	0	0	0	113.4	R130 D156 G358 L359	R130-G154 PolarHBondContact O-N 3.36Å; G154-D156 PolarHBondContact O-N 3.05Å; G154-D156 VanDerWaalsContact O-N 3.17Å; G154-G358 CarbonylContact O-C 3.5Å; G154-G358 VanDerWaalsContact O-C 3.28Å; G154-G358 WeakPolarHBondContact O-CA 3.38Å; G154-L359 WeakPolarHBondContact O-CA 3.39Å; G154-L359 VanDerWaalsContact O-CB 3.32Å; G154-L359 WeakPolarHBondContact O-CB 3.42Å; G154-L359 PolarHBondContact O-N 3.49Å
155	F	69.7	Low	79.2	Confident	1 Å²	1	30 Å²	30	0%	0.004	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-52.3	128.8	167.9	-70.7	-62.2	0	0	0	110.6	R130 I132 I152 V173 T175 L179 A181 V183 V203 L359	R130-F155 WeakPolarHBondContact CA-O 3.5Å; R130-F155 WeakPolarHBondContact CB-O 3.22Å; R130-F155 WeakPolarHBondContact CG-O 3.39Å; I132-F155 HydrophobicContact CD1-CD2 3.73Å; I132-F155 HydrophobicContact CD1-CE2 3.87Å; I132-F155 HydrophobicContact CG1-CD2 4.35Å; I152-F155 HydrophobicContact CB-CE2 4.27Å; I152-F155 HydrophobicContact CG2-CD2 3.76Å; I152-F155 HydrophobicContact CG2-CE2 3.29Å; I152-F155 HydrophobicContact CG2-CZ 4.22Å; F155-V173 HydrophobicContact CD2-CG1 4.34Å; F155-V173 HydrophobicContact CE2-CG1 4.48Å; F155-V173 HydrophobicContact CE2-CG2 4.29Å; F155-V173 HydrophobicContact CG-CG1 4.45Å; F155-T175 HydrophobicContact CB-CG2 4.04Å; F155-T175 HydrophobicContact CD1-CG2 3.99Å; F155-T175 HydrophobicContact CG-CG2 4.26Å; F155-L179 HydrophobicContact CD1-CD2 4.4Å; F155-A181 HydrophobicContact CE1-CB 3.52Å; F155-A181 HydrophobicContact CZ-CB 3.85Å; F155-V183 HydrophobicContact CE2-CG2 3.95Å; F155-V183 HydrophobicContact CZ-CG2 3.62Å; F155-V203 HydrophobicContact CE1-CG2 3.74Å; F155-V203 HydrophobicContact CZ-CG2 3.54Å; F155-L359 HydrophobicContact CD1-CD1 4.06Å; F155-L359 HydrophobicContact CE1-CD1 4.04Å
156	D	68.9	Low	80.2	Confident	27 Å²	27	30 Å²	30	14%	0.144	17%	0.165	C	C	.	.	S	Bend	trans	-59.4	160.2	164.2	-156.2	5.6	0	0	0	109.3	R130 G154 A158 T175 L359	R130-D156 IonicContact NE-OD1 3.37Å; G154-D156 PolarHBondContact O-N 3.05Å; G154-D156 VanDerWaalsContact O-N 3.17Å; D156-A158 PolarHBondContact O-N 3.33Å; D156-T175 WeakPolarHBondContact O-CB 3.49Å; D156-L359 PolarHBondContact N-O 3.14Å
157	F	75.1	Confident	81	Confident	91 Å²	91	32.3 Å²	32.3	40%	0.399	17%	0.172	S	C	.	.	S	Bend	trans	-29.9	103.3	-168.3	-58.2	-78.2	0	0	0	114.3	P128 N159 T175 V176	P128-F157 HydrophobicContact CB-CD1 3.75Å; P128-F157 HydrophobicContact CB-CE1 4.04Å; P128-F157 WeakPolarHBondContact O-CD1 3.28Å; P128-F157 WeakPolarHBondContact O-CE1 3.49Å; F157-N159 PolarHBondContact O-N 3.21Å; F157-T175 CarbonylContact O-C 3.53Å; F157-T175 WeakPolarHBondContact O-CA 3.22Å; F157-V176 HydrophobicContact CB-CB 4.22Å; F157-V176 HydrophobicContact CB-CG2 3.69Å; F157-V176 HydrophobicContact CD2-CG2 4.33Å; F157-V176 HydrophobicContact CG-CG2 4.46Å; F157-V176 PolarHBondContact O-N 3.36Å
158	A	83.4	Confident	81.5	Confident	4 Å²	4	34.1 Å²	34.1	3%	0.033	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.2	179.8	0	0	0	0	0	110	C126 D156 V173	C126-A158 HydrophobicContact CB-CB 3.79Å; C126-A158 VanDerWaalsContact SG-CB 3.59Å; D156-A158 PolarHBondContact O-N 3.33Å; A158-V173 HydrophobicContact CB-CG1 3.92Å
159	N	87.1	Confident	82.1	Confident	29 Å²	29	35.5 Å²	35.5	16%	0.155	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-32.3	-175.8	-70.4	-38.8	0	0	0	112.5	F157 G174 Q218 V219	F157-N159 PolarHBondContact O-N 3.21Å; N159-G174 PolarHBondContact N-O 2.87Å; N159-Q218 PolarHBondContact ND2-OE1 3.26Å; N159-Q218 VanDerWaalsContact ND2-OE1 3.07Å; N159-V219 WeakPolarHBondContact CB-O 3.36Å
160	A	92	Very high	82.7	Confident	3 Å²	3	32.7 Å²	32.7	3%	0.025	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.9	-176.5	0	0	0	0	0	110.5	V173 G174 V219 V222	A160-V173 WeakPolarHBondContact O-CA 3.13Å; A160-G174 PolarHBondContact N-O 2.81Å; A160-G174 VanDerWaalsContact N-O 3.1Å; A160-G174 PolarHBondContact O-N 2.87Å; A160-V219 HydrophobicContact CB-CG1 4.45Å; A160-V222 HydrophobicContact CB-CG1 4.47Å; A160-V222 HydrophobicContact CB-CG2 3.94Å
161	I	93.9	Very high	83.5	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.021	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.3	177	-173.2	165.8	0	0	0	110	Q112 A114 L124 C126 I132 V171 A172	Q112-I161 HydrophobicContact CB-CG2 4.05Å; Q112-I161 HydrophobicContact CG-CG2 3.91Å; A114-I161 HydrophobicContact CB-CG1 4.15Å; A114-I161 HydrophobicContact CB-CG2 4.01Å; L124-I161 HydrophobicContact CB-CD1 3.84Å; L124-I161 HydrophobicContact CD1-CD1 3.86Å; L124-I161 HydrophobicContact CG-CD1 4.49Å; C126-I161 WeakPolarHBondContact SG-CB 3.43Å; C126-I161 WeakPolarHBondContact SG-CG2 3.37Å; I132-I161 HydrophobicContact CD1-CD1 4.24Å; I132-I161 HydrophobicContact CG2-CD1 3.72Å; I161-V171 HydrophobicContact CD1-CG1 3.85Å; I161-V171 HydrophobicContact CG1-CG1 3.7Å; I161-A172 VanDerWaalsContact CA-O 3.27Å; I161-A172 WeakPolarHBondContact CA-O 3.41Å
162	D	95.6	Very high	84.5	Confident	19 Å²	19	29.2 Å²	29.2	10%	0.102	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	152.8	171.3	-166.2	27.9	0	0	0	111.1	V171 A172 V222 Q223 F224	D162-V171 WeakPolarHBondContact O-CA 3.21Å; D162-A172 PolarHBondContact N-O 2.82Å; D162-A172 PolarHBondContact O-N 2.94Å; D162-V222 HydrophobicContact CB-CG2 4.2Å; D162-Q223 WeakPolarHBondContact OD2-CA 3.28Å; D162-Q223 PolarHBondContact OD2-NE2 2.76Å; D162-F224 HydrophobicContact CB-CD2 4.16Å; D162-F224 PolarHBondContact OD2-N 2.79Å
163	V	93	Very high	85.4	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.018	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.1	179.4	176	0	0	0	0	108.2	A114 F116 L124 T165 V171	A114-V163 HydrophobicContact CB-CG2 3.85Å; F116-V163 HydrophobicContact CD1-CG1 3.9Å; F116-V163 HydrophobicContact CE1-CG1 3.99Å; F116-V163 HydrophobicContact CE1-CG2 4.26Å; F116-V163 HydrophobicContact CZ-CG2 4.35Å; L124-V163 HydrophobicContact CD1-CG2 3.79Å; V163-T165 PolarHBondContact O-N 3.22Å; V163-V171 HydrophobicContact CG2-CG2 4.19Å
164	S	92.2	Very high	86.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.			trans	-63.6	126.9	178.9	174.5	0	0	0	0	111	K166 R167 Q168 L170	S164-K166 VanDerWaalsContact C-N 3.32Å; S164-K166 PolarHBondContact OG-N 2.95Å; S164-R167 WeakPolarHBondContact CB-O 3.21Å; S164-R167 CarbonylContact O-C 3.53Å; S164-R167 PolarHBondContact OG-N 3.17Å; S164-Q168 WeakPolarHBondContact O-CA 3.35Å; S164-Q168 PolarHBondContact O-N 2.85Å; S164-L170 PolarHBondContact N-O 3.32Å
165	T	89	Confident	87	Confident	60 Å²	60	26.4 Å²	26.4	37%	0.368	13%	0.125	S	C	.	.	S	Bend	trans	-65	-37.5	174.4	53.2	0	0	0	0	111.8	P117 V163 P226	P117-T165 HydrophobicContact CG-CG2 4.03Å; V163-T165 PolarHBondContact O-N 3.22Å; T165-P226 VanDerWaalsContact OG1-C 3.3Å; T165-P226 PolarHBondContact OG1-O 3.07Å
166	K	88.2	Confident	87.3	Confident	108 Å²	108	27.3 Å²	27.3	47%	0.47	13%	0.13	S	C	.	.	S	Bend	trans	-78.7	-37.8	-179.7	-173.1	175.2	178	-176	0	112.5	S164 D229	S164-K166 VanDerWaalsContact C-N 3.32Å; S164-K166 PolarHBondContact OG-N 2.95Å; K166-D229 WeakPolarHBondContact CD-OD1 3.37Å; K166-D229 IonicContact NZ-OD1 2.95Å; K166-D229 IonicContact NZ-OD2 3.28Å; K166-D229 PolarHBondContact NZ-OD2 3.1Å
167	R	89.3	Confident	87.5	Confident	93 Å²	93	26.7 Å²	26.7	35%	0.351	13%	0.13	S	C	.	.			trans	-128.9	83.3	-177	-65	-179.9	-174.9	-84	0.9	110	S164 H169 L170 D229	S164-R167 WeakPolarHBondContact CB-O 3.21Å; S164-R167 CarbonylContact O-C 3.53Å; S164-R167 PolarHBondContact OG-N 3.17Å; R167-H169 PolarHBondContact O-N 3.27Å; R167-L170 HydrophobicContact CB-CB 4.1Å; R167-L170 WeakPolarHBondContact O-CB 3.49Å; R167-L170 PolarHBondContact O-N 2.91Å; R167-D229 IonicContact CZ-OD1 2.66Å; R167-D229 IonicContact NE-OD1 3.6Å; R167-D229 PolarHBondContact NE-OD1 3.09Å; R167-D229 IonicContact NH2-OD1 3.83Å
168	Q	87.2	Confident	87.5	Confident	52 Å²	52	23.2 Å²	23.2	24%	0.243	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.5	-171.5	-61.5	-172	-42.8	0	0	115.9	N118 S164	N118-Q168 VanDerWaalsContact CG-NE2 3.3Å; N118-Q168 VanDerWaalsContact N-NE2 3.16Å; N118-Q168 VanDerWaalsContact ND2-CD 3.26Å; N118-Q168 PolarHBondContact ND2-NE2 3.01Å; N118-Q168 PolarHBondContact ND2-OE1 2.94Å; S164-Q168 WeakPolarHBondContact O-CA 3.35Å; S164-Q168 PolarHBondContact O-N 2.85Å
169	H	84.8	Confident	87.4	Confident	49 Å²	49	23 Å²	23	23%	0.227	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-14	168.9	56.4	-88	0	0	0	113	R167 D184 L185 R186	R167-H169 PolarHBondContact O-N 3.27Å; H169-D184 IonicContact CD2-OD1 3.8Å; H169-D184 PolarHBondContact CD2-OD1 2.88Å; H169-D184 IonicContact CD2-OD2 2.79Å; H169-D184 IonicContact CG-OD1 3.79Å; H169-L185 WeakPolarHBondContact O-CB 3.14Å; H169-L185 VanDerWaalsContact O-CG 3.32Å; H169-L185 WeakPolarHBondContact O-CG 3.35Å; H169-L185 PolarHBondContact O-N 3.42Å; H169-R186 HydrophobicContact CB-CG 3.83Å; H169-R186 PolarHBondContact CD2-NE 2.85Å; H169-R186 VanDerWaalsContact CD2-NE 3.31Å; H169-R186 PolarHBondContact NE2-NH2 3.02Å
170	L	89.2	Confident	87.4	Confident	12 Å²	12	21.8 Å²	21.8	6%	0.063	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.1	-177.6	-170.8	67.1	0	0	0	110.3	S164 R167 L182 V183 F224	S164-L170 PolarHBondContact N-O 3.32Å; R167-L170 HydrophobicContact CB-CB 4.1Å; R167-L170 WeakPolarHBondContact O-CB 3.49Å; R167-L170 PolarHBondContact O-N 2.91Å; L170-L182 HydrophobicContact CD1-CB 4.28Å; L170-L182 HydrophobicContact CD1-CD2 4.43Å; L170-L182 HydrophobicContact CG-CD2 4.42Å; L170-V183 WeakPolarHBondContact CA-O 3.29Å; L170-F224 HydrophobicContact CD2-CE1 3.94Å; L170-F224 HydrophobicContact CD2-CZ 4.01Å; L170-F224 HydrophobicContact CG-CE1 4.43Å; L170-F224 HydrophobicContact CG-CZ 3.99Å
171	V	90.8	Very high	87.1	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	135.1	179.5	179	0	0	0	0	109.2	L124 I161 D162 V163 V173 L182 V183 L185	L124-V171 HydrophobicContact CD1-CG1 4.05Å; L124-V171 HydrophobicContact CD1-CG2 3.91Å; I161-V171 HydrophobicContact CD1-CG1 3.85Å; I161-V171 HydrophobicContact CG1-CG1 3.7Å; D162-V171 WeakPolarHBondContact O-CA 3.21Å; V163-V171 HydrophobicContact CG2-CG2 4.19Å; V171-V173 HydrophobicContact CG1-CG2 4.05Å; V171-L182 WeakPolarHBondContact O-CA 3.4Å; V171-V183 PolarHBondContact N-O 3.33Å; V171-V183 PolarHBondContact O-N 2.84Å; V171-L185 HydrophobicContact CG2-CD1 3.67Å; V171-L185 HydrophobicContact CG2-CD2 4.03Å; V171-L185 HydrophobicContact CG2-CG 3.78Å
172	A	93	Very high	86.8	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	134.5	171	0	0	0	0	0	108.9	I161 D162 A181 L182 V222 F224 L231	I161-A172 VanDerWaalsContact CA-O 3.27Å; I161-A172 WeakPolarHBondContact CA-O 3.41Å; D162-A172 PolarHBondContact N-O 2.82Å; D162-A172 PolarHBondContact O-N 2.94Å; A172-A181 CarbonylContact C-O 3.53Å; A172-A181 WeakPolarHBondContact CA-O 3.45Å; A172-L182 HydrophobicContact CB-CD2 4.04Å; A172-V222 HydrophobicContact CB-CB 4.17Å; A172-V222 HydrophobicContact CB-CG2 4.05Å; A172-F224 HydrophobicContact CB-CD2 4.34Å; A172-F224 HydrophobicContact CB-CE2 3.49Å; A172-F224 VanDerWaalsContact CB-CE2 3.49Å; A172-F224 HydrophobicContact CB-CZ 3.68Å; A172-L231 HydrophobicContact CB-CD1 3.65Å; A172-L231 HydrophobicContact CB-CD2 3.76Å; A172-L231 HydrophobicContact CB-CG 4.4Å
173	V	90.9	Very high	86.3	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	119.3	-179.7	-175.3	0	0	0	0	108.6	I132 F155 A158 A160 V171 T175 V180 A181 V183	I132-V173 HydrophobicContact CD1-CB 4.22Å; I132-V173 HydrophobicContact CD1-CG1 3.76Å; I132-V173 HydrophobicContact CD1-CG2 3.39Å; F155-V173 HydrophobicContact CD2-CG1 4.34Å; F155-V173 HydrophobicContact CE2-CG1 4.48Å; F155-V173 HydrophobicContact CE2-CG2 4.29Å; F155-V173 HydrophobicContact CG-CG1 4.45Å; A158-V173 HydrophobicContact CB-CG1 3.92Å; A160-V173 WeakPolarHBondContact O-CA 3.13Å; V171-V173 HydrophobicContact CG1-CG2 4.05Å; V173-T175 HydrophobicContact CG1-CG2 4.02Å; V173-V180 CarbonylContact O-C 3.51Å; V173-V180 WeakPolarHBondContact O-CA 3.34Å; V173-A181 PolarHBondContact N-O 3.11Å; V173-A181 PolarHBondContact O-N 3.48Å; V173-V183 HydrophobicContact CG2-CG2 4.26Å
174	G	89.9	Confident	85.7	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.1	170.5	0	0	0	0	0	110.7	N159 A160	N159-G174 PolarHBondContact N-O 2.87Å; A160-G174 PolarHBondContact N-O 2.81Å; A160-G174 VanDerWaalsContact N-O 3.1Å; A160-G174 PolarHBondContact O-N 2.87Å
175	T	84	Confident	85.2	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	179.5	-176.7	72.1	0	0	0	0	112.9	F155 D156 F157 V173 L179 V219	F155-T175 HydrophobicContact CB-CG2 4.04Å; F155-T175 HydrophobicContact CD1-CG2 3.99Å; F155-T175 HydrophobicContact CG-CG2 4.26Å; D156-T175 WeakPolarHBondContact O-CB 3.49Å; F157-T175 CarbonylContact O-C 3.53Å; F157-T175 WeakPolarHBondContact O-CA 3.22Å; V173-T175 HydrophobicContact CG1-CG2 4.02Å; T175-L179 HydrophobicContact CG2-CD2 3.56Å; T175-L179 PolarHBondContact N-O 2.68Å; T175-L179 VanDerWaalsContact N-O 3.09Å; T175-L179 WeakPolarHBondContact OG1-CD2 3.39Å; T175-V219 PolarHBondContact O-N 3.43Å; T175-V219 VanDerWaalsContact O-N 3.17Å
176	V	76.1	Confident	84.6	Confident	20 Å²	20	28.2 Å²	28.2	12%	0.121	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-61.2	133.7	157	158	0	0	0	0	109.7	F157 F216	F157-V176 HydrophobicContact CB-CB 4.22Å; F157-V176 HydrophobicContact CB-CG2 3.69Å; F157-V176 HydrophobicContact CD2-CG2 4.33Å; F157-V176 HydrophobicContact CG-CG2 4.46Å; F157-V176 PolarHBondContact O-N 3.36Å; V176-F216 HydrophobicContact CB-CZ 4.15Å; V176-F216 HydrophobicContact CG1-CE1 4.31Å; V176-F216 HydrophobicContact CG1-CE2 3.65Å; V176-F216 HydrophobicContact CG1-CZ 3.28Å; V176-F216 HydrophobicContact CG2-CE1 4.41Å; V176-F216 HydrophobicContact CG2-CZ 3.92Å
177	G	73.1	Confident	83.9	Confident	14 Å²	14	27.6 Å²	27.6	14%	0.144	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	92.6	161.2	-163.6	0	0	0	0	0	111.5	L179 V217 Q218	G177-L179 PolarHBondContact O-N 2.87Å; G177-V217 CarbonylContact C-O 3.32Å; G177-V217 WeakPolarHBondContact CA-O 3.49Å; G177-V217 PolarHBondContact N-O 3.35Å; G177-Q218 WeakPolarHBondContact O-CA 3.36Å
178	P	75.8	Confident	82.9	Confident	17 Å²	17	24.2 Å²	24.2	11%	0.11	12%	0.12	C	C	.	.	S	Bend	trans	-74	45.5	175.7	32.3	-34.4	0	0	0	111.1	I207 G208 N209 V217 F235 L257	P178-I207 CarbonylContact O-C 3.22Å; P178-G208 WeakPolarHBondContact O-CA 3.25Å; P178-N209 WeakPolarHBondContact CG-O 3.36Å; P178-V217 HydrophobicContact CB-CB 4.38Å; P178-V217 HydrophobicContact CB-CG1 3.9Å; P178-F235 HydrophobicContact CB-CD1 4.22Å; P178-F235 HydrophobicContact CB-CE1 4.22Å; P178-L257 HydrophobicContact CB-CD1 4.03Å
179	L	80.1	Confident	81.3	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.			trans	-107	119.4	-177.5	175.8	127.4	0	0	0	111.1	F155 T175 G177 A181 I206 I207 V219 F361 L364	F155-L179 HydrophobicContact CD1-CD2 4.4Å; T175-L179 HydrophobicContact CG2-CD2 3.56Å; T175-L179 PolarHBondContact N-O 2.68Å; T175-L179 VanDerWaalsContact N-O 3.09Å; T175-L179 WeakPolarHBondContact OG1-CD2 3.39Å; G177-L179 PolarHBondContact O-N 2.87Å; L179-A181 HydrophobicContact CD2-CB 4.09Å; L179-I206 HydrophobicContact CD1-CB 4.32Å; L179-I206 HydrophobicContact CD1-CD1 4.46Å; L179-I206 HydrophobicContact CD1-CG2 3.87Å; L179-I206 HydrophobicContact CG-CG2 4.47Å; L179-I207 WeakPolarHBondContact CA-O 3.27Å; L179-V219 WeakPolarHBondContact O-CG2 3.42Å; L179-F361 HydrophobicContact CB-CB 4.17Å; L179-F361 HydrophobicContact CB-CD2 3.78Å; L179-F361 HydrophobicContact CB-CG 4.38Å; L179-F361 HydrophobicContact CD1-CB 4.26Å; L179-F361 HydrophobicContact CD1-CD2 3.57Å; L179-F361 HydrophobicContact CD1-CE2 4.44Å; L179-F361 HydrophobicContact CD1-CG 4.41Å; L179-F361 HydrophobicContact CG-CD2 4.19Å; L179-L364 HydrophobicContact CD1-CD2 3.71Å
180	V	87.7	Confident	79.7	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.024	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	115.8	162.4	178.3	0	0	0	0	107.6	V173 I206 I207 V219 V222 L231 F235	V173-V180 CarbonylContact O-C 3.51Å; V173-V180 WeakPolarHBondContact O-CA 3.34Å; V180-I206 VanDerWaalsContact O-CA 3.27Å; V180-I206 WeakPolarHBondContact O-CA 3.14Å; V180-I207 PolarHBondContact N-O 3.4Å; V180-I207 PolarHBondContact O-N 3.42Å; V180-V219 HydrophobicContact CG2-CG1 4.09Å; V180-V219 HydrophobicContact CG2-CG2 3.64Å; V180-V222 HydrophobicContact CG1-CG1 4.05Å; V180-V222 HydrophobicContact CG2-CG1 4.22Å; V180-L231 HydrophobicContact CG1-CD2 3.81Å; V180-F235 HydrophobicContact CG2-CE1 4.12Å; V180-F235 HydrophobicContact CG2-CZ 3.66Å
181	A	86	Confident	77.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.8	177	0	0	0	0	0	111.3	F155 A172 V173 L179 V203 I206	F155-A181 HydrophobicContact CE1-CB 3.52Å; F155-A181 HydrophobicContact CZ-CB 3.85Å; A172-A181 CarbonylContact C-O 3.53Å; A172-A181 WeakPolarHBondContact CA-O 3.45Å; V173-A181 PolarHBondContact N-O 3.11Å; V173-A181 PolarHBondContact O-N 3.48Å; L179-A181 HydrophobicContact CD2-CB 4.09Å; A181-V203 HydrophobicContact CB-CG1 4.21Å; A181-V203 HydrophobicContact CB-CG2 4.18Å; A181-I206 HydrophobicContact CB-CG2 4.42Å
182	L	87.3	Confident	74.7	Confident	4 Å²	4	35 Å²	35	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123.2	167.3	-71.5	174.9	0	0	0	109.2	L170 V171 A172 V203 C204 S205 F224 L231	L170-L182 HydrophobicContact CD1-CB 4.28Å; L170-L182 HydrophobicContact CD1-CD2 4.43Å; L170-L182 HydrophobicContact CG-CD2 4.42Å; V171-L182 WeakPolarHBondContact O-CA 3.4Å; A172-L182 HydrophobicContact CB-CD2 4.04Å; L182-V203 WeakPolarHBondContact O-CA 3.47Å; L182-C204 VanDerWaalsContact CB-SG 3.51Å; L182-C204 PolarHBondContact O-N 3.21Å; L182-C204 PolarHBondContact O-SG 2.96Å; L182-S205 PolarHBondContact N-O 3.06Å; L182-S205 VanDerWaalsContact N-O 3.07Å; L182-F224 HydrophobicContact CD2-CE1 4.2Å; L182-F224 HydrophobicContact CD2-CZ 3.78Å; L182-L231 HydrophobicContact CD2-CD2 3.93Å
183	V	84	Confident	72.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.6	-177.6	-175.1	0	0	0	0	110	I152 F155 L170 V171 V173 V188 V203	I152-V183 HydrophobicContact CD1-CB 4.14Å; I152-V183 HydrophobicContact CD1-CG1 3.56Å; I152-V183 HydrophobicContact CD1-CG2 4.24Å; I152-V183 HydrophobicContact CG1-CG1 4.14Å; F155-V183 HydrophobicContact CE2-CG2 3.95Å; F155-V183 HydrophobicContact CZ-CG2 3.62Å; L170-V183 WeakPolarHBondContact CA-O 3.29Å; V171-V183 PolarHBondContact N-O 3.33Å; V171-V183 PolarHBondContact O-N 2.84Å; V173-V183 HydrophobicContact CG2-CG2 4.26Å; V183-V188 HydrophobicContact CG1-CG2 4.34Å; V183-V203 HydrophobicContact CG2-CG2 4.25Å
184	D	81.4	Confident	70	Confident	19 Å²	19	43.8 Å²	43.8	10%	0.102	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	108.3	171.4	-165.9	-31.5	0	0	0	110.1	H169 R186 N187 T202	H169-D184 IonicContact CD2-OD1 3.8Å; H169-D184 PolarHBondContact CD2-OD1 2.88Å; H169-D184 IonicContact CD2-OD2 2.79Å; H169-D184 IonicContact CG-OD1 3.79Å; D184-R186 PolarHBondContact O-N 2.65Å; D184-R186 VanDerWaalsContact O-N 3.09Å; D184-R186 VanDerWaalsContact OD1-CB 3.27Å; D184-R186 WeakPolarHBondContact OD1-CB 3.33Å; D184-R186 WeakPolarHBondContact OD1-CG 3.31Å; D184-R186 IonicContact OD1-CZ 3.73Å; D184-R186 PolarHBondContact OD1-N 2.81Å; D184-R186 IonicContact OD1-NE 3.78Å; D184-R186 PolarHBondContact OD1-NE 3.04Å; D184-R186 IonicContact OD1-NH2 2.82Å; D184-R186 IonicContact OD2-CZ 3.93Å; D184-R186 IonicContact OD2-NE 3.41Å; D184-R186 PolarHBondContact OD2-NE 2.73Å; D184-R186 IonicContact OD2-NH2 3.87Å; D184-R186 PolarHBondContact OD2-NH2 3.39Å; D184-N187 PolarHBondContact O-N 3.07Å; D184-T202 PolarHBondContact N-O 3.21Å
185	L	81	Confident	68	Low	36 Å²	36	47.8 Å²	47.8	19%	0.188	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-17.9	-179.5	-63.9	-179.5	0	0	0	113.4	F116 L151 I152 H169 V171 N187 V188	F116-L185 HydrophobicContact CE1-CD1 4Å; F116-L185 HydrophobicContact CZ-CD1 4.04Å; L151-L185 HydrophobicContact CD1-CD2 4.05Å; I152-L185 HydrophobicContact CD1-CD2 4.26Å; H169-L185 WeakPolarHBondContact O-CB 3.14Å; H169-L185 VanDerWaalsContact O-CG 3.32Å; H169-L185 WeakPolarHBondContact O-CG 3.35Å; H169-L185 PolarHBondContact O-N 3.42Å; V171-L185 HydrophobicContact CG2-CD1 3.67Å; V171-L185 HydrophobicContact CG2-CD2 4.03Å; V171-L185 HydrophobicContact CG2-CG 3.78Å; L185-N187 VanDerWaalsContact C-N 3.29Å; L185-V188 HydrophobicContact CD2-CG2 4.21Å; L185-V188 WeakPolarHBondContact O-CB 3.23Å; L185-V188 PolarHBondContact O-N 3.34Å
186	R	77.7	Confident	66.3	Low	164 Å²	164	48.3 Å²	48.3	62%	0.619	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-25.5	175.3	-60.3	171.6	-63.8	171.1	1.9	112.3	H169 D184 V188	H169-R186 HydrophobicContact CB-CG 3.83Å; H169-R186 PolarHBondContact CD2-NE 2.85Å; H169-R186 VanDerWaalsContact CD2-NE 3.31Å; H169-R186 PolarHBondContact NE2-NH2 3.02Å; D184-R186 PolarHBondContact O-N 2.65Å; D184-R186 VanDerWaalsContact O-N 3.09Å; D184-R186 VanDerWaalsContact OD1-CB 3.27Å; D184-R186 WeakPolarHBondContact OD1-CB 3.33Å; D184-R186 WeakPolarHBondContact OD1-CG 3.31Å; D184-R186 IonicContact OD1-CZ 3.73Å; D184-R186 PolarHBondContact OD1-N 2.81Å; D184-R186 IonicContact OD1-NE 3.78Å; D184-R186 PolarHBondContact OD1-NE 3.04Å; D184-R186 IonicContact OD1-NH2 2.82Å; D184-R186 IonicContact OD2-CZ 3.93Å; D184-R186 IonicContact OD2-NE 3.41Å; D184-R186 PolarHBondContact OD2-NE 2.73Å; D184-R186 IonicContact OD2-NH2 3.87Å; D184-R186 PolarHBondContact OD2-NH2 3.39Å; R186-V188 VanDerWaalsContact C-N 3.32Å
