A0A087X7K2_POEFO Loading...

Formiminotransferase cyclodeaminase N-terminal like 1

AlphaFold DB , UniProt , Accession A0A087X7K2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 290 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	39.6	Very low	79	Confident	235 Å²	235	79.8 Å²	79.8	100%	1.158	38%	0.375	S	S	*	.				0	109.5	0	-170.1	175.2	149.5	0	0	106.5	R3	M1-R3 PolarHBondContact O-N 3.01Å; M1-R3 VanDerWaalsContact O-N 3.13Å
2	Q	47.3	Very low	80	Confident	135 Å²	135	77.8 Å²	77.8	63%	0.631	36%	0.364	S	S	*	.			trans	-63.8	112.2	-177.9	-162.5	163.7	0.8	0	0	107.5	K4 G277	Q2-K4 PolarHBondContact O-N 3.2Å; Q2-K4 VanDerWaalsContact O-N 3.11Å; Q2-G277 PolarHBondContact NE2-O 2.84Å
3	R	58	Low	80.8	Confident	107 Å²	107	79 Å²	79	40%	0.404	37%	0.374	S	S	.	.			trans	-69.6	108.2	173.5	-70.6	-174.4	-178.9	151.9	3.6	105.7	M1 E5 T6 D33 A34	M1-R3 PolarHBondContact O-N 3.01Å; M1-R3 VanDerWaalsContact O-N 3.13Å; R3-E5 PolarHBondContact O-N 3.13Å; R3-T6 PolarHBondContact O-N 3.08Å; R3-T6 VanDerWaalsContact O-N 3.08Å; R3-D33 PolarHBondContact NH1-O 3Å; R3-D33 VanDerWaalsContact NH1-O 3.09Å; R3-A34 VanDerWaalsContact NH1-CA 3.35Å
4	K	67.1	Low	81.6	Confident	180 Å²	180	74.6 Å²	74.6	78%	0.783	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-10.2	-177.4	-72.6	-173.4	173.9	-173.8	0	113.8	Q2	Q2-K4 PolarHBondContact O-N 3.2Å; Q2-K4 VanDerWaalsContact O-N 3.11Å
5	E	87.4	Confident	82.2	Confident	99 Å²	99	80.8 Å²	80.8	46%	0.463	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	25.6	-177.7	-54.4	-176.9	168.7	0	0	112.3	R3 A26 S27 S30	R3-E5 PolarHBondContact O-N 3.13Å; E5-A26 CarbonylContact O-C 3.45Å; E5-A26 WeakPolarHBondContact O-CA 3.14Å; E5-A26 VanDerWaalsContact O-CB 3.23Å; E5-A26 WeakPolarHBondContact O-CB 3.14Å; E5-S27 PolarHBondContact O-N 2.8Å; E5-S27 VanDerWaalsContact O-N 3.08Å; E5-S27 WeakPolarHBondContact OE2-CB 3.49Å; E5-S27 PolarHBondContact OE2-OG 3.08Å; E5-S30 PolarHBondContact OE2-OG 3.15Å
6	T	95.1	Very high	82.7	Confident	20 Å²	20	79.4 Å²	79.4	12%	0.123	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	135.5	177.9	-52.2	0	0	0	0	111	R3 I24 V25 A26 S30 A34	R3-T6 PolarHBondContact O-N 3.08Å; R3-T6 VanDerWaalsContact O-N 3.08Å; T6-I24 HydrophobicContact CG2-CG2 3.86Å; T6-V25 CarbonylContact C-O 3.57Å; T6-V25 WeakPolarHBondContact CA-O 3.41Å; T6-A26 HydrophobicContact CG2-CB 3.86Å; T6-A26 WeakPolarHBondContact OG1-CB 3.43Å; T6-S30 WeakPolarHBondContact OG1-CB 3.38Å; T6-A34 HydrophobicContact CG2-CB 3.65Å
7	T	96.1	Very high	83.3	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	143.8	175.9	-170.8	0	0	0	0	111.1	L9 I24 V25 A273 L274 I278 G279	T7-L9 HydrophobicContact CG2-CD2 3.51Å; T7-L9 HydrophobicContact CG2-CG 3.93Å; T7-I24 WeakPolarHBondContact O-CA 2.83Å; T7-V25 HydrophobicContact CG2-CB 4.12Å; T7-V25 PolarHBondContact N-O 2.9Å; T7-V25 PolarHBondContact O-N 3.01Å; T7-A273 HydrophobicContact CG2-CB 3.99Å; T7-L274 HydrophobicContact CG2-CD2 4.03Å; T7-L274 HydrophobicContact CG2-CG 4.19Å; T7-I278 VanDerWaalsContact CB-O 3.23Å; T7-I278 WeakPolarHBondContact CB-O 3.27Å; T7-I278 PolarHBondContact OG1-O 3.01Å; T7-G279 WeakPolarHBondContact CA-O 3.24Å
8	V	96.6	Very high	83.9	Confident	33 Å²	33	75.4 Å²	75.4	20%	0.2	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	104.1	166.4	-178.8	0	0	0	0	107.1	I11 I22 I24 G279 F281 W282	V8-I11 HydrophobicContact CG1-CD1 4.21Å; V8-I11 HydrophobicContact CG1-CG1 3.83Å; V8-I22 HydrophobicContact CG1-CG2 3.76Å; V8-I24 HydrophobicContact CG2-CG1 4.43Å; V8-G279 PolarHBondContact N-O 2.96Å; V8-F281 PolarHBondContact O-N 3.4Å; V8-F281 VanDerWaalsContact O-N 3.15Å; V8-W282 HydrophobicContact CG1-CG 4.26Å; V8-W282 PolarHBondContact O-N 3.4Å
9	L	94.8	Very high	84.5	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-38.8	-175.7	-69.9	-171.1	0	0	0	112.8	T7 T23 V25 F261 L269 A270 A273 F281 W282 Q285	T7-L9 HydrophobicContact CG2-CD2 3.51Å; T7-L9 HydrophobicContact CG2-CG 3.93Å; L9-T23 HydrophobicContact CB-CG2 4.3Å; L9-T23 PolarHBondContact N-O 3.09Å; L9-V25 HydrophobicContact CD1-CB 4.26Å; L9-V25 HydrophobicContact CD1-CG2 3.45Å; L9-V25 VanDerWaalsContact CD1-CG2 3.45Å; L9-V25 HydrophobicContact CG-CB 4.42Å; L9-V25 HydrophobicContact CG-CG2 3.94Å; L9-F261 HydrophobicContact CB-CE2 3.77Å; L9-F261 HydrophobicContact CB-CZ 4.33Å; L9-F261 HydrophobicContact CD1-CE2 4.4Å; L9-L269 HydrophobicContact CD1-CB 4.31Å; L9-L269 HydrophobicContact CD2-CB 4.41Å; L9-A270 HydrophobicContact CD1-CB 4.09Å; L9-A273 HydrophobicContact CD2-CB 3.93Å; L9-F281 HydrophobicContact CD2-CB 4.03Å; L9-F281 HydrophobicContact CD2-CD1 3.91Å; L9-F281 HydrophobicContact CD2-CG 4.08Å; L9-W282 WeakPolarHBondContact O-CA 3.49Å; L9-W282 PolarHBondContact O-N 2.95Å; L9-Q285 PolarHBondContact O-OE1 3.02Å; L9-Q285 VanDerWaalsContact O-OE1 3.11Å
10	N	94.1	Very high	85	Confident	29 Å²	29	73.8 Å²	73.8	16%	0.155	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	148	-177.1	-176.9	39.3	0	0	0	111.3	T23 F261	N10-T23 PolarHBondContact O-N 2.84Å; N10-F261 HydrophobicContact CB-CE2 3.62Å; N10-F261 HydrophobicContact CB-CZ 3.71Å
11	I	93.2	Very high	85.5	Confident	39 Å²	39	72.3 Å²	72.3	20%	0.2	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	106.5	164.6	-53.9	-178.6	0	0	0	107.1	V8 N13 V21 I22 W282	V8-I11 HydrophobicContact CG1-CD1 4.21Å; V8-I11 HydrophobicContact CG1-CG1 3.83Å; I11-N13 VanDerWaalsContact CG2-ND2 3.31Å; I11-N13 WeakPolarHBondContact CG2-ND2 3.28Å; I11-N13 WeakPolarHBondContact CG2-OD1 3.3Å; I11-V21 WeakPolarHBondContact CA-O 3.39Å; I11-I22 HydrophobicContact CG1-CG2 4.43Å; I11-I22 HydrophobicContact CG2-CG1 4.43Å; I11-W282 HydrophobicContact CD1-CD2 3.68Å; I11-W282 HydrophobicContact CD1-CE3 4.21Å; I11-W282 HydrophobicContact CD1-CG 4Å; I11-W282 HydrophobicContact CD1-CH2 4.42Å; I11-W282 HydrophobicContact CD1-CZ2 3.93Å; I11-W282 HydrophobicContact CG1-CB 4.34Å; I11-W282 HydrophobicContact CG1-CD2 4.01Å; I11-W282 HydrophobicContact CG1-CE3 4.49Å; I11-W282 HydrophobicContact CG1-CG 3.94Å
12	F	90.8	Very high	88.2	Confident	56 Å²	56	65.2 Å²	65.2	25%	0.246	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120	168.7	176.7	-99.5	0	0	0	108.3	D14 Y17 S20 V21 V259	F12-D14 HydrophobicContact CD1-CB 4.47Å; F12-D14 HydrophobicContact CE1-CB 3.64Å; F12-D14 HydrophobicContact CZ-CB 3.86Å; F12-Y17 HydrophobicContact CE1-CD2 4.35Å; F12-S20 CarbonylContact O-C 3.56Å; F12-S20 WeakPolarHBondContact O-CA 3.15Å; F12-V21 HydrophobicContact CB-CB 4.29Å; F12-V21 HydrophobicContact CD1-CG2 4.41Å; F12-V21 PolarHBondContact N-O 3.38Å; F12-V21 PolarHBondContact O-N 3.13Å; F12-V259 HydrophobicContact CB-CG1 4.08Å; F12-V259 HydrophobicContact CD1-CG1 3.61Å; F12-V259 HydrophobicContact CD2-CG1 4.17Å; F12-V259 HydrophobicContact CD2-CG2 4.49Å; F12-V259 HydrophobicContact CE1-CG1 4.03Å; F12-V259 HydrophobicContact CE1-CG2 4.31Å; F12-V259 HydrophobicContact CE2-CG2 4.18Å; F12-V259 HydrophobicContact CG-CG1 3.69Å; F12-V259 HydrophobicContact CZ-CG1 4.49Å; F12-V259 HydrophobicContact CZ-CG2 4.08Å
13	N	91	Very high	90.5	Very high	93 Å²	93	59.9 Å²	59.9	50%	0.497	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.5	176.5	-62	-60.9	0	0	0	108.3	I11 S20	I11-N13 VanDerWaalsContact CG2-ND2 3.31Å; I11-N13 WeakPolarHBondContact CG2-ND2 3.28Å; I11-N13 WeakPolarHBondContact CG2-OD1 3.3Å; N13-S20 VanDerWaalsContact OD1-CB 3.23Å; N13-S20 WeakPolarHBondContact OD1-CB 3.48Å; N13-S20 PolarHBondContact OD1-OG 2.66Å
14	D	91.3	Very high	92.4	Very high	18 Å²	18	56.7 Å²	56.7	10%	0.096	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	125.8	-177.7	-170.3	-68.9	0	0	0	110.8	F12 D16 Y17 N18 R19 H194	F12-D14 HydrophobicContact CD1-CB 4.47Å; F12-D14 HydrophobicContact CE1-CB 3.64Å; F12-D14 HydrophobicContact CZ-CB 3.86Å; D14-D16 PolarHBondContact OD1-N 3.23Å; D14-Y17 HydrophobicContact CB-CD2 3.79Å; D14-Y17 HydrophobicContact CB-CG 4.13Å; D14-Y17 WeakPolarHBondContact OD1-CB 3.48Å; D14-Y17 PolarHBondContact OD1-N 3.31Å; D14-N18 WeakPolarHBondContact O-CA 3.41Å; D14-N18 PolarHBondContact O-N 3Å; D14-R19 PolarHBondContact N-O 2.81Å; D14-R19 PolarHBondContact O-N 2.98Å; D14-R19 VanDerWaalsContact O-N 3.13Å; D14-H194 IonicContact OD1-CD2 3.78Å; D14-H194 IonicContact OD1-NE2 2.77Å; D14-H194 IonicContact OD2-CD2 2.76Å; D14-H194 IonicContact OD2-CE1 3.2Å; D14-H194 IonicContact OD2-NE2 2.68Å; D14-H194 PolarHBondContact OD2-NE2 2.86Å
15	H	91.3	Very high	93.8	Very high	167 Å²	167	49 Å²	49	77%	0.773	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-41.7	-175	179.1	-84.7	0	0	0	112.2	N18	H15-N18 PolarHBondContact O-N 3.08Å; H15-N18 VanDerWaalsContact O-N 3.08Å
16	D	90.1	Very high	94.2	Very high	58 Å²	58	45.4 Å²	45.4	31%	0.31	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-43	-178.7	-74.8	-6	0	0	0	110.1	D14 N18 V54 E195	D14-D16 PolarHBondContact OD1-N 3.23Å; D16-N18 PolarHBondContact O-N 3Å; D16-V54 HydrophobicContact CB-CG2 4.31Å; D16-V54 VanDerWaalsContact O-CG2 3.3Å; D16-V54 WeakPolarHBondContact O-CG2 3.05Å; D16-V54 PolarHBondContact O-N 3.44Å; D16-E195 PolarHBondContact OD2-N 3.15Å
17	Y	92.4	Very high	94.2	Very high	10 Å²	10	46.1 Å²	46.1	4%	0.039	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.4	171.3	-62.9	-18.4	0	0	0	112.8	F12 D14 R19 V54 H55 L192 H194 E199	F12-Y17 HydrophobicContact CE1-CD2 4.35Å; D14-Y17 HydrophobicContact CB-CD2 3.79Å; D14-Y17 HydrophobicContact CB-CG 4.13Å; D14-Y17 WeakPolarHBondContact OD1-CB 3.48Å; D14-Y17 PolarHBondContact OD1-N 3.31Å; Y17-R19 PolarHBondContact O-N 2.88Å; Y17-V54 HydrophobicContact CD1-CG2 3.62Å; Y17-V54 HydrophobicContact CE1-CG2 4.06Å; Y17-H55 HydrophobicContact CD1-CB 3.82Å; Y17-H55 HydrophobicContact CG-CB 3.92Å; Y17-L192 HydrophobicContact CD1-CD1 4.25Å; Y17-L192 HydrophobicContact CE1-CB 4.19Å; Y17-L192 HydrophobicContact CE1-CD1 3.52Å; Y17-H194 AromaticContact CE1-CD2 3.8Å; Y17-H194 AromaticContact CZ-CD2 3.83Å; Y17-E199 PolarHBondContact OH-OE1 3.35Å
18	N	94.4	Very high	94.2	Very high	77 Å²	77	48 Å²	48	41%	0.412	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	41.4	-168.4	-166.5	10.3	0	0	0	111	D14 H15 D16 H51 A52	D14-N18 WeakPolarHBondContact O-CA 3.41Å; D14-N18 PolarHBondContact O-N 3Å; H15-N18 PolarHBondContact O-N 3.08Å; H15-N18 VanDerWaalsContact O-N 3.08Å; D16-N18 PolarHBondContact O-N 3Å; N18-H51 PolarHBondContact O-CE1 3.09Å; N18-H51 VanDerWaalsContact O-CE1 3.22Å; N18-A52 WeakPolarHBondContact CB-O 3.43Å; N18-A52 PolarHBondContact ND2-O 2.81Å
19	R	94.5	Very high	94.1	Very high	51 Å²	51	52.8 Å²	52.8	19%	0.192	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144.6	-170.2	-174.3	-179.2	179.1	149.5	11.6	110.7	D14 Y17 H55 D62	D14-R19 PolarHBondContact N-O 2.81Å; D14-R19 PolarHBondContact O-N 2.98Å; D14-R19 VanDerWaalsContact O-N 3.13Å; Y17-R19 PolarHBondContact O-N 2.88Å; R19-H55 PolarHBondContact NH1-CE1 3.32Å; R19-H55 VanDerWaalsContact NH1-CE1 3.3Å; R19-H55 PolarHBondContact NH1-ND1 3.04Å; R19-D62 IonicContact CZ-OD2 3.67Å; R19-D62 IonicContact NH1-OD2 3.73Å; R19-D62 PolarHBondContact NH1-OD2 3.18Å; R19-D62 IonicContact NH2-OD2 3.67Å; R19-D62 PolarHBondContact NH2-OD2 3.31Å