187	N	71.5	Confident	65.2	Low	95 Å²	95	47.9 Å²	47.9	51%	0.508	31%	0.312	S	S	.	.	S	Bend	trans	-86.6	-9.9	177	-65.4	-9.5	0	0	0	111.8	D184 L185 S189 T202	D184-N187 PolarHBondContact O-N 3.07Å; L185-N187 VanDerWaalsContact C-N 3.29Å; N187-S189 PolarHBondContact O-N 3.31Å; N187-T202 HydrophobicContact CB-CG2 4.48Å
188	V	68.5	Low	64.4	Low	23 Å²	23	50 Å²	50	14%	0.139	33%	0.325	C	S	.	.	S	Bend	trans	-73.6	96.4	173.3	-178.5	0	0	0	0	107.9	L151 I152 V183 L185 R186 G190 T202	L151-V188 WeakPolarHBondContact O-CG1 3.33Å; I152-V188 HydrophobicContact CG1-CG2 4.09Å; V183-V188 HydrophobicContact CG1-CG2 4.34Å; L185-V188 HydrophobicContact CD2-CG2 4.21Å; L185-V188 WeakPolarHBondContact O-CB 3.23Å; L185-V188 PolarHBondContact O-N 3.34Å; R186-V188 VanDerWaalsContact C-N 3.32Å; V188-G190 PolarHBondContact O-N 3.13Å; V188-T202 HydrophobicContact CB-CG2 4.31Å; V188-T202 HydrophobicContact CG2-CG2 3.74Å
189	S	54.9	Low	63.7	Low	74 Å²	74	49.4 Å²	49.4	52%	0.517	32%	0.32	S	S	.	.			trans	-63.6	131.4	172.8	46.2	0	0	0	0	110.1	N187 C191	N187-S189 PolarHBondContact O-N 3.31Å; S189-C191 PolarHBondContact O-N 3.03Å; S189-C191 PolarHBondContact O-SG 2.77Å
190	G	49.8	Very low	62.9	Low	79 Å²	79	50.2 Å²	50.2	81%	0.814	33%	0.325	S	S	*	.			trans	-66.1	102.2	177.3	0	0	0	0	0	110.5	V188 S192	V188-G190 PolarHBondContact O-N 3.13Å; G190-S192 PolarHBondContact O-N 3.32Å
191	C	39.9	Very low	61.7	Low	52 Å²	52	55.5 Å²	55.5	35%	0.351	35%	0.353	S	S	.	.			trans	-80.6	108.7	-179.9	-62.8	0	0	0	0	110.7	S189 S193 S197	S189-C191 PolarHBondContact O-N 3.03Å; S189-C191 PolarHBondContact O-SG 2.77Å; C191-S193 WeakPolarHBondContact CB-O 3.48Å; C191-S193 PolarHBondContact O-N 2.84Å; C191-S197 PolarHBondContact SG-N 2.81Å
192	S	36.9	Very low	60.9	Low	135 Å²	135	55.6 Å²	55.6	94%	0.944	35%	0.354	S	S	*	.	S	Bend	trans	-68.7	-13.6	163.6	-36.3	0	0	0	0	112.4	G190	G190-S192 PolarHBondContact O-N 3.32Å
193	S	38	Very low	60.2	Low	78 Å²	78	55.8 Å²	55.8	55%	0.545	36%	0.355	S	S	.	.	S	Bend	trans	-94.9	141.3	174.6	44.9	0	0	0	0	110.3	C191 S195	C191-S193 WeakPolarHBondContact CB-O 3.48Å; C191-S193 PolarHBondContact O-N 2.84Å; S193-S195 PolarHBondContact O-N 2.82Å
194	S	46	Very low	59.6	Low	106 Å²	106	58.2 Å²	58.2	74%	0.741	37%	0.372	S	S	*	.	S	Bend	trans	-58.9	-3	-177.3	43.2	0	0	0	0	115.9
195	S	48.5	Very low	59.1	Low	84 Å²	84	57.5 Å²	57.5	59%	0.587	37%	0.368	S	S	*	.	S	Bend	trans	-103.4	98.1	173.9	-49.4	0	0	0	0	108	S193	S193-S195 PolarHBondContact O-N 2.82Å
196	G	49	Very low	58.5	Low	11 Å²	11	56 Å²	56	11%	0.113	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-53	163.4	178.9	0	0	0	0	0	113.9	N153 S198	N153-G196 WeakPolarHBondContact ND2-CA 3.33Å; N153-G196 PolarHBondContact ND2-N 3.2Å; N153-G196 VanDerWaalsContact ND2-N 3.2Å; N153-G196 PolarHBondContact ND2-O 3.07Å; N153-G196 PolarHBondContact OD1-O 2.9Å; G196-S198 PolarHBondContact O-N 2.76Å
197	S	51.8	Low	58.2	Low	11 Å²	11	48.4 Å²	48.4	8%	0.077	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-53.9	125.1	-179.9	-173.7	0	0	0	0	109.7	N153 C191 S199	N153-S197 PolarHBondContact OD1-O 2.89Å; C191-S197 PolarHBondContact SG-N 2.81Å; S197-S199 PolarHBondContact O-N 3.01Å
198	S	56.3	Low	57.7	Low	59 Å²	59	44.4 Å²	44.4	41%	0.413	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-53.7	116.1	-179.4	105.8	0	0	0	0	108.2	G196 V200 D201	G196-S198 PolarHBondContact O-N 2.76Å; S198-V200 PolarHBondContact O-N 2.79Å; S198-D201 PolarHBondContact O-N 3.23Å; S198-D201 VanDerWaalsContact O-N 3.11Å; S198-D201 PolarHBondContact OG-OD2 3.08Å
199	S	60.7	Low	57.2	Low	3 Å²	3	44.6 Å²	44.6	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-52.6	-28.7	-172.7	-76.3	0	0	0	0	113	I152 N153 S197 D201 T202 V203	I152-S199 WeakPolarHBondContact CG2-OG 3.27Å; N153-S199 PolarHBondContact N-OG 2.84Å; N153-S199 WeakPolarHBondContact O-CB 3.3Å; N153-S199 PolarHBondContact O-N 2.81Å; N153-S199 PolarHBondContact O-OG 2.89Å; S197-S199 PolarHBondContact O-N 3.01Å; S199-D201 PolarHBondContact O-N 3.4Å; S199-T202 PolarHBondContact O-N 3Å; S199-T202 VanDerWaalsContact O-N 3.14Å; S199-T202 PolarHBondContact O-OG1 3.26Å; S199-V203 VanDerWaalsContact O-CG2 3.28Å; S199-V203 WeakPolarHBondContact O-CG2 3.31Å; S199-V203 PolarHBondContact O-N 3.42Å; S199-V203 VanDerWaalsContact O-N 3.16Å
200	V	63.1	Low	57	Low	17 Å²	17	49.5 Å²	49.5	10%	0.103	32%	0.321	C	S	.	.	H	α-helix	trans	-53.2	-41.9	-178.5	-176.5	0	0	0	0	111.6	S198 T202 L359 L364 K367 N368	S198-V200 PolarHBondContact O-N 2.79Å; V200-T202 VanDerWaalsContact C-N 3.32Å; V200-T202 PolarHBondContact O-N 3.31Å; V200-L359 HydrophobicContact CG2-CD2 3.45Å; V200-L359 VanDerWaalsContact CG2-CD2 3.45Å; V200-L359 HydrophobicContact CG2-CG 4.49Å; V200-L364 HydrophobicContact CG1-CD1 4.2Å; V200-L364 HydrophobicContact CG2-CD1 4.3Å; V200-K367 HydrophobicContact CG2-CD 4.2Å; V200-N368 WeakPolarHBondContact CG1-ND2 3.38Å
201	D	63.2	Low	56.8	Low	115 Å²	115	47.6 Å²	47.6	62%	0.615	30%	0.295	S	S	*	.	H	α-helix	trans	-79.3	-18.6	-173.4	-57.2	-43.4	0	0	0	112.7	S198 S199	S198-D201 PolarHBondContact O-N 3.23Å; S198-D201 VanDerWaalsContact O-N 3.11Å; S198-D201 PolarHBondContact OG-OD2 3.08Å; S199-D201 PolarHBondContact O-N 3.4Å
202	T	68.3	Low	57.1	Low	2 Å²	2	54.8 Å²	54.8	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-97.1	-17.7	-177.5	58.9	0	0	0	0	112.9	D184 N187 V188 S199 V200	D184-T202 PolarHBondContact N-O 3.21Å; N187-T202 HydrophobicContact CB-CG2 4.48Å; V188-T202 HydrophobicContact CB-CG2 4.31Å; V188-T202 HydrophobicContact CG2-CG2 3.74Å; S199-T202 PolarHBondContact O-N 3Å; S199-T202 VanDerWaalsContact O-N 3.14Å; S199-T202 PolarHBondContact O-OG1 3.26Å; V200-T202 VanDerWaalsContact C-N 3.32Å; V200-T202 PolarHBondContact O-N 3.31Å
203	V	73.4	Confident	57.5	Low	8 Å²	8	50.8 Å²	50.8	5%	0.048	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	120	175.9	173	0	0	0	0	110	F155 A181 L182 V183 S199 I206 L364 L371	F155-V203 HydrophobicContact CE1-CG2 3.74Å; F155-V203 HydrophobicContact CZ-CG2 3.54Å; A181-V203 HydrophobicContact CB-CG1 4.21Å; A181-V203 HydrophobicContact CB-CG2 4.18Å; L182-V203 WeakPolarHBondContact O-CA 3.47Å; V183-V203 HydrophobicContact CG2-CG2 4.25Å; S199-V203 VanDerWaalsContact O-CG2 3.28Å; S199-V203 WeakPolarHBondContact O-CG2 3.31Å; S199-V203 PolarHBondContact O-N 3.42Å; S199-V203 VanDerWaalsContact O-N 3.16Å; V203-I206 HydrophobicContact CG1-CG2 3.79Å; V203-L364 HydrophobicContact CG1-CD2 4.46Å; V203-L371 HydrophobicContact CG1-CD2 4.5Å
204	C	71.1	Confident	58	Low	52 Å²	52	51.4 Å²	51.4	35%	0.351	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-23.9	-179.8	65.2	0	0	0	0	114	L182	L182-C204 VanDerWaalsContact CB-SG 3.51Å; L182-C204 PolarHBondContact O-N 3.21Å; L182-C204 PolarHBondContact O-SG 2.96Å
205	S	70.6	Confident	58.6	Low	3 Å²	3	47.3 Å²	47.3	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	147.1	-172	173.1	0	0	0	0	111.9	L182 P372 P374	L182-S205 PolarHBondContact N-O 3.06Å; L182-S205 VanDerWaalsContact N-O 3.07Å; S205-P372 VanDerWaalsContact CA-O 3.25Å; S205-P372 WeakPolarHBondContact CA-O 3.36Å; S205-P372 WeakPolarHBondContact CB-O 3.43Å; S205-P372 PolarHBondContact OG-O 3.15Å; S205-P372 VanDerWaalsContact OG-O 3.12Å; S205-P374 WeakPolarHBondContact OG-CD 3.25Å
206	I	69.7	Low	59.5	Low	5 Å²	5	49 Å²	49	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	146.3	177.9	63.7	177	0	0	0	113.1	L179 V180 A181 V203 F361 L364 L371 P374	L179-I206 HydrophobicContact CD1-CB 4.32Å; L179-I206 HydrophobicContact CD1-CD1 4.46Å; L179-I206 HydrophobicContact CD1-CG2 3.87Å; L179-I206 HydrophobicContact CG-CG2 4.47Å; V180-I206 VanDerWaalsContact O-CA 3.27Å; V180-I206 WeakPolarHBondContact O-CA 3.14Å; A181-I206 HydrophobicContact CB-CG2 4.42Å; V203-I206 HydrophobicContact CG1-CG2 3.79Å; I206-F361 HydrophobicContact CD1-CD2 4.31Å; I206-F361 HydrophobicContact CD1-CE2 3.86Å; I206-L364 HydrophobicContact CD1-CD2 4.08Å; I206-L364 HydrophobicContact CG2-CD2 3.81Å; I206-L371 HydrophobicContact CD1-CD1 4.1Å; I206-P374 WeakPolarHBondContact O-CD 3.12Å
207	I	71.2	Confident	60.9	Low	5 Å²	5	48.9 Å²	48.9	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.7	158.3	-103.2	168.1	0	0	0	109.1	P178 L179 V180 F235 L243 P374 V376	P178-I207 CarbonylContact O-C 3.22Å; L179-I207 WeakPolarHBondContact CA-O 3.27Å; V180-I207 PolarHBondContact N-O 3.4Å; V180-I207 PolarHBondContact O-N 3.42Å; I207-F235 HydrophobicContact CG2-CE1 4.34Å; I207-F235 HydrophobicContact CG2-CE2 4.44Å; I207-F235 HydrophobicContact CG2-CZ 3.64Å; I207-L243 HydrophobicContact CD1-CD1 3.59Å; I207-L243 HydrophobicContact CD1-CD2 3.07Å; I207-L243 HydrophobicContact CD1-CG 3.89Å; I207-P374 HydrophobicContact CB-CG 4.42Å; I207-P374 HydrophobicContact CD1-CG 3.74Å; I207-P374 HydrophobicContact CG1-CG 3.72Å; I207-V376 HydrophobicContact CD1-CG2 3.66Å
208	G	60.8	Low	62.5	Low	11 Å²	11	48.8 Å²	48.8	11%	0.113	28%	0.278	C	S	.	.			trans	179.5	157.3	161.9	0	0	0	0	0	114.9	P178 F361	P178-G208 WeakPolarHBondContact O-CA 3.25Å; G208-F361 VanDerWaalsContact CA-CE2 3.46Å; G208-F361 VanDerWaalsContact CA-CZ 3.41Å; G208-F361 WeakPolarHBondContact O-CZ 3.49Å
209	N	57.4	Low	64	Low	26 Å²	26	46 Å²	46	14%	0.139	26%	0.258	C	S	.	.			trans	-116.9	150.5	176.3	-171.5	18	0	0	0	111.7	P178 S211 S256 L257	P178-N209 WeakPolarHBondContact CG-O 3.36Å; N209-S211 PolarHBondContact O-N 3.07Å; N209-S256 PolarHBondContact ND2-OG 3.01Å; N209-S256 PolarHBondContact OD1-OG 3.25Å; N209-L257 HydrophobicContact CB-CB 3.9Å; N209-L257 HydrophobicContact CB-CD1 4.02Å; N209-L257 HydrophobicContact CB-CG 3.8Å; N209-L257 PolarHBondContact ND2-N 3.12Å; N209-L257 PolarHBondContact ND2-O 3.34Å
210	R	50.9	Low	65.5	Low	178 Å²	178	46.3 Å²	46.3	67%	0.672	26%	0.26	S	S	*	.			trans	-77.9	102.2	158.2	-66	-179	-170.7	-121.7	3.2	108.3	K212	R210-K212 PolarHBondContact O-N 3.13Å
211	S	46.5	Very low	66.9	Low	39 Å²	39	46.1 Å²	46.1	27%	0.273	26%	0.259	S	S	.	.			trans	-60.2	110.7	163.4	-173.4	0	0	0	0	108.5	N209 S213 L262	N209-S211 PolarHBondContact O-N 3.07Å; S211-S213 VanDerWaalsContact C-N 3.25Å; S211-S213 WeakPolarHBondContact CB-O 3.18Å; S211-S213 PolarHBondContact OG-O 3.49Å; S211-S213 PolarHBondContact OG-OG 2.85Å; S211-L262 WeakPolarHBondContact OG-CD1 3.41Å; S211-L262 WeakPolarHBondContact OG-CD2 3.48Å
212	K	46.3	Very low	68.5	Low	203 Å²	203	41 Å²	41	88%	0.883	23%	0.232	S	C	*	.	S	Bend	trans	-66.6	-31.8	173.4	-75.2	-174.6	178.7	178.1	0	111.2	R210	R210-K212 PolarHBondContact O-N 3.13Å
213	S	44.4	Very low	69.8	Low	50 Å²	50	43 Å²	43	35%	0.35	24%	0.242	S	C	.	.	S	Bend	trans	-83	135.5	170.4	47.3	0	0	0	0	109.5	S211 G215 L262	S211-S213 VanDerWaalsContact C-N 3.25Å; S211-S213 WeakPolarHBondContact CB-O 3.18Å; S211-S213 PolarHBondContact OG-O 3.49Å; S211-S213 PolarHBondContact OG-OG 2.85Å; S213-G215 PolarHBondContact O-N 3.5Å; S213-L262 WeakPolarHBondContact OG-CB 3.39Å; S213-L262 WeakPolarHBondContact OG-CD1 3.36Å
214	G	49.3	Very low	70.9	Confident	92 Å²	92	42.8 Å²	42.8	95%	0.948	24%	0.24	S	C	*	.			trans	-64.1	26.1	-174.9	0	0	0	0	0	117.5
215	G	57.7	Low	72	Confident	19 Å²	19	40.5 Å²	40.5	20%	0.196	23%	0.225	C	C	.	.			trans	-73.9	125.4	173.7	0	0	0	0	0	112.1	S213 V217	S213-G215 PolarHBondContact O-N 3.5Å; G215-V217 PolarHBondContact O-N 3.08Å
216	F	68.7	Low	72.7	Confident	119 Å²	119	43.5 Å²	43.5	52%	0.522	24%	0.244	S	C	.	.			trans	-72.8	114.5	171.8	-170.9	-92	0	0	0	110	V176 Q218	V176-F216 HydrophobicContact CB-CZ 4.15Å; V176-F216 HydrophobicContact CG1-CE1 4.31Å; V176-F216 HydrophobicContact CG1-CE2 3.65Å; V176-F216 HydrophobicContact CG1-CZ 3.28Å; V176-F216 HydrophobicContact CG2-CE1 4.41Å; V176-F216 HydrophobicContact CG2-CZ 3.92Å; F216-Q218 HydrophobicContact CE1-CB 4.16Å; F216-Q218 HydrophobicContact CE1-CG 4.48Å
217	V	77.9	Confident	73.3	Confident	10 Å²	10	52.4 Å²	52.4	6%	0.061	28%	0.283	C	S	.	.			trans	-108.4	137.7	173.2	174.8	0	0	0	0	108.2	G177 P178 G215 F235 S236 L262	G177-V217 CarbonylContact C-O 3.32Å; G177-V217 WeakPolarHBondContact CA-O 3.49Å; G177-V217 PolarHBondContact N-O 3.35Å; P178-V217 HydrophobicContact CB-CB 4.38Å; P178-V217 HydrophobicContact CB-CG1 3.9Å; G215-V217 PolarHBondContact O-N 3.08Å; V217-F235 HydrophobicContact CG1-CB 4.12Å; V217-F235 HydrophobicContact CG1-CD1 4.2Å; V217-S236 WeakPolarHBondContact CG1-O 3.42Å; V217-L262 HydrophobicContact CG2-CD2 3.79Å
218	Q	84.2	Confident	74	Confident	9 Å²	9	52.9 Å²	52.9	4%	0.042	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-137.3	158.7	174.4	64.2	179.1	4.5	0	0	110.1	N159 G177 F216 S236 K389	N159-Q218 PolarHBondContact ND2-OE1 3.26Å; N159-Q218 VanDerWaalsContact ND2-OE1 3.07Å; G177-Q218 WeakPolarHBondContact O-CA 3.36Å; F216-Q218 HydrophobicContact CE1-CB 4.16Å; F216-Q218 HydrophobicContact CE1-CG 4.48Å; Q218-S236 PolarHBondContact N-OG 2.98Å; Q218-S236 PolarHBondContact O-N 3.31Å; Q218-S236 PolarHBondContact O-OG 2.84Å; Q218-K389 VanDerWaalsContact NE2-CG 3.3Å
219	V	89	Confident	75.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129	171.8	-174.3	0	0	0	0	109.4	N159 A160 T175 L179 V180 V222 S234 F235	N159-V219 WeakPolarHBondContact CB-O 3.36Å; A160-V219 HydrophobicContact CB-CG1 4.45Å; T175-V219 PolarHBondContact O-N 3.43Å; T175-V219 VanDerWaalsContact O-N 3.17Å; L179-V219 WeakPolarHBondContact O-CG2 3.42Å; V180-V219 HydrophobicContact CG2-CG1 4.09Å; V180-V219 HydrophobicContact CG2-CG2 3.64Å; V219-V222 HydrophobicContact CG1-CG1 3.7Å; V219-S234 WeakPolarHBondContact CA-O 3.47Å; V219-F235 HydrophobicContact CG2-CD1 3.99Å; V219-F235 HydrophobicContact CG2-CE1 3.65Å; V219-F235 HydrophobicContact CG2-CZ 4.36Å
220	T	90.9	Very high	77.2	Confident	10 Å²	10	54.8 Å²	54.8	6%	0.061	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-30.8	177.7	61.9	0	0	0	0	112.8	S234 N385 K391	T220-S234 PolarHBondContact N-O 3.41Å; T220-S234 WeakPolarHBondContact OG1-CB 3.25Å; T220-S234 PolarHBondContact OG1-O 3.15Å; T220-S234 PolarHBondContact OG1-OG 3.37Å; T220-N385 PolarHBondContact OG1-ND2 3.09Å; T220-K391 PolarHBondContact OG1-O 3.32Å
221	S	94.1	Very high	79.3	Confident	12 Å²	12	46.3 Å²	46.3	8%	0.084	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	148.1	174.4	72	0	0	0	0	111.6	S233 S234 K391 A393	S221-S233 WeakPolarHBondContact O-CA 3.45Å; S221-S234 PolarHBondContact O-N 2.81Å; S221-S234 WeakPolarHBondContact OG-CB 3.37Å; S221-K391 WeakPolarHBondContact CB-O 2.87Å; S221-K391 PolarHBondContact OG-O 3.47Å; S221-A393 PolarHBondContact OG-N 2.93Å; S221-A393 VanDerWaalsContact OG-N 3.11Å
222	V	95.3	Very high	81.6	Confident	7 Å²	7	44.5 Å²	44.5	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.2	165.4	-64.9	0	0	0	0	107.5	A160 D162 A172 V180 V219 L231 L232	A160-V222 HydrophobicContact CB-CG1 4.47Å; A160-V222 HydrophobicContact CB-CG2 3.94Å; D162-V222 HydrophobicContact CB-CG2 4.2Å; A172-V222 HydrophobicContact CB-CB 4.17Å; A172-V222 HydrophobicContact CB-CG2 4.05Å; V180-V222 HydrophobicContact CG1-CG1 4.05Å; V180-V222 HydrophobicContact CG2-CG1 4.22Å; V219-V222 HydrophobicContact CG1-CG1 3.7Å; V222-L231 HydrophobicContact CB-CD1 4.3Å; V222-L232 CarbonylContact C-O 3.39Å; V222-L232 VanDerWaalsContact CA-O 3.28Å; V222-L232 WeakPolarHBondContact CA-O 3.2Å
223	Q	96.2	Very high	83.9	Confident	46 Å²	46	34.8 Å²	34.8	22%	0.215	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	119.9	-178.1	-173.6	65.8	43.9	0	0	109.6	D162 L232 N394 F395	D162-Q223 WeakPolarHBondContact OD2-CA 3.28Å; D162-Q223 PolarHBondContact OD2-NE2 2.76Å; Q223-L232 HydrophobicContact CB-CB 4.46Å; Q223-L232 PolarHBondContact N-O 3.33Å; Q223-L232 PolarHBondContact O-N 2.81Å; Q223-N394 WeakPolarHBondContact CG-OD1 3.38Å; Q223-F395 HydrophobicContact CG-CD2 4.38Å; Q223-F395 WeakPolarHBondContact O-CE2 3.19Å
224	F	96.1	Very high	86.2	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.009	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	147.3	172.2	-78.7	-75.4	0	0	0	111	D162 L170 A172 L182 L231	D162-F224 HydrophobicContact CB-CD2 4.16Å; D162-F224 PolarHBondContact OD2-N 2.79Å; L170-F224 HydrophobicContact CD2-CE1 3.94Å; L170-F224 HydrophobicContact CD2-CZ 4.01Å; L170-F224 HydrophobicContact CG-CE1 4.43Å; L170-F224 HydrophobicContact CG-CZ 3.99Å; A172-F224 HydrophobicContact CB-CD2 4.34Å; A172-F224 HydrophobicContact CB-CE2 3.49Å; A172-F224 VanDerWaalsContact CB-CE2 3.49Å; A172-F224 HydrophobicContact CB-CZ 3.68Å; L182-F224 HydrophobicContact CD2-CE1 4.2Å; L182-F224 HydrophobicContact CD2-CZ 3.78Å; F224-L231 HydrophobicContact CD1-CB 4.26Å; F224-L231 HydrophobicContact CD1-CD1 3.88Å; F224-L231 HydrophobicContact CD2-CD1 4.11Å; F224-L231 HydrophobicContact CE1-CB 4.28Å; F224-L231 HydrophobicContact CE1-CD1 3.98Å; F224-L231 HydrophobicContact CE2-CD1 4.22Å; F224-L231 HydrophobicContact CG-CD1 3.95Å; F224-L231 HydrophobicContact CZ-CD1 4.15Å
225	A	93.8	Very high	88.1	Confident	5 Å²	5	28 Å²	28	4%	0.041	15%	0.147	C	C	.	.			trans	-64.4	132.3	170.7	0	0	0	0	0	109.9	F227 G228 E230 F395	A225-F227 PolarHBondContact O-N 2.91Å; A225-G228 PolarHBondContact O-N 3.12Å; A225-E230 HydrophobicContact CB-CB 4.01Å; A225-E230 PolarHBondContact N-O 2.8Å; A225-F395 VanDerWaalsContact CA-CE2 3.4Å; A225-F395 HydrophobicContact CB-CD2 4.27Å; A225-F395 HydrophobicContact CB-CE1 4.11Å; A225-F395 HydrophobicContact CB-CE2 3.79Å; A225-F395 HydrophobicContact CB-CZ 3.68Å; A225-F395 VanDerWaalsContact N-CE2 3.27Å
226	P	86.8	Confident	89.5	Confident	65 Å²	65	27.6 Å²	27.6	42%	0.422	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.2	-177.4	-28.7	34.7	0	0	0	115.2	T165	T165-P226 VanDerWaalsContact OG1-C 3.3Å; T165-P226 PolarHBondContact OG1-O 3.07Å
227	F	81.8	Confident	90	Very high	193 Å²	193	26.7 Å²	26.7	85%	0.846	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.9	6.8	-177.1	-52.3	-67.9	0	0	0	113.8	A225	A225-F227 PolarHBondContact O-N 2.91Å
228	G	85.5	Confident	90.2	Very high	15 Å²	15	26.7 Å²	26.7	16%	0.155	14%	0.136	C	C	.	.	S	Bend	trans	-117.7	173.4	-172.6	0	0	0	0	0	113	A225 E230	A225-G228 PolarHBondContact O-N 3.12Å; G228-E230 VanDerWaalsContact C-N 3.26Å
229	D	90.7	Very high	90.3	Very high	32 Å²	32	27 Å²	27	17%	0.171	14%	0.138	C	C	.	.	S	Bend	trans	-100.2	34.5	166.1	-60.4	-66.1	0	0	0	109.7	K166 R167 S245 I246	K166-D229 WeakPolarHBondContact CD-OD1 3.37Å; K166-D229 IonicContact NZ-OD1 2.95Å; K166-D229 IonicContact NZ-OD2 3.28Å; K166-D229 PolarHBondContact NZ-OD2 3.1Å; R167-D229 IonicContact CZ-OD1 2.66Å; R167-D229 IonicContact NE-OD1 3.6Å; R167-D229 PolarHBondContact NE-OD1 3.09Å; R167-D229 IonicContact NH2-OD1 3.83Å; D229-S245 WeakPolarHBondContact O-CB 3.26Å; D229-S245 PolarHBondContact O-N 3.15Å; D229-S245 PolarHBondContact O-OG 2.84Å; D229-I246 HydrophobicContact CB-CD1 3.57Å; D229-I246 HydrophobicContact CB-CG1 3.95Å; D229-I246 WeakPolarHBondContact OD1-CD1 3.43Å
230	E	94.4	Very high	90.4	Very high	44 Å²	44	27 Å²	27	21%	0.206	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	147	-178.2	-59.5	172.4	119.6	0	0	109.8	A225 G228 L242 L243 I377 F395 K415	A225-E230 HydrophobicContact CB-CB 4.01Å; A225-E230 PolarHBondContact N-O 2.8Å; G228-E230 VanDerWaalsContact C-N 3.26Å; E230-L242 HydrophobicContact CB-CD1 3.88Å; E230-L243 CarbonylContact C-O 3.47Å; E230-L243 VanDerWaalsContact CA-O 3.25Å; E230-L243 WeakPolarHBondContact CA-O 3.35Å; E230-I377 HydrophobicContact CG-CD1 4.04Å; E230-F395 HydrophobicContact CB-CZ 4.26Å; E230-K415 WeakPolarHBondContact OE1-CE 3.27Å; E230-K415 IonicContact OE1-NZ 3.12Å; E230-K415 PolarHBondContact OE1-NZ 3.29Å; E230-K415 WeakPolarHBondContact OE2-CE 3.45Å; E230-K415 IonicContact OE2-NZ 2.81Å; E230-K415 PolarHBondContact OE2-NZ 2.87Å
231	L	95.3	Very high	90.5	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.2	-179.7	177.9	71	0	0	0	109.4	A172 V180 L182 V222 F224 L243	A172-L231 HydrophobicContact CB-CD1 3.65Å; A172-L231 HydrophobicContact CB-CD2 3.76Å; A172-L231 HydrophobicContact CB-CG 4.4Å; V180-L231 HydrophobicContact CG1-CD2 3.81Å; L182-L231 HydrophobicContact CD2-CD2 3.93Å; V222-L231 HydrophobicContact CB-CD1 4.3Å; F224-L231 HydrophobicContact CD1-CB 4.26Å; F224-L231 HydrophobicContact CD1-CD1 3.88Å; F224-L231 HydrophobicContact CD2-CD1 4.11Å; F224-L231 HydrophobicContact CE1-CB 4.28Å; F224-L231 HydrophobicContact CE1-CD1 3.98Å; F224-L231 HydrophobicContact CE2-CD1 4.22Å; F224-L231 HydrophobicContact CG-CD1 3.95Å; F224-L231 HydrophobicContact CZ-CD1 4.15Å; L231-L243 HydrophobicContact CB-CB 4.3Å; L231-L243 HydrophobicContact CD2-CD1 4.21Å; L231-L243 PolarHBondContact N-O 3.26Å; L231-L243 WeakPolarHBondContact O-CB 3.39Å; L231-L243 PolarHBondContact O-N 3.07Å