20	S	94.9	Very high	94.1	Very high	67 Å²	67	53.8 Å²	53.8	47%	0.469	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	142.8	169.8	-55.5	0	0	0	0	111.4	F12 N13	F12-S20 CarbonylContact O-C 3.56Å; F12-S20 WeakPolarHBondContact O-CA 3.15Å; N13-S20 VanDerWaalsContact OD1-CB 3.23Å; N13-S20 WeakPolarHBondContact OD1-CB 3.48Å; N13-S20 PolarHBondContact OD1-OG 2.66Å
21	V	95.2	Very high	94.2	Very high	43 Å²	43	53.5 Å²	53.5	26%	0.261	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.9	168.3	-179.3	0	0	0	0	107.8	I11 F12	I11-V21 WeakPolarHBondContact CA-O 3.39Å; F12-V21 HydrophobicContact CB-CB 4.29Å; F12-V21 HydrophobicContact CD1-CG2 4.41Å; F12-V21 PolarHBondContact N-O 3.38Å; F12-V21 PolarHBondContact O-N 3.13Å
22	I	96.3	Very high	94.4	Very high	86 Å²	86	56.3 Å²	56.3	44%	0.441	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	120.8	178.9	-53.7	176.6	0	0	0	107.7	V8 I11 I24	V8-I22 HydrophobicContact CG1-CG2 3.76Å; I11-I22 HydrophobicContact CG1-CG2 4.43Å; I11-I22 HydrophobicContact CG2-CG1 4.43Å; I22-I24 HydrophobicContact CG2-CD1 4.25Å; I22-I24 HydrophobicContact CG2-CG1 3.76Å
23	T	96.9	Very high	94.7	Very high	24 Å²	24	56.3 Å²	56.3	15%	0.147	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	104.9	175	-54.4	0	0	0	0	108.9	L9 N10 F261	L9-T23 HydrophobicContact CB-CG2 4.3Å; L9-T23 PolarHBondContact N-O 3.09Å; N10-T23 PolarHBondContact O-N 2.84Å; T23-F261 HydrophobicContact CG2-CD2 4.26Å; T23-F261 HydrophobicContact CG2-CE2 4.27Å
24	I	97.4	Very high	95	Very high	40 Å²	40	52.4 Å²	52.4	21%	0.205	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.5	176.7	-52.9	179.3	0	0	0	108.2	T6 T7 V8 I22 I31 A34 A38	T6-I24 HydrophobicContact CG2-CG2 3.86Å; T7-I24 WeakPolarHBondContact O-CA 2.83Å; V8-I24 HydrophobicContact CG2-CG1 4.43Å; I22-I24 HydrophobicContact CG2-CD1 4.25Å; I22-I24 HydrophobicContact CG2-CG1 3.76Å; I24-I31 HydrophobicContact CG2-CD1 4.07Å; I24-A34 HydrophobicContact CG2-CB 4.12Å; I24-A38 HydrophobicContact CD1-CB 4.31Å
25	V	96.8	Very high	95.3	Very high	19 Å²	19	52.3 Å²	52.3	12%	0.115	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.5	170.5	-176.9	0	0	0	0	109	T6 T7 L9 L69 A270	T6-V25 CarbonylContact C-O 3.57Å; T6-V25 WeakPolarHBondContact CA-O 3.41Å; T7-V25 HydrophobicContact CG2-CB 4.12Å; T7-V25 PolarHBondContact N-O 2.9Å; T7-V25 PolarHBondContact O-N 3.01Å; L9-V25 HydrophobicContact CD1-CB 4.26Å; L9-V25 HydrophobicContact CD1-CG2 3.45Å; L9-V25 VanDerWaalsContact CD1-CG2 3.45Å; L9-V25 HydrophobicContact CG-CB 4.42Å; L9-V25 HydrophobicContact CG-CG2 3.94Å; V25-L69 HydrophobicContact CG1-CD2 3.83Å; V25-L69 HydrophobicContact CG2-CD2 4.2Å; V25-A270 HydrophobicContact CB-CB 4.14Å; V25-A270 HydrophobicContact CG1-CB 3.63Å; V25-A270 HydrophobicContact CG2-CB 4.27Å
26	A	95.9	Very high	95.7	Very high	22 Å²	22	45.1 Å²	45.1	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	166.6	-179.6	0	0	0	0	0	111.2	E5 T6 I31	E5-A26 CarbonylContact O-C 3.45Å; E5-A26 WeakPolarHBondContact O-CA 3.14Å; E5-A26 VanDerWaalsContact O-CB 3.23Å; E5-A26 WeakPolarHBondContact O-CB 3.14Å; T6-A26 HydrophobicContact CG2-CB 3.86Å; T6-A26 WeakPolarHBondContact OG1-CB 3.43Å; A26-I31 HydrophobicContact CB-CB 4Å; A26-I31 HydrophobicContact CB-CD1 3.84Å
27	S	94.8	Very high	96	Very high	35 Å²	35	45.8 Å²	45.8	25%	0.245	26%	0.256	C	S	.	.			trans	-59.3	156.8	165.1	66	0	0	0	0	110.9	E5 D29 S30 I31	E5-S27 PolarHBondContact O-N 2.8Å; E5-S27 VanDerWaalsContact O-N 3.08Å; E5-S27 WeakPolarHBondContact OE2-CB 3.49Å; E5-S27 PolarHBondContact OE2-OG 3.08Å; S27-D29 PolarHBondContact O-N 2.97Å; S27-S30 PolarHBondContact O-N 3.05Å; S27-S30 WeakPolarHBondContact OG-CB 3.33Å; S27-S30 PolarHBondContact OG-N 3.18Å; S27-S30 PolarHBondContact OG-OG 3.36Å; S27-I31 PolarHBondContact O-N 3.47Å
28	V	95.1	Very high	96.3	Very high	40 Å²	40	47 Å²	47	24%	0.242	27%	0.269	C	S	.	.	H	α-helix	trans	-54.6	-36.5	176.5	175.3	0	0	0	0	111.2	V73 D77 Q81	V28-V73 HydrophobicContact CG2-CG1 4.05Å; V28-V73 HydrophobicContact CG2-CG2 3.86Å; V28-D77 HydrophobicContact CG1-CB 4.16Å; V28-D77 HydrophobicContact CG2-CB 4.22Å; V28-Q81 HydrophobicContact CG1-CG 4.13Å; V28-Q81 PolarHBondContact O-NE2 3.35Å; V28-Q81 PolarHBondContact O-OE1 2.87Å
29	D	93.8	Very high	96.4	Very high	135 Å²	135	43.6 Å²	43.6	72%	0.722	25%	0.251	S	S	*	.	H	α-helix	trans	-74.2	-27.9	-179.8	-66	-28.1	0	0	0	113.1	S27	S27-D29 PolarHBondContact O-N 2.97Å
30	S	95.8	Very high	96.6	Very high	21 Å²	21	45.3 Å²	45.3	15%	0.147	26%	0.261	C	S	.	.	H	α-helix	trans	-97	-24.2	-175.2	-69.3	0	0	0	0	114.4	E5 T6 S27 R32 D33 A34	E5-S30 PolarHBondContact OE2-OG 3.15Å; T6-S30 WeakPolarHBondContact OG1-CB 3.38Å; S27-S30 PolarHBondContact O-N 3.05Å; S27-S30 WeakPolarHBondContact OG-CB 3.33Å; S27-S30 PolarHBondContact OG-N 3.18Å; S27-S30 PolarHBondContact OG-OG 3.36Å; S30-R32 PolarHBondContact O-N 3.4Å; S30-D33 PolarHBondContact O-N 2.9Å; S30-A34 PolarHBondContact O-N 3.31Å; S30-A34 VanDerWaalsContact O-N 3.17Å
31	I	96.9	Very high	96.8	Very high	22 Å²	22	47.3 Å²	47.3	11%	0.113	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-41.5	-170.3	-168.7	64.3	0	0	0	112.9	I24 A26 S27 D33 A34 V35 Q81	I24-I31 HydrophobicContact CG2-CD1 4.07Å; A26-I31 HydrophobicContact CB-CB 4Å; A26-I31 HydrophobicContact CB-CD1 3.84Å; S27-I31 PolarHBondContact O-N 3.47Å; I31-D33 PolarHBondContact O-N 3.2Å; I31-A34 PolarHBondContact O-N 2.97Å; I31-V35 HydrophobicContact CD1-CG2 4.07Å; I31-V35 HydrophobicContact CG1-CG2 4.16Å; I31-V35 WeakPolarHBondContact O-CB 3.47Å; I31-V35 WeakPolarHBondContact O-CG2 3.3Å; I31-V35 PolarHBondContact O-N 3.09Å; I31-Q81 HydrophobicContact CG2-CB 3.99Å; I31-Q81 HydrophobicContact CG2-CG 3.66Å