232	L	96.1	Very high	90.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	137.2	164.9	-75.5	171.1	0	0	0	109.6	V222 Q223 I240 Y241 L242 Y380 F395 V401	V222-L232 CarbonylContact C-O 3.39Å; V222-L232 VanDerWaalsContact CA-O 3.28Å; V222-L232 WeakPolarHBondContact CA-O 3.2Å; Q223-L232 HydrophobicContact CB-CB 4.46Å; Q223-L232 PolarHBondContact N-O 3.33Å; Q223-L232 PolarHBondContact O-N 2.81Å; L232-I240 HydrophobicContact CD2-CG2 3.85Å; L232-Y241 WeakPolarHBondContact CA-O 3.39Å; L232-L242 HydrophobicContact CD2-CB 4.27Å; L232-L242 HydrophobicContact CD2-CD1 3.94Å; L232-L242 HydrophobicContact CG-CD1 4.29Å; L232-Y380 HydrophobicContact CD2-CD2 4.41Å; L232-Y380 HydrophobicContact CD2-CE2 3.82Å; L232-F395 HydrophobicContact CB-CE2 4.16Å; L232-F395 HydrophobicContact CB-CZ 4.32Å; L232-F395 HydrophobicContact CD1-CD1 3.97Å; L232-F395 HydrophobicContact CD1-CD2 3.66Å; L232-F395 HydrophobicContact CD1-CE1 3.95Å; L232-F395 HydrophobicContact CD1-CE2 3.63Å; L232-F395 HydrophobicContact CD1-CG 3.85Å; L232-F395 HydrophobicContact CD1-CZ 3.81Å; L232-F395 HydrophobicContact CD2-CZ 4.42Å; L232-F395 HydrophobicContact CG-CD1 4.42Å; L232-F395 HydrophobicContact CG-CD2 4.2Å; L232-F395 HydrophobicContact CG-CE1 3.88Å; L232-F395 HydrophobicContact CG-CE2 3.62Å; L232-F395 HydrophobicContact CG-CZ 3.47Å; L232-F395 VanDerWaalsContact CG-CZ 3.47Å; L232-V401 HydrophobicContact CD1-CG1 3.83Å; L232-V401 HydrophobicContact CD1-CG2 4.13Å; L232-V401 HydrophobicContact CD2-CG1 3.9Å; L232-V401 HydrophobicContact CD2-CG2 3.95Å
233	S	93.5	Very high	90.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	126.1	173	52.4	0	0	0	0	109.7	S221 F235 I240 Y241 L243	S221-S233 WeakPolarHBondContact O-CA 3.45Å; S233-F235 WeakPolarHBondContact OG-CE2 3.4Å; S233-I240 CarbonylContact O-C 3.59Å; S233-I240 WeakPolarHBondContact O-CA 3.46Å; S233-Y241 PolarHBondContact N-O 3.09Å; S233-Y241 PolarHBondContact O-N 2.7Å; S233-Y241 PolarHBondContact OG-O 3.05Å; S233-L243 WeakPolarHBondContact OG-CD1 3.44Å
234	S	92.4	Very high	90.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.9	178.3	-172.6	0	0	0	0	110.1	V219 T220 S221 N385	V219-S234 WeakPolarHBondContact CA-O 3.47Å; T220-S234 PolarHBondContact N-O 3.41Å; T220-S234 WeakPolarHBondContact OG1-CB 3.25Å; T220-S234 PolarHBondContact OG1-O 3.15Å; T220-S234 PolarHBondContact OG1-OG 3.37Å; S221-S234 PolarHBondContact O-N 2.81Å; S221-S234 WeakPolarHBondContact OG-CB 3.37Å; S234-N385 PolarHBondContact OG-ND2 2.88Å
235	F	89.1	Confident	89.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.2	-176.7	-63.1	-96	0	0	0	111	P178 V180 I207 V217 V219 S233 R237 G238 D239 Y241 N385	P178-F235 HydrophobicContact CB-CD1 4.22Å; P178-F235 HydrophobicContact CB-CE1 4.22Å; V180-F235 HydrophobicContact CG2-CE1 4.12Å; V180-F235 HydrophobicContact CG2-CZ 3.66Å; I207-F235 HydrophobicContact CG2-CE1 4.34Å; I207-F235 HydrophobicContact CG2-CE2 4.44Å; I207-F235 HydrophobicContact CG2-CZ 3.64Å; V217-F235 HydrophobicContact CG1-CB 4.12Å; V217-F235 HydrophobicContact CG1-CD1 4.2Å; V219-F235 HydrophobicContact CG2-CD1 3.99Å; V219-F235 HydrophobicContact CG2-CE1 3.65Å; V219-F235 HydrophobicContact CG2-CZ 4.36Å; S233-F235 WeakPolarHBondContact OG-CE2 3.4Å; F235-R237 PolarHBondContact O-N 3.4Å; F235-G238 PolarHBondContact O-N 2.97Å; F235-D239 PolarHBondContact N-O 2.85Å; F235-Y241 AromaticContact CD2-CD2 3.63Å; F235-Y241 HydrophobicContact CD2-CD2 3.63Å; F235-Y241 AromaticContact CD2-CE2 3.99Å; F235-Y241 HydrophobicContact CD2-CE2 3.99Å; F235-Y241 AromaticContact CE2-CD2 3.6Å; F235-Y241 HydrophobicContact CE2-CD2 3.6Å; F235-Y241 HydrophobicContact CE2-CE2 4.27Å; F235-Y241 HydrophobicContact CE2-CG 4.49Å; F235-N385 PolarHBondContact O-ND2 3.33Å; F235-N385 VanDerWaalsContact O-ND2 3.14Å
236	S	86.9	Confident	89.2	Confident	9 Å²	9	28.2 Å²	28.2	6%	0.063	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	136.8	172.9	68.7	0	0	0	0	110.1	V217 Q218 G238 N385	V217-S236 WeakPolarHBondContact CG1-O 3.42Å; Q218-S236 PolarHBondContact N-OG 2.98Å; Q218-S236 PolarHBondContact O-N 3.31Å; Q218-S236 PolarHBondContact O-OG 2.84Å; S236-G238 PolarHBondContact O-N 2.77Å; S236-G238 VanDerWaalsContact O-N 3.13Å; S236-N385 CarbonylContact C-O 3.57Å; S236-N385 WeakPolarHBondContact CA-O 2.94Å
237	R	79.5	Confident	89	Confident	101 Å²	101	32.2 Å²	32.2	38%	0.381	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	18.3	-176.6	-50.3	174.9	175.9	-172.4	-0.8	113.2	F235 N385 C386	F235-R237 PolarHBondContact O-N 3.4Å; R237-N385 PolarHBondContact N-O 2.8Å; R237-C386 HydrophobicContact CG-CB 3.78Å
238	G	81.7	Confident	88.9	Confident	10 Å²	10	26.2 Å²	26.2	10%	0.103	13%	0.129	C	C	.	.	S	Bend	trans	-134.9	-164.7	178.3	0	0	0	0	0	110.5	F235 S236	F235-G238 PolarHBondContact O-N 2.97Å; S236-G238 PolarHBondContact O-N 2.77Å; S236-G238 VanDerWaalsContact O-N 3.13Å
239	D	87	Confident	88.2	Confident	16 Å²	16	28 Å²	28	9%	0.086	14%	0.137	C	C	.	.			trans	-97.2	179.6	-179	-64.1	-37.1	0	0	0	111.6	F235 Y241 Q261 R379 Y380 T381	F235-D239 PolarHBondContact N-O 2.85Å; D239-Y241 HydrophobicContact CB-CE2 3.86Å; D239-Q261 PolarHBondContact OD2-NE2 3.06Å; D239-R379 HydrophobicContact CB-CG 3.86Å; D239-R379 VanDerWaalsContact OD2-CD 3.27Å; D239-R379 WeakPolarHBondContact OD2-CD 3.21Å; D239-R379 IonicContact OD2-CZ 3.26Å; D239-R379 IonicContact OD2-NE 2.65Å; D239-R379 PolarHBondContact OD2-NE 2.7Å; D239-Y380 WeakPolarHBondContact CB-O 3.3Å; D239-T381 WeakPolarHBondContact OD2-CG2 3.26Å
240	I	92.4	Very high	87	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	137.3	166.9	-60.9	151.8	0	0	0	108.2	L232 S233 R379 Y380 H383 A393 W413	L232-I240 HydrophobicContact CD2-CG2 3.85Å; S233-I240 CarbonylContact O-C 3.59Å; S233-I240 WeakPolarHBondContact O-CA 3.46Å; I240-R379 WeakPolarHBondContact O-CA 3.21Å; I240-Y380 HydrophobicContact CB-CD2 4.1Å; I240-Y380 HydrophobicContact CG2-CD2 3.89Å; I240-Y380 PolarHBondContact N-O 3.43Å; I240-Y380 PolarHBondContact O-N 3.02Å; I240-H383 VanDerWaalsContact CD1-CE1 3.46Å; I240-H383 WeakPolarHBondContact CD1-CE1 3.41Å; I240-H383 WeakPolarHBondContact CD1-NE2 3.09Å; I240-A393 HydrophobicContact CD1-CB 3.77Å; I240-A393 HydrophobicContact CG1-CB 3.94Å; I240-A393 HydrophobicContact CG2-CB 3.86Å; I240-W413 HydrophobicContact CD1-CH2 3.96Å; I240-W413 HydrophobicContact CD1-CZ3 4.04Å
241	Y	92.6	Very high	85.1	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.9	179.6	-63.9	-88	0	0	0	110.9	L232 S233 F235 D239 F255 L257 V376 R379	L232-Y241 WeakPolarHBondContact CA-O 3.39Å; S233-Y241 PolarHBondContact N-O 3.09Å; S233-Y241 PolarHBondContact O-N 2.7Å; S233-Y241 PolarHBondContact OG-O 3.05Å; F235-Y241 AromaticContact CD2-CD2 3.63Å; F235-Y241 HydrophobicContact CD2-CD2 3.63Å; F235-Y241 AromaticContact CD2-CE2 3.99Å; F235-Y241 HydrophobicContact CD2-CE2 3.99Å; F235-Y241 AromaticContact CE2-CD2 3.6Å; F235-Y241 HydrophobicContact CE2-CD2 3.6Å; F235-Y241 HydrophobicContact CE2-CE2 4.27Å; F235-Y241 HydrophobicContact CE2-CG 4.49Å; D239-Y241 HydrophobicContact CB-CE2 3.86Å; Y241-F255 AromaticContact CD1-CE1 3.82Å; Y241-F255 HydrophobicContact CD1-CE1 3.82Å; Y241-F255 HydrophobicContact CD1-CZ 4.08Å; Y241-F255 HydrophobicContact CE1-CD1 4.25Å; Y241-F255 AromaticContact CE1-CE1 3.21Å; Y241-F255 HydrophobicContact CE1-CE1 3.21Å; Y241-F255 AromaticContact CE1-CZ 3.57Å; Y241-F255 HydrophobicContact CE1-CZ 3.57Å; Y241-F255 AromaticContact CZ-CE1 3.87Å; Y241-L257 HydrophobicContact CD2-CD2 4.39Å; Y241-L257 HydrophobicContact CE1-CD2 4.38Å; Y241-L257 HydrophobicContact CE2-CD2 3.35Å; Y241-L257 WeakPolarHBondContact OH-CD2 3.47Å; Y241-V376 HydrophobicContact CD1-CG1 3.91Å; Y241-R379 HydrophobicContact CD1-CB 4.05Å; Y241-R379 HydrophobicContact CD1-CG 3.94Å; Y241-R379 HydrophobicContact CE1-CB 3.91Å; Y241-R379 VanDerWaalsContact CE1-CD 3.47Å; Y241-R379 HydrophobicContact CE1-CG 3.43Å; Y241-R379 VanDerWaalsContact CE1-CG 3.43Å
242	L	94.2	Very high	82.9	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.7	168.3	-176.9	66.4	0	0	0	108.9	E230 L232 I377 N378 Y380 F395 K415	E230-L242 HydrophobicContact CB-CD1 3.88Å; L232-L242 HydrophobicContact CD2-CB 4.27Å; L232-L242 HydrophobicContact CD2-CD1 3.94Å; L232-L242 HydrophobicContact CG-CD1 4.29Å; L242-I377 HydrophobicContact CB-CB 4.39Å; L242-I377 HydrophobicContact CD2-CB 4.03Å; L242-I377 HydrophobicContact CD2-CD1 4.41Å; L242-I377 HydrophobicContact CD2-CG2 3.85Å; L242-I377 HydrophobicContact CG-CB 4.06Å; L242-I377 HydrophobicContact CG-CD1 4.25Å; L242-I377 HydrophobicContact CG-CG2 4.44Å; L242-I377 PolarHBondContact O-N 2.77Å; L242-N378 HydrophobicContact CB-CB 4.14Å; L242-N378 HydrophobicContact CD2-CB 4.43Å; L242-N378 PolarHBondContact N-O 2.98Å; L242-N378 PolarHBondContact O-N 3.35Å; L242-Y380 HydrophobicContact CB-CE2 3.86Å; L242-Y380 WeakPolarHBondContact CD2-OH 3.37Å; L242-F395 HydrophobicContact CD1-CE1 3.65Å; L242-F395 HydrophobicContact CD1-CZ 3.75Å; L242-K415 HydrophobicContact CD2-CG 3.93Å
243	L	92.3	Very high	80.5	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	145.2	-173.4	-46.2	179.6	0	0	0	110.1	I207 E230 L231 S233 P374 V375 V376	I207-L243 HydrophobicContact CD1-CD1 3.59Å; I207-L243 HydrophobicContact CD1-CD2 3.07Å; I207-L243 HydrophobicContact CD1-CG 3.89Å; E230-L243 CarbonylContact C-O 3.47Å; E230-L243 VanDerWaalsContact CA-O 3.25Å; E230-L243 WeakPolarHBondContact CA-O 3.35Å; L231-L243 HydrophobicContact CB-CB 4.3Å; L231-L243 HydrophobicContact CD2-CD1 4.21Å; L231-L243 PolarHBondContact N-O 3.26Å; L231-L243 WeakPolarHBondContact O-CB 3.39Å; L231-L243 PolarHBondContact O-N 3.07Å; S233-L243 WeakPolarHBondContact OG-CD1 3.44Å; L243-P374 HydrophobicContact CD1-CG 4.46Å; L243-V375 WeakPolarHBondContact CA-O 3.23Å; L243-V376 HydrophobicContact CD2-CB 4.45Å; L243-V376 HydrophobicContact CD2-CG2 3.85Å
244	D	90	Very high	78.3	Confident	15 Å²	15	46.2 Å²	46.2	8%	0.08	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.3	162.3	-160.9	-59.1	0	0	0	109.1	I246 R247 P374 V375 I377	D244-I246 VanDerWaalsContact C-N 3.25Å; D244-I246 PolarHBondContact O-N 3.44Å; D244-I246 PolarHBondContact OD1-N 2.92Å; D244-R247 HydrophobicContact CB-CB 4.12Å; D244-R247 PolarHBondContact OD1-N 3.11Å; D244-R247 IonicContact OD2-CZ 3.74Å; D244-R247 IonicContact OD2-NE 3.87Å; D244-R247 PolarHBondContact OD2-NE 3.06Å; D244-R247 IonicContact OD2-NH2 3.93Å; D244-R247 PolarHBondContact OD2-NH2 3.41Å; D244-P374 VanDerWaalsContact O-CB 3.27Å; D244-P374 WeakPolarHBondContact O-CB 3.49Å; D244-V375 HydrophobicContact CB-CB 4.04Å; D244-V375 PolarHBondContact N-O 2.95Å; D244-I377 HydrophobicContact CB-CD1 3.95Å; D244-I377 HydrophobicContact CB-CG1 4.2Å
245	S	86.4	Confident	76.3	Confident	9 Å²	9	49.7 Å²	49.7	6%	0.063	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-0.9	-176.8	75.6	0	0	0	0	113.7	D229	D229-S245 WeakPolarHBondContact O-CB 3.26Å; D229-S245 PolarHBondContact O-N 3.15Å; D229-S245 PolarHBondContact O-OG 2.84Å
246	I	84.6	Confident	74.4	Confident	79 Å²	79	53.1 Å²	53.1	41%	0.405	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-50.2	179.3	-60.9	176	0	0	0	110.8	D229 D244 T248	D229-I246 HydrophobicContact CB-CD1 3.57Å; D229-I246 HydrophobicContact CB-CG1 3.95Å; D229-I246 WeakPolarHBondContact OD1-CD1 3.43Å; D244-I246 VanDerWaalsContact C-N 3.25Å; D244-I246 PolarHBondContact O-N 3.44Å; D244-I246 PolarHBondContact OD1-N 2.92Å; I246-T248 PolarHBondContact O-N 3.01Å
247	R	82.9	Confident	72.7	Confident	148 Å²	148	53.4 Å²	53.4	56%	0.558	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	123.9	-177.9	-68.2	-172.3	-66.3	161.6	5.1	109	D244 V375	D244-R247 HydrophobicContact CB-CB 4.12Å; D244-R247 PolarHBondContact OD1-N 3.11Å; D244-R247 IonicContact OD2-CZ 3.74Å; D244-R247 IonicContact OD2-NE 3.87Å; D244-R247 PolarHBondContact OD2-NE 3.06Å; D244-R247 IonicContact OD2-NH2 3.93Å; D244-R247 PolarHBondContact OD2-NH2 3.41Å; R247-V375 HydrophobicContact CB-CG2 3.93Å; R247-V375 WeakPolarHBondContact O-CG2 3.32Å; R247-V375 PolarHBondContact O-N 2.97Å
248	T	79	Confident	71	Confident	67 Å²	67	50.5 Å²	50.5	41%	0.411	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	155.2	178.1	54.7	0	0	0	0	110.2	I246 P372 Q373	I246-T248 PolarHBondContact O-N 3.01Å; T248-P372 HydrophobicContact CG2-CB 3.63Å; T248-P372 WeakPolarHBondContact OG1-CB 3.46Å; T248-Q373 CarbonylContact C-O 3.51Å; T248-Q373 WeakPolarHBondContact CA-O 3.5Å; T248-Q373 WeakPolarHBondContact CB-O 3.49Å
249	T	72.5	Confident	69.1	Low	52 Å²	52	53 Å²	53	32%	0.319	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	144.2	174.1	74.8	0	0	0	0	108.9	A251 Q373 V375	T249-A251 VanDerWaalsContact C-N 3.27Å; T249-Q373 PolarHBondContact N-O 2.9Å; T249-Q373 PolarHBondContact O-N 2.71Å; T249-V375 HydrophobicContact CG2-CB 4.44Å; T249-V375 HydrophobicContact CG2-CG2 3.44Å; T249-V375 VanDerWaalsContact CG2-CG2 3.44Å
250	S	64.8	Low	66.9	Low	128 Å²	128	60.5 Å²	60.5	90%	0.895	36%	0.357	S	S	*	.			trans	-89.6	6.7	170	49.1	0	0	0	0	112.2	S252	S250-S252 PolarHBondContact O-N 3.27Å
251	A	54.1	Low	64.6	Low	52 Å²	52	62.5 Å²	62.5	43%	0.43	37%	0.366	S	S	.	.			trans	-59.7	115.7	179.2	0	0	0	0	0	108.8	T249 D253	T249-A251 VanDerWaalsContact C-N 3.27Å; A251-D253 PolarHBondContact O-N 3.01Å
252	S	50.2	Low	62.2	Low	116 Å²	116	63.8 Å²	63.8	81%	0.811	37%	0.373	S	S	*	.	S	Bend	trans	-58.9	-23.7	175.3	48.8	0	0	0	0	112.5	S250 G254	S250-S252 PolarHBondContact O-N 3.27Å; S252-G254 PolarHBondContact O-N 3.07Å
253	D	44.8	Very low	59.4	Low	144 Å²	144	71.1 Å²	71.1	77%	0.77	41%	0.407	S	S	*	.	S	Bend	trans	-78.5	76.3	169	-68.8	-21.1	0	0	0	108.2	A251 F255	A251-D253 PolarHBondContact O-N 3.01Å; D253-F255 PolarHBondContact O-N 2.84Å
254	G	47.2	Very low	56.7	Low	21 Å²	21	75.4 Å²	75.4	22%	0.216	43%	0.433	C	S	.	.			trans	-51.1	143.9	170.6	0	0	0	0	0	110.8	S252 S256	S252-G254 PolarHBondContact O-N 3.07Å; G254-S256 PolarHBondContact O-N 3.43Å
255	F	49.8	Very low	54.2	Low	72 Å²	72	79.1 Å²	79.1	32%	0.316	46%	0.458	S	S	.	.			trans	-56.5	108.3	-174.2	-171.7	-85.7	0	0	0	110.2	Y241 D253 V376	Y241-F255 AromaticContact CD1-CE1 3.82Å; Y241-F255 HydrophobicContact CD1-CE1 3.82Å; Y241-F255 HydrophobicContact CD1-CZ 4.08Å; Y241-F255 HydrophobicContact CE1-CD1 4.25Å; Y241-F255 AromaticContact CE1-CE1 3.21Å; Y241-F255 HydrophobicContact CE1-CE1 3.21Å; Y241-F255 AromaticContact CE1-CZ 3.57Å; Y241-F255 HydrophobicContact CE1-CZ 3.57Å; Y241-F255 AromaticContact CZ-CE1 3.87Å; D253-F255 PolarHBondContact O-N 2.84Å; F255-V376 HydrophobicContact CB-CG2 3.95Å; F255-V376 HydrophobicContact CD1-CG2 4.02Å; F255-V376 HydrophobicContact CD2-CB 3.8Å; F255-V376 HydrophobicContact CD2-CG1 4.25Å; F255-V376 HydrophobicContact CD2-CG2 3.5Å; F255-V376 HydrophobicContact CE1-CG2 4.45Å; F255-V376 HydrophobicContact CE2-CB 3.87Å; F255-V376 HydrophobicContact CE2-CG1 3.83Å; F255-V376 HydrophobicContact CE2-CG2 3.95Å; F255-V376 HydrophobicContact CG-CB 4.34Å; F255-V376 HydrophobicContact CG-CG2 3.54Å; F255-V376 HydrophobicContact CZ-CB 4.49Å; F255-V376 HydrophobicContact CZ-CG1 4.04Å; F255-V376 HydrophobicContact CZ-CG2 4.4Å
256	S	50.1	Low	51.9	Low	73 Å²	73	87 Å²	87	51%	0.51	49%	0.488	S	S	.	.			trans	-88.7	115.9	-178.3	175.2	0	0	0	0	109.4	N209 G254 S258	N209-S256 PolarHBondContact ND2-OG 3.01Å; N209-S256 PolarHBondContact OD1-OG 3.25Å; G254-S256 PolarHBondContact O-N 3.43Å; S256-S258 PolarHBondContact O-N 2.87Å
257	L	51.3	Low	49.7	Very low	14 Å²	14	89.6 Å²	89.6	7%	0.073	50%	0.501	C	S	.	.			trans	-50.8	130.8	160.2	-54.9	172.2	0	0	0	108	P178 N209 Y241 A259	P178-L257 HydrophobicContact CB-CD1 4.03Å; N209-L257 HydrophobicContact CB-CB 3.9Å; N209-L257 HydrophobicContact CB-CD1 4.02Å; N209-L257 HydrophobicContact CB-CG 3.8Å; N209-L257 PolarHBondContact ND2-N 3.12Å; N209-L257 PolarHBondContact ND2-O 3.34Å; Y241-L257 HydrophobicContact CD2-CD2 4.39Å; Y241-L257 HydrophobicContact CE1-CD2 4.38Å; Y241-L257 HydrophobicContact CE2-CD2 3.35Å; Y241-L257 WeakPolarHBondContact OH-CD2 3.47Å; L257-A259 PolarHBondContact O-N 3.11Å
258	S	44.2	Very low	47.6	Very low	41 Å²	41	87.5 Å²	87.5	29%	0.287	50%	0.497	S	S	.	.			trans	-70.4	136.3	-177.5	54.3	0	0	0	0	110.4	S256 E260 Q261	S256-S258 PolarHBondContact O-N 2.87Å; S258-E260 PolarHBondContact O-N 2.92Å; S258-Q261 VanDerWaalsContact O-CB 3.23Å; S258-Q261 WeakPolarHBondContact O-CB 3.43Å; S258-Q261 WeakPolarHBondContact O-CG 3.5Å; S258-Q261 PolarHBondContact O-N 3.14Å; S258-Q261 PolarHBondContact O-OE1 3.28Å; S258-Q261 VanDerWaalsContact OG-CG 3.25Å; S258-Q261 WeakPolarHBondContact OG-CG 3.49Å; S258-Q261 PolarHBondContact OG-NE2 3.38Å; S258-Q261 PolarHBondContact OG-OE1 3.45Å
259	A	40.1	Very low	45.5	Very low	63 Å²	63	93.2 Å²	93.2	52%	0.521	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-61.5	-25.5	-178.3	0	0	0	0	0	113.1	L257 Q261 L262	L257-A259 PolarHBondContact O-N 3.11Å; A259-Q261 PolarHBondContact O-N 2.79Å; A259-Q261 VanDerWaalsContact O-N 3.16Å; A259-L262 PolarHBondContact O-N 2.71Å
260	E	41.7	Very low	44.1	Very low	173 Å²	173	94.3 Å²	94.3	81%	0.808	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-60.8	-19.1	173.7	-68.9	179.3	163.4	0	0	113	S258 L262	S258-E260 PolarHBondContact O-N 2.92Å; E260-L262 VanDerWaalsContact C-N 3.32Å; E260-L262 PolarHBondContact O-N 3.45Å
261	Q	44.9	Very low	43	Very low	42 Å²	42	94.8 Å²	94.8	20%	0.196	51%	0.507	C	S	.	.	G	3₁₀ helix	trans	-77.9	-13	179.7	-65.3	166.8	-34.9	0	0	113.6	D239 S258 A259 Q263	D239-Q261 PolarHBondContact OD2-NE2 3.06Å; S258-Q261 VanDerWaalsContact O-CB 3.23Å; S258-Q261 WeakPolarHBondContact O-CB 3.43Å; S258-Q261 WeakPolarHBondContact O-CG 3.5Å; S258-Q261 PolarHBondContact O-N 3.14Å; S258-Q261 PolarHBondContact O-OE1 3.28Å; S258-Q261 VanDerWaalsContact OG-CG 3.25Å; S258-Q261 WeakPolarHBondContact OG-CG 3.49Å; S258-Q261 PolarHBondContact OG-NE2 3.38Å; S258-Q261 PolarHBondContact OG-OE1 3.45Å; A259-Q261 PolarHBondContact O-N 2.79Å; A259-Q261 VanDerWaalsContact O-N 3.16Å; Q261-Q263 VanDerWaalsContact C-N 3.3Å; Q261-Q263 PolarHBondContact O-N 3.07Å
262	L	40.4	Very low	42.2	Very low	27 Å²	27	98.8 Å²	98.8	14%	0.141	53%	0.529	C	S	.	.	G	3₁₀ helix	trans	-93.9	26.3	-174	-77.3	136.9	0	0	0	113.6	S211 S213 V217 A259 E260 T264	S211-L262 WeakPolarHBondContact OG-CD1 3.41Å; S211-L262 WeakPolarHBondContact OG-CD2 3.48Å; S213-L262 WeakPolarHBondContact OG-CB 3.39Å; S213-L262 WeakPolarHBondContact OG-CD1 3.36Å; V217-L262 HydrophobicContact CG2-CD2 3.79Å; A259-L262 PolarHBondContact O-N 2.71Å; E260-L262 VanDerWaalsContact C-N 3.32Å; E260-L262 PolarHBondContact O-N 3.45Å; L262-T264 PolarHBondContact O-N 3.24Å; L262-T264 VanDerWaalsContact O-N 3.09Å
263	Q	36.1	Very low	42	Very low	156 Å²	156	96 Å²	96	73%	0.729	52%	0.519	S	S	*	.			trans	-47	122.2	177.7	-77.4	-176	-1.1	0	0	110.1	Q261	Q261-Q263 VanDerWaalsContact C-N 3.3Å; Q261-Q263 PolarHBondContact O-N 3.07Å
264	T	35.5	Very low	42.2	Very low	91 Å²	91	91.4 Å²	91.4	56%	0.558	49%	0.494	S	S	*	.			trans	-46.8	139.6	173.9	40.5	0	0	0	0	109.6	L262 Y266	L262-T264 PolarHBondContact O-N 3.24Å; L262-T264 VanDerWaalsContact O-N 3.09Å; T264-Y266 WeakPolarHBondContact O-CD2 3.46Å; T264-Y266 PolarHBondContact O-N 3.29Å; T264-Y266 VanDerWaalsContact OG1-CE2 3.27Å; T264-Y266 WeakPolarHBondContact OG1-CE2 3.49Å
265	P	37.7	Very low	42.4	Very low	93 Å²	93	92.6 Å²	92.6	60%	0.604	49%	0.492	S	S	*	.			trans	-69.1	84.9	-175.3	29.8	-33.7	0	0	0	109.2	I267	P265-I267 PolarHBondContact O-N 3.01Å
266	Y	38.3	Very low	42.3	Very low	176 Å²	176	92.8 Å²	92.8	69%	0.69	50%	0.502	S	S	*	.			trans	-69.3	118.3	160.2	-74.2	-79.9	0	0	0	106.1	T264 H268	T264-Y266 WeakPolarHBondContact O-CD2 3.46Å; T264-Y266 PolarHBondContact O-N 3.29Å; T264-Y266 VanDerWaalsContact OG1-CE2 3.27Å; T264-Y266 WeakPolarHBondContact OG1-CE2 3.49Å; Y266-H268 PolarHBondContact O-N 3Å
267	I	38.3	Very low	42.2	Very low	133 Å²	133	90.6 Å²	90.6	68%	0.682	49%	0.485	S	S	*	.			trans	-66.7	87.9	165.4	-58.8	175.4	0	0	0	105.6	P265 F269	P265-I267 PolarHBondContact O-N 3.01Å; I267-F269 HydrophobicContact CG2-CE2 4.29Å; I267-F269 PolarHBondContact O-N 2.91Å
268	H	38.2	Very low	42.3	Very low	103 Å²	103	90.7 Å²	90.7	48%	0.477	49%	0.486	S	S	.	.			trans	-74.3	113.5	170	-108.6	-95.1	0	0	0	107.9	Y266 R270	Y266-H268 PolarHBondContact O-N 3Å; H268-R270 PolarHBondContact O-N 2.9Å
269	F	34.7	Very low	42.6	Very low	187 Å²	187	89.9 Å²	89.9	82%	0.82	48%	0.484	S	S	*	.			trans	-70.6	115.1	165	-75.4	-83.7	0	0	0	107.6	I267	I267-F269 HydrophobicContact CG2-CE2 4.29Å; I267-F269 PolarHBondContact O-N 2.91Å