32	R	97.7	Very high	96.9	Very high	98 Å²	98	46.4 Å²	46.4	37%	0.37	26%	0.26	S	S	.	.	H	α-helix	trans	-54.9	-53.3	178.5	178.9	-161.5	73.8	-155.2	-2.2	111.2	S30 A34 V35 L36 A84 V85	S30-R32 PolarHBondContact O-N 3.4Å; R32-A34 VanDerWaalsContact C-N 3.26Å; R32-A34 PolarHBondContact O-N 3.3Å; R32-V35 PolarHBondContact O-N 3.02Å; R32-L36 HydrophobicContact CG-CD1 3.83Å; R32-L36 HydrophobicContact CG-CG 4.35Å; R32-L36 WeakPolarHBondContact O-CB 3.43Å; R32-L36 VanDerWaalsContact O-CG 3.3Å; R32-L36 WeakPolarHBondContact O-CG 3.32Å; R32-L36 PolarHBondContact O-N 3.13Å; R32-A84 HydrophobicContact CG-CB 4.16Å; R32-V85 HydrophobicContact CB-CG2 4.26Å; R32-V85 HydrophobicContact CG-CG2 4.03Å
33	D	96.9	Very high	96.9	Very high	56 Å²	56	42.4 Å²	42.4	30%	0.299	24%	0.24	S	C	.	.	H	α-helix	trans	-70.9	-27.3	-173.8	-69.8	-14	0	0	0	111.7	R3 S30 I31 S37	R3-D33 PolarHBondContact NH1-O 3Å; R3-D33 VanDerWaalsContact NH1-O 3.09Å; S30-D33 PolarHBondContact O-N 2.9Å; I31-D33 PolarHBondContact O-N 3.2Å; D33-S37 WeakPolarHBondContact O-CB 3.48Å; D33-S37 PolarHBondContact O-N 3.04Å
34	A	96.9	Very high	97	Very high	12 Å²	12	44.4 Å²	44.4	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-71.1	-48.2	176.7	0	0	0	0	0	110.4	R3 T6 I24 S30 I31 R32 S37 A38	R3-A34 VanDerWaalsContact NH1-CA 3.35Å; T6-A34 HydrophobicContact CG2-CB 3.65Å; I24-A34 HydrophobicContact CG2-CB 4.12Å; S30-A34 PolarHBondContact O-N 3.31Å; S30-A34 VanDerWaalsContact O-N 3.17Å; I31-A34 PolarHBondContact O-N 2.97Å; R32-A34 VanDerWaalsContact C-N 3.26Å; R32-A34 PolarHBondContact O-N 3.3Å; A34-S37 PolarHBondContact O-N 3.29Å; A34-A38 PolarHBondContact O-N 2.72Å
35	V	98.2	Very high	97	Very high	16 Å²	16	48.6 Å²	48.6	10%	0.097	28%	0.28	C	S	.	.	H	α-helix	trans	-63.4	-45.8	177.4	172.8	0	0	0	0	111.1	I31 R32 S37 A38 C39 I64 V85	I31-V35 HydrophobicContact CD1-CG2 4.07Å; I31-V35 HydrophobicContact CG1-CG2 4.16Å; I31-V35 WeakPolarHBondContact O-CB 3.47Å; I31-V35 WeakPolarHBondContact O-CG2 3.3Å; I31-V35 PolarHBondContact O-N 3.09Å; R32-V35 PolarHBondContact O-N 3.02Å; V35-S37 VanDerWaalsContact C-N 3.3Å; V35-S37 PolarHBondContact O-N 2.83Å; V35-A38 PolarHBondContact O-N 3.42Å; V35-C39 PolarHBondContact O-N 2.81Å; V35-C39 PolarHBondContact O-SG 2.98Å; V35-I64 HydrophobicContact CG1-CD1 4.14Å; V35-I64 HydrophobicContact CG1-CG2 3.58Å; V35-V85 HydrophobicContact CB-CG2 4.24Å; V35-V85 HydrophobicContact CG1-CG1 3.75Å; V35-V85 HydrophobicContact CG1-CG2 4.14Å
36	L	98.3	Very high	97	Very high	15 Å²	15	50.7 Å²	50.7	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-37.1	178.1	-74.5	179.3	0	0	0	112.7	R32 C39 Q40 V85 L89	R32-L36 HydrophobicContact CG-CD1 3.83Å; R32-L36 HydrophobicContact CG-CG 4.35Å; R32-L36 WeakPolarHBondContact O-CB 3.43Å; R32-L36 VanDerWaalsContact O-CG 3.3Å; R32-L36 WeakPolarHBondContact O-CG 3.32Å; R32-L36 PolarHBondContact O-N 3.13Å; L36-C39 PolarHBondContact O-N 3.29Å; L36-Q40 VanDerWaalsContact O-CG 3.32Å; L36-Q40 WeakPolarHBondContact O-CG 3.26Å; L36-Q40 PolarHBondContact O-N 2.81Å; L36-Q40 PolarHBondContact O-NE2 3.43Å; L36-V85 HydrophobicContact CD2-CG1 4.17Å; L36-V85 WeakPolarHBondContact CD2-O 3.38Å; L36-L89 HydrophobicContact CD2-CB 3.99Å; L36-L89 VanDerWaalsContact CD2-N 3.29Å
37	S	97.4	Very high	97	Very high	73 Å²	73	51.8 Å²	51.8	51%	0.51	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-44.6	175.4	-170.4	0	0	0	0	111.3	D33 A34 V35 C39 E41	D33-S37 WeakPolarHBondContact O-CB 3.48Å; D33-S37 PolarHBondContact O-N 3.04Å; A34-S37 PolarHBondContact O-N 3.29Å; V35-S37 VanDerWaalsContact C-N 3.3Å; V35-S37 PolarHBondContact O-N 2.83Å; S37-C39 VanDerWaalsContact C-N 3.34Å; S37-E41 PolarHBondContact O-N 2.89Å
38	A	97.4	Very high	97.1	Very high	36 Å²	36	51.3 Å²	51.3	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-39.2	176.5	0	0	0	0	0	111.9	I24 A34 V35 E41 A42	I24-A38 HydrophobicContact CD1-CB 4.31Å; A34-A38 PolarHBondContact O-N 2.72Å; V35-A38 PolarHBondContact O-N 3.42Å; A38-E41 PolarHBondContact O-N 3.13Å; A38-A42 WeakPolarHBondContact O-CB 3.49Å; A38-A42 PolarHBondContact O-N 2.47Å
39	C	98.3	Very high	97	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.034	31%	0.305	C	S	.	.	H	α-helix	trans	-66.8	-40.7	179.6	-64.2	0	0	0	0	112.9	V35 L36 S37 E41 A42 C43 V61 I64 L89	V35-C39 PolarHBondContact O-N 2.81Å; V35-C39 PolarHBondContact O-SG 2.98Å; L36-C39 PolarHBondContact O-N 3.29Å; S37-C39 VanDerWaalsContact C-N 3.34Å; C39-E41 VanDerWaalsContact C-N 3.34Å; C39-A42 PolarHBondContact O-N 2.71Å; C39-C43 WeakPolarHBondContact O-CB 3.47Å; C39-C43 PolarHBondContact O-N 2.81Å; C39-C43 PolarHBondContact O-SG 3.45Å; C39-C43 VanDerWaalsContact O-SG 3.35Å; C39-V61 HydrophobicContact CB-CG2 4.01Å; C39-I64 WeakPolarHBondContact SG-CD1 3.41Å; C39-L89 HydrophobicContact CB-CD1 3.76Å
40	Q	98.1	Very high	96.9	Very high	87 Å²	87	54.2 Å²	54.2	41%	0.407	31%	0.306	S	S	.	.	H	α-helix	trans	-61.5	-44.6	177.2	-76.3	169.2	62.5	0	0	111	L36 C43 A44 V93	L36-Q40 VanDerWaalsContact O-CG 3.32Å; L36-Q40 WeakPolarHBondContact O-CG 3.26Å; L36-Q40 PolarHBondContact O-N 2.81Å; L36-Q40 PolarHBondContact O-NE2 3.43Å; Q40-C43 PolarHBondContact O-N 3.32Å; Q40-A44 WeakPolarHBondContact O-CB 3.47Å; Q40-A44 PolarHBondContact O-N 2.96Å; Q40-V93 HydrophobicContact CG-CG2 4.04Å