270	R	43.3	Very low	43.2	Very low	76 Å²	76	91.5 Å²	91.5	29%	0.287	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-84.5	138	177.8	-76.7	-163.8	-174.8	115.4	-9.6	110.9	H268 D274 D277	H268-R270 PolarHBondContact O-N 2.9Å; R270-D274 WeakPolarHBondContact CD-O 3.02Å; R270-D274 HydrophobicContact CG-CB 4.46Å; R270-D277 IonicContact CZ-OD1 3.74Å; R270-D277 IonicContact CZ-OD2 2.71Å; R270-D277 VanDerWaalsContact CZ-OD2 3.26Å; R270-D277 IonicContact NE-OD1 3.18Å; R270-D277 PolarHBondContact NE-OD1 2.94Å; R270-D277 IonicContact NE-OD2 2.82Å; R270-D277 PolarHBondContact NE-OD2 2.8Å; R270-D277 IonicContact NH2-OD1 2.61Å; R270-D277 PolarHBondContact NH2-OD1 3.44Å; R270-D277 IonicContact NH2-OD2 2.72Å; R270-D277 PolarHBondContact NH2-OD2 3.25Å
271	L	41.1	Very low	43.7	Very low	137 Å²	137	89.3 Å²	89.3	72%	0.717	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-86.8	152.9	155.2	-63.2	171.5	0	0	0	108.9	G273 D274	L271-G273 PolarHBondContact O-N 3.21Å; L271-D274 WeakPolarHBondContact O-CB 3.41Å; L271-D274 PolarHBondContact O-N 2.75Å; L271-D274 VanDerWaalsContact O-N 3.11Å
272	P	38.4	Very low	43.8	Very low	137 Å²	137	87.3 Å²	87.3	89%	0.89	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	124.7	171	-25.1	34.3	0	0	0	110.9
273	G	45	Very low	44.5	Very low	58 Å²	58	88.2 Å²	88.2	60%	0.598	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	3.3	-177.7	0	0	0	0	0	116.4	L271 W275	L271-G273 PolarHBondContact O-N 3.21Å; G273-W275 VanDerWaalsContact O-CD1 3.31Å
274	D	49.6	Very low	45.1	Very low	47 Å²	47	82.8 Å²	82.8	25%	0.251	45%	0.453	S	S	.	.			trans	-86.4	115.6	177.1	-178.5	8.3	0	0	0	112.7	R270 L271 S276	R270-D274 WeakPolarHBondContact CD-O 3.02Å; R270-D274 HydrophobicContact CG-CB 4.46Å; L271-D274 WeakPolarHBondContact O-CB 3.41Å; L271-D274 PolarHBondContact O-N 2.75Å; L271-D274 VanDerWaalsContact O-N 3.11Å; D274-S276 WeakPolarHBondContact OD1-CB 3.2Å; D274-S276 PolarHBondContact OD1-N 2.6Å; D274-S276 PolarHBondContact OD1-OG 3.29Å; D274-S276 PolarHBondContact OD2-OG 3.17Å
275	W	51.7	Low	46.1	Very low	45 Å²	45	81.8 Å²	81.8	17%	0.17	45%	0.449	C	S	.	.			trans	-109.4	8.9	-179.7	-52.5	104.1	0	0	0	114	G273 D277 T278 G279 S282 D283 P284 R409	G273-W275 VanDerWaalsContact O-CD1 3.31Å; W275-D277 PolarHBondContact O-N 2.91Å; W275-T278 PolarHBondContact O-N 3.12Å; W275-G279 PolarHBondContact O-N 2.82Å; W275-G279 VanDerWaalsContact O-N 3.17Å; W275-S282 WeakPolarHBondContact CZ3-O 3.2Å; W275-D283 HydrophobicContact CD2-CB 4.05Å; W275-D283 HydrophobicContact CG-CB 4.12Å; W275-D283 HydrophobicContact CZ2-CB 4.41Å; W275-D283 VanDerWaalsContact NE1-CG 3.3Å; W275-D283 PolarHBondContact NE1-OD2 3.03Å; W275-P284 HydrophobicContact CH2-CG 4.01Å; W275-P284 HydrophobicContact CZ2-CG 4.39Å; W275-R409 VanDerWaalsContact CZ3-NH1 3.33Å
276	S	48.3	Very low	46.7	Very low	76 Å²	76	80.3 Å²	80.3	53%	0.531	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-20.6	-170.6	50.9	0	0	0	0	114.9	D274	D274-S276 WeakPolarHBondContact OD1-CB 3.2Å; D274-S276 PolarHBondContact OD1-N 2.6Å; D274-S276 PolarHBondContact OD1-OG 3.29Å; D274-S276 PolarHBondContact OD2-OG 3.17Å
277	D	48.4	Very low	47.2	Very low	27 Å²	27	75.6 Å²	75.6	14%	0.144	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-18.5	-161.9	84.6	-33.4	0	0	0	112.4	R270 W275 R384	R270-D277 IonicContact CZ-OD1 3.74Å; R270-D277 IonicContact CZ-OD2 2.71Å; R270-D277 VanDerWaalsContact CZ-OD2 3.26Å; R270-D277 IonicContact NE-OD1 3.18Å; R270-D277 PolarHBondContact NE-OD1 2.94Å; R270-D277 IonicContact NE-OD2 2.82Å; R270-D277 PolarHBondContact NE-OD2 2.8Å; R270-D277 IonicContact NH2-OD1 2.61Å; R270-D277 PolarHBondContact NH2-OD1 3.44Å; R270-D277 IonicContact NH2-OD2 2.72Å; R270-D277 PolarHBondContact NH2-OD2 3.25Å; W275-D277 PolarHBondContact O-N 2.91Å; D277-R384 VanDerWaalsContact CG-NE 3.26Å; D277-R384 VanDerWaalsContact O-CZ 3.32Å; D277-R384 PolarHBondContact O-NE 2.77Å; D277-R384 PolarHBondContact O-NH2 3.2Å; D277-R384 IonicContact OD1-NE 3.81Å; D277-R384 IonicContact OD2-CZ 2.79Å; D277-R384 IonicContact OD2-NE 3.02Å; D277-R384 PolarHBondContact OD2-NE 2.93Å; D277-R384 IonicContact OD2-NH1 2.6Å; D277-R384 PolarHBondContact OD2-NH1 3.45Å; D277-R384 IonicContact OD2-NH2 3.54Å
278	T	52.3	Low	47.4	Very low	16 Å²	16	73.9 Å²	73.9	10%	0.098	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-0.7	170.5	53.8	0	0	0	0	112.2	W275 S282 G382 R384	W275-T278 PolarHBondContact O-N 3.12Å; T278-S282 VanDerWaalsContact CB-CB 3.5Å; T278-S282 WeakPolarHBondContact CB-OG 3.47Å; T278-S282 PolarHBondContact O-OG 2.89Å; T278-S282 WeakPolarHBondContact OG1-CB 3.28Å; T278-S282 PolarHBondContact OG1-OG 3.27Å; T278-G382 VanDerWaalsContact CB-O 3.24Å; T278-G382 WeakPolarHBondContact CB-O 3.31Å; T278-G382 WeakPolarHBondContact CG2-O 3.14Å; T278-R384 HydrophobicContact CG2-CG 4.21Å
279	G	50.3	Low	47.4	Very low	24 Å²	24	74 Å²	74	25%	0.247	43%	0.428	C	S	.	.			trans	76.5	161.5	-176	0	0	0	0	0	112.8	W275 H281 S282	W275-G279 PolarHBondContact O-N 2.82Å; W275-G279 VanDerWaalsContact O-N 3.17Å; G279-H281 PolarHBondContact O-N 3.4Å; G279-H281 VanDerWaalsContact O-N 3.13Å; G279-S282 PolarHBondContact O-N 3.43Å
280	P	53	Low	47.2	Very low	98 Å²	98	72.4 Å²	72.4	64%	0.636	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-60.1	-26.4	-177.4	24.7	-34.3	0	0	0	112.7	S282 D283 V286	P280-S282 PolarHBondContact O-N 2.94Å; P280-S282 VanDerWaalsContact O-N 3.17Å; P280-D283 WeakPolarHBondContact O-CB 3.17Å; P280-D283 PolarHBondContact O-N 3.07Å; P280-V286 WeakPolarHBondContact O-CG2 3.32Å
281	H	52.1	Low	47	Very low	126 Å²	126	71.6 Å²	71.6	58%	0.583	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-63.1	-17.4	175.4	-62.9	-58.2	0	0	0	113.7	G279 D283 Y287	G279-H281 PolarHBondContact O-N 3.4Å; G279-H281 VanDerWaalsContact O-N 3.13Å; H281-D283 VanDerWaalsContact C-N 3.31Å; H281-Y287 WeakPolarHBondContact O-CE2 3.42Å; H281-Y287 PolarHBondContact O-OH 2.83Å
282	S	47.1	Very low	46.5	Very low	0 Å²	0	73.4 Å²	73.4	0%	0	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-86.1	-6.3	179.8	-63.1	0	0	0	0	113.8	W275 T278 G279 P280 P284	W275-S282 WeakPolarHBondContact CZ3-O 3.2Å; T278-S282 VanDerWaalsContact CB-CB 3.5Å; T278-S282 WeakPolarHBondContact CB-OG 3.47Å; T278-S282 PolarHBondContact O-OG 2.89Å; T278-S282 WeakPolarHBondContact OG1-CB 3.28Å; T278-S282 PolarHBondContact OG1-OG 3.27Å; G279-S282 PolarHBondContact O-N 3.43Å; P280-S282 PolarHBondContact O-N 2.94Å; P280-S282 VanDerWaalsContact O-N 3.17Å; S282-P284 WeakPolarHBondContact O-CD 3.47Å
283	D	55.8	Low	46.3	Very low	46 Å²	46	70.9 Å²	70.9	25%	0.246	45%	0.447	C	S	.	.			trans	-71.5	118.3	174	-170.9	-17.7	0	0	0	109.9	W275 P280 H281 S285 V286	W275-D283 HydrophobicContact CD2-CB 4.05Å; W275-D283 HydrophobicContact CG-CB 4.12Å; W275-D283 HydrophobicContact CZ2-CB 4.41Å; W275-D283 VanDerWaalsContact NE1-CG 3.3Å; W275-D283 PolarHBondContact NE1-OD2 3.03Å; P280-D283 WeakPolarHBondContact O-CB 3.17Å; P280-D283 PolarHBondContact O-N 3.07Å; H281-D283 VanDerWaalsContact C-N 3.31Å; D283-S285 PolarHBondContact O-N 3.39Å; D283-S285 PolarHBondContact OD1-N 3.02Å; D283-S285 PolarHBondContact OD1-OG 3.27Å; D283-S285 VanDerWaalsContact OD1-OG 3.12Å; D283-S285 PolarHBondContact OD2-OG 3.4Å; D283-V286 HydrophobicContact CB-CG2 4.09Å; D283-V286 WeakPolarHBondContact O-CB 3.42Å; D283-V286 PolarHBondContact O-N 3.44Å
284	P	47.9	Very low	45.6	Very low	42 Å²	42	76.7 Å²	76.7	27%	0.273	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-53.4	-26.5	177.5	-25.9	33.8	0	0	0	113.9	W275 S282 V286 Y287 V423 L487	W275-P284 HydrophobicContact CH2-CG 4.01Å; W275-P284 HydrophobicContact CZ2-CG 4.39Å; S282-P284 WeakPolarHBondContact O-CD 3.47Å; P284-V286 PolarHBondContact O-N 2.99Å; P284-Y287 PolarHBondContact O-N 2.94Å; P284-V423 HydrophobicContact CG-CB 4.46Å; P284-L487 HydrophobicContact CB-CD1 4.38Å
285	S	55.8	Low	44.7	Very low	70 Å²	70	78.3 Å²	78.3	49%	0.49	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-62.4	-28.5	179.5	71.3	0	0	0	0	112.7	D283 Y287 S288	D283-S285 PolarHBondContact O-N 3.39Å; D283-S285 PolarHBondContact OD1-N 3.02Å; D283-S285 PolarHBondContact OD1-OG 3.27Å; D283-S285 VanDerWaalsContact OD1-OG 3.12Å; D283-S285 PolarHBondContact OD2-OG 3.4Å; S285-Y287 PolarHBondContact O-N 3.15Å; S285-S288 PolarHBondContact O-N 2.91Å; S285-S288 PolarHBondContact O-OG 3.26Å
286	V	50.7	Low	43.7	Very low	63 Å²	63	80 Å²	80	38%	0.382	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-65.3	-27.1	-176.5	176.5	0	0	0	0	112.4	P280 D283 P284	P280-V286 WeakPolarHBondContact O-CG2 3.32Å; D283-V286 HydrophobicContact CB-CG2 4.09Å; D283-V286 WeakPolarHBondContact O-CB 3.42Å; D283-V286 PolarHBondContact O-N 3.44Å; P284-V286 PolarHBondContact O-N 2.99Å
287	Y	49.1	Very low	42.9	Very low	77 Å²	77	80.4 Å²	80.4	30%	0.302	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-93.9	1.2	-174.7	-60.1	-64.8	0	0	0	114.4	H281 P284 S285 T289 I420	H281-Y287 WeakPolarHBondContact O-CE2 3.42Å; H281-Y287 PolarHBondContact O-OH 2.83Å; P284-Y287 PolarHBondContact O-N 2.94Å; S285-Y287 PolarHBondContact O-N 3.15Å; Y287-T289 PolarHBondContact O-N 3.36Å; Y287-I420 WeakPolarHBondContact CD1-O 3.16Å; Y287-I420 HydrophobicContact CD2-CG2 4.39Å; Y287-I420 HydrophobicContact CE1-CB 4.34Å; Y287-I420 WeakPolarHBondContact CE1-O 3.44Å; Y287-I420 HydrophobicContact CE2-CB 3.85Å; Y287-I420 HydrophobicContact CE2-CG2 3.74Å; Y287-I420 WeakPolarHBondContact OH-CB 3.5Å
288	S	43.6	Very low	42	Very low	96 Å²	96	87.5 Å²	87.5	67%	0.671	56%	0.555	S	S	*	*	S	Bend	trans	-76.2	-17.7	-175.9	60.8	0	0	0	0	114.7	S285	S285-S288 PolarHBondContact O-N 2.91Å; S285-S288 PolarHBondContact O-OG 3.26Å
289	T	36.5	Very low	41.1	Very low	107 Å²	107	90 Å²	90	66%	0.656	58%	0.584	S	S	*	*	S	Bend	trans	-110.9	-9.3	-163	56.8	0	0	0	0	118.6	Y287	Y287-T289 PolarHBondContact O-N 3.36Å
290	N	32.3	Very low	40.4	Very low	152 Å²	152	94.7 Å²	94.7	81%	0.813	60%	0.599	S	S	*	*			trans	-126	75.4	-168.5	-68.9	-11.8	0	0	0	114.5
291	A	37.5	Very low	39.4	Very low	59 Å²	59	94.6 Å²	94.6	49%	0.488	59%	0.592	S	S	.	*			trans	-138.2	71.7	175.8	0	0	0	0	0	113.1
292	D	32.1	Very low	38.4	Very low	175 Å²	175	92.5 Å²	92.5	94%	0.936	59%	0.592	S	S	*	*			trans	-128.3	112.3	162.7	-82.2	-31.2	0	0	0	109
293	G	32.6	Very low	37.9	Very low	84 Å²	84	99 Å²	99	87%	0.866	62%	0.624	S	S	*	*			trans	174.6	106.8	178	0	0	0	0	0	114.6
294	N	31.9	Very low	36.9	Very low	180 Å²	180	101.4 Å²	101.4	96%	0.963	64%	0.636	S	S	*	*			trans	-83.3	153.4	-171.9	-101	-28.2	0	0	0	115.3
295	G	29	Very low	36.2	Very low	82 Å²	82	101.8 Å²	101.8	85%	0.845	64%	0.64	S	S	*	*			trans	134.2	119	144.1	0	0	0	0	0	118.1
296	G	31.3	Very low	35.5	Very low	79 Å²	79	104.9 Å²	104.9	81%	0.814	65%	0.647	S	S	*	*			trans	117.6	90.8	158.4	0	0	0	0	0	116.6
297	T	32.5	Very low	35.1	Very low	85 Å²	85	104.8 Å²	104.8	52%	0.521	65%	0.646	S	S	.	*			trans	-123.9	-5.1	-154	26.6	0	0	0	0	120	I301	T297-I301 WeakPolarHBondContact O-CD1 3.27Å
298	Q	28.5	Very low	34.7	Very low	176 Å²	176	102.7 Å²	102.7	82%	0.822	64%	0.64	S	S	*	*	S	Bend	trans	-111.9	-16.5	-166.1	-84.1	175	-15.6	0	0	117.4
299	G	33	Very low	34.6	Very low	68 Å²	68	103.2 Å²	103.2	70%	0.701	64%	0.635	S	S	*	*	S	Bend	trans	-78.5	-20.4	-174.9	0	0	0	0	0	116.4
300	Q	37.1	Very low	35	Very low	124 Å²	124	107.5 Å²	107.5	58%	0.579	64%	0.64	S	S	*	*	S	Bend	trans	-96.4	-12.5	-171.2	-71.2	177.5	-5.6	0	0	114.1
301	I	30.5	Very low	35.4	Very low	95 Å²	95	101 Å²	101	49%	0.487	61%	0.605	S	S	.	*	H	α-helix	trans	-72.4	-34.6	-172.1	-64.9	171.6	0	0	0	112	T297	T297-I301 WeakPolarHBondContact O-CD1 3.27Å
302	S	32.6	Very low	35.6	Very low	83 Å²	83	100.6 Å²	100.6	58%	0.58	59%	0.594	S	S	*	*	H	α-helix	trans	-75.5	-29.2	-175.7	85.8	0	0	0	0	113.6	S305	S302-S305 PolarHBondContact O-OG 3.26Å; S302-S305 VanDerWaalsContact O-OG 3.11Å
303	M	34.9	Very low	36.1	Very low	135 Å²	135	96 Å²	96	67%	0.665	58%	0.581	S	S	*	*	H	α-helix	trans	-74.6	-32.3	-176.7	-123	-168.6	-68.9	0	0	112.4	T307	M303-T307 PolarHBondContact O-N 3.42Å; M303-T307 PolarHBondContact O-OG1 3.26Å
304	L	36.2	Very low	36.7	Very low	97 Å²	97	96.1 Å²	96.1	51%	0.508	57%	0.565	S	S	.	*	H	α-helix	trans	-76.1	-41.2	-178.1	-135.2	102.3	0	0	0	111.5	E306 T307 I308	L304-E306 VanDerWaalsContact C-N 3.33Å; L304-E306 PolarHBondContact O-N 2.7Å; L304-T307 PolarHBondContact O-N 3.15Å; L304-I308 HydrophobicContact CD2-CD1 4.14Å; L304-I308 WeakPolarHBondContact O-CD1 3.35Å; L304-I308 VanDerWaalsContact O-CG1 3.26Å; L304-I308 WeakPolarHBondContact O-CG1 3.35Å; L304-I308 PolarHBondContact O-N 3.18Å
305	S	33.1	Very low	37.1	Very low	50 Å²	50	95.2 Å²	95.2	35%	0.35	55%	0.548	S	S	.	.	H	α-helix	trans	-64	-38.1	179.1	61.9	0	0	0	0	112.4	S302 I308 N309	S302-S305 PolarHBondContact O-OG 3.26Å; S302-S305 VanDerWaalsContact O-OG 3.11Å; S305-I308 PolarHBondContact O-N 2.79Å; S305-N309 WeakPolarHBondContact O-CB 3.14Å; S305-N309 PolarHBondContact O-N 2.87Å; S305-N309 PolarHBondContact O-ND2 2.85Å
306	E	40.9	Very low	37.3	Very low	136 Å²	136	95.7 Å²	95.7	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-67.2	-38.6	177	-160.4	172.3	-163.9	0	0	111.9	L304 R310	L304-E306 VanDerWaalsContact C-N 3.33Å; L304-E306 PolarHBondContact O-N 2.7Å; E306-R310 PolarHBondContact O-N 3.17Å
307	T	41.3	Very low	37.4	Very low	60 Å²	60	99.9 Å²	99.9	37%	0.368	54%	0.538	S	S	.	.	H	α-helix	trans	-66.1	-41.9	176	-54.2	0	0	0	0	111.4	M303 L304 R310 V311 F439	M303-T307 PolarHBondContact O-N 3.42Å; M303-T307 PolarHBondContact O-OG1 3.26Å; L304-T307 PolarHBondContact O-N 3.15Å; T307-R310 WeakPolarHBondContact O-CB 3.44Å; T307-R310 PolarHBondContact O-N 2.52Å; T307-V311 WeakPolarHBondContact O-CG2 3.06Å; T307-V311 PolarHBondContact O-N 3.29Å; T307-F439 HydrophobicContact CG2-CD1 3.75Å; T307-F439 HydrophobicContact CG2-CE1 4.41Å
308	I	41	Very low	37.4	Very low	34 Å²	34	104.3 Å²	104.3	17%	0.174	55%	0.545	C	S	.	.	H	α-helix	trans	-64.4	-47.8	177.9	-68.9	162.2	0	0	0	111.3	L304 S305 R310 V311 I312 C473	L304-I308 HydrophobicContact CD2-CD1 4.14Å; L304-I308 WeakPolarHBondContact O-CD1 3.35Å; L304-I308 VanDerWaalsContact O-CG1 3.26Å; L304-I308 WeakPolarHBondContact O-CG1 3.35Å; L304-I308 PolarHBondContact O-N 3.18Å; S305-I308 PolarHBondContact O-N 2.79Å; I308-R310 PolarHBondContact O-N 2.9Å; I308-V311 PolarHBondContact O-N 2.88Å; I308-V311 VanDerWaalsContact O-N 3.07Å; I308-I312 HydrophobicContact CG2-CD1 3.83Å; I308-I312 HydrophobicContact CG2-CG1 4.47Å; I308-I312 WeakPolarHBondContact O-CG1 3.25Å; I308-I312 PolarHBondContact O-N 2.97Å; I308-C473 HydrophobicContact CD1-CB 4.28Å
309	N	42.9	Very low	38.1	Very low	106 Å²	106	100.3 Å²	100.3	57%	0.567	53%	0.533	S	S	*	.	H	α-helix	trans	-61.1	-31.8	179	-74.8	-26.5	0	0	0	111.8	S305 A313	S305-N309 WeakPolarHBondContact O-CB 3.14Å; S305-N309 PolarHBondContact O-N 2.87Å; S305-N309 PolarHBondContact O-ND2 2.85Å; N309-A313 VanDerWaalsContact O-CB 3.28Å; N309-A313 WeakPolarHBondContact O-CB 3.46Å; N309-A313 PolarHBondContact O-N 2.87Å
310	R	43.3	Very low	38.6	Very low	198 Å²	198	99.8 Å²	99.8	75%	0.747	52%	0.516	S	S	*	.	H	α-helix	trans	-63.5	-45.7	172.9	-116.6	179.7	155.8	-169.3	-6.6	112.7	E306 T307 I308 A313 T314	E306-R310 PolarHBondContact O-N 3.17Å; T307-R310 WeakPolarHBondContact O-CB 3.44Å; T307-R310 PolarHBondContact O-N 2.52Å; I308-R310 PolarHBondContact O-N 2.9Å; R310-A313 PolarHBondContact O-N 2.91Å; R310-T314 PolarHBondContact O-N 3.25Å; R310-T314 PolarHBondContact O-OG1 2.88Å
311	V	41.7	Very low	38.5	Very low	14 Å²	14	98.6 Å²	98.6	9%	0.085	52%	0.519	C	S	.	.	H	α-helix	trans	-65.9	-39.9	179.9	176.6	0	0	0	0	111.5	T307 I308 T314 F439	T307-V311 WeakPolarHBondContact O-CG2 3.06Å; T307-V311 PolarHBondContact O-N 3.29Å; I308-V311 PolarHBondContact O-N 2.88Å; I308-V311 VanDerWaalsContact O-N 3.07Å; V311-T314 WeakPolarHBondContact CA-OG1 3.07Å; V311-T314 PolarHBondContact O-N 2.83Å; V311-T314 PolarHBondContact O-OG1 3.16Å; V311-F439 HydrophobicContact CG2-CB 3.99Å; V311-F439 HydrophobicContact CG2-CD1 4.06Å; V311-F439 HydrophobicContact CG2-CD2 3.46Å; V311-F439 VanDerWaalsContact CG2-CD2 3.46Å; V311-F439 HydrophobicContact CG2-CE1 4.46Å; V311-F439 HydrophobicContact CG2-CE2 3.92Å; V311-F439 HydrophobicContact CG2-CG 3.54Å; V311-F439 HydrophobicContact CG2-CZ 4.4Å
312	I	40.6	Very low	38.6	Very low	52 Å²	52	103.9 Å²	103.9	27%	0.267	53%	0.533	S	S	.	.	H	α-helix	trans	-69.5	-43.3	178.6	-63.2	171.5	0	0	0	111	I308 T314 R315	I308-I312 HydrophobicContact CG2-CD1 3.83Å; I308-I312 HydrophobicContact CG2-CG1 4.47Å; I308-I312 WeakPolarHBondContact O-CG1 3.25Å; I308-I312 PolarHBondContact O-N 2.97Å; I312-T314 PolarHBondContact O-N 3.26Å; I312-R315 VanDerWaalsContact O-CB 3.31Å; I312-R315 WeakPolarHBondContact O-CB 3.49Å; I312-R315 PolarHBondContact O-N 2.9Å; I312-R315 VanDerWaalsContact O-N 3.07Å
313	A	44.1	Very low	39	Very low	78 Å²	78	102 Å²	102	65%	0.645	52%	0.516	S	S	*	.	H	α-helix	trans	-62.2	-26.7	178.5	0	0	0	0	0	112.6	N309 R310 R315	N309-A313 VanDerWaalsContact O-CB 3.28Å; N309-A313 WeakPolarHBondContact O-CB 3.46Å; N309-A313 PolarHBondContact O-N 2.87Å; R310-A313 PolarHBondContact O-N 2.91Å; A313-R315 VanDerWaalsContact C-N 3.29Å; A313-R315 PolarHBondContact O-N 2.97Å
314	T	44.2	Very low	38.9	Very low	87 Å²	87	98.4 Å²	98.4	53%	0.534	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	5.6	175.9	43.1	0	0	0	0	115	R310 V311 I312 T316	R310-T314 PolarHBondContact O-N 3.25Å; R310-T314 PolarHBondContact O-OG1 2.88Å; V311-T314 WeakPolarHBondContact CA-OG1 3.07Å; V311-T314 PolarHBondContact O-N 2.83Å; V311-T314 PolarHBondContact O-OG1 3.16Å; I312-T314 PolarHBondContact O-N 3.26Å; T314-T316 PolarHBondContact O-N 2.91Å; T314-T316 PolarHBondContact O-OG1 3.04Å
315	R	40.6	Very low	39	Very low	160 Å²	160	101 Å²	101	60%	0.604	51%	0.507	S	S	*	.			trans	-61.1	21.7	168.6	-82.3	-167.2	175.7	-173.6	3	114.6	I312 A313 N317	I312-R315 VanDerWaalsContact O-CB 3.31Å; I312-R315 WeakPolarHBondContact O-CB 3.49Å; I312-R315 PolarHBondContact O-N 2.9Å; I312-R315 VanDerWaalsContact O-N 3.07Å; A313-R315 VanDerWaalsContact C-N 3.29Å; A313-R315 PolarHBondContact O-N 2.97Å; R315-N317 PolarHBondContact O-N 3.15Å
316	T	33.9	Very low	39	Very low	92 Å²	92	104.3 Å²	104.3	56%	0.564	52%	0.521	S	S	*	.			trans	-61.5	108.4	167.4	54.5	0	0	0	0	108.6	T314 R318	T314-T316 PolarHBondContact O-N 2.91Å; T314-T316 PolarHBondContact O-OG1 3.04Å; T316-R318 WeakPolarHBondContact O-CB 3.37Å; T316-R318 WeakPolarHBondContact O-CG 3.48Å; T316-R318 PolarHBondContact O-N 3.48Å
317	N	32	Very low	38.5	Very low	168 Å²	168	101.4 Å²	101.4	90%	0.898	51%	0.509	S	S	*	.			trans	-28.7	97.7	171.3	-73.1	-37.7	0	0	0	112.6	R315	R315-N317 PolarHBondContact O-N 3.15Å
318	R	33.5	Very low	38.4	Very low	178 Å²	178	107.9 Å²	107.9	67%	0.672	53%	0.527	S	S	*	.			trans	-141.1	108.1	-179.6	-78	-171.1	178.9	-177.9	1.2	113.1	T316	T316-R318 WeakPolarHBondContact O-CB 3.37Å; T316-R318 WeakPolarHBondContact O-CG 3.48Å; T316-R318 PolarHBondContact O-N 3.48Å
319	V	43.7	Very low	38	Very low	92 Å²	92	112 Å²	112	56%	0.558	55%	0.553	S	S	*	*	S	Bend	trans	71.1	38	135.2	-152.5	0	0	0	0	119.7
320	V	42.6	Very low	37.3	Very low	56 Å²	56	111.9 Å²	111.9	34%	0.339	56%	0.557	S	S	.	*	S	Bend	trans	-110.4	-20.1	144.4	-174.3	0	0	0	0	114.5	H29 R322 L323 M324	H29-V320 WeakPolarHBondContact NE2-CG2 3.49Å; V320-R322 PolarHBondContact O-N 3.45Å; V320-L323 PolarHBondContact O-N 2.52Å; V320-M324 HydrophobicContact CG1-CG 4.48Å
321	P	34.9	Very low	36.5	Very low	100 Å²	100	107.6 Å²	107.6	65%	0.649	56%	0.557	S	S	*	*	H	α-helix	trans	-62.8	-37.1	-178.4	-24.1	33	0	0	0	114.9	L323 M324	P321-L323 VanDerWaalsContact C-N 3.27Å; P321-L323 PolarHBondContact O-N 3.18Å; P321-M324 PolarHBondContact O-N 3.12Å
322	R	33.6	Very low	35.8	Very low	205 Å²	205	115.4 Å²	115.4	77%	0.774	59%	0.593	S	S	*	*	H	α-helix	trans	-71.1	-23.4	-175.8	-152.9	175.5	-171.9	170.8	1.8	113.1	V320	V320-R322 PolarHBondContact O-N 3.45Å
323	L	39.3	Very low	35.2	Very low	44 Å²	44	118.3 Å²	118.3	23%	0.23	62%	0.618	C	S	.	*	H	α-helix	trans	-78.3	-35	178.6	-171.1	67.9	0	0	0	111.8	V53 V320 P321 E325 L326 L327	V53-L323 HydrophobicContact CG1-CD2 4.41Å; V53-L323 HydrophobicContact CG2-CD2 3.93Å; V320-L323 PolarHBondContact O-N 2.52Å; P321-L323 VanDerWaalsContact C-N 3.27Å; P321-L323 PolarHBondContact O-N 3.18Å; L323-E325 PolarHBondContact O-N 2.83Å; L323-L326 PolarHBondContact O-N 3.02Å; L323-L327 HydrophobicContact CD1-CD1 4.13Å; L323-L327 HydrophobicContact CD1-CG 4.3Å; L323-L327 HydrophobicContact CD2-CD1 4.21Å; L323-L327 HydrophobicContact CG-CD1 3.75Å; L323-L327 HydrophobicContact CG-CG 4.28Å; L323-L327 WeakPolarHBondContact O-CB 3.23Å; L323-L327 WeakPolarHBondContact O-CG 3.39Å; L323-L327 PolarHBondContact O-N 3.43Å
324	M	34.1	Very low	34.3	Very low	59 Å²	59	123 Å²	123	29%	0.291	63%	0.626	S	S	.	*	H	α-helix	trans	-66.3	-26.6	176.8	-67.4	-69	-106.5	0	0	112.5	D51 V320 P321 R328	D51-M324 HydrophobicContact CB-CE 3.8Å; D51-M324 HydrophobicContact CB-SD 3.93Å; D51-M324 VanDerWaalsContact OD2-CE 3.26Å; D51-M324 WeakPolarHBondContact OD2-CE 3.46Å; V320-M324 HydrophobicContact CG1-CG 4.48Å; P321-M324 PolarHBondContact O-N 3.12Å; M324-R328 WeakPolarHBondContact O-CG 3.48Å
325	E	37.2	Very low	33.6	Very low	151 Å²	151	124.5 Å²	124.5	71%	0.706	64%	0.637	S	S	*	*	H	α-helix	trans	-80.2	-31.6	177.3	-162.3	145.7	-153.5	0	0	112.4	L323	L323-E325 PolarHBondContact O-N 2.83Å