41	E	98.1	Very high	96.9	Very high	109 Å²	109	55.7 Å²	55.7	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-47.3	177	-167.2	61.6	-153.7	0	0	111.4	S37 A38 C39 C43 A44 L45	S37-E41 PolarHBondContact O-N 2.89Å; A38-E41 PolarHBondContact O-N 3.13Å; C39-E41 VanDerWaalsContact C-N 3.34Å; E41-C43 VanDerWaalsContact C-N 3.35Å; E41-C43 PolarHBondContact O-N 3.22Å; E41-A44 WeakPolarHBondContact O-CB 3.36Å; E41-A44 PolarHBondContact O-N 2.88Å; E41-A44 VanDerWaalsContact O-N 3.09Å; E41-L45 HydrophobicContact CG-CD1 3.86Å; E41-L45 HydrophobicContact CG-CG 4.42Å; E41-L45 WeakPolarHBondContact O-CG 3.44Å; E41-L45 PolarHBondContact O-N 3.02Å; E41-L45 WeakPolarHBondContact OE1-CD1 3.4Å
42	A	97.8	Very high	96.6	Very high	23 Å²	23	58.4 Å²	58.4	19%	0.19	34%	0.336	C	S	.	.	H	α-helix	trans	-58.2	-45.2	177.2	0	0	0	0	0	112	A38 C39 A44 L45 I46 V61	A38-A42 WeakPolarHBondContact O-CB 3.49Å; A38-A42 PolarHBondContact O-N 2.47Å; C39-A42 PolarHBondContact O-N 2.71Å; A42-A44 VanDerWaalsContact C-N 3.31Å; A42-A44 PolarHBondContact O-N 2.89Å; A42-L45 PolarHBondContact O-N 2.91Å; A42-I46 HydrophobicContact CB-CD1 4.24Å; A42-I46 VanDerWaalsContact O-CB 3.22Å; A42-I46 WeakPolarHBondContact O-CB 3.36Å; A42-I46 WeakPolarHBondContact O-CG1 3.44Å; A42-I46 PolarHBondContact O-N 3.32Å; A42-V61 HydrophobicContact CB-CG2 3.65Å
43	C	97.4	Very high	96.3	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.02	34%	0.336	C	S	.	.	H	α-helix	trans	-68.6	-27.1	176.6	-71.7	0	0	0	0	113.3	C39 Q40 E41 S60 V93 R142 Y143	C39-C43 WeakPolarHBondContact O-CB 3.47Å; C39-C43 PolarHBondContact O-N 2.81Å; C39-C43 PolarHBondContact O-SG 3.45Å; C39-C43 VanDerWaalsContact O-SG 3.35Å; Q40-C43 PolarHBondContact O-N 3.32Å; E41-C43 VanDerWaalsContact C-N 3.35Å; E41-C43 PolarHBondContact O-N 3.22Å; C43-S60 PolarHBondContact SG-OG 3.32Å; C43-V93 HydrophobicContact CB-CG1 3.78Å; C43-V93 HydrophobicContact CB-CG2 4.19Å; C43-R142 PolarHBondContact O-NH2 3.35Å; C43-Y143 HydrophobicContact CB-CD1 4.04Å; C43-Y143 HydrophobicContact CB-CE1 3.98Å; C43-Y143 WeakPolarHBondContact O-CE1 3.32Å
44	A	97.3	Very high	96	Very high	65 Å²	65	55.7 Å²	55.7	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-70.4	-45.8	173.4	0	0	0	0	0	111	Q40 E41 A42 R142	Q40-A44 WeakPolarHBondContact O-CB 3.47Å; Q40-A44 PolarHBondContact O-N 2.96Å; E41-A44 WeakPolarHBondContact O-CB 3.36Å; E41-A44 PolarHBondContact O-N 2.88Å; E41-A44 VanDerWaalsContact O-N 3.09Å; A42-A44 VanDerWaalsContact C-N 3.31Å; A42-A44 PolarHBondContact O-N 2.89Å; A44-R142 PolarHBondContact O-NH2 3.13Å
45	L	97.4	Very high	95.7	Very high	128 Å²	128	56.3 Å²	56.3	67%	0.67	34%	0.34	S	S	*	.	H	α-helix	trans	-83.5	-31.4	-172	-63.6	177.1	0	0	0	114.2	E41 A42	E41-L45 HydrophobicContact CG-CD1 3.86Å; E41-L45 HydrophobicContact CG-CG 4.42Å; E41-L45 WeakPolarHBondContact O-CG 3.44Å; E41-L45 PolarHBondContact O-N 3.02Å; E41-L45 WeakPolarHBondContact OE1-CD1 3.4Å; A42-L45 PolarHBondContact O-N 2.91Å
46	I	97.4	Very high	95.5	Very high	64 Å²	64	57.2 Å²	57.2	33%	0.328	35%	0.346	S	S	.	.			trans	-102.5	130.6	-170.3	-58.3	168.8	0	0	0	110.5	A42 M48	A42-I46 HydrophobicContact CB-CD1 4.24Å; A42-I46 VanDerWaalsContact O-CB 3.22Å; A42-I46 WeakPolarHBondContact O-CB 3.36Å; A42-I46 WeakPolarHBondContact O-CG1 3.44Å; A42-I46 PolarHBondContact O-N 3.32Å; I46-M48 HydrophobicContact CG2-SD 4.21Å
47	D	96.8	Very high	95.3	Very high	44 Å²	44	58.2 Å²	58.2	24%	0.235	35%	0.354	C	S	.	.			trans	-114.3	110.2	168.7	-161.3	-44.9	0	0	0	110.2	R49 G50 R142	D47-R49 PolarHBondContact O-N 3.5Å; D47-R49 VanDerWaalsContact O-N 3.13Å; D47-R49 VanDerWaalsContact OD1-CB 3.28Å; D47-R49 WeakPolarHBondContact OD1-CB 3.28Å; D47-R49 WeakPolarHBondContact OD1-CG 2.96Å; D47-R49 IonicContact OD1-CZ 3.79Å; D47-R49 PolarHBondContact OD1-N 2.91Å; D47-R49 VanDerWaalsContact OD1-N 3.08Å; D47-R49 IonicContact OD1-NE 2.81Å; D47-R49 PolarHBondContact OD1-NE 2.81Å; D47-R49 IonicContact OD1-NH2 3.75Å; D47-R49 IonicContact OD2-CZ 2.9Å; D47-R49 IonicContact OD2-NE 3.53Å; D47-R49 PolarHBondContact OD2-NE 3.44Å; D47-R49 IonicContact OD2-NH2 2.66Å; D47-R49 PolarHBondContact OD2-NH2 2.84Å; D47-G50 PolarHBondContact O-N 3.45Å; D47-G50 VanDerWaalsContact O-N 3.15Å; D47-R142 VanDerWaalsContact CG-NH1 3.34Å; D47-R142 IonicContact OD2-CZ 2.86Å; D47-R142 IonicContact OD2-NH1 3.72Å; D47-R142 PolarHBondContact OD2-NH1 3.2Å
48	M	95.4	Very high	95.1	Very high	26 Å²	26	55.1 Å²	55.1	13%	0.128	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-65.1	-16.8	-176.5	-73.3	-58.4	-63.7	0	0	113.7	I46 G50 H51 C57 S60 E141 R142	I46-M48 HydrophobicContact CG2-SD 4.21Å; M48-G50 PolarHBondContact O-N 3.23Å; M48-H51 HydrophobicContact CE-CB 3.99Å; M48-H51 PolarHBondContact O-N 3.32Å; M48-H51 HydrophobicContact SD-CB 3.87Å; M48-C57 HydrophobicContact CE-CB 4.47Å; M48-S60 VanDerWaalsContact CG-N 3.3Å; M48-S60 PolarHBondContact SD-N 3.28Å; M48-S60 VanDerWaalsContact SD-N 3.43Å; M48-E141 VanDerWaalsContact CB-O 3.28Å; M48-E141 WeakPolarHBondContact CB-O 3.39Å; M48-R142 WeakPolarHBondContact CB-O 3.45Å; M48-R142 PolarHBondContact N-O 3.29Å
49	R	93.9	Very high	95.1	Very high	165 Å²	165	53.5 Å²	53.5	62%	0.623	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-65.3	-26.2	175.5	-64.1	174	-68.2	173.2	3	113	D47 E141	D47-R49 PolarHBondContact O-N 3.5Å; D47-R49 VanDerWaalsContact O-N 3.13Å; D47-R49 VanDerWaalsContact OD1-CB 3.28Å; D47-R49 WeakPolarHBondContact OD1-CB 3.28Å; D47-R49 WeakPolarHBondContact OD1-CG 2.96Å; D47-R49 IonicContact OD1-CZ 3.79Å; D47-R49 PolarHBondContact OD1-N 2.91Å; D47-R49 VanDerWaalsContact OD1-N 3.08Å; D47-R49 IonicContact OD1-NE 2.81Å; D47-R49 PolarHBondContact OD1-NE 2.81Å; D47-R49 IonicContact OD1-NH2 3.75Å; D47-R49 IonicContact OD2-CZ 2.9Å; D47-R49 IonicContact OD2-NE 3.53Å; D47-R49 PolarHBondContact OD2-NE 3.44Å; D47-R49 IonicContact OD2-NH2 2.66Å; D47-R49 PolarHBondContact OD2-NH2 2.84Å; R49-E141 HydrophobicContact CG-CB 3.8Å
50	G	92.1	Very high	95	Very high	71 Å²	71	53.9 Å²	53.9	73%	0.732	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-103.4	1.1	177.3	0	0	0	0	0	113.8	D47 M48	D47-G50 PolarHBondContact O-N 3.45Å; D47-G50 VanDerWaalsContact O-N 3.15Å; M48-G50 PolarHBondContact O-N 3.23Å
51	H	94.4	Very high	95	Very high	51 Å²	51	50.7 Å²	50.7	24%	0.236	31%	0.308	C	S	.	.			trans	-79.5	130.1	-175.3	177.3	82	0	0	0	111.3	N18 M48	N18-H51 PolarHBondContact O-CE1 3.09Å; N18-H51 VanDerWaalsContact O-CE1 3.22Å; M48-H51 HydrophobicContact CE-CB 3.99Å; M48-H51 PolarHBondContact O-N 3.32Å; M48-H51 HydrophobicContact SD-CB 3.87Å
52	A	91.3	Very high	95	Very high	79 Å²	79	46 Å²	46	65%	0.653	29%	0.286	S	S	*	.			trans	-144.3	124.8	173.5	0	0	0	0	0	109.5	N18	N18-A52 WeakPolarHBondContact CB-O 3.43Å; N18-A52 PolarHBondContact ND2-O 2.81Å
53	G	91.3	Very high	95	Very high	36 Å²	36	46.5 Å²	46.5	37%	0.371	29%	0.285	S	S	.	.			trans	-150.8	161.6	177.8	0	0	0	0	0	110.4	H55	G53-H55 VanDerWaalsContact C-N 3.29Å
54	V	90.5	Very high	95.1	Very high	62 Å²	62	47 Å²	47	38%	0.376	29%	0.288	S	S	.	.	S	Bend	trans	-75.4	-23.3	179.7	-51.4	0	0	0	0	112.1	D16 Y17 P193	D16-V54 HydrophobicContact CB-CG2 4.31Å; D16-V54 VanDerWaalsContact O-CG2 3.3Å; D16-V54 WeakPolarHBondContact O-CG2 3.05Å; D16-V54 PolarHBondContact O-N 3.44Å; Y17-V54 HydrophobicContact CD1-CG2 3.62Å; Y17-V54 HydrophobicContact CE1-CG2 4.06Å; V54-P193 HydrophobicContact CB-CG 4.38Å; V54-P193 HydrophobicContact CG1-CG 4.37Å; V54-P193 WeakPolarHBondContact CG2-O 3.48Å
55	H	92	Very high	95.1	Very high	25 Å²	25	46 Å²	46	12%	0.116	28%	0.276	C	S	.	.	S	Bend	trans	-83.7	134.2	175.3	-164.9	-75.8	0	0	0	110	Y17 R19 G53 W121 L192	Y17-H55 HydrophobicContact CD1-CB 3.82Å; Y17-H55 HydrophobicContact CG-CB 3.92Å; R19-H55 PolarHBondContact NH1-CE1 3.32Å; R19-H55 VanDerWaalsContact NH1-CE1 3.3Å; R19-H55 PolarHBondContact NH1-ND1 3.04Å; G53-H55 VanDerWaalsContact C-N 3.29Å; H55-W121 AromaticContact CE1-CH2 3.63Å; H55-W121 AromaticContact ND1-CH2 3.91Å; H55-L192 HydrophobicContact CB-CD1 4.41Å
56	P	92.4	Very high	95.2	Very high	34 Å²	34	40.7 Å²	40.7	22%	0.221	25%	0.248	C	C	.	.			trans	-62.8	144.5	176.1	-10.6	22	0	0	0	110.8	W121 F122 L190	P56-W121 HydrophobicContact CB-CD2 4.39Å; P56-W121 HydrophobicContact CB-CE3 3.81Å; P56-W121 HydrophobicContact CB-CH2 3.69Å; P56-W121 HydrophobicContact CB-CZ2 4.29Å; P56-W121 HydrophobicContact CB-CZ3 3.44Å; P56-W121 VanDerWaalsContact CB-CZ3 3.44Å; P56-W121 HydrophobicContact CG-CE3 4.42Å; P56-W121 HydrophobicContact CG-CH2 4.14Å; P56-W121 HydrophobicContact CG-CZ3 3.74Å; P56-W121 WeakPolarHBondContact O-CH2 3.39Å; P56-W121 WeakPolarHBondContact O-CZ2 3.3Å; P56-F122 HydrophobicContact CG-CD1 4.27Å; P56-L190 HydrophobicContact CG-CD1 4.43Å
57	C	94.1	Very high	95.1	Very high	36 Å²	36	40.7 Å²	40.7	24%	0.243	24%	0.244	C	C	.	.			trans	-154.1	136.5	-175.2	-178.8	0	0	0	0	107.9	M48 G59	M48-C57 HydrophobicContact CE-CB 4.47Å; C57-G59 PolarHBondContact SG-O 3.16Å; C57-G59 VanDerWaalsContact SG-O 3.32Å
58	M	94.8	Very high	95.1	Very high	9 Å²	9	38.9 Å²	38.9	4%	0.044	24%	0.235	C	C	.	.			trans	-117.7	-7.1	177.4	-157.5	-172.9	-65.4	0	0	113.3	D62 M119 W121 L128 L131 G144 L145	M58-D62 PolarHBondContact N-OD1 2.77Å; M58-M119 HydrophobicContact CE-CB 3.99Å; M58-M119 VanDerWaalsContact CE-O 3.23Å; M58-M119 WeakPolarHBondContact CE-O 3.47Å; M58-M119 HydrophobicContact SD-CB 4.46Å; M58-W121 HydrophobicContact CB-CG 4.45Å; M58-W121 HydrophobicContact CE-CB 3.5Å; M58-W121 VanDerWaalsContact CE-CB 3.5Å; M58-W121 HydrophobicContact CE-CG 4.01Å; M58-W121 VanDerWaalsContact CE-N 3.28Å; M58-L128 HydrophobicContact CG-CD2 4.09Å; M58-L128 HydrophobicContact SD-CD2 4.19Å; M58-L131 HydrophobicContact SD-CD1 3.83Å; M58-G144 CarbonylContact O-C 3.1Å; M58-G144 WeakPolarHBondContact O-CA 3.22Å; M58-L145 CarbonylContact C-O 3.5Å; M58-L145 HydrophobicContact CG-CB 4.09Å; M58-L145 PolarHBondContact O-N 2.9Å; M58-L145 HydrophobicContact SD-CB 3.66Å; M58-L145 HydrophobicContact SD-CD2 3.54Å; M58-L145 VanDerWaalsContact SD-CD2 3.54Å; M58-L145 HydrophobicContact SD-CG 4.11Å
59	G	96.1	Very high	95	Very high	2 Å²	2	39.6 Å²	39.6	2%	0.021	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-151.2	157.1	-178.5	0	0	0	0	0	114.9	C57 V61 D62 Y143	C57-G59 PolarHBondContact SG-O 3.16Å; C57-G59 VanDerWaalsContact SG-O 3.32Å; G59-V61 CarbonylContact O-C 3.4Å; G59-V61 PolarHBondContact O-N 3.5Å; G59-D62 PolarHBondContact O-N 3.08Å; G59-Y143 CarbonylContact C-O 3.57Å; G59-Y143 WeakPolarHBondContact CA-O 3.32Å
60	S	96.9	Very high	94.6	Very high	13 Å²	13	33.1 Å²	33.1	9%	0.091	22%	0.224	C	C	.	.	S	Bend	trans	-58.4	-36.6	174.3	50.2	0	0	0	0	111.2	C43 M48 Y143	C43-S60 PolarHBondContact SG-OG 3.32Å; M48-S60 VanDerWaalsContact CG-N 3.3Å; M48-S60 PolarHBondContact SD-N 3.28Å; M48-S60 VanDerWaalsContact SD-N 3.43Å; S60-Y143 PolarHBondContact N-O 2.96Å; S60-Y143 PolarHBondContact OG-O 3.22Å