326	L	33.2	Very low	32.8	Very low	120 Å²	120	126.5 Å²	126.5	63%	0.628	65%	0.651	S	S	*	*	H	α-helix	trans	-80.8	-37.4	176.7	-84.9	155.5	0	0	0	113.1	L323 R328 V329	L323-L326 PolarHBondContact O-N 3.02Å; L326-R328 VanDerWaalsContact C-N 3.3Å; L326-R328 PolarHBondContact O-N 3.49Å; L326-V329 PolarHBondContact O-N 3.02Å
327	L	31.4	Very low	32.4	Very low	75 Å²	75	126.5 Å²	126.5	39%	0.393	66%	0.66	S	S	.	*	H	α-helix	trans	-75.8	-13.1	-178.8	-71.2	174.4	0	0	0	114.2	V53 L323 V329	V53-L327 HydrophobicContact CG1-CD1 3.98Å; V53-L327 HydrophobicContact CG2-CD1 3.97Å; L323-L327 HydrophobicContact CD1-CD1 4.13Å; L323-L327 HydrophobicContact CD1-CG 4.3Å; L323-L327 HydrophobicContact CD2-CD1 4.21Å; L323-L327 HydrophobicContact CG-CD1 3.75Å; L323-L327 HydrophobicContact CG-CG 4.28Å; L323-L327 WeakPolarHBondContact O-CB 3.23Å; L323-L327 WeakPolarHBondContact O-CG 3.39Å; L323-L327 PolarHBondContact O-N 3.43Å; L327-V329 PolarHBondContact O-N 3.27Å
328	R	37.7	Very low	32.1	Very low	196 Å²	196	127.1 Å²	127.1	74%	0.74	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-13	170.5	-81.6	-177.8	-179.4	149.3	2.9	113.5	M324 L326	M324-R328 WeakPolarHBondContact O-CG 3.48Å; L326-R328 VanDerWaalsContact C-N 3.3Å; L326-R328 PolarHBondContact O-N 3.49Å
329	V	32.8	Very low	31.8	Very low	121 Å²	121	126.6 Å²	126.6	73%	0.733	67%	0.671	S	S	*	*	S	Bend	trans	-101.6	-12.5	-176.1	-174.5	0	0	0	0	112.8	L326 L327	L326-V329 PolarHBondContact O-N 3.02Å; L327-V329 PolarHBondContact O-N 3.27Å
330	T	28.7	Very low	30.9	Very low	104 Å²	104	127.5 Å²	127.5	64%	0.638	68%	0.681	S	S	*	*			trans	-112.5	61.3	-175.8	54.7	0	0	0	0	112
331	S	26	Very low	30	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	71%	0.707	S	S	*	*			trans	-122.5	47.2	166.2	65.9	0	0	0	0	111.4
332	E	27.8	Very low	29.8	Very low	177 Å²	177	135 Å²	135	83%	0.827	72%	0.715	S	S	*	*			trans	-120.7	121.1	165.6	-69.6	-165.5	174.5	0	0	110.4
333	S	26.9	Very low	29.5	Very low	113 Å²	113	128.3 Å²	128.3	79%	0.79	71%	0.709	S	S	*	*			trans	-54	124.5	-175.9	47.9	0	0	0	0	113.6
334	H	26.2	Very low	29.3	Very low	177 Å²	177	132.4 Å²	132.4	82%	0.819	74%	0.739	S	S	*	*			trans	-111.2	124.1	160.6	-78.1	-52.5	0	0	0	110.5
335	P	28.4	Very low	29.1	Very low	118 Å²	118	136.3 Å²	136.3	77%	0.766	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-78.8	142.6	-175.5	28.8	-27.7	0	0	0	111.7	A337	P335-A337 PolarHBondContact O-N 3.42Å
336	F	25.2	Very low	28.7	Very low	203 Å²	203	133.6 Å²	133.6	89%	0.89	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-52.6	124.2	-178.4	-71.1	-95.6	0	0	0	113.4
337	A	25.7	Very low	28.3	Very low	92 Å²	92	133 Å²	133	76%	0.76	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-99.9	123	163.3	0	0	0	0	0	109.6	P335 I339	P335-A337 PolarHBondContact O-N 3.42Å; A337-I339 PolarHBondContact O-N 3.07Å
338	L	25.1	Very low	28.1	Very low	180 Å²	180	136.2 Å²	136.2	94%	0.942	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-63.4	120.6	175.8	-77.1	147.3	0	0	0	110.4
339	I	27.4	Very low	27.6	Very low	168 Å²	168	130.8 Å²	130.8	86%	0.862	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-92.8	119.1	169.8	-65	169.6	0	0	0	107.6	A337	A337-I339 PolarHBondContact O-N 3.07Å
340	S	24.4	Very low	27.2	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-70.4	151.2	176	41.4	0	0	0	0	112.5
341	E	24.4	Very low	27.2	Very low	186 Å²	186	134.7 Å²	134.7	87%	0.869	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-64	149.8	-171.5	-63.2	-173.9	156.9	0	0	114.5
342	P	30.8	Very low	27.5	Very low	128 Å²	128	134 Å²	134	83%	0.831	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-86.2	134.1	-176.5	22	-9.5	0	0	0	112.5
343	G	26.9	Very low	27.5	Very low	63 Å²	63	134.4 Å²	134.4	65%	0.649	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-71.2	163.4	172.2	0	0	0	0	0	113.5
344	P	35.7	Very low	28.1	Very low	130 Å²	130	132.6 Å²	132.6	84%	0.844	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-89.9	119	-164.6	33.9	-29.6	0	0	0	111.3
345	T	30	Very low	28.6	Very low	142 Å²	142	131.6 Å²	131.6	87%	0.871	75%	0.754	S	S	*	*			trans	-111.9	98.2	160.7	45	0	0	0	0	109
346	A	26.8	Very low	29.3	Very low	94 Å²	94	133.4 Å²	133.4	78%	0.777	76%	0.757	S	S	*	*			trans	-70.4	150.2	164.7	0	0	0	0	0	110.8
347	S	26.7	Very low	30.5	Very low	107 Å²	107	126.5 Å²	126.5	75%	0.748	74%	0.743	S	S	*	*			trans	123.3	93.8	144.9	90	0	0	0	0	115.2
348	L	26.4	Very low	31.9	Very low	142 Å²	142	122.5 Å²	122.5	74%	0.743	71%	0.711	S	S	*	*				154.4	65.3	123.7	-105.8	98.1	0	0	0	107.8	D350	L348-D350 VanDerWaalsContact C-N 3.29Å; L348-D350 PolarHBondContact O-N 2.91Å; L348-D350 VanDerWaalsContact O-N 3.11Å
349	V	26.3	Very low	33.5	Very low	83 Å²	83	114.4 Å²	114.4	50%	0.503	67%	0.669	S	S	.	*			trans	-78	92.8	162.6	-177.1	0	0	0	0	105.1	H351	V349-H351 PolarHBondContact O-N 2.96Å
350	D	26.1	Very low	35.3	Very low	138 Å²	138	109.8 Å²	109.8	74%	0.738	65%	0.645	S	S	*	*			trans	-53.4	114.4	164.2	-93.2	-27.4	0	0	0	107	L348 V352	L348-D350 VanDerWaalsContact C-N 3.29Å; L348-D350 PolarHBondContact O-N 2.91Å; L348-D350 VanDerWaalsContact O-N 3.11Å; D350-V352 PolarHBondContact O-N 3.05Å
351	H	28	Very low	37.2	Very low	169 Å²	169	105.5 Å²	105.5	78%	0.782	61%	0.613	S	S	*	*			trans	-63.7	82.9	177.5	-65.3	-72.7	0	0	0	108.6	V349 K353	V349-H351 PolarHBondContact O-N 2.96Å; H351-K353 PolarHBondContact O-N 3.13Å
352	V	32.3	Very low	39.3	Very low	92 Å²	92	99.7 Å²	99.7	56%	0.558	59%	0.592	S	S	*	*			trans	-59.2	96	149.9	179.4	0	0	0	0	103.9	D350 I354	D350-V352 PolarHBondContact O-N 3.05Å; V352-I354 PolarHBondContact O-N 2.85Å
353	K	28.4	Very low	41.1	Very low	187 Å²	187	94.9 Å²	94.9	81%	0.813	56%	0.563	S	S	*	*			trans	-60.5	92.9	165.9	-78.2	-175.5	175.5	-178.8	0	105	H351 E355	H351-K353 PolarHBondContact O-N 3.13Å; K353-E355 VanDerWaalsContact C-N 3.27Å; K353-E355 PolarHBondContact O-N 2.47Å
354	I	38	Very low	43.1	Very low	75 Å²	75	91.9 Å²	91.9	39%	0.385	53%	0.532	S	S	.	.			trans	-56.9	106.6	158.5	-59.4	171.7	0	0	0	102.4	D129 R130 V352 D356	D129-I354 HydrophobicContact CB-CD1 4.1Å; R130-I354 HydrophobicContact CB-CG2 4.49Å; V352-I354 PolarHBondContact O-N 2.85Å; I354-D356 PolarHBondContact O-N 3.39Å; I354-D356 VanDerWaalsContact O-N 3.13Å
355	E	37.5	Very low	44.6	Very low	155 Å²	155	87.5 Å²	87.5	72%	0.724	50%	0.503	S	S	*	.			trans	-50.8	127.8	174.6	-72.9	-171.9	158.5	0	0	107.1	K353 G357	K353-E355 VanDerWaalsContact C-N 3.27Å; K353-E355 PolarHBondContact O-N 2.47Å; E355-G357 CarbonylContact O-C 3.51Å; E355-G357 PolarHBondContact O-N 2.98Å
356	D	42.8	Very low	46.6	Very low	157 Å²	157	87.6 Å²	87.6	84%	0.84	49%	0.494	S	S	*	.	S	Bend	trans	-55.4	-20.7	-178.5	-80.5	-42.1	0	0	0	111.6	R130 I354 G358	R130-D356 PolarHBondContact NH1-O 3.34Å; I354-D356 PolarHBondContact O-N 3.39Å; I354-D356 VanDerWaalsContact O-N 3.13Å; D356-G358 VanDerWaalsContact C-N 3.31Å; D356-G358 PolarHBondContact O-N 3.16Å
357	G	50.2	Low	48.7	Very low	57 Å²	57	89.5 Å²	89.5	59%	0.588	49%	0.485	S	S	*	.			trans	-76.9	67.6	169.1	0	0	0	0	0	113.9	E355	E355-G357 CarbonylContact O-C 3.51Å; E355-G357 PolarHBondContact O-N 2.98Å
358	G	56	Low	50.7	Low	8 Å²	8	87.4 Å²	87.4	8%	0.082	47%	0.465	C	S	.	.			trans	-55.2	148	155.6	0	0	0	0	0	110.3	G154 D356 N360	G154-G358 CarbonylContact O-C 3.5Å; G154-G358 VanDerWaalsContact O-C 3.28Å; G154-G358 WeakPolarHBondContact O-CA 3.38Å; D356-G358 VanDerWaalsContact C-N 3.31Å; D356-G358 PolarHBondContact O-N 3.16Å; G358-N360 PolarHBondContact O-N 3.23Å
359	L	58.6	Low	52.6	Low	11 Å²	11	85.4 Å²	85.4	6%	0.058	46%	0.461	C	S	.	.	B	Isolated β-bridge	trans	-53.8	77.4	156	-66.7	-172.1	0	0	0	110.3	G154 F155 D156 V200 L364	G154-L359 WeakPolarHBondContact O-CA 3.39Å; G154-L359 VanDerWaalsContact O-CB 3.32Å; G154-L359 WeakPolarHBondContact O-CB 3.42Å; G154-L359 PolarHBondContact O-N 3.49Å; F155-L359 HydrophobicContact CD1-CD1 4.06Å; F155-L359 HydrophobicContact CE1-CD1 4.04Å; D156-L359 PolarHBondContact N-O 3.14Å; V200-L359 HydrophobicContact CG2-CD2 3.45Å; V200-L359 VanDerWaalsContact CG2-CD2 3.45Å; V200-L359 HydrophobicContact CG2-CG 4.49Å; L359-L364 HydrophobicContact CD1-CD1 4.23Å; L359-L364 HydrophobicContact CD2-CB 4.23Å; L359-L364 HydrophobicContact CD2-CD1 3.66Å; L359-L364 HydrophobicContact CD2-CG 4.47Å
360	N	64.7	Low	54.5	Low	70 Å²	70	88.6 Å²	88.6	37%	0.374	48%	0.475	S	S	.	.			trans	-73.6	146.6	154.2	67.7	31.4	0	0	0	108.1	G358 P362 A363 L364	G358-N360 PolarHBondContact O-N 3.23Å; N360-P362 VanDerWaalsContact C-N 3.28Å; N360-P362 WeakPolarHBondContact OD1-CD 3.32Å; N360-A363 PolarHBondContact O-N 3.15Å; N360-A363 VanDerWaalsContact O-N 3.13Å; N360-A363 WeakPolarHBondContact OD1-CB 3.44Å; N360-A363 PolarHBondContact OD1-N 3.08Å; N360-L364 PolarHBondContact O-N 2.66Å; N360-L364 VanDerWaalsContact O-N 3.12Å
361	F	63.8	Low	56.6	Low	21 Å²	21	83.1 Å²	83.1	9%	0.092	45%	0.445	C	S	.	.	H	α-helix	trans	-47.7	-44.9	-178.8	177.5	-100.2	0	0	0	113.2	L179 I206 G208 A363 L364 C365	L179-F361 HydrophobicContact CB-CB 4.17Å; L179-F361 HydrophobicContact CB-CD2 3.78Å; L179-F361 HydrophobicContact CB-CG 4.38Å; L179-F361 HydrophobicContact CD1-CB 4.26Å; L179-F361 HydrophobicContact CD1-CD2 3.57Å; L179-F361 HydrophobicContact CD1-CE2 4.44Å; L179-F361 HydrophobicContact CD1-CG 4.41Å; L179-F361 HydrophobicContact CG-CD2 4.19Å; I206-F361 HydrophobicContact CD1-CD2 4.31Å; I206-F361 HydrophobicContact CD1-CE2 3.86Å; G208-F361 VanDerWaalsContact CA-CE2 3.46Å; G208-F361 VanDerWaalsContact CA-CZ 3.41Å; G208-F361 WeakPolarHBondContact O-CZ 3.49Å; F361-A363 PolarHBondContact O-N 3.32Å; F361-L364 PolarHBondContact O-N 3.11Å; F361-C365 PolarHBondContact O-N 2.93Å; F361-C365 VanDerWaalsContact O-N 3.15Å; F361-C365 PolarHBondContact O-SG 2.86Å; F361-C365 VanDerWaalsContact O-SG 3.41Å
362	P	68.6	Low	58.6	Low	65 Å²	65	77.5 Å²	77.5	42%	0.422	42%	0.424	S	S	.	.	H	α-helix	trans	-61.6	-44.2	178.4	-23.9	35.2	0	0	0	114.7	N360 C365 Q366	N360-P362 VanDerWaalsContact C-N 3.28Å; N360-P362 WeakPolarHBondContact OD1-CD 3.32Å; P362-C365 PolarHBondContact O-N 2.97Å; P362-Q366 VanDerWaalsContact O-CG 3.3Å; P362-Q366 WeakPolarHBondContact O-CG 3.35Å; P362-Q366 PolarHBondContact O-N 3.28Å; P362-Q366 VanDerWaalsContact O-N 3.08Å
363	A	70.6	Confident	60.7	Low	27 Å²	27	75 Å²	75	22%	0.223	41%	0.407	C	S	.	.	H	α-helix	trans	-69.3	-35.8	-179	0	0	0	0	0	111.7	N360 F361 Q366 K367	N360-A363 PolarHBondContact O-N 3.15Å; N360-A363 VanDerWaalsContact O-N 3.13Å; N360-A363 WeakPolarHBondContact OD1-CB 3.44Å; N360-A363 PolarHBondContact OD1-N 3.08Å; F361-A363 PolarHBondContact O-N 3.32Å; A363-Q366 PolarHBondContact O-N 2.99Å; A363-K367 WeakPolarHBondContact O-CB 3.28Å; A363-K367 WeakPolarHBondContact O-CG 3.45Å; A363-K367 PolarHBondContact O-N 3.28Å
364	L	68.7	Low	63.2	Low	0 Å²	0	66.5 Å²	66.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-63.6	-47.4	175.8	-176.8	67.7	0	0	0	111.1	L179 V200 V203 I206 L359 N360 F361 Q366 K367 N368 L371	L179-L364 HydrophobicContact CD1-CD2 3.71Å; V200-L364 HydrophobicContact CG1-CD1 4.2Å; V200-L364 HydrophobicContact CG2-CD1 4.3Å; V203-L364 HydrophobicContact CG1-CD2 4.46Å; I206-L364 HydrophobicContact CD1-CD2 4.08Å; I206-L364 HydrophobicContact CG2-CD2 3.81Å; L359-L364 HydrophobicContact CD1-CD1 4.23Å; L359-L364 HydrophobicContact CD2-CB 4.23Å; L359-L364 HydrophobicContact CD2-CD1 3.66Å; L359-L364 HydrophobicContact CD2-CG 4.47Å; N360-L364 PolarHBondContact O-N 2.66Å; N360-L364 VanDerWaalsContact O-N 3.12Å; F361-L364 PolarHBondContact O-N 3.11Å; L364-Q366 VanDerWaalsContact C-N 3.26Å; L364-Q366 PolarHBondContact O-N 2.91Å; L364-K367 PolarHBondContact O-N 2.97Å; L364-N368 PolarHBondContact O-N 2.99Å; L364-L371 HydrophobicContact CD1-CD1 4.1Å; L364-L371 HydrophobicContact CD2-CD1 4.11Å; L364-L371 HydrophobicContact CG-CD1 3.81Å
365	C	67.4	Low	65.5	Low	37 Å²	37	64.8 Å²	64.8	25%	0.25	36%	0.363	C	S	.	.	H	α-helix	trans	-62.4	-32.2	175.9	-68.1	0	0	0	0	112.8	F361 P362 N368 P369	F361-C365 PolarHBondContact O-N 2.93Å; F361-C365 VanDerWaalsContact O-N 3.15Å; F361-C365 PolarHBondContact O-SG 2.86Å; F361-C365 VanDerWaalsContact O-SG 3.41Å; P362-C365 PolarHBondContact O-N 2.97Å; C365-N368 CarbonylContact O-C 3.48Å; C365-P369 VanDerWaalsContact O-CA 3.27Å; C365-P369 WeakPolarHBondContact O-CA 3.3Å
366	Q	70.3	Confident	67.8	Low	144 Å²	144	59 Å²	59	67%	0.673	34%	0.338	S	S	*	.	H	α-helix	trans	-71.4	-41	174.4	-74.6	172.6	8.9	0	0	112.3	P362 A363 L364	P362-Q366 VanDerWaalsContact O-CG 3.3Å; P362-Q366 WeakPolarHBondContact O-CG 3.35Å; P362-Q366 PolarHBondContact O-N 3.28Å; P362-Q366 VanDerWaalsContact O-N 3.08Å; A363-Q366 PolarHBondContact O-N 2.99Å; L364-Q366 VanDerWaalsContact C-N 3.26Å; L364-Q366 PolarHBondContact O-N 2.91Å
367	K	70.8	Confident	70.1	Confident	135 Å²	135	54.5 Å²	54.5	59%	0.587	31%	0.314	S	S	*	.	H	α-helix	trans	-69.7	-42.3	179	-77.9	-175	176.4	-176.3	0	112.2	V200 A363 L364	V200-K367 HydrophobicContact CG2-CD 4.2Å; A363-K367 WeakPolarHBondContact O-CB 3.28Å; A363-K367 WeakPolarHBondContact O-CG 3.45Å; A363-K367 PolarHBondContact O-N 3.28Å; L364-K367 PolarHBondContact O-N 2.97Å
368	N	69.9	Low	72.1	Confident	62 Å²	62	53.1 Å²	53.1	33%	0.332	29%	0.293	S	S	.	.			trans	-129.3	82.3	178.1	-77.3	-25.7	0	0	0	111	V200 L364 C365 N370 L371	V200-N368 WeakPolarHBondContact CG1-ND2 3.38Å; L364-N368 PolarHBondContact O-N 2.99Å; C365-N368 CarbonylContact O-C 3.48Å; N368-N370 PolarHBondContact O-N 3.24Å; N368-L371 HydrophobicContact CB-CD1 3.76Å; N368-L371 HydrophobicContact CB-CG 3.67Å; N368-L371 PolarHBondContact O-N 3.47Å
369	P	66.1	Low	73.8	Confident	100 Å²	100	57.6 Å²	57.6	65%	0.649	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.2	-180	26.5	-34.7	0	0	0	113.4	C365	C365-P369 VanDerWaalsContact O-CA 3.27Å; C365-P369 WeakPolarHBondContact O-CA 3.3Å
370	N	65.6	Low	75.3	Confident	150 Å²	150	57.1 Å²	57.1	80%	0.802	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	19.7	-179.2	-61.8	-28.7	0	0	0	113	N368 P372	N368-N370 PolarHBondContact O-N 3.24Å; N370-P372 VanDerWaalsContact O-CD 3.31Å; N370-P372 WeakPolarHBondContact O-CD 3.37Å
371	L	70.5	Confident	76.3	Confident	23 Å²	23	56.4 Å²	56.4	12%	0.12	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-58.3	121	174.1	-89.6	164	0	0	0	109.4	V203 I206 L364 N368 Q373	V203-L371 HydrophobicContact CG1-CD2 4.5Å; I206-L371 HydrophobicContact CD1-CD1 4.1Å; L364-L371 HydrophobicContact CD1-CD1 4.1Å; L364-L371 HydrophobicContact CD2-CD1 4.11Å; L364-L371 HydrophobicContact CG-CD1 3.81Å; N368-L371 HydrophobicContact CB-CD1 3.76Å; N368-L371 HydrophobicContact CB-CG 3.67Å; N368-L371 PolarHBondContact O-N 3.47Å; L371-Q373 PolarHBondContact O-N 3.15Å
372	P	69.4	Low	77.2	Confident	52 Å²	52	56.1 Å²	56.1	34%	0.338	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-58.2	133.3	177.4	-21.1	31.4	0	0	0	110.3	S205 T248 N370	S205-P372 VanDerWaalsContact CA-O 3.25Å; S205-P372 WeakPolarHBondContact CA-O 3.36Å; S205-P372 WeakPolarHBondContact CB-O 3.43Å; S205-P372 PolarHBondContact OG-O 3.15Å; S205-P372 VanDerWaalsContact OG-O 3.12Å; T248-P372 HydrophobicContact CG2-CB 3.63Å; T248-P372 WeakPolarHBondContact OG1-CB 3.46Å; N370-P372 VanDerWaalsContact O-CD 3.31Å; N370-P372 WeakPolarHBondContact O-CD 3.37Å
373	Q	77.2	Confident	77.9	Confident	40 Å²	40	53.6 Å²	53.6	19%	0.187	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	136.9	179.2	-64.7	-163.5	26.5	0	0	110.7	T248 T249 L371	T248-Q373 CarbonylContact C-O 3.51Å; T248-Q373 WeakPolarHBondContact CA-O 3.5Å; T248-Q373 WeakPolarHBondContact CB-O 3.49Å; T249-Q373 PolarHBondContact N-O 2.9Å; T249-Q373 PolarHBondContact O-N 2.71Å; L371-Q373 PolarHBondContact O-N 3.15Å
374	P	81.4	Confident	78.6	Confident	8 Å²	8	55.2 Å²	55.2	5%	0.052	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	143.2	-179.3	30	-27.6	0	0	0	109.8	S205 I206 I207 L243 D244 V376	S205-P374 WeakPolarHBondContact OG-CD 3.25Å; I206-P374 WeakPolarHBondContact O-CD 3.12Å; I207-P374 HydrophobicContact CB-CG 4.42Å; I207-P374 HydrophobicContact CD1-CG 3.74Å; I207-P374 HydrophobicContact CG1-CG 3.72Å; L243-P374 HydrophobicContact CD1-CG 4.46Å; D244-P374 VanDerWaalsContact O-CB 3.27Å; D244-P374 WeakPolarHBondContact O-CB 3.49Å; P374-V376 PolarHBondContact O-N 3.41Å
375	V	85.1	Confident	79.4	Confident	38 Å²	38	55.4 Å²	55.4	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	122.4	175.7	175	0	0	0	0	108.8	L243 D244 R247 T249 I377	L243-V375 WeakPolarHBondContact CA-O 3.23Å; D244-V375 HydrophobicContact CB-CB 4.04Å; D244-V375 PolarHBondContact N-O 2.95Å; R247-V375 HydrophobicContact CB-CG2 3.93Å; R247-V375 WeakPolarHBondContact O-CG2 3.32Å; R247-V375 PolarHBondContact O-N 2.97Å; T249-V375 HydrophobicContact CG2-CB 4.44Å; T249-V375 HydrophobicContact CG2-CG2 3.44Å; T249-V375 VanDerWaalsContact CG2-CG2 3.44Å; V375-I377 PolarHBondContact O-N 2.77Å
376	V	87.3	Confident	80.1	Confident	34 Å²	34	56.5 Å²	56.5	21%	0.206	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	111.9	167.5	-179.7	0	0	0	0	108.1	I207 Y241 L243 F255 P374	I207-V376 HydrophobicContact CD1-CG2 3.66Å; Y241-V376 HydrophobicContact CD1-CG1 3.91Å; L243-V376 HydrophobicContact CD2-CB 4.45Å; L243-V376 HydrophobicContact CD2-CG2 3.85Å; F255-V376 HydrophobicContact CB-CG2 3.95Å; F255-V376 HydrophobicContact CD1-CG2 4.02Å; F255-V376 HydrophobicContact CD2-CB 3.8Å; F255-V376 HydrophobicContact CD2-CG1 4.25Å; F255-V376 HydrophobicContact CD2-CG2 3.5Å; F255-V376 HydrophobicContact CE1-CG2 4.45Å; F255-V376 HydrophobicContact CE2-CB 3.87Å; F255-V376 HydrophobicContact CE2-CG1 3.83Å; F255-V376 HydrophobicContact CE2-CG2 3.95Å; F255-V376 HydrophobicContact CG-CB 4.34Å; F255-V376 HydrophobicContact CG-CG2 3.54Å; F255-V376 HydrophobicContact CZ-CB 4.49Å; F255-V376 HydrophobicContact CZ-CG1 4.04Å; F255-V376 HydrophobicContact CZ-CG2 4.4Å; P374-V376 PolarHBondContact O-N 3.41Å
377	I	90.3	Very high	80.3	Confident	62 Å²	62	56.6 Å²	56.6	32%	0.318	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-44.7	179.4	-59.7	171.3	0	0	0	109.7	E230 L242 D244 V375	E230-I377 HydrophobicContact CG-CD1 4.04Å; L242-I377 HydrophobicContact CB-CB 4.39Å; L242-I377 HydrophobicContact CD2-CB 4.03Å; L242-I377 HydrophobicContact CD2-CD1 4.41Å; L242-I377 HydrophobicContact CD2-CG2 3.85Å; L242-I377 HydrophobicContact CG-CB 4.06Å; L242-I377 HydrophobicContact CG-CD1 4.25Å; L242-I377 HydrophobicContact CG-CG2 4.44Å; L242-I377 PolarHBondContact O-N 2.77Å; D244-I377 HydrophobicContact CB-CD1 3.95Å; D244-I377 HydrophobicContact CB-CG1 4.2Å; V375-I377 PolarHBondContact O-N 2.77Å
378	N	92.3	Very high	80.7	Confident	28 Å²	28	51.1 Å²	51.1	15%	0.15	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	164.7	-176.6	-150.9	-12.8	0	0	0	112.3	L242 Y380 K415 L416 G418	L242-N378 HydrophobicContact CB-CB 4.14Å; L242-N378 HydrophobicContact CD2-CB 4.43Å; L242-N378 PolarHBondContact N-O 2.98Å; L242-N378 PolarHBondContact O-N 3.35Å; N378-Y380 HydrophobicContact CB-CE1 4.41Å; N378-K415 PolarHBondContact ND2-O 3.31Å; N378-L416 PolarHBondContact ND2-O 3.22Å; N378-G418 WeakPolarHBondContact ND2-CA 3.45Å; N378-G418 PolarHBondContact ND2-N 3.38Å; N378-G418 VanDerWaalsContact ND2-N 3.1Å
379	R	90.6	Very high	80.9	Confident	103 Å²	103	55.6 Å²	55.6	39%	0.389	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	132.9	177.7	-176.7	-179.1	85.3	-179.6	6.7	110.1	D239 I240 Y241 T381	D239-R379 HydrophobicContact CB-CG 3.86Å; D239-R379 VanDerWaalsContact OD2-CD 3.27Å; D239-R379 WeakPolarHBondContact OD2-CD 3.21Å; D239-R379 IonicContact OD2-CZ 3.26Å; D239-R379 IonicContact OD2-NE 2.65Å; D239-R379 PolarHBondContact OD2-NE 2.7Å; I240-R379 WeakPolarHBondContact O-CA 3.21Å; Y241-R379 HydrophobicContact CD1-CB 4.05Å; Y241-R379 HydrophobicContact CD1-CG 3.94Å; Y241-R379 HydrophobicContact CE1-CB 3.91Å; Y241-R379 VanDerWaalsContact CE1-CD 3.47Å; Y241-R379 HydrophobicContact CE1-CG 3.43Å; Y241-R379 VanDerWaalsContact CE1-CG 3.43Å; R379-T381 HydrophobicContact CG-CG2 4.12Å
380	Y	90.8	Very high	81.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.2	-180	-47.1	-75.2	0	0	0	110.7	L232 D239 I240 L242 N378 V401 W413 K415	L232-Y380 HydrophobicContact CD2-CD2 4.41Å; L232-Y380 HydrophobicContact CD2-CE2 3.82Å; D239-Y380 WeakPolarHBondContact CB-O 3.3Å; I240-Y380 HydrophobicContact CB-CD2 4.1Å; I240-Y380 HydrophobicContact CG2-CD2 3.89Å; I240-Y380 PolarHBondContact N-O 3.43Å; I240-Y380 PolarHBondContact O-N 3.02Å; L242-Y380 HydrophobicContact CB-CE2 3.86Å; L242-Y380 WeakPolarHBondContact CD2-OH 3.37Å; N378-Y380 HydrophobicContact CB-CE1 4.41Å; Y380-V401 HydrophobicContact CD2-CB 4.41Å; Y380-V401 HydrophobicContact CD2-CG1 4.03Å; Y380-V401 HydrophobicContact CD2-CG2 4.49Å; Y380-V401 HydrophobicContact CE1-CB 4.35Å; Y380-V401 HydrophobicContact CE1-CG2 4.2Å; Y380-V401 HydrophobicContact CE2-CB 4.12Å; Y380-V401 HydrophobicContact CE2-CG1 4.05Å; Y380-V401 HydrophobicContact CE2-CG2 3.74Å; Y380-V401 HydrophobicContact CG-CG1 4.46Å; Y380-W413 HydrophobicContact CD1-CB 3.5Å; Y380-W413 VanDerWaalsContact CD1-CB 3.5Å; Y380-W413 HydrophobicContact CD1-CD2 4.34Å; Y380-W413 AromaticContact CD1-CG 3.71Å; Y380-W413 HydrophobicContact CD1-CG 3.71Å; Y380-W413 HydrophobicContact CE1-CB 4.04Å; Y380-W413 HydrophobicContact CG-CB 4.3Å; Y380-W413 HydrophobicContact CG-CD2 4.31Å; Y380-W413 HydrophobicContact CG-CG 4.14Å; Y380-K415 WeakPolarHBondContact OH-CA 3.45Å; Y380-K415 PolarHBondContact OH-O 2.79Å