61	V	98.2	Very high	94.2	Very high	19 Å²	19	38.4 Å²	38.4	12%	0.115	23%	0.229	C	C	.	.	S	Bend	trans	-110.1	104.5	155.5	-177	0	0	0	0	106.1	C39 A42 G59 I64 T146	C39-V61 HydrophobicContact CB-CG2 4.01Å; A42-V61 HydrophobicContact CB-CG2 3.65Å; G59-V61 CarbonylContact O-C 3.4Å; G59-V61 PolarHBondContact O-N 3.5Å; V61-I64 HydrophobicContact CG1-CD1 3.81Å; V61-I64 HydrophobicContact CG1-CG1 3.61Å; V61-T146 HydrophobicContact CB-CG2 4.33Å; V61-T146 HydrophobicContact CG1-CG2 4.09Å; V61-T146 WeakPolarHBondContact O-CA 3.3Å; V61-T146 VanDerWaalsContact O-CB 3.26Å; V61-T146 WeakPolarHBondContact O-CB 3.26Å; V61-T146 VanDerWaalsContact O-CG2 3.3Å; V61-T146 WeakPolarHBondContact O-CG2 3.29Å; V61-T146 PolarHBondContact O-OG1 2.93Å
62	D	97.6	Very high	93.8	Very high	11 Å²	11	40.7 Å²	40.7	6%	0.059	26%	0.257	C	S	.	.			trans	-73.3	-53.5	-173.3	-178	54.1	0	0	0	111.5	R19 M58 G59 W121 G147	R19-D62 IonicContact CZ-OD2 3.67Å; R19-D62 IonicContact NH1-OD2 3.73Å; R19-D62 PolarHBondContact NH1-OD2 3.18Å; R19-D62 IonicContact NH2-OD2 3.67Å; R19-D62 PolarHBondContact NH2-OD2 3.31Å; M58-D62 PolarHBondContact N-OD1 2.77Å; G59-D62 PolarHBondContact O-N 3.08Å; D62-W121 PolarHBondContact OD1-NE1 3.13Å; D62-W121 WeakPolarHBondContact OD2-CZ2 3.37Å; D62-G147 PolarHBondContact O-N 3.11Å
63	L	98.2	Very high	94	Very high	33 Å²	33	38.4 Å²	38.4	17%	0.173	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	140.3	-175.5	-64.3	173.4	0	0	0	111.6	F99 F101 L112 G147	L63-F99 HydrophobicContact CD2-CZ 4.06Å; L63-F101 HydrophobicContact CD2-CE1 4.48Å; L63-L112 HydrophobicContact CD1-CD1 4.24Å; L63-L112 HydrophobicContact CD1-CD2 3.87Å; L63-L112 HydrophobicContact CD2-CD1 3.6Å; L63-G147 CarbonylContact C-O 3.53Å; L63-G147 WeakPolarHBondContact CA-O 3.39Å
64	I	98.7	Very high	94.2	Very high	13 Å²	13	36.9 Å²	36.9	7%	0.067	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	80.6	173.7	-47.7	177.2	0	0	0	108.5	V35 C39 V61 V85 L89 T146 G147 V148 G149	V35-I64 HydrophobicContact CG1-CD1 4.14Å; V35-I64 HydrophobicContact CG1-CG2 3.58Å; C39-I64 WeakPolarHBondContact SG-CD1 3.41Å; V61-I64 HydrophobicContact CG1-CD1 3.81Å; V61-I64 HydrophobicContact CG1-CG1 3.61Å; I64-V85 HydrophobicContact CD1-CG1 3.83Å; I64-V85 HydrophobicContact CG2-CG1 4.3Å; I64-L89 HydrophobicContact CD1-CD2 4.43Å; I64-T146 HydrophobicContact CD1-CG2 3.98Å; I64-T146 HydrophobicContact CG1-CG2 4.02Å; I64-G147 PolarHBondContact N-O 3.26Å; I64-V148 HydrophobicContact CB-CG1 4.32Å; I64-V148 HydrophobicContact CB-CG2 4.13Å; I64-V148 HydrophobicContact CD1-CG2 3.94Å; I64-V148 HydrophobicContact CG1-CG2 4.28Å; I64-V148 WeakPolarHBondContact O-CA 3.34Å; I64-G149 PolarHBondContact O-N 3.14Å
65	P	98.1	Very high	94.5	Very high	44 Å²	44	35.9 Å²	35.9	29%	0.286	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	137.7	168.8	33.1	-32.6	0	0	0	110.8	Y67 F101 G149	P65-Y67 HydrophobicContact CB-CE1 3.69Å; P65-Y67 HydrophobicContact CB-CE2 4.08Å; P65-Y67 WeakPolarHBondContact CB-OH 3.39Å; P65-Y67 HydrophobicContact CG-CE1 4.44Å; P65-Y67 HydrophobicContact CG-CE2 4Å; P65-Y67 WeakPolarHBondContact CG-OH 3.4Å; P65-F101 HydrophobicContact CB-CE2 4.39Å; P65-F101 HydrophobicContact CB-CZ 3.95Å; P65-G149 CarbonylContact C-O 3.48Å
66	I	98.3	Very high	94.7	Very high	17 Å²	17	43.3 Å²	43.3	9%	0.087	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.6	173.5	-58	-171.4	0	0	0	108.6	C78 Q81 A82 V85 G149 A150 S151	I66-C78 HydrophobicContact CG2-CB 4.03Å; I66-Q81 HydrophobicContact CD1-CB 3.86Å; I66-A82 HydrophobicContact CD1-CB 4Å; I66-A82 HydrophobicContact CG1-CB 4.46Å; I66-V85 HydrophobicContact CD1-CG2 4.44Å; I66-G149 PolarHBondContact N-O 3.22Å; I66-A150 VanDerWaalsContact O-CA 3.27Å; I66-A150 WeakPolarHBondContact O-CA 3.49Å; I66-S151 PolarHBondContact O-N 2.95Å
67	Y	97.1	Very high	95	Very high	65 Å²	65	44.1 Å²	44.1	26%	0.255	24%	0.239	S	C	.	.			trans	-117	141.7	-178.1	-50.1	-55.4	0	0	0	110.5	P65 S151 P152 Y153 V154	P65-Y67 HydrophobicContact CB-CE1 3.69Å; P65-Y67 HydrophobicContact CB-CE2 4.08Å; P65-Y67 WeakPolarHBondContact CB-OH 3.39Å; P65-Y67 HydrophobicContact CG-CE1 4.44Å; P65-Y67 HydrophobicContact CG-CE2 4Å; P65-Y67 WeakPolarHBondContact CG-OH 3.4Å; Y67-S151 VanDerWaalsContact CE1-OG 3.3Å; Y67-S151 WeakPolarHBondContact CE1-OG 3.35Å; Y67-P152 WeakPolarHBondContact CD1-O 3.5Å; Y67-Y153 HydrophobicContact CD2-CD2 4.19Å; Y67-Y153 HydrophobicContact CD2-CE2 4.34Å; Y67-Y153 HydrophobicContact CD2-CG 4.46Å; Y67-Y153 HydrophobicContact CG-CD2 4.24Å; Y67-Y153 HydrophobicContact CG-CG 4.43Å; Y67-V154 HydrophobicContact CE1-CB 4.05Å; Y67-V154 HydrophobicContact CE1-CG2 3.72Å; Y67-V154 WeakPolarHBondContact OH-CB 3.4Å
68	P	95.9	Very high	95.2	Very high	5 Å²	5	42.6 Å²	42.6	3%	0.032	23%	0.229	C	C	.	.			trans	-68.3	139.8	166.9	29.2	-31.7	0	0	0	109	V73 W103 S151 V225	P68-V73 HydrophobicContact CB-CB 4.42Å; P68-V73 HydrophobicContact CB-CG1 4.19Å; P68-V73 VanDerWaalsContact CB-O 3.29Å; P68-V73 WeakPolarHBondContact CB-O 3.41Å; P68-W103 HydrophobicContact CG-CH2 4.27Å; P68-W103 HydrophobicContact CG-CZ3 4.14Å; P68-S151 WeakPolarHBondContact CD-O 3.48Å; P68-V225 HydrophobicContact CB-CG1 4.12Å; P68-V225 HydrophobicContact CB-CG2 4.32Å; P68-V225 HydrophobicContact CG-CB 4.37Å; P68-V225 HydrophobicContact CG-CG1 3.79Å; P68-V225 HydrophobicContact CG-CG2 3.6Å
69	L	92.9	Very high	95.4	Very high	42 Å²	42	43.5 Å²	43.5	22%	0.22	24%	0.235	C	C	.	.			trans	-133	121.5	176.2	-168.2	68.7	0	0	0	108.4	V25 Y153 C266 M267 A270	V25-L69 HydrophobicContact CG1-CD2 3.83Å; V25-L69 HydrophobicContact CG2-CD2 4.2Å; L69-Y153 HydrophobicContact CD1-CD2 4.34Å; L69-Y153 HydrophobicContact CD1-CE2 4.15Å; L69-C266 HydrophobicContact CD1-CB 4.16Å; L69-M267 HydrophobicContact CD1-CB 3.9Å; L69-M267 HydrophobicContact CG-CB 4.17Å; L69-M267 HydrophobicContact CG-CG 4.37Å; L69-A270 HydrophobicContact CD2-CB 4.01Å