381	T	86.9	Confident	82.6	Confident	55 Å²	55	46 Å²	46	34%	0.337	23%	0.233	S	C	.	.			trans	-116.2	169.7	-171.4	64	0	0	0	0	111.3	D239 R379 W413	D239-T381 WeakPolarHBondContact OD2-CG2 3.26Å; R379-T381 HydrophobicContact CG-CG2 4.12Å; T381-W413 WeakPolarHBondContact O-CZ2 3.28Å; T381-W413 PolarHBondContact O-NE1 3.03Å
382	G	81.2	Confident	83.7	Confident	16 Å²	16	46.1 Å²	46.1	17%	0.165	23%	0.233	C	C	.	.	S	Bend	trans	103.6	-34.7	174.1	0	0	0	0	0	113.9	T278	T278-G382 VanDerWaalsContact CB-O 3.24Å; T278-G382 WeakPolarHBondContact CB-O 3.31Å; T278-G382 WeakPolarHBondContact CG2-O 3.14Å
383	H	83.8	Confident	85	Confident	11 Å²	11	43.7 Å²	43.7	5%	0.051	22%	0.217	C	C	.	.			trans	-72.8	162.4	173.2	83.1	-57	0	0	0	112.3	I240 F411 W413	I240-H383 VanDerWaalsContact CD1-CE1 3.46Å; I240-H383 WeakPolarHBondContact CD1-CE1 3.41Å; I240-H383 WeakPolarHBondContact CD1-NE2 3.09Å; H383-F411 HydrophobicContact CB-CD2 3.85Å; H383-F411 HydrophobicContact CB-CE2 4.17Å; H383-F411 HydrophobicContact CB-CG 4.11Å; H383-W413 HydrophobicContact CB-CH2 3.8Å; H383-W413 HydrophobicContact CB-CZ2 3.95Å; H383-W413 AromaticContact CG-CH2 3.81Å; H383-W413 AromaticContact ND1-CH2 3.94Å; H383-W413 AromaticContact ND1-CZ2 3.98Å
384	R	84.3	Confident	85.9	Confident	62 Å²	62	42.3 Å²	42.3	23%	0.234	21%	0.211	C	C	.	.			trans	-120	133.1	179.6	-77.2	178	165	-126.4	-27.1	111.4	D277 T278 K391 S405 D406	D277-R384 VanDerWaalsContact CG-NE 3.26Å; D277-R384 VanDerWaalsContact O-CZ 3.32Å; D277-R384 PolarHBondContact O-NE 2.77Å; D277-R384 PolarHBondContact O-NH2 3.2Å; D277-R384 IonicContact OD1-NE 3.81Å; D277-R384 IonicContact OD2-CZ 2.79Å; D277-R384 IonicContact OD2-NE 3.02Å; D277-R384 PolarHBondContact OD2-NE 2.93Å; D277-R384 IonicContact OD2-NH1 2.6Å; D277-R384 PolarHBondContact OD2-NH1 3.45Å; D277-R384 IonicContact OD2-NH2 3.54Å; T278-R384 HydrophobicContact CG2-CG 4.21Å; R384-K391 WeakPolarHBondContact O-CE 3.17Å; R384-S405 PolarHBondContact N-OG 3.33Å; R384-D406 HydrophobicContact CB-CB 3.9Å; R384-D406 VanDerWaalsContact O-CG 3.27Å; R384-D406 PolarHBondContact O-N 3.29Å
385	N	85.8	Confident	86.6	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	21%	0.212	C	C	.	.			trans	-137.5	55.7	-176.3	-170.1	10.1	0	0	0	112.4	T220 S234 F235 S236 R237 K391	T220-N385 PolarHBondContact OG1-ND2 3.09Å; S234-N385 PolarHBondContact OG-ND2 2.88Å; F235-N385 PolarHBondContact O-ND2 3.33Å; F235-N385 VanDerWaalsContact O-ND2 3.14Å; S236-N385 CarbonylContact C-O 3.57Å; S236-N385 WeakPolarHBondContact CA-O 2.94Å; R237-N385 PolarHBondContact N-O 2.8Å; N385-K391 HydrophobicContact CB-CD 3.92Å; N385-K391 VanDerWaalsContact OD1-CB 3.26Å; N385-K391 WeakPolarHBondContact OD1-CB 3.18Å; N385-K391 WeakPolarHBondContact OD1-CE 3.47Å
386	C	81.7	Confident	86.8	Confident	61 Å²	61	41.6 Å²	41.6	41%	0.412	20%	0.203	S	C	.	.	S	Bend	trans	-123.4	-12.6	-177.2	64.5	0	0	0	0	114.9	R237 D406	R237-C386 HydrophobicContact CG-CB 3.78Å; C386-D406 PolarHBondContact N-OD2 3.45Å
387	R	76.1	Confident	86.7	Confident	145 Å²	145	42.8 Å²	42.8	55%	0.547	22%	0.223	S	C	.	.	S	Bend	trans	-91.6	-33.6	-178.7	-64.8	-171.1	172.7	161.5	-10.2	113.7	D406	R387-D406 HydrophobicContact CB-CB 4.29Å; R387-D406 HydrophobicContact CG-CB 4.03Å; R387-D406 PolarHBondContact N-OD2 2.81Å; R387-D406 PolarHBondContact NH1-O 2.92Å
388	T	77.7	Confident	86.4	Confident	21 Å²	21	43.2 Å²	43.2	13%	0.129	24%	0.242	C	C	.	.			trans	-122.4	162.7	-178.3	62.5	0	0	0	0	111.5	K391 V430 N432 I448	T388-K391 PolarHBondContact OG1-NZ 2.91Å; T388-V430 HydrophobicContact CG2-CG1 3.93Å; T388-N432 WeakPolarHBondContact CB-OD1 3.29Å; T388-N432 WeakPolarHBondContact CG2-OD1 3.44Å; T388-N432 PolarHBondContact OG1-OD1 2.8Å; T388-I448 HydrophobicContact CG2-CD1 4.23Å
389	K	75.8	Confident	86.3	Confident	155 Å²	155	46.8 Å²	46.8	67%	0.674	26%	0.257	S	S	*	.	S	Bend	trans	-106.7	5	-175.7	-62.5	-169.7	172.7	-173.2	0	114.1	Q218	Q218-K389 VanDerWaalsContact NE2-CG 3.3Å
390	C	78	Confident	86.4	Confident	49 Å²	49	43.6 Å²	43.6	33%	0.331	25%	0.245	S	C	.	.			trans	-128.3	23.6	-169.4	54.5	0	0	0	0	113.1	E392	C390-E392 PolarHBondContact O-N 2.93Å
391	K	87.7	Confident	86.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.245	C	C	.	.			trans	-73.2	124	-175.7	-157.8	171.9	-56.2	-58.6	0	111.3	T220 S221 R384 N385 T388 G404 D406 V431 N432	T220-K391 PolarHBondContact OG1-O 3.32Å; S221-K391 WeakPolarHBondContact CB-O 2.87Å; S221-K391 PolarHBondContact OG-O 3.47Å; R384-K391 WeakPolarHBondContact O-CE 3.17Å; N385-K391 HydrophobicContact CB-CD 3.92Å; N385-K391 VanDerWaalsContact OD1-CB 3.26Å; N385-K391 WeakPolarHBondContact OD1-CB 3.18Å; N385-K391 WeakPolarHBondContact OD1-CE 3.47Å; T388-K391 PolarHBondContact OG1-NZ 2.91Å; K391-G404 WeakPolarHBondContact CD-O 3.46Å; K391-D406 WeakPolarHBondContact CE-OD1 3.42Å; K391-D406 IonicContact NZ-OD1 2.7Å; K391-D406 PolarHBondContact NZ-OD1 2.95Å; K391-V431 PolarHBondContact NZ-O 2.61Å; K391-N432 PolarHBondContact NZ-OD1 3.08Å
392	E	93.8	Very high	87.1	Confident	25 Å²	25	41 Å²	41	12%	0.117	23%	0.229	C	C	.	.			trans	-89.1	144.6	-177.9	-63.6	178.6	176.8	0	0	112	C390 S403 N432 C433 V434 Q435	C390-E392 PolarHBondContact O-N 2.93Å; E392-S403 WeakPolarHBondContact O-CB 3.43Å; E392-S403 PolarHBondContact O-OG 3.3Å; E392-N432 PolarHBondContact N-O 3.34Å; E392-C433 PolarHBondContact OE1-SG 2.82Å; E392-C433 WeakPolarHBondContact OE2-CA 3.39Å; E392-V434 HydrophobicContact CB-CG2 4.18Å; E392-V434 PolarHBondContact OE2-N 2.86Å; E392-Q435 PolarHBondContact OE2-NE2 2.86Å
393	A	96.3	Very high	87.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.3	162.3	0	0	0	0	0	108.6	S221 I240 I402	S221-A393 PolarHBondContact OG-N 2.93Å; S221-A393 VanDerWaalsContact OG-N 3.11Å; I240-A393 HydrophobicContact CD1-CB 3.77Å; I240-A393 HydrophobicContact CG1-CB 3.94Å; I240-A393 HydrophobicContact CG2-CB 3.86Å; A393-I402 WeakPolarHBondContact CA-O 3.47Å
394	N	97.1	Very high	88.1	Confident	11 Å²	11	39.7 Å²	39.7	6%	0.059	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	155.5	-175.5	-86.9	-70.5	0	0	0	112	Q223 V401 I402 V434 Q435 P436	Q223-N394 WeakPolarHBondContact CG-OD1 3.38Å; N394-V401 WeakPolarHBondContact O-CA 3.33Å; N394-I402 HydrophobicContact CB-CG1 4.06Å; N394-I402 PolarHBondContact N-O 3.39Å; N394-I402 PolarHBondContact O-N 3.22Å; N394-V434 PolarHBondContact ND2-O 2.8Å; N394-Q435 PolarHBondContact ND2-NE2 3.26Å; N394-P436 HydrophobicContact CB-CG 4.03Å
395	F	95.3	Very high	88.4	Confident	17 Å²	17	36.7 Å²	36.7	8%	0.075	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.4	168	-65.6	-86.4	0	0	0	109.5	Q223 A225 E230 L232 L242 K415 P436	Q223-F395 HydrophobicContact CG-CD2 4.38Å; Q223-F395 WeakPolarHBondContact O-CE2 3.19Å; A225-F395 VanDerWaalsContact CA-CE2 3.4Å; A225-F395 HydrophobicContact CB-CD2 4.27Å; A225-F395 HydrophobicContact CB-CE1 4.11Å; A225-F395 HydrophobicContact CB-CE2 3.79Å; A225-F395 HydrophobicContact CB-CZ 3.68Å; A225-F395 VanDerWaalsContact N-CE2 3.27Å; E230-F395 HydrophobicContact CB-CZ 4.26Å; L232-F395 HydrophobicContact CB-CE2 4.16Å; L232-F395 HydrophobicContact CB-CZ 4.32Å; L232-F395 HydrophobicContact CD1-CD1 3.97Å; L232-F395 HydrophobicContact CD1-CD2 3.66Å; L232-F395 HydrophobicContact CD1-CE1 3.95Å; L232-F395 HydrophobicContact CD1-CE2 3.63Å; L232-F395 HydrophobicContact CD1-CG 3.85Å; L232-F395 HydrophobicContact CD1-CZ 3.81Å; L232-F395 HydrophobicContact CD2-CZ 4.42Å; L232-F395 HydrophobicContact CG-CD1 4.42Å; L232-F395 HydrophobicContact CG-CD2 4.2Å; L232-F395 HydrophobicContact CG-CE1 3.88Å; L232-F395 HydrophobicContact CG-CE2 3.62Å; L232-F395 HydrophobicContact CG-CZ 3.47Å; L232-F395 VanDerWaalsContact CG-CZ 3.47Å; L242-F395 HydrophobicContact CD1-CE1 3.65Å; L242-F395 HydrophobicContact CD1-CZ 3.75Å; F395-K415 HydrophobicContact CD1-CD 4.15Å; F395-K415 HydrophobicContact CE1-CD 4.2Å; F395-P436 WeakPolarHBondContact O-CG 3.49Å
396	W	90	Very high	88.4	Confident	14 Å²	14	36.7 Å²	36.7	5%	0.053	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	101	173.2	-168.7	26	0	0	0	110.4	M1 Y400 I402 V412 P436 F485	M1-W396 HydrophobicContact CE-CH2 3.54Å; M1-W396 HydrophobicContact CE-CZ2 4.42Å; M1-W396 HydrophobicContact CE-CZ3 3.97Å; M1-W396 HydrophobicContact CG-CH2 4.44Å; M1-W396 HydrophobicContact SD-CH2 3.43Å; M1-W396 WeakPolarHBondContact SD-CH2 3.38Å; M1-W396 HydrophobicContact SD-CZ2 3.92Å; M1-W396 HydrophobicContact SD-CZ3 4.43Å; W396-Y400 PolarHBondContact N-O 2.74Å; W396-Y400 PolarHBondContact O-N 3.48Å; W396-I402 HydrophobicContact CB-CD1 4.39Å; W396-I402 HydrophobicContact CB-CG1 4.38Å; W396-I402 HydrophobicContact CB-CG2 3.57Å; W396-I402 HydrophobicContact CD2-CG2 4.1Å; W396-I402 HydrophobicContact CE3-CG2 3.61Å; W396-I402 HydrophobicContact CG-CG2 4.16Å; W396-V412 HydrophobicContact CE3-CG1 4Å; W396-V412 HydrophobicContact CE3-CG2 4.39Å; W396-V412 HydrophobicContact CZ3-CG1 4.12Å; W396-V412 HydrophobicContact CZ3-CG2 4.08Å; W396-P436 HydrophobicContact CB-CG 4.32Å; W396-P436 HydrophobicContact CG-CG 4.47Å; W396-F485 HydrophobicContact CE3-CE2 4.43Å; W396-F485 HydrophobicContact CH2-CD1 4.31Å; W396-F485 HydrophobicContact CH2-CD2 4.35Å; W396-F485 AromaticContact CH2-CE1 3.51Å; W396-F485 HydrophobicContact CH2-CE1 3.51Å; W396-F485 AromaticContact CH2-CE2 3.57Å; W396-F485 HydrophobicContact CH2-CE2 3.57Å; W396-F485 AromaticContact CH2-CZ 3.08Å; W396-F485 HydrophobicContact CH2-CZ 3.08Å; W396-F485 HydrophobicContact CZ2-CE1 4.1Å; W396-F485 HydrophobicContact CZ2-CE2 4.44Å; W396-F485 AromaticContact CZ2-CZ 3.66Å; W396-F485 HydrophobicContact CZ2-CZ 3.66Å; W396-F485 HydrophobicContact CZ3-CD2 4.26Å; W396-F485 HydrophobicContact CZ3-CE1 4.33Å; W396-F485 AromaticContact CZ3-CE2 3.57Å; W396-F485 HydrophobicContact CZ3-CE2 3.57Å; W396-F485 AromaticContact CZ3-CZ 3.62Å; W396-F485 HydrophobicContact CZ3-CZ 3.62Å
397	G	84.6	Confident	88.4	Confident	60 Å²	60	34.6 Å²	34.6	62%	0.619	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	-156.4	-164.4	0	0	0	0	0	111.7
398	G	85.3	Confident	88.9	Confident	70 Å²	70	27.8 Å²	27.8	72%	0.722	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-4.3	179.6	0	0	0	0	0	115.3
399	K	89.3	Confident	89.4	Confident	104 Å²	104	28.9 Å²	28.9	45%	0.452	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-16.8	-166.5	-66.7	-175.3	-177.9	175.3	0	114.7	K415	K399-K415 WeakPolarHBondContact O-CB 3.48Å; K399-K415 PolarHBondContact O-N 3.03Å
400	Y	93.5	Very high	90.1	Very high	35 Å²	35	21.5 Å²	21.5	14%	0.137	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	152.9	-171.7	-52.7	-70	0	0	0	111.9	W396 V412 W413 V421 I484	W396-Y400 PolarHBondContact N-O 2.74Å; W396-Y400 PolarHBondContact O-N 3.48Å; Y400-V412 HydrophobicContact CD1-CG1 4.33Å; Y400-V412 HydrophobicContact CG-CG1 4.28Å; Y400-W413 WeakPolarHBondContact CA-O 3.45Å; Y400-W413 WeakPolarHBondContact CB-O 3.3Å; Y400-V421 HydrophobicContact CD1-CG2 4Å; Y400-V421 HydrophobicContact CE1-CG2 4.05Å; Y400-I484 HydrophobicContact CE2-CD1 4.25Å
401	V	95.8	Very high	90.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.2	167.8	174.3	0	0	0	0	107.1	L232 Y380 N394 V412 W413 K415	L232-V401 HydrophobicContact CD1-CG1 3.83Å; L232-V401 HydrophobicContact CD1-CG2 4.13Å; L232-V401 HydrophobicContact CD2-CG1 3.9Å; L232-V401 HydrophobicContact CD2-CG2 3.95Å; Y380-V401 HydrophobicContact CD2-CB 4.41Å; Y380-V401 HydrophobicContact CD2-CG1 4.03Å; Y380-V401 HydrophobicContact CD2-CG2 4.49Å; Y380-V401 HydrophobicContact CE1-CB 4.35Å; Y380-V401 HydrophobicContact CE1-CG2 4.2Å; Y380-V401 HydrophobicContact CE2-CB 4.12Å; Y380-V401 HydrophobicContact CE2-CG1 4.05Å; Y380-V401 HydrophobicContact CE2-CG2 3.74Å; Y380-V401 HydrophobicContact CG-CG1 4.46Å; N394-V401 WeakPolarHBondContact O-CA 3.33Å; V401-V412 WeakPolarHBondContact O-CA 3.42Å; V401-W413 HydrophobicContact CG1-CE3 4.31Å; V401-W413 PolarHBondContact N-O 3.25Å; V401-W413 PolarHBondContact O-N 3.2Å; V401-K415 HydrophobicContact CG2-CB 4.17Å; V401-K415 HydrophobicContact CG2-CG 4.12Å
402	I	95.7	Very high	90.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	148.1	179.8	69.8	167.1	0	0	0	111.1	A393 N394 W396 F411 V412 V434 P436 L443	A393-I402 WeakPolarHBondContact CA-O 3.47Å; N394-I402 HydrophobicContact CB-CG1 4.06Å; N394-I402 PolarHBondContact N-O 3.39Å; N394-I402 PolarHBondContact O-N 3.22Å; W396-I402 HydrophobicContact CB-CD1 4.39Å; W396-I402 HydrophobicContact CB-CG1 4.38Å; W396-I402 HydrophobicContact CB-CG2 3.57Å; W396-I402 HydrophobicContact CD2-CG2 4.1Å; W396-I402 HydrophobicContact CE3-CG2 3.61Å; W396-I402 HydrophobicContact CG-CG2 4.16Å; I402-F411 VanDerWaalsContact CA-O 3.31Å; I402-F411 WeakPolarHBondContact CA-O 3.43Å; I402-V412 HydrophobicContact CG2-CB 4.4Å; I402-V412 HydrophobicContact CG2-CG1 4.08Å; I402-V412 HydrophobicContact CG2-CG2 4.06Å; I402-V434 HydrophobicContact CD1-CB 3.91Å; I402-V434 HydrophobicContact CD1-CG2 4.32Å; I402-V434 HydrophobicContact CG1-CB 4.33Å; I402-V434 HydrophobicContact CG1-CG2 4.2Å; I402-P436 HydrophobicContact CD1-CG 3.68Å; I402-P436 HydrophobicContact CG1-CG 4.35Å; I402-L443 HydrophobicContact CD1-CD1 3.3Å; I402-L443 HydrophobicContact CD1-CD2 3.99Å; I402-L443 HydrophobicContact CD1-CG 4.26Å
403	S	96	Very high	90.8	Very high	0 Å²	0	18 Å²	18	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	150.4	172.5	-168.9	0	0	0	0	111	E392 I410 F411	E392-S403 WeakPolarHBondContact O-CB 3.43Å; E392-S403 PolarHBondContact O-OG 3.3Å; S403-I410 WeakPolarHBondContact O-CA 3.45Å; S403-F411 PolarHBondContact N-O 2.79Å; S403-F411 VanDerWaalsContact N-O 3.11Å; S403-F411 PolarHBondContact O-N 3.01Å
404	G	91.1	Very high	90.6	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	173.5	165.9	0	0	0	0	0	111.9	K391 R409	K391-G404 WeakPolarHBondContact CD-O 3.46Å; G404-R409 CarbonylContact C-O 3.59Å
405	S	90.2	Very high	90.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.127	C	C	.	.			trans	-144.3	155.5	178.4	-174.9	0	0	0	0	111.2	R384 C407 G408 R409 V431	R384-S405 PolarHBondContact N-OG 3.33Å; S405-C407 VanDerWaalsContact CB-SG 3.56Å; S405-C407 PolarHBondContact O-N 2.95Å; S405-C407 VanDerWaalsContact O-N 3.13Å; S405-C407 PolarHBondContact OG-SG 3.32Å; S405-G408 PolarHBondContact O-N 2.78Å; S405-R409 WeakPolarHBondContact CB-O 3.3Å; S405-R409 PolarHBondContact N-O 3.23Å; S405-V431 PolarHBondContact O-N 3.38Å
406	D	86.3	Confident	90.3	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-4.2	174.9	-69.7	-18.8	0	0	0	114.7	R384 C386 R387 K391 H429 V430	R384-D406 HydrophobicContact CB-CB 3.9Å; R384-D406 VanDerWaalsContact O-CG 3.27Å; R384-D406 PolarHBondContact O-N 3.29Å; C386-D406 PolarHBondContact N-OD2 3.45Å; R387-D406 HydrophobicContact CB-CB 4.29Å; R387-D406 HydrophobicContact CG-CB 4.03Å; R387-D406 PolarHBondContact N-OD2 2.81Å; R387-D406 PolarHBondContact NH1-O 2.92Å; K391-D406 WeakPolarHBondContact CE-OD1 3.42Å; K391-D406 IonicContact NZ-OD1 2.7Å; K391-D406 PolarHBondContact NZ-OD1 2.95Å; D406-H429 CarbonylContact C-O 3.28Å; D406-V430 HydrophobicContact CB-CG2 4.48Å
407	C	81.7	Confident	90.4	Very high	17 Å²	17	29.2 Å²	29.2	12%	0.115	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	5.5	171.5	66.3	0	0	0	0	113.6	S405 R409 H429	S405-C407 VanDerWaalsContact CB-SG 3.56Å; S405-C407 PolarHBondContact O-N 2.95Å; S405-C407 VanDerWaalsContact O-N 3.13Å; S405-C407 PolarHBondContact OG-SG 3.32Å; C407-R409 PolarHBondContact O-N 2.91Å; C407-H429 CarbonylContact C-O 3.59Å; C407-H429 VanDerWaalsContact C-O 3.22Å
408	G	85.6	Confident	90.7	Very high	1 Å²	1	27 Å²	27	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	81.5	1	179.7	0	0	0	0	0	112.8	S405 G426 D427 H429 V431	S405-G408 PolarHBondContact O-N 2.78Å; G408-G426 CarbonylContact O-C 3.47Å; G408-G426 WeakPolarHBondContact O-CA 3.46Å; G408-G426 PolarHBondContact O-N 3.04Å; G408-D427 WeakPolarHBondContact CA-O 3.27Å; G408-D427 PolarHBondContact O-N 2.85Å; G408-H429 VanDerWaalsContact CA-O 3.31Å; G408-H429 WeakPolarHBondContact CA-O 3.47Å; G408-H429 PolarHBondContact N-O 3.06Å; G408-V431 WeakPolarHBondContact O-CG2 3.49Å
409	R	88.6	Confident	90.9	Very high	45 Å²	45	28.1 Å²	28.1	17%	0.17	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	155.9	178.9	-61	-174.5	173.9	107.6	1.9	112.6	W275 G404 S405 C407 F411 V423 H424 E425	W275-R409 VanDerWaalsContact CZ3-NH1 3.33Å; G404-R409 CarbonylContact C-O 3.59Å; S405-R409 WeakPolarHBondContact CB-O 3.3Å; S405-R409 PolarHBondContact N-O 3.23Å; C407-R409 PolarHBondContact O-N 2.91Å; R409-F411 HydrophobicContact CB-CE2 4.15Å; R409-V423 HydrophobicContact CB-CG1 3.78Å; R409-V423 HydrophobicContact CG-CG1 4.24Å; R409-H424 CarbonylContact C-O 3.57Å; R409-H424 WeakPolarHBondContact CA-O 3.35Å; R409-H424 WeakPolarHBondContact CB-O 3.32Å; R409-E425 IonicContact NE-OE1 2.68Å; R409-E425 IonicContact NH2-OE1 2.81Å; R409-E425 PolarHBondContact NH2-OE1 2.84Å
410	I	90.2	Very high	90.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.5	170.6	-59.6	171.9	0	0	0	107.1	S403 V423 H424 V431 V434 L443 W455	S403-I410 WeakPolarHBondContact O-CA 3.45Å; I410-V423 CarbonylContact O-C 3.52Å; I410-V423 WeakPolarHBondContact O-CA 3.49Å; I410-H424 PolarHBondContact N-O 3.49Å; I410-H424 PolarHBondContact O-N 2.81Å; I410-V431 HydrophobicContact CG1-CG1 4.09Å; I410-V431 HydrophobicContact CG1-CG2 4.17Å; I410-V434 HydrophobicContact CD1-CG1 4.36Å; I410-V434 HydrophobicContact CG1-CG1 4.28Å; I410-V434 HydrophobicContact CG2-CG1 4.18Å; I410-L443 HydrophobicContact CD1-CD2 4.15Å; I410-L443 HydrophobicContact CG2-CD2 4.16Å; I410-W455 HydrophobicContact CD1-CZ2 3.81Å
411	F	90.6	Very high	90.4	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	140.7	176.8	-76.3	-106.8	0	0	0	109.7	H383 I402 S403 R409 W413 I420 V423	H383-F411 HydrophobicContact CB-CD2 3.85Å; H383-F411 HydrophobicContact CB-CE2 4.17Å; H383-F411 HydrophobicContact CB-CG 4.11Å; I402-F411 VanDerWaalsContact CA-O 3.31Å; I402-F411 WeakPolarHBondContact CA-O 3.43Å; S403-F411 PolarHBondContact N-O 2.79Å; S403-F411 VanDerWaalsContact N-O 3.11Å; S403-F411 PolarHBondContact O-N 3.01Å; R409-F411 HydrophobicContact CB-CE2 4.15Å; F411-W413 HydrophobicContact CB-CD2 4.34Å; F411-W413 HydrophobicContact CB-CE3 4.12Å; F411-W413 HydrophobicContact CB-CH2 3.2Å; F411-W413 HydrophobicContact CB-CZ2 3.42Å; F411-W413 VanDerWaalsContact CB-CZ2 3.42Å; F411-W413 HydrophobicContact CB-CZ3 3.56Å; F411-W413 AromaticContact CD1-CZ2 4Å; F411-W413 HydrophobicContact CD1-CZ2 4Å; F411-W413 HydrophobicContact CG-CH2 4.01Å; F411-W413 AromaticContact CG-CZ2 3.91Å; F411-W413 HydrophobicContact CG-CZ2 3.91Å; F411-I420 HydrophobicContact CD1-CD1 3.87Å; F411-I420 HydrophobicContact CD1-CG1 4.21Å; F411-I420 HydrophobicContact CD1-CG2 4.37Å; F411-I420 HydrophobicContact CE1-CD1 3.94Å; F411-V423 HydrophobicContact CD1-CG2 3.86Å; F411-V423 HydrophobicContact CD2-CG1 4.43Å; F411-V423 HydrophobicContact CE1-CG1 4.34Å; F411-V423 HydrophobicContact CE1-CG2 3.89Å; F411-V423 HydrophobicContact CE2-CG1 4.22Å; F411-V423 HydrophobicContact CG-CG2 4.47Å; F411-V423 HydrophobicContact CZ-CG1 4.19Å
412	V	91.5	Very high	89.8	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121.9	174.8	-174.1	0	0	0	0	107.7	W396 Y400 V401 I402 I420 V421 A422	W396-V412 HydrophobicContact CE3-CG1 4Å; W396-V412 HydrophobicContact CE3-CG2 4.39Å; W396-V412 HydrophobicContact CZ3-CG1 4.12Å; W396-V412 HydrophobicContact CZ3-CG2 4.08Å; Y400-V412 HydrophobicContact CD1-CG1 4.33Å; Y400-V412 HydrophobicContact CG-CG1 4.28Å; V401-V412 WeakPolarHBondContact O-CA 3.42Å; I402-V412 HydrophobicContact CG2-CB 4.4Å; I402-V412 HydrophobicContact CG2-CG1 4.08Å; I402-V412 HydrophobicContact CG2-CG2 4.06Å; V412-I420 WeakPolarHBondContact O-CA 3.48Å; V412-V421 HydrophobicContact CB-CG2 4.16Å; V412-V421 HydrophobicContact CG1-CG2 3.74Å; V412-V421 WeakPolarHBondContact O-CG2 3.29Å; V412-V421 PolarHBondContact O-N 2.92Å; V412-A422 HydrophobicContact CB-CB 4.1Å; V412-A422 HydrophobicContact CG2-CB 4.24Å; V412-A422 PolarHBondContact N-O 3.22Å; V412-A422 PolarHBondContact O-N 3.03Å
413	W	92.2	Very high	89.3	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	147.1	176.7	-60.2	-95.9	0	0	0	111.1	I240 Y380 T381 H383 Y400 V401 F411 K415 D419 I420	I240-W413 HydrophobicContact CD1-CH2 3.96Å; I240-W413 HydrophobicContact CD1-CZ3 4.04Å; Y380-W413 HydrophobicContact CD1-CB 3.5Å; Y380-W413 VanDerWaalsContact CD1-CB 3.5Å; Y380-W413 HydrophobicContact CD1-CD2 4.34Å; Y380-W413 AromaticContact CD1-CG 3.71Å; Y380-W413 HydrophobicContact CD1-CG 3.71Å; Y380-W413 HydrophobicContact CE1-CB 4.04Å; Y380-W413 HydrophobicContact CG-CB 4.3Å; Y380-W413 HydrophobicContact CG-CD2 4.31Å; Y380-W413 HydrophobicContact CG-CG 4.14Å; T381-W413 WeakPolarHBondContact O-CZ2 3.28Å; T381-W413 PolarHBondContact O-NE1 3.03Å; H383-W413 HydrophobicContact CB-CH2 3.8Å; H383-W413 HydrophobicContact CB-CZ2 3.95Å; H383-W413 AromaticContact CG-CH2 3.81Å; H383-W413 AromaticContact ND1-CH2 3.94Å; H383-W413 AromaticContact ND1-CZ2 3.98Å; Y400-W413 WeakPolarHBondContact CA-O 3.45Å; Y400-W413 WeakPolarHBondContact CB-O 3.3Å; V401-W413 HydrophobicContact CG1-CE3 4.31Å; V401-W413 PolarHBondContact N-O 3.25Å; V401-W413 PolarHBondContact O-N 3.2Å; F411-W413 HydrophobicContact CB-CD2 4.34Å; F411-W413 HydrophobicContact CB-CE3 4.12Å; F411-W413 HydrophobicContact CB-CH2 3.2Å; F411-W413 HydrophobicContact CB-CZ2 3.42Å; F411-W413 VanDerWaalsContact CB-CZ2 3.42Å; F411-W413 HydrophobicContact CB-CZ3 3.56Å; F411-W413 AromaticContact CD1-CZ2 4Å; F411-W413 HydrophobicContact CD1-CZ2 4Å; F411-W413 HydrophobicContact CG-CH2 4.01Å; F411-W413 AromaticContact CG-CZ2 3.91Å; F411-W413 HydrophobicContact CG-CZ2 3.91Å; W413-K415 PolarHBondContact O-N 3.02Å; W413-D419 CarbonylContact C-O 3.47Å; W413-D419 WeakPolarHBondContact CA-O 3.29Å; W413-I420 VanDerWaalsContact CD1-CG1 3.4Å; W413-I420 HydrophobicContact CG-CG1 4.36Å
414	N	91.7	Very high	88.7	Confident	43 Å²	43	25 Å²	25	23%	0.23	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	121.6	159.5	-175.5	-53.6	0	0	0	108.7	L416 T417 G418 D419 V421	N414-L416 VanDerWaalsContact C-N 3.28Å; N414-L416 PolarHBondContact O-N 3.3Å; N414-L416 PolarHBondContact OD1-N 3.11Å; N414-T417 WeakPolarHBondContact CB-OG1 3.22Å; N414-T417 PolarHBondContact OD1-N 2.98Å; N414-T417 VanDerWaalsContact OD1-N 3.09Å; N414-G418 WeakPolarHBondContact O-CA 3.44Å; N414-G418 PolarHBondContact O-N 3Å; N414-D419 PolarHBondContact N-O 3.19Å; N414-V421 HydrophobicContact CB-CG1 3.87Å
415	K	93.9	Very high	88.4	Confident	16 Å²	16	31.4 Å²	31.4	7%	0.07	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-37.4	-175.7	179.1	175.7	170.5	-77.3	0	112.5	E230 L242 N378 Y380 F395 K399 V401 W413	E230-K415 WeakPolarHBondContact OE1-CE 3.27Å; E230-K415 IonicContact OE1-NZ 3.12Å; E230-K415 PolarHBondContact OE1-NZ 3.29Å; E230-K415 WeakPolarHBondContact OE2-CE 3.45Å; E230-K415 IonicContact OE2-NZ 2.81Å; E230-K415 PolarHBondContact OE2-NZ 2.87Å; L242-K415 HydrophobicContact CD2-CG 3.93Å; N378-K415 PolarHBondContact ND2-O 3.31Å; Y380-K415 WeakPolarHBondContact OH-CA 3.45Å; Y380-K415 PolarHBondContact OH-O 2.79Å; F395-K415 HydrophobicContact CD1-CD 4.15Å; F395-K415 HydrophobicContact CE1-CD 4.2Å; K399-K415 WeakPolarHBondContact O-CB 3.48Å; K399-K415 PolarHBondContact O-N 3.03Å; V401-K415 HydrophobicContact CG2-CB 4.17Å; V401-K415 HydrophobicContact CG2-CG 4.12Å; W413-K415 PolarHBondContact O-N 3.02Å
416	L	92.9	Very high	88	Confident	140 Å²	140	31.4 Å²	31.4	73%	0.733	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-44	-175	-65.1	177.5	0	0	0	112.4	N378 N414	N378-L416 PolarHBondContact ND2-O 3.22Å; N414-L416 VanDerWaalsContact C-N 3.28Å; N414-L416 PolarHBondContact O-N 3.3Å; N414-L416 PolarHBondContact OD1-N 3.11Å
417	T	92.2	Very high	87.8	Confident	78 Å²	78	31.9 Å²	31.9	48%	0.479	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-22.9	-175.2	69.1	0	0	0	0	113.1	N414 D419	N414-T417 WeakPolarHBondContact CB-OG1 3.22Å; N414-T417 PolarHBondContact OD1-N 2.98Å; N414-T417 VanDerWaalsContact OD1-N 3.09Å; T417-D419 WeakPolarHBondContact CB-OD2 3.43Å; T417-D419 PolarHBondContact O-N 3.09Å; T417-D419 VanDerWaalsContact OG1-CG 3.27Å; T417-D419 PolarHBondContact OG1-N 2.7Å; T417-D419 PolarHBondContact OG1-OD2 3.14Å
418	G	89.6	Confident	87.6	Confident	13 Å²	13	38.6 Å²	38.6	13%	0.134	20%	0.201	C	C	.	.			trans	81.5	-1.3	-175.5	0	0	0	0	0	113.6	N378 N414	N378-G418 WeakPolarHBondContact ND2-CA 3.45Å; N378-G418 PolarHBondContact ND2-N 3.38Å; N378-G418 VanDerWaalsContact ND2-N 3.1Å; N414-G418 WeakPolarHBondContact O-CA 3.44Å; N414-G418 PolarHBondContact O-N 3Å
419	D	89.7	Confident	87.3	Confident	95 Å²	95	43.7 Å²	43.7	51%	0.508	22%	0.224	S	C	.	.			trans	-71.9	137.9	179.8	-57.8	-47.4	0	0	0	111	W413 N414 T417 V421	W413-D419 CarbonylContact C-O 3.47Å; W413-D419 WeakPolarHBondContact CA-O 3.29Å; N414-D419 PolarHBondContact N-O 3.19Å; T417-D419 WeakPolarHBondContact CB-OD2 3.43Å; T417-D419 PolarHBondContact O-N 3.09Å; T417-D419 VanDerWaalsContact OG1-CG 3.27Å; T417-D419 PolarHBondContact OG1-N 2.7Å; T417-D419 PolarHBondContact OG1-OD2 3.14Å; D419-V421 PolarHBondContact O-N 3.28Å
420	I	87.1	Confident	87.2	Confident	8 Å²	8	41.7 Å²	41.7	4%	0.041	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.1	166	-60.4	161.3	0	0	0	107.2	Y287 F411 V412 W413 V423	Y287-I420 WeakPolarHBondContact CD1-O 3.16Å; Y287-I420 HydrophobicContact CD2-CG2 4.39Å; Y287-I420 HydrophobicContact CE1-CB 4.34Å; Y287-I420 WeakPolarHBondContact CE1-O 3.44Å; Y287-I420 HydrophobicContact CE2-CB 3.85Å; Y287-I420 HydrophobicContact CE2-CG2 3.74Å; Y287-I420 WeakPolarHBondContact OH-CB 3.5Å; F411-I420 HydrophobicContact CD1-CD1 3.87Å; F411-I420 HydrophobicContact CD1-CG1 4.21Å; F411-I420 HydrophobicContact CD1-CG2 4.37Å; F411-I420 HydrophobicContact CE1-CD1 3.94Å; V412-I420 WeakPolarHBondContact O-CA 3.48Å; W413-I420 VanDerWaalsContact CD1-CG1 3.4Å; W413-I420 HydrophobicContact CG-CG1 4.36Å; I420-V423 HydrophobicContact CG2-CG2 3.56Å
421	V	86	Confident	87.1	Confident	34 Å²	34	41.7 Å²	41.7	21%	0.206	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-18.9	177.3	-63.8	0	0	0	0	112.2	Y400 V412 N414 D419	Y400-V421 HydrophobicContact CD1-CG2 4Å; Y400-V421 HydrophobicContact CE1-CG2 4.05Å; V412-V421 HydrophobicContact CB-CG2 4.16Å; V412-V421 HydrophobicContact CG1-CG2 3.74Å; V412-V421 WeakPolarHBondContact O-CG2 3.29Å; V412-V421 PolarHBondContact O-N 2.92Å; N414-V421 HydrophobicContact CB-CG1 3.87Å; D419-V421 PolarHBondContact O-N 3.28Å
422	A	83.1	Confident	87.1	Confident	10 Å²	10	41.7 Å²	41.7	8%	0.083	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	151.4	173.5	0	0	0	0	0	111.6	V412	V412-A422 HydrophobicContact CB-CB 4.1Å; V412-A422 HydrophobicContact CG2-CB 4.24Å; V412-A422 PolarHBondContact N-O 3.22Å; V412-A422 PolarHBondContact O-N 3.03Å
423	V	84.5	Confident	87.1	Confident	11 Å²	11	41.7 Å²	41.7	7%	0.067	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.7	169.3	-173.1	0	0	0	0	108	P284 R409 I410 F411 I420	P284-V423 HydrophobicContact CG-CB 4.46Å; R409-V423 HydrophobicContact CB-CG1 3.78Å; R409-V423 HydrophobicContact CG-CG1 4.24Å; I410-V423 CarbonylContact O-C 3.52Å; I410-V423 WeakPolarHBondContact O-CA 3.49Å; F411-V423 HydrophobicContact CD1-CG2 3.86Å; F411-V423 HydrophobicContact CD2-CG1 4.43Å; F411-V423 HydrophobicContact CE1-CG1 4.34Å; F411-V423 HydrophobicContact CE1-CG2 3.89Å; F411-V423 HydrophobicContact CE2-CG1 4.22Å; F411-V423 HydrophobicContact CG-CG2 4.47Å; F411-V423 HydrophobicContact CZ-CG1 4.19Å; I420-V423 HydrophobicContact CG2-CG2 3.56Å
424	H	84.6	Confident	87.2	Confident	10 Å²	10	41.7 Å²	41.7	5%	0.046	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.4	-175.9	-62.5	-53.3	0	0	0	112.3	M1 R409 I410 G426 W455	M1-H424 WeakPolarHBondContact CE-CD2 3.48Å; M1-H424 WeakPolarHBondContact CE-NE2 3.48Å; R409-H424 CarbonylContact C-O 3.57Å; R409-H424 WeakPolarHBondContact CA-O 3.35Å; R409-H424 WeakPolarHBondContact CB-O 3.32Å; I410-H424 PolarHBondContact N-O 3.49Å; I410-H424 PolarHBondContact O-N 2.81Å; H424-G426 PolarHBondContact O-N 2.86Å; H424-W455 HydrophobicContact CB-CH2 4.28Å; H424-W455 HydrophobicContact CB-CZ3 3.93Å
425	E	83.4	Confident	87.4	Confident	135 Å²	135	40.9 Å²	40.9	63%	0.631	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	84.9	180	-61.6	-162.4	151.2	0	0	112.6	K3 R409 W455	K3-E425 PolarHBondContact NZ-O 3Å; R409-E425 IonicContact NE-OE1 2.68Å; R409-E425 IonicContact NH2-OE1 2.81Å; R409-E425 PolarHBondContact NH2-OE1 2.84Å; E425-W455 VanDerWaalsContact O-CH2 3.31Å; E425-W455 WeakPolarHBondContact O-CH2 3.48Å
426	G	82.1	Confident	87.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.			trans	-60.4	-79.3	-177.4	0	0	0	0	0	114.7	K3 G408 H424 K453	K3-G426 PolarHBondContact NZ-O 3.45Å; G408-G426 CarbonylContact O-C 3.47Å; G408-G426 WeakPolarHBondContact O-CA 3.46Å; G408-G426 PolarHBondContact O-N 3.04Å; H424-G426 PolarHBondContact O-N 2.86Å; G426-K453 WeakPolarHBondContact O-CD 2.87Å; G426-K453 WeakPolarHBondContact O-CE 3.46Å
427	D	82	Confident	87.2	Confident	12 Å²	12	35 Å²	35	6%	0.064	18%	0.183	C	C	.	.			trans	-120.8	167.8	-176.2	-79.5	17.8	0	0	0	110.1	G408 H429 V431 G447 D449 K453	G408-D427 WeakPolarHBondContact CA-O 3.27Å; G408-D427 PolarHBondContact O-N 2.85Å; D427-H429 VanDerWaalsContact C-N 3.26Å; D427-H429 PolarHBondContact O-N 3.07Å; D427-V431 HydrophobicContact CB-CG2 3.82Å; D427-G447 WeakPolarHBondContact OD2-CA 3.31Å; D427-G447 PolarHBondContact OD2-N 2.78Å; D427-D449 WeakPolarHBondContact CA-OD2 3.18Å; D427-D449 WeakPolarHBondContact CB-OD2 3.35Å; D427-K453 VanDerWaalsContact CG-NZ 3.26Å; D427-K453 VanDerWaalsContact OD1-CD 3.27Å; D427-K453 WeakPolarHBondContact OD1-CD 3.39Å; D427-K453 WeakPolarHBondContact OD1-CE 3.09Å; D427-K453 IonicContact OD1-NZ 2.94Å; D427-K453 PolarHBondContact OD1-NZ 3.45Å; D427-K453 IonicContact OD2-NZ 3.88Å
428	Q	78.2	Confident	87	Confident	158 Å²	158	34.2 Å²	34.2	74%	0.738	18%	0.179	S	C	*	.	S	Bend	trans	-68.4	-27.7	176.3	-65	-176	5.8	0	0	112.7	D449	Q428-D449 PolarHBondContact N-OD1 3.02Å; Q428-D449 PolarHBondContact N-OD2 3.03Å
429	H	79.9	Confident	86.6	Confident	108 Å²	108	37.9 Å²	37.9	50%	0.5	19%	0.191	S	C	.	.	S	Bend	trans	-126.9	-67.1	-172.9	-65.5	-50	0	0	0	114.3	D406 C407 G408 D427	D406-H429 CarbonylContact C-O 3.28Å; C407-H429 CarbonylContact C-O 3.59Å; C407-H429 VanDerWaalsContact C-O 3.22Å; G408-H429 VanDerWaalsContact CA-O 3.31Å; G408-H429 WeakPolarHBondContact CA-O 3.47Å; G408-H429 PolarHBondContact N-O 3.06Å; D427-H429 VanDerWaalsContact C-N 3.26Å; D427-H429 PolarHBondContact O-N 3.07Å
430	V	85.4	Confident	86.2	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.018	17%	0.174	C	C	.	.			trans	-139.8	132.4	-173.6	177	0	0	0	0	107.8	T388 D406 N432 G447 I448	T388-V430 HydrophobicContact CG2-CG1 3.93Å; D406-V430 HydrophobicContact CB-CG2 4.48Å; V430-N432 WeakPolarHBondContact CG1-OD1 3.28Å; V430-G447 WeakPolarHBondContact O-CA 3.47Å; V430-I448 HydrophobicContact CB-CD1 3.61Å; V430-I448 HydrophobicContact CB-CG1 3.9Å; V430-I448 HydrophobicContact CG1-CD1 4.37Å; V430-I448 HydrophobicContact CG2-CD1 3.54Å; V430-I448 HydrophobicContact CG2-CG1 4.38Å; V430-I448 PolarHBondContact O-N 2.59Å; V430-I448 VanDerWaalsContact O-N 3.09Å
431	V	88.7	Confident	85.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.5	165.7	-177.7	0	0	0	0	108.2	K391 S405 G408 I410 D427 V434	K391-V431 PolarHBondContact NZ-O 2.61Å; S405-V431 PolarHBondContact O-N 3.38Å; G408-V431 WeakPolarHBondContact O-CG2 3.49Å; I410-V431 HydrophobicContact CG1-CG1 4.09Å; I410-V431 HydrophobicContact CG1-CG2 4.17Å; D427-V431 HydrophobicContact CB-CG2 3.82Å; V431-V434 HydrophobicContact CG1-CG1 4.02Å
432	N	90.3	Very high	85.9	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-47.9	179.8	-70.9	-36.3	0	0	0	111.8	T388 K391 E392 V430 S446	T388-N432 WeakPolarHBondContact CB-OD1 3.29Å; T388-N432 WeakPolarHBondContact CG2-OD1 3.44Å; T388-N432 PolarHBondContact OG1-OD1 2.8Å; K391-N432 PolarHBondContact NZ-OD1 3.08Å; E392-N432 PolarHBondContact N-O 3.34Å; V430-N432 WeakPolarHBondContact CG1-OD1 3.28Å; N432-S446 PolarHBondContact N-O 3.06Å
433	C	91.8	Very high	86.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138	-176.8	-62.1	0	0	0	0	111	N19 I21 E392 S445 S446	N19-C433 PolarHBondContact O-SG 3.25Å; I21-C433 HydrophobicContact CB-CB 4.49Å; I21-C433 HydrophobicContact CD1-CB 4.09Å; I21-C433 HydrophobicContact CG1-CB 4.34Å; E392-C433 PolarHBondContact OE1-SG 2.82Å; E392-C433 WeakPolarHBondContact OE2-CA 3.39Å; C433-S445 WeakPolarHBondContact O-CA 3.35Å; C433-S445 WeakPolarHBondContact O-CB 3.5Å; C433-S446 PolarHBondContact N-O 3.34Å; C433-S446 PolarHBondContact O-N 3.36Å; C433-S446 VanDerWaalsContact O-N 3.13Å
434	V	94.1	Very high	86.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	102.9	174	-79.2	0	0	0	0	108.8	E392 N394 I402 I410 V431 P436 L443 A444	E392-V434 HydrophobicContact CB-CG2 4.18Å; E392-V434 PolarHBondContact OE2-N 2.86Å; N394-V434 PolarHBondContact ND2-O 2.8Å; I402-V434 HydrophobicContact CD1-CB 3.91Å; I402-V434 HydrophobicContact CD1-CG2 4.32Å; I402-V434 HydrophobicContact CG1-CB 4.33Å; I402-V434 HydrophobicContact CG1-CG2 4.2Å; I410-V434 HydrophobicContact CD1-CG1 4.36Å; I410-V434 HydrophobicContact CG1-CG1 4.28Å; I410-V434 HydrophobicContact CG2-CG1 4.18Å; V431-V434 HydrophobicContact CG1-CG1 4.02Å; V434-P436 WeakPolarHBondContact O-CD 3.32Å; V434-L443 HydrophobicContact CB-CD1 4.18Å; V434-A444 CarbonylContact C-O 3.58Å; V434-A444 WeakPolarHBondContact CA-O 3.23Å
435	Q	94.9	Very high	87	Confident	27 Å²	27	32.6 Å²	32.6	13%	0.126	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	100	-173.3	-70.1	-67.9	-38.7	0	0	110	I21 W23 E392 N394 A444	I21-Q435 HydrophobicContact CB-CG 4.01Å; I21-Q435 HydrophobicContact CG2-CB 4.08Å; I21-Q435 HydrophobicContact CG2-CG 4.05Å; I21-Q435 WeakPolarHBondContact O-CG 3.49Å; W23-Q435 PolarHBondContact NE1-O 3.09Å; E392-Q435 PolarHBondContact OE2-NE2 2.86Å; N394-Q435 PolarHBondContact ND2-NE2 3.26Å; Q435-A444 HydrophobicContact CB-CB 4.49Å; Q435-A444 PolarHBondContact N-O 2.71Å; Q435-A444 PolarHBondContact O-N 3.43Å
436	P	93.5	Very high	87.2	Confident	22 Å²	22	26.2 Å²	26.2	14%	0.143	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	139.8	170.2	-24.8	35.3	0	0	0	110.9	W23 N394 F395 W396 I402 V434 L443	W23-P436 VanDerWaalsContact CD1-O 3.28Å; N394-P436 HydrophobicContact CB-CG 4.03Å; F395-P436 WeakPolarHBondContact O-CG 3.49Å; W396-P436 HydrophobicContact CB-CG 4.32Å; W396-P436 HydrophobicContact CG-CG 4.47Å; I402-P436 HydrophobicContact CD1-CG 3.68Å; I402-P436 HydrophobicContact CG1-CG 4.35Å; V434-P436 WeakPolarHBondContact O-CD 3.32Å; P436-L443 HydrophobicContact CG-CD1 4.45Å
437	H	90.6	Very high	87.3	Confident	10 Å²	10	26.2 Å²	26.2	5%	0.046	13%	0.131	C	C	.	.			trans	-63	142.6	169.9	-179.7	-66.5	0	0	0	109.4	W23 G27 F439 M440 I442	W23-H437 AromaticContact CE3-CD2 3.91Å; W23-H437 AromaticContact CH2-CD2 3.8Å; W23-H437 HydrophobicContact CZ2-CB 4.18Å; W23-H437 AromaticContact CZ3-CD2 3.69Å; G27-H437 WeakPolarHBondContact CA-NE2 3.26Å; G27-H437 PolarHBondContact O-NE2 3.48Å; G27-H437 VanDerWaalsContact O-NE2 3.07Å; H437-F439 VanDerWaalsContact C-N 3.3Å; H437-F439 AromaticContact CE1-CD2 3.97Å; H437-F439 PolarHBondContact ND1-N 3.41Å; H437-F439 PolarHBondContact O-N 2.86Å; H437-M440 PolarHBondContact ND1-N 2.52Å; H437-I442 HydrophobicContact CB-CB 3.78Å; H437-I442 HydrophobicContact CB-CG2 4.21Å; H437-I442 VanDerWaalsContact CB-O 3.31Å; H437-I442 WeakPolarHBondContact CB-O 3.26Å; H437-I442 PolarHBondContact N-O 3.07Å
438	P	86.6	Confident	87.1	Confident	61 Å²	61	28 Å²	28	40%	0.396	14%	0.141	S	C	.	.	S	Bend	trans	-59.9	-34.1	-174.1	19.7	-33.1	0	0	0	114.6
439	F	82	Confident	87	Confident	90 Å²	90	21.4 Å²	21.4	40%	0.395	11%	0.11	S	C	.	.	S	Bend	trans	-121	-35.7	-175.4	-45.5	-61.9	0	0	0	115.9	E25 T307 V311 H437	E25-F439 VanDerWaalsContact O-CE2 3.23Å; E25-F439 WeakPolarHBondContact O-CE2 3.39Å; E25-F439 VanDerWaalsContact O-CZ 3.25Å; E25-F439 WeakPolarHBondContact O-CZ 3.15Å; T307-F439 HydrophobicContact CG2-CD1 3.75Å; T307-F439 HydrophobicContact CG2-CE1 4.41Å; V311-F439 HydrophobicContact CG2-CB 3.99Å; V311-F439 HydrophobicContact CG2-CD1 4.06Å; V311-F439 HydrophobicContact CG2-CD2 3.46Å; V311-F439 VanDerWaalsContact CG2-CD2 3.46Å; V311-F439 HydrophobicContact CG2-CE1 4.46Å; V311-F439 HydrophobicContact CG2-CE2 3.92Å; V311-F439 HydrophobicContact CG2-CG 3.54Å; V311-F439 HydrophobicContact CG2-CZ 4.4Å; H437-F439 VanDerWaalsContact C-N 3.3Å; H437-F439 AromaticContact CE1-CD2 3.97Å; H437-F439 PolarHBondContact ND1-N 3.41Å; H437-F439 PolarHBondContact O-N 2.86Å
440	M	81.8	Confident	86.7	Confident	28 Å²	28	19.7 Å²	19.7	14%	0.138	10%	0.102	C	C	.	.	S	Bend	trans	-96.1	159	-172.5	-62.8	-177.2	-157.4	0	0	112	H437 I442 I469	H437-M440 PolarHBondContact ND1-N 2.52Å; M440-I442 HydrophobicContact CB-CB 4.42Å; M440-I442 HydrophobicContact CB-CD1 3.96Å; M440-I442 HydrophobicContact CB-CG1 4.14Å; M440-I442 PolarHBondContact O-N 2.78Å; M440-I442 HydrophobicContact SD-CD1 3.98Å; M440-I469 HydrophobicContact CE-CB 4.31Å; M440-I469 HydrophobicContact CE-CD1 3.35Å; M440-I469 HydrophobicContact CE-CG1 3.49Å; M440-I469 VanDerWaalsContact CE-CG1 3.49Å; M440-I469 HydrophobicContact CE-CG2 3.82Å; M440-I469 HydrophobicContact SD-CD1 4.47Å; M440-I469 HydrophobicContact SD-CG1 4.01Å; M440-I469 HydrophobicContact SD-CG2 4.32Å
441	P	80.5	Confident	86.2	Confident	25 Å²	25	20.4 Å²	20.4	16%	0.162	11%	0.106	C	C	.	.	S	Bend	trans	-73	38.7	175	37.5	-44.3	0	0	0	112.6	P457 V472 L476	P441-P457 HydrophobicContact CB-CG 4.01Å; P441-P457 HydrophobicContact CG-CG 3.64Å; P441-P457 WeakPolarHBondContact O-CD 3.48Å; P441-V472 HydrophobicContact CG-CG1 3.71Å; P441-L476 HydrophobicContact CB-CD1 4.44Å; P441-L476 HydrophobicContact CG-CD1 3.93Å
442	I	86.8	Confident	86.1	Confident	5 Å²	5	20.6 Å²	20.6	3%	0.026	11%	0.107	C	C	.	.			trans	-104.4	147.2	-178.2	-68	168.1	0	0	0	108.4	W23 F45 H437 M440 V454 W455 A456	W23-I442 HydrophobicContact CH2-CG2 4.16Å; W23-I442 HydrophobicContact CZ2-CG2 3.95Å; F45-I442 HydrophobicContact CE1-CD1 3.68Å; F45-I442 HydrophobicContact CZ-CD1 4.05Å; H437-I442 HydrophobicContact CB-CB 3.78Å; H437-I442 HydrophobicContact CB-CG2 4.21Å; H437-I442 VanDerWaalsContact CB-O 3.31Å; H437-I442 WeakPolarHBondContact CB-O 3.26Å; H437-I442 PolarHBondContact N-O 3.07Å; M440-I442 HydrophobicContact CB-CB 4.42Å; M440-I442 HydrophobicContact CB-CD1 3.96Å; M440-I442 HydrophobicContact CB-CG1 4.14Å; M440-I442 PolarHBondContact O-N 2.78Å; M440-I442 HydrophobicContact SD-CD1 3.98Å; I442-V454 HydrophobicContact CG2-CG1 3.61Å; I442-W455 VanDerWaalsContact CA-O 3.23Å; I442-W455 WeakPolarHBondContact CA-O 3.35Å; I442-W455 WeakPolarHBondContact CG2-O 3.38Å; I442-A456 HydrophobicContact CG1-CB 4.19Å
443	L	90.6	Very high	85.8	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	138.3	175.2	169.9	65.8	0	0	0	109.3	M1 I402 I410 V434 P436 V454 W455	M1-L443 HydrophobicContact CE-CD2 4.47Å; I402-L443 HydrophobicContact CD1-CD1 3.3Å; I402-L443 HydrophobicContact CD1-CD2 3.99Å; I402-L443 HydrophobicContact CD1-CG 4.26Å; I410-L443 HydrophobicContact CD1-CD2 4.15Å; I410-L443 HydrophobicContact CG2-CD2 4.16Å; V434-L443 HydrophobicContact CB-CD1 4.18Å; P436-L443 HydrophobicContact CG-CD1 4.45Å; L443-V454 CarbonylContact O-C 3.1Å; L443-V454 WeakPolarHBondContact O-CA 3.21Å; L443-W455 HydrophobicContact CB-CB 4.07Å; L443-W455 HydrophobicContact CB-CG 4.37Å; L443-W455 HydrophobicContact CD2-CG 4.46Å; L443-W455 PolarHBondContact N-O 3.3Å; L443-W455 PolarHBondContact O-N 3.2Å
444	A	91.4	Very high	85.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.9	163.6	0	0	0	0	0	109.5	I21 W23 I30 V434 Q435 V452 K453	I21-A444 HydrophobicContact CG2-CB 4.06Å; W23-A444 HydrophobicContact CZ2-CB 3.81Å; I30-A444 HydrophobicContact CD1-CB 3.97Å; V434-A444 CarbonylContact C-O 3.58Å; V434-A444 WeakPolarHBondContact CA-O 3.23Å; Q435-A444 HydrophobicContact CB-CB 4.49Å; Q435-A444 PolarHBondContact N-O 2.71Å; Q435-A444 PolarHBondContact O-N 3.43Å; A444-V452 HydrophobicContact CB-CG1 4.43Å; A444-K453 CarbonylContact C-O 3.57Å; A444-K453 VanDerWaalsContact CA-O 3.29Å; A444-K453 WeakPolarHBondContact CA-O 3.36Å
445	S	91.8	Very high	85.1	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.8	176.2	69.2	0	0	0	0	112.1	I21 C433 K453 W455	I21-S445 VanDerWaalsContact CD1-C 3.44Å; C433-S445 WeakPolarHBondContact O-CA 3.35Å; C433-S445 WeakPolarHBondContact O-CB 3.5Å; S445-K453 PolarHBondContact N-O 2.81Å; S445-K453 PolarHBondContact O-N 3.33Å; S445-W455 PolarHBondContact OG-NE1 2.91Å
446	S	88.6	Confident	84.3	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	170.5	166.6	61.7	0	0	0	0	111	V18 I21 N432 C433	V18-S446 PolarHBondContact O-OG 3.36Å; I21-S446 VanDerWaalsContact CD1-CB 3.48Å; I21-S446 WeakPolarHBondContact CD1-OG 3.44Å; N432-S446 PolarHBondContact N-O 3.06Å; C433-S446 PolarHBondContact N-O 3.34Å; C433-S446 PolarHBondContact O-N 3.36Å; C433-S446 VanDerWaalsContact O-N 3.13Å
447	G	83.7	Confident	83.3	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	-133.6	178.9	0	0	0	0	0	111.2	D427 V430	D427-G447 WeakPolarHBondContact OD2-CA 3.31Å; D427-G447 PolarHBondContact OD2-N 2.78Å; V430-G447 WeakPolarHBondContact O-CA 3.47Å
448	I	78	Confident	82.1	Confident	51 Å²	51	20.8 Å²	20.8	26%	0.262	11%	0.11	S	C	.	.	S	Bend	trans	-77	-16.9	178.6	-65.3	178.2	0	0	0	111.3	Q17 T388 V430	Q17-I448 HydrophobicContact CG-CG2 4.3Å; T388-I448 HydrophobicContact CG2-CD1 4.23Å; V430-I448 HydrophobicContact CB-CD1 3.61Å; V430-I448 HydrophobicContact CB-CG1 3.9Å; V430-I448 HydrophobicContact CG1-CD1 4.37Å; V430-I448 HydrophobicContact CG2-CD1 3.54Å; V430-I448 HydrophobicContact CG2-CG1 4.38Å; V430-I448 PolarHBondContact O-N 2.59Å; V430-I448 VanDerWaalsContact O-N 3.09Å
449	D	76.3	Confident	80.7	Confident	19 Å²	19	20.4 Å²	20.4	10%	0.102	12%	0.117	C	C	.	.	S	Bend	trans	-67.7	160	172.2	-65.3	2	0	0	0	111.3	D427 Q428 N451 K453	D427-D449 WeakPolarHBondContact CA-OD2 3.18Å; D427-D449 WeakPolarHBondContact CB-OD2 3.35Å; Q428-D449 PolarHBondContact N-OD1 3.02Å; Q428-D449 PolarHBondContact N-OD2 3.03Å; D449-N451 VanDerWaalsContact C-N 3.32Å; D449-N451 PolarHBondContact O-N 3.08Å; D449-K453 IonicContact OD2-NZ 3.78Å; D449-K453 PolarHBondContact OD2-NZ 3.1Å
450	H	73.5	Confident	79.5	Confident	72 Å²	72	24.1 Å²	24.1	33%	0.333	14%	0.136	S	C	.	.	S	Bend	trans	-86.6	11.8	-174.5	59	-89.8	0	0	0	115.3	I16	I16-H450 WeakPolarHBondContact O-CA 3.19Å; I16-H450 WeakPolarHBondContact O-CB 3.33Å
451	N	75.7	Confident	78.2	Confident	18 Å²	18	30.2 Å²	30.2	10%	0.096	17%	0.169	C	C	.	.	S	Bend	trans	-135.9	157	-175.4	60.1	8.6	0	0	0	112.4	S5 D449 K453	S5-N451 PolarHBondContact OG-ND2 3.3Å; D449-N451 VanDerWaalsContact C-N 3.32Å; D449-N451 PolarHBondContact O-N 3.08Å; N451-K453 WeakPolarHBondContact OD1-CE 3.4Å; N451-K453 PolarHBondContact OD1-NZ 2.73Å
452	V	84.6	Confident	76.8	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.018	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.7	168.6	175.3	0	0	0	0	107.7	C6 L8 V18 I21 I30 A444	C6-V452 CarbonylContact C-O 3.37Å; C6-V452 WeakPolarHBondContact CA-O 3.34Å; C6-V452 WeakPolarHBondContact CB-O 3.47Å; C6-V452 PolarHBondContact N-O 3.28Å; C6-V452 PolarHBondContact O-N 2.97Å; L8-V452 HydrophobicContact CD1-CG2 3.73Å; L8-V452 HydrophobicContact CD2-CG2 4.38Å; L8-V452 HydrophobicContact CG-CG2 4.08Å; V18-V452 HydrophobicContact CG1-CG2 4.02Å; I21-V452 HydrophobicContact CD1-CG1 3.86Å; I21-V452 HydrophobicContact CD1-CG2 4.01Å; I21-V452 HydrophobicContact CG1-CG2 4.17Å; I30-V452 HydrophobicContact CD1-CG1 4.41Å; A444-V452 HydrophobicContact CB-CG1 4.43Å
453	K	85.5	Confident	75.1	Confident	3 Å²	3	33.2 Å²	33.2	1%	0.013	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.2	179.7	-64.2	163.1	178.7	85.4	0	108.9	K3 F4 G426 D427 A444 S445 D449 N451	K3-K453 HydrophobicContact CD-CD 4.08Å; K3-K453 VanDerWaalsContact CE-CD 3.43Å; K3-K453 VanDerWaalsContact CE-CE 3.42Å; K3-K453 HydrophobicContact CG-CB 4.38Å; K3-K453 HydrophobicContact CG-CG 4.49Å; F4-K453 CarbonylContact O-C 3.59Å; F4-K453 WeakPolarHBondContact O-CA 3.36Å; G426-K453 WeakPolarHBondContact O-CD 2.87Å; G426-K453 WeakPolarHBondContact O-CE 3.46Å; D427-K453 VanDerWaalsContact CG-NZ 3.26Å; D427-K453 VanDerWaalsContact OD1-CD 3.27Å; D427-K453 WeakPolarHBondContact OD1-CD 3.39Å; D427-K453 WeakPolarHBondContact OD1-CE 3.09Å; D427-K453 IonicContact OD1-NZ 2.94Å; D427-K453 PolarHBondContact OD1-NZ 3.45Å; D427-K453 IonicContact OD2-NZ 3.88Å; A444-K453 CarbonylContact C-O 3.57Å; A444-K453 VanDerWaalsContact CA-O 3.29Å; A444-K453 WeakPolarHBondContact CA-O 3.36Å; S445-K453 PolarHBondContact N-O 2.81Å; S445-K453 PolarHBondContact O-N 3.33Å; D449-K453 IonicContact OD2-NZ 3.78Å; D449-K453 PolarHBondContact OD2-NZ 3.1Å; N451-K453 WeakPolarHBondContact OD1-CE 3.4Å; N451-K453 PolarHBondContact OD1-NZ 2.73Å
454	V	86	Confident	73.3	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.9	176.4	-178.7	0	0	0	0	108.3	F4 C6 I30 P44 I442 L443 L464	F4-V454 PolarHBondContact N-O 3.12Å; F4-V454 PolarHBondContact O-N 2.87Å; C6-V454 HydrophobicContact CB-CG2 4.48Å; I30-V454 HydrophobicContact CD1-CG2 4.01Å; P44-V454 HydrophobicContact CB-CG2 3.83Å; I442-V454 HydrophobicContact CG2-CG1 3.61Å; L443-V454 CarbonylContact O-C 3.1Å; L443-V454 WeakPolarHBondContact O-CA 3.21Å; V454-L464 HydrophobicContact CG1-CD1 4.44Å
455	W	85.8	Confident	71.5	Confident	7 Å²	7	41.1 Å²	41.1	3%	0.027	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134	-176.4	-53.3	76.4	0	0	0	109.3	M1 R2 K3 I410 H424 E425 I442 L443 S445	M1-W455 HydrophobicContact CB-CE3 4.16Å; M1-W455 HydrophobicContact CE-CB 4.38Å; M1-W455 HydrophobicContact SD-CB 3.68Å; R2-W455 VanDerWaalsContact O-CA 3.32Å; R2-W455 WeakPolarHBondContact O-CA 3.34Å; K3-W455 HydrophobicContact CB-CD2 4.27Å; K3-W455 HydrophobicContact CB-CE3 3.87Å; K3-W455 HydrophobicContact CB-CH2 3.81Å; K3-W455 HydrophobicContact CB-CZ2 4.16Å; K3-W455 HydrophobicContact CB-CZ3 3.66Å; K3-W455 HydrophobicContact CD-CH2 3.5Å; K3-W455 HydrophobicContact CD-CZ2 3.62Å; K3-W455 HydrophobicContact CD-CZ3 4.22Å; K3-W455 HydrophobicContact CG-CH2 3.95Å; K3-W455 HydrophobicContact CG-CZ2 3.91Å; K3-W455 HydrophobicContact CG-CZ3 4.31Å; I410-W455 HydrophobicContact CD1-CZ2 3.81Å; H424-W455 HydrophobicContact CB-CH2 4.28Å; H424-W455 HydrophobicContact CB-CZ3 3.93Å; E425-W455 VanDerWaalsContact O-CH2 3.31Å; E425-W455 WeakPolarHBondContact O-CH2 3.48Å; I442-W455 VanDerWaalsContact CA-O 3.23Å; I442-W455 WeakPolarHBondContact CA-O 3.35Å; I442-W455 WeakPolarHBondContact CG2-O 3.38Å; L443-W455 HydrophobicContact CB-CB 4.07Å; L443-W455 HydrophobicContact CB-CG 4.37Å; L443-W455 HydrophobicContact CD2-CG 4.46Å; L443-W455 PolarHBondContact N-O 3.3Å; L443-W455 PolarHBondContact O-N 3.2Å; S445-W455 PolarHBondContact OG-NE1 2.91Å
456	A	77.9	Confident	69.5	Low	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.8	176.7	0	0	0	0	0	111.5	M1 R2 F4 I442 V458 L464 M467	M1-A456 CarbonylContact C-O 3.49Å; M1-A456 WeakPolarHBondContact CA-O 3.44Å; R2-A456 PolarHBondContact N-O 3.03Å; R2-A456 PolarHBondContact O-N 3.11Å; R2-A456 VanDerWaalsContact O-N 3.07Å; F4-A456 HydrophobicContact CE2-CB 4.33Å; I442-A456 HydrophobicContact CG1-CB 4.19Å; A456-V458 HydrophobicContact CB-CG2 4.33Å; A456-V458 PolarHBondContact O-N 3.25Å; A456-L464 HydrophobicContact CB-CD2 4.18Å; A456-M467 HydrophobicContact CB-CE 3.26Å; A456-M467 HydrophobicContact CB-SD 4.12Å
457	P	72.8	Confident	67.6	Low	30 Å²	30	49.1 Å²	49.1	20%	0.195	26%	0.257	C	S	.	.			trans	-82.7	53.7	179.5	36.2	-37	0	0	0	111.2	P441 V472 F485	P441-P457 HydrophobicContact CB-CG 4.01Å; P441-P457 HydrophobicContact CG-CG 3.64Å; P441-P457 WeakPolarHBondContact O-CD 3.48Å; P457-V472 HydrophobicContact CG-CG1 4.25Å; P457-F485 HydrophobicContact CB-CD1 4.49Å; P457-F485 HydrophobicContact CB-CE1 4.1Å
458	V	65	Low	66	Low	23 Å²	23	51.8 Å²	51.8	14%	0.139	27%	0.271	C	S	.	.			trans	-101.1	145.5	174.1	-74	0	0	0	0	111.2	R2 F4 A456 V462 M467	R2-V458 HydrophobicContact CB-CG2 3.81Å; F4-V458 HydrophobicContact CE2-CG2 3.76Å; F4-V458 HydrophobicContact CZ-CG2 3.69Å; A456-V458 HydrophobicContact CB-CG2 4.33Å; A456-V458 PolarHBondContact O-N 3.25Å; V458-V462 HydrophobicContact CB-CB 4.18Å; V458-V462 HydrophobicContact CG1-CB 4.3Å; V458-V462 HydrophobicContact CG1-CG1 4.25Å; V458-M467 HydrophobicContact CB-CE 4.34Å; V458-M467 HydrophobicContact CG1-CE 3.34Å; V458-M467 HydrophobicContact CG1-CG 3.56Å; V458-M467 HydrophobicContact CG1-SD 3.36Å; V458-M467 WeakPolarHBondContact CG1-SD 3.46Å; V458-M467 HydrophobicContact CG2-CE 4.05Å
459	G	55.7	Low	64.5	Low	52 Å²	52	50.9 Å²	50.9	54%	0.536	27%	0.267	S	S	.	.			trans	-63.7	169.1	167.6	0	0	0	0	0	112	D461 V462	G459-D461 PolarHBondContact O-N 3.44Å; G459-D461 VanDerWaalsContact O-N 3.11Å; G459-V462 PolarHBondContact O-N 3.45Å
460	E	57.8	Low	63	Low	169 Å²	169	55.2 Å²	55.2	79%	0.79	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.3	-172	-65.4	-171.2	154.6	0	0	113.7	R2	R2-E460 VanDerWaalsContact CZ-O 3.28Å; R2-E460 PolarHBondContact NH1-O 3.18Å
461	D	54.5	Low	61.6	Low	155 Å²	155	55.6 Å²	55.6	83%	0.829	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.9	-171.2	-63.3	-38.2	0	0	0	115.2	G459	G459-D461 PolarHBondContact O-N 3.44Å; G459-D461 VanDerWaalsContact O-N 3.11Å
462	V	50.9	Low	60	Low	55 Å²	55	55.6 Å²	55.6	33%	0.333	29%	0.292	S	S	.	.			trans	-98.6	121.3	-176.2	-174.5	0	0	0	0	110.8	R2 V458 G459 E466	R2-V462 PolarHBondContact NH1-O 3.32Å; V458-V462 HydrophobicContact CB-CB 4.18Å; V458-V462 HydrophobicContact CG1-CB 4.3Å; V458-V462 HydrophobicContact CG1-CG1 4.25Å; G459-V462 PolarHBondContact O-N 3.45Å; V462-E466 HydrophobicContact CG1-CB 4.18Å
463	S	51.9	Low	58	Low	39 Å²	39	56.5 Å²	56.5	27%	0.273	30%	0.298	S	S	.	.			trans	-68.6	144.7	171.4	178.3	0	0	0	0	110.4	R465 E466	S463-R465 PolarHBondContact O-N 3.01Å; S463-R465 WeakPolarHBondContact OG-CG 3.33Å; S463-R465 PolarHBondContact OG-N 3.12Å; S463-E466 PolarHBondContact O-N 2.89Å
464	L	52.6	Low	56	Low	19 Å²	19	59 Å²	59	10%	0.099	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-29	170.4	-101.5	168.7	0	0	0	112.9	F4 V454 A456 M467	F4-L464 HydrophobicContact CB-CD1 3.31Å; F4-L464 HydrophobicContact CB-CG 4.41Å; F4-L464 HydrophobicContact CD1-CB 4.3Å; F4-L464 HydrophobicContact CD1-CD1 3.6Å; F4-L464 HydrophobicContact CD1-CG 3.91Å; F4-L464 HydrophobicContact CD2-CD1 3.3Å; F4-L464 HydrophobicContact CD2-CD2 4.37Å; F4-L464 HydrophobicContact CD2-CG 3.53Å; F4-L464 HydrophobicContact CE1-CB 4.14Å; F4-L464 HydrophobicContact CE1-CD1 4.14Å; F4-L464 HydrophobicContact CE1-CG 3.91Å; F4-L464 HydrophobicContact CE2-CD1 3.89Å; F4-L464 HydrophobicContact CE2-CD2 4.34Å; F4-L464 HydrophobicContact CE2-CG 3.54Å; F4-L464 HydrophobicContact CG-CD1 3.11Å; F4-L464 HydrophobicContact CG-CG 3.7Å; F4-L464 HydrophobicContact CZ-CB 4.25Å; F4-L464 HydrophobicContact CZ-CD1 4.25Å; F4-L464 HydrophobicContact CZ-CG 3.71Å; V454-L464 HydrophobicContact CG1-CD1 4.44Å; A456-L464 HydrophobicContact CB-CD2 4.18Å; L464-M467 HydrophobicContact CD2-CE 3.28Å; L464-M467 HydrophobicContact CG-CE 3.97Å
465	R	53.2	Low	53.9	Low	147 Å²	147	63.7 Å²	63.7	56%	0.555	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-34.6	-178.7	-57.7	177.2	-171	176.9	0.6	113.8	S48 S463 M467	S48-R465 VanDerWaalsContact CB-NH2 3.31Å; S463-R465 PolarHBondContact O-N 3.01Å; S463-R465 WeakPolarHBondContact OG-CG 3.33Å; S463-R465 PolarHBondContact OG-N 3.12Å; R465-M467 VanDerWaalsContact C-N 3.3Å
466	E	50.3	Low	51.8	Low	135 Å²	135	65.8 Å²	65.8	63%	0.631	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-6.3	-177.1	-69.4	173.7	175	0	0	111.6	V462 S463 N468	V462-E466 HydrophobicContact CG1-CB 4.18Å; S463-E466 PolarHBondContact O-N 2.89Å; E466-N468 VanDerWaalsContact C-N 3.29Å; E466-N468 PolarHBondContact O-N 2.91Å
467	M	48.5	Very low	50.2	Low	33 Å²	33	72.5 Å²	72.5	16%	0.163	38%	0.379	C	S	.	.			trans	-64.6	94.8	169.3	-92.5	-166.9	-89.2	0	0	109.4	A456 V458 L464 R465 V472	A456-M467 HydrophobicContact CB-CE 3.26Å; A456-M467 HydrophobicContact CB-SD 4.12Å; V458-M467 HydrophobicContact CB-CE 4.34Å; V458-M467 HydrophobicContact CG1-CE 3.34Å; V458-M467 HydrophobicContact CG1-CG 3.56Å; V458-M467 HydrophobicContact CG1-SD 3.36Å; V458-M467 WeakPolarHBondContact CG1-SD 3.46Å; V458-M467 HydrophobicContact CG2-CE 4.05Å; L464-M467 HydrophobicContact CD2-CE 3.28Å; L464-M467 HydrophobicContact CG-CE 3.97Å; R465-M467 VanDerWaalsContact C-N 3.3Å; M467-V472 HydrophobicContact CB-CG2 3.94Å; M467-V472 HydrophobicContact CG-CG2 3.43Å; M467-V472 VanDerWaalsContact CG-CG2 3.43Å; M467-V472 HydrophobicContact SD-CG2 3.22Å; M467-V472 WeakPolarHBondContact SD-CG2 3.39Å
468	N	48.8	Very low	48.5	Very low	55 Å²	55	74.9 Å²	74.9	29%	0.294	40%	0.4	S	S	.	.			trans	-66.7	129.4	151.2	-172.4	4.1	0	0	0	107.1	E466 E470 D471 V472	E466-N468 VanDerWaalsContact C-N 3.29Å; E466-N468 PolarHBondContact O-N 2.91Å; N468-E470 PolarHBondContact ND2-OE2 3.3Å; N468-E470 VanDerWaalsContact ND2-OE2 3.07Å; N468-E470 PolarHBondContact O-N 3.15Å; N468-E470 VanDerWaalsContact O-N 3.12Å; N468-E470 PolarHBondContact OD1-N 2.81Å; N468-D471 HydrophobicContact CB-CB 4.32Å; N468-D471 WeakPolarHBondContact CB-OD2 3.34Å; N468-D471 PolarHBondContact O-N 3.23Å; N468-V472 PolarHBondContact O-N 3.34Å
469	I	47.7	Very low	47	Very low	32 Å²	32	78 Å²	78	16%	0.164	42%	0.416	C	S	.	.	H	α-helix	trans	-54.6	-33.6	178.8	-63.1	162.3	0	0	0	110.3	M440 C473	M440-I469 HydrophobicContact CE-CB 4.31Å; M440-I469 HydrophobicContact CE-CD1 3.35Å; M440-I469 HydrophobicContact CE-CG1 3.49Å; M440-I469 VanDerWaalsContact CE-CG1 3.49Å; M440-I469 HydrophobicContact CE-CG2 3.82Å; M440-I469 HydrophobicContact SD-CD1 4.47Å; M440-I469 HydrophobicContact SD-CG1 4.01Å; M440-I469 HydrophobicContact SD-CG2 4.32Å; I469-C473 PolarHBondContact O-N 3.36Å; I469-C473 PolarHBondContact O-SG 3Å
470	E	44.9	Very low	45.7	Very low	110 Å²	110	80.8 Å²	80.8	51%	0.514	43%	0.425	S	S	.	.	H	α-helix	trans	-63.3	-40.2	175	-63	173.9	164.5	0	0	112.4	N468 C473 S474	N468-E470 PolarHBondContact ND2-OE2 3.3Å; N468-E470 VanDerWaalsContact ND2-OE2 3.07Å; N468-E470 PolarHBondContact O-N 3.15Å; N468-E470 VanDerWaalsContact O-N 3.12Å; N468-E470 PolarHBondContact OD1-N 2.81Å; E470-C473 PolarHBondContact O-N 2.9Å; E470-S474 WeakPolarHBondContact O-CB 3.44Å; E470-S474 PolarHBondContact O-N 3.34Å; E470-S474 PolarHBondContact O-OG 2.82Å
471	D	43.7	Very low	44.7	Very low	80 Å²	80	81.3 Å²	81.3	43%	0.428	42%	0.424	S	S	.	.	H	α-helix	trans	-72.9	-33.8	-178.5	-69.8	-29	0	0	0	112.6	N468 C473 S474 N475	N468-D471 HydrophobicContact CB-CB 4.32Å; N468-D471 WeakPolarHBondContact CB-OD2 3.34Å; N468-D471 PolarHBondContact O-N 3.23Å; D471-C473 VanDerWaalsContact C-N 3.31Å; D471-S474 VanDerWaalsContact CA-OG 3.3Å; D471-S474 WeakPolarHBondContact CA-OG 3.34Å; D471-S474 PolarHBondContact O-OG 3.21Å; D471-S474 VanDerWaalsContact O-OG 3.07Å; D471-N475 WeakPolarHBondContact O-CB 3.35Å; D471-N475 VanDerWaalsContact O-CG 3.27Å; D471-N475 PolarHBondContact O-N 2.98Å; D471-N475 PolarHBondContact O-ND2 3.11Å
472	V	41.3	Very low	43.8	Very low	18 Å²	18	75 Å²	75	11%	0.109	40%	0.396	C	S	.	.	H	α-helix	trans	-64.1	-43	173.4	-177.6	0	0	0	0	110.1	P441 P457 M467 N468 L476	P441-V472 HydrophobicContact CG-CG1 3.71Å; P457-V472 HydrophobicContact CG-CG1 4.25Å; M467-V472 HydrophobicContact CB-CG2 3.94Å; M467-V472 HydrophobicContact CG-CG2 3.43Å; M467-V472 VanDerWaalsContact CG-CG2 3.43Å; M467-V472 HydrophobicContact SD-CG2 3.22Å; M467-V472 WeakPolarHBondContact SD-CG2 3.39Å; N468-V472 PolarHBondContact O-N 3.34Å; V472-L476 HydrophobicContact CG1-CD1 4.39Å; V472-L476 WeakPolarHBondContact O-CB 3.36Å; V472-L476 WeakPolarHBondContact O-CD1 3.48Å; V472-L476 VanDerWaalsContact O-CG 3.24Å; V472-L476 WeakPolarHBondContact O-CG 3.29Å; V472-L476 PolarHBondContact O-N 3.42Å; V472-L476 VanDerWaalsContact O-N 3.11Å
473	C	42.3	Very low	43	Very low	22 Å²	22	74.6 Å²	74.6	15%	0.149	39%	0.394	C	S	.	.	H	α-helix	trans	-68.6	-43.8	178.3	-63.8	0	0	0	0	111.2	I308 I469 E470 D471 L476 Y477	I308-C473 HydrophobicContact CD1-CB 4.28Å; I469-C473 PolarHBondContact O-N 3.36Å; I469-C473 PolarHBondContact O-SG 3Å; E470-C473 PolarHBondContact O-N 2.9Å; D471-C473 VanDerWaalsContact C-N 3.31Å; C473-L476 WeakPolarHBondContact O-CB 3.42Å; C473-L476 PolarHBondContact O-N 3.34Å; C473-Y477 WeakPolarHBondContact O-CD2 3.41Å; C473-Y477 WeakPolarHBondContact O-CE2 3.31Å
474	S	45.1	Very low	42.4	Very low	57 Å²	57	76 Å²	76	40%	0.399	40%	0.398	S	S	.	.	H	α-helix	trans	-64.4	-44.6	178.7	70.4	0	0	0	0	112.2	E470 D471 L476 Y477 A478	E470-S474 WeakPolarHBondContact O-CB 3.44Å; E470-S474 PolarHBondContact O-N 3.34Å; E470-S474 PolarHBondContact O-OG 2.82Å; D471-S474 VanDerWaalsContact CA-OG 3.3Å; D471-S474 WeakPolarHBondContact CA-OG 3.34Å; D471-S474 PolarHBondContact O-OG 3.21Å; D471-S474 VanDerWaalsContact O-OG 3.07Å; S474-L476 VanDerWaalsContact C-N 3.34Å; S474-L476 PolarHBondContact O-N 3.1Å; S474-Y477 WeakPolarHBondContact O-CB 3.28Å; S474-Y477 PolarHBondContact O-N 3.36Å; S474-Y477 VanDerWaalsContact O-N 3.09Å; S474-A478 PolarHBondContact O-N 3.25Å
475	N	41.4	Very low	41.8	Very low	99 Å²	99	75.9 Å²	75.9	53%	0.529	40%	0.397	S	S	.	.	H	α-helix	trans	-66.6	-32.8	178	-75.5	-42.8	0	0	0	112.9	D471 Y477 A478 L479	D471-N475 WeakPolarHBondContact O-CB 3.35Å; D471-N475 VanDerWaalsContact O-CG 3.27Å; D471-N475 PolarHBondContact O-N 2.98Å; D471-N475 PolarHBondContact O-ND2 3.11Å; N475-Y477 PolarHBondContact O-N 2.88Å; N475-A478 PolarHBondContact O-N 2.79Å; N475-L479 PolarHBondContact O-N 2.96Å; N475-L479 VanDerWaalsContact O-N 3.14Å
476	L	40.6	Very low	40.6	Very low	51 Å²	51	78 Å²	78	27%	0.267	41%	0.405	S	S	.	.	H	α-helix	trans	-59.7	-29.8	171.8	-83.9	167.1	0	0	0	112.9	P441 V472 C473 S474 I484	P441-L476 HydrophobicContact CB-CD1 4.44Å; P441-L476 HydrophobicContact CG-CD1 3.93Å; V472-L476 HydrophobicContact CG1-CD1 4.39Å; V472-L476 WeakPolarHBondContact O-CB 3.36Å; V472-L476 WeakPolarHBondContact O-CD1 3.48Å; V472-L476 VanDerWaalsContact O-CG 3.24Å; V472-L476 WeakPolarHBondContact O-CG 3.29Å; V472-L476 PolarHBondContact O-N 3.42Å; V472-L476 VanDerWaalsContact O-N 3.11Å; C473-L476 WeakPolarHBondContact O-CB 3.42Å; C473-L476 PolarHBondContact O-N 3.34Å; S474-L476 VanDerWaalsContact C-N 3.34Å; S474-L476 PolarHBondContact O-N 3.1Å; L476-I484 HydrophobicContact CD2-CG2 3.57Å
477	Y	44.3	Very low	39.6	Very low	142 Å²	142	80.4 Å²	80.4	56%	0.557	42%	0.421	S	S	*	.	H	α-helix	trans	-78	-24.2	174.5	-61.5	-69.7	0	0	0	113	C473 S474 N475	C473-Y477 WeakPolarHBondContact O-CD2 3.41Å; C473-Y477 WeakPolarHBondContact O-CE2 3.31Å; S474-Y477 WeakPolarHBondContact O-CB 3.28Å; S474-Y477 PolarHBondContact O-N 3.36Å; S474-Y477 VanDerWaalsContact O-N 3.09Å; N475-Y477 PolarHBondContact O-N 2.88Å
478	A	38.1	Very low	39.1	Very low	79 Å²	79	82.8 Å²	82.8	65%	0.653	43%	0.434	S	S	*	.	H	α-helix	trans	-86.5	-18.7	-179.5	0	0	0	0	0	113.5	S474 N475	S474-A478 PolarHBondContact O-N 3.25Å; N475-A478 PolarHBondContact O-N 2.79Å
479	L	33	Very low	38.6	Very low	89 Å²	89	84.3 Å²	84.3	47%	0.466	44%	0.441	S	S	.	.	S	Bend	trans	-70.6	127.9	178.3	-72.7	168.6	0	0	0	110.8	N475 K481	N475-L479 PolarHBondContact O-N 2.96Å; N475-L479 VanDerWaalsContact O-N 3.14Å; L479-K481 PolarHBondContact O-N 3.38Å
480	P	29.1	Very low	38.1	Very low	110 Å²	110	87.2 Å²	87.2	71%	0.714	46%	0.457	S	S	*	.			trans	-57.8	139.9	174.1	6.9	-7.6	0	0	0	109.7	G482	P480-G482 PolarHBondContact O-N 2.91Å
481	K	36.7	Very low	37.7	Very low	181 Å²	181	85.8 Å²	85.8	79%	0.787	45%	0.453	S	S	*	.	S	Bend	trans	-68.1	50.5	-173.5	-64.8	179.3	-178	154.2	0	114.6	L479	L479-K481 PolarHBondContact O-N 3.38Å
482	G	35.4	Very low	37.3	Very low	22 Å²	22	86.2 Å²	86.2	23%	0.227	46%	0.455	C	S	.	.	S	Bend	trans	-80.9	-176.6	152.5	0	0	0	0	0	109.9	P480 I484	P480-G482 PolarHBondContact O-N 2.91Å; G482-I484 PolarHBondContact O-N 2.69Å; G482-I484 VanDerWaalsContact O-N 3.17Å
483	P	34	Very low	37.1	Very low	47 Å²	47	90.7 Å²	90.7	31%	0.305	48%	0.478	S	S	.	.			trans	-48.4	132.6	165.9	22.4	-31.2	0	0	0	107.6	F485	P483-F485 CarbonylContact O-C 3.59Å; P483-F485 PolarHBondContact O-N 2.79Å
484	I	39.7	Very low	36.7	Very low	68 Å²	68	95.6 Å²	95.6	35%	0.349	50%	0.501	S	S	.	.	S	Bend	trans	-51.8	-12	-178.2	-65.1	169.6	0	0	0	111.7	Y400 L476 G482	Y400-I484 HydrophobicContact CE2-CD1 4.25Å; L476-I484 HydrophobicContact CD2-CG2 3.57Å; G482-I484 PolarHBondContact O-N 2.69Å; G482-I484 VanDerWaalsContact O-N 3.17Å
485	F	39.6	Very low	36.1	Very low	17 Å²	17	98.6 Å²	98.6	8%	0.075	51%	0.509	C	S	.	.			trans	-127.6	75.2	-173.7	-42.6	-74.4	0	0	0	109	M1 W396 P457 P483	M1-F485 HydrophobicContact CG-CD1 3.61Å; M1-F485 HydrophobicContact CG-CE1 3.9Å; M1-F485 HydrophobicContact CG-CG 4.48Å; M1-F485 HydrophobicContact SD-CE1 4.35Å; W396-F485 HydrophobicContact CE3-CE2 4.43Å; W396-F485 HydrophobicContact CH2-CD1 4.31Å; W396-F485 HydrophobicContact CH2-CD2 4.35Å; W396-F485 AromaticContact CH2-CE1 3.51Å; W396-F485 HydrophobicContact CH2-CE1 3.51Å; W396-F485 AromaticContact CH2-CE2 3.57Å; W396-F485 HydrophobicContact CH2-CE2 3.57Å; W396-F485 AromaticContact CH2-CZ 3.08Å; W396-F485 HydrophobicContact CH2-CZ 3.08Å; W396-F485 HydrophobicContact CZ2-CE1 4.1Å; W396-F485 HydrophobicContact CZ2-CE2 4.44Å; W396-F485 AromaticContact CZ2-CZ 3.66Å; W396-F485 HydrophobicContact CZ2-CZ 3.66Å; W396-F485 HydrophobicContact CZ3-CD2 4.26Å; W396-F485 HydrophobicContact CZ3-CE1 4.33Å; W396-F485 AromaticContact CZ3-CE2 3.57Å; W396-F485 HydrophobicContact CZ3-CE2 3.57Å; W396-F485 AromaticContact CZ3-CZ 3.62Å; W396-F485 HydrophobicContact CZ3-CZ 3.62Å; P457-F485 HydrophobicContact CB-CD1 4.49Å; P457-F485 HydrophobicContact CB-CE1 4.1Å; P483-F485 CarbonylContact O-C 3.59Å; P483-F485 PolarHBondContact O-N 2.79Å
486	R	27.3	Very low	35.6	Very low	192 Å²	192	98.6 Å²	98.6	73%	0.725	51%	0.508	S	S	*	.			trans	-69.8	131	153.4	-77.4	-172.4	176.8	178.8	-0.2	106.8
487	L	29.5	Very low	35.1	Very low	185 Å²	185	102.9 Å²	102.9	97%	0.969	53%	0.53	S	S	*	.			trans	-54.6	0	170.2	-90.4	162.9	0	0	0	109.8	P284	P284-L487 HydrophobicContact CB-CD1 4.38Å

Retrieved 487 of 487 residues in 350.5 ms (Link to these results)

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