70	G	84.9	Confident	95.5	Very high	29 Å²	29	47.7 Å²	47.7	30%	0.299	25%	0.254	S	S	.	.	S	Bend	trans	80.5	172.2	-171.5	0	0	0	0	0	113.6	A72	G70-A72 VanDerWaalsContact C-N 3.34Å
71	E	83.6	Confident	95.6	Very high	182 Å²	182	48.2 Å²	48.2	85%	0.85	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-15.9	-173.6	-61.1	-172.9	163.9	0	0	113.8
72	A	87.6	Confident	95.6	Very high	98 Å²	98	47.3 Å²	47.3	81%	0.81	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-9.2	-175.7	0	0	0	0	0	114.1	G70	G70-A72 VanDerWaalsContact C-N 3.34Å
73	V	94.3	Very high	95.6	Very high	32 Å²	32	49 Å²	49	19%	0.194	26%	0.258	C	S	.	.			trans	-115.9	119.9	-177	-177.7	0	0	0	0	109.5	V28 P68 D77	V28-V73 HydrophobicContact CG2-CG1 4.05Å; V28-V73 HydrophobicContact CG2-CG2 3.86Å; P68-V73 HydrophobicContact CB-CB 4.42Å; P68-V73 HydrophobicContact CB-CG1 4.19Å; P68-V73 VanDerWaalsContact CB-O 3.29Å; P68-V73 WeakPolarHBondContact CB-O 3.41Å; V73-D77 HydrophobicContact CG1-CB 3.99Å
74	G	95.9	Very high	95.7	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.031	26%	0.258	C	S	.	.			trans	-100.1	-179.2	-176.8	0	0	0	0	0	114.4	R76 D77 C78 D226	G74-R76 VanDerWaalsContact C-N 3.29Å; G74-R76 PolarHBondContact O-N 2.88Å; G74-D77 PolarHBondContact N-OD2 2.95Å; G74-D77 PolarHBondContact O-N 2.62Å; G74-C78 PolarHBondContact O-N 3.44Å; G74-C78 PolarHBondContact O-SG 3.03Å; G74-C78 VanDerWaalsContact O-SG 3.33Å; G74-D226 VanDerWaalsContact CA-OD1 3.27Å; G74-D226 WeakPolarHBondContact CA-OD1 3.49Å; G74-D226 WeakPolarHBondContact CA-OD2 3.23Å
75	E	96.3	Very high	95.7	Very high	41 Å²	41	47.8 Å²	47.8	19%	0.192	26%	0.255	C	S	.	.	H	α-helix	trans	-56.3	-45.6	173	171.3	175.7	152	0	0	110.8	D77 C78 V79 W103 D226 R228	E75-D77 PolarHBondContact O-N 2.96Å; E75-C78 PolarHBondContact O-N 3.38Å; E75-V79 HydrophobicContact CG-CG2 4.39Å; E75-V79 WeakPolarHBondContact O-CG2 3.45Å; E75-V79 PolarHBondContact O-N 2.81Å; E75-W103 HydrophobicContact CB-CD2 4.3Å; E75-W103 HydrophobicContact CB-CE3 4.05Å; E75-W103 HydrophobicContact CB-CH2 4.19Å; E75-W103 HydrophobicContact CB-CZ2 4.4Å; E75-W103 HydrophobicContact CB-CZ3 4.01Å; E75-W103 HydrophobicContact CG-CB 4.2Å; E75-W103 HydrophobicContact CG-CD2 3.57Å; E75-W103 HydrophobicContact CG-CE3 3.69Å; E75-W103 HydrophobicContact CG-CG 3.84Å; E75-W103 HydrophobicContact CG-CH2 4.47Å; E75-W103 HydrophobicContact CG-CZ2 4.35Å; E75-W103 HydrophobicContact CG-CZ3 4.16Å; E75-D226 PolarHBondContact N-OD2 2.87Å; E75-R228 IonicContact OE2-NH1 3.47Å; E75-R228 PolarHBondContact OE2-NH1 3.38Å
76	R	97.3	Very high	95.7	Very high	182 Å²	182	45.7 Å²	45.7	69%	0.687	24%	0.241	S	C	*	.	H	α-helix	trans	-61	-42.9	-176.6	-178.2	178.6	176.1	171.7	0.4	112.3	G74 V79 Q80	G74-R76 VanDerWaalsContact C-N 3.29Å; G74-R76 PolarHBondContact O-N 2.88Å; R76-V79 PolarHBondContact O-N 2.83Å; R76-Q80 WeakPolarHBondContact O-CB 3.44Å; R76-Q80 WeakPolarHBondContact O-CG 3.37Å; R76-Q80 PolarHBondContact O-N 3.13Å
77	D	98	Very high	95.7	Very high	51 Å²	51	50.5 Å²	50.5	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-47.2	179.7	-57.2	-51.5	0	0	0	109.9	V28 V73 G74 E75 V79 Q80 Q81	V28-D77 HydrophobicContact CG1-CB 4.16Å; V28-D77 HydrophobicContact CG2-CB 4.22Å; V73-D77 HydrophobicContact CG1-CB 3.99Å; G74-D77 PolarHBondContact N-OD2 2.95Å; G74-D77 PolarHBondContact O-N 2.62Å; E75-D77 PolarHBondContact O-N 2.96Å; D77-V79 PolarHBondContact O-N 3.23Å; D77-Q80 PolarHBondContact O-N 3.09Å; D77-Q81 WeakPolarHBondContact O-CG 3.22Å; D77-Q81 PolarHBondContact O-N 2.89Å
78	C	98.1	Very high	95.8	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.02	25%	0.25	C	C	.	.	H	α-helix	trans	-61.5	-42.8	178.8	-61.7	0	0	0	0	112.2	I66 G74 E75 Q81 A82 A150	I66-C78 HydrophobicContact CG2-CB 4.03Å; G74-C78 PolarHBondContact O-N 3.44Å; G74-C78 PolarHBondContact O-SG 3.03Å; G74-C78 VanDerWaalsContact O-SG 3.33Å; E75-C78 PolarHBondContact O-N 3.38Å; C78-Q81 PolarHBondContact O-N 2.92Å; C78-A82 WeakPolarHBondContact O-CB 3.31Å; C78-A82 PolarHBondContact O-N 3.46Å; C78-A150 HydrophobicContact CB-CB 3.77Å
79	V	98.6	Very high	95.9	Very high	28 Å²	28	47.5 Å²	47.5	17%	0.17	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-45.2	176.2	171.6	0	0	0	0	111.2	E75 R76 D77 Q81 A82 L83 W103 A150	E75-V79 HydrophobicContact CG-CG2 4.39Å; E75-V79 WeakPolarHBondContact O-CG2 3.45Å; E75-V79 PolarHBondContact O-N 2.81Å; R76-V79 PolarHBondContact O-N 2.83Å; D77-V79 PolarHBondContact O-N 3.23Å; V79-Q81 VanDerWaalsContact C-N 3.32Å; V79-Q81 PolarHBondContact O-N 3.33Å; V79-A82 PolarHBondContact O-N 3.03Å; V79-L83 HydrophobicContact CG1-CD1 3.94Å; V79-L83 HydrophobicContact CG1-CG 4.37Å; V79-L83 WeakPolarHBondContact O-CG 3.21Å; V79-L83 PolarHBondContact O-N 2.87Å; V79-W103 HydrophobicContact CG2-CB 3.41Å; V79-W103 VanDerWaalsContact CG2-CB 3.41Å; V79-A150 HydrophobicContact CG2-CB 4.17Å
80	Q	98.6	Very high	96.2	Very high	90 Å²	90	46.7 Å²	46.7	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-59.3	-44.9	178	-76.6	-177.4	-17.2	0	0	111.4	R76 D77 A84	R76-Q80 WeakPolarHBondContact O-CB 3.44Å; R76-Q80 WeakPolarHBondContact O-CG 3.37Å; R76-Q80 PolarHBondContact O-N 3.13Å; D77-Q80 PolarHBondContact O-N 3.09Å; Q80-A84 VanDerWaalsContact O-CB 3.29Å; Q80-A84 WeakPolarHBondContact O-CB 3.28Å; Q80-A84 PolarHBondContact O-N 3.36Å
81	Q	98.7	Very high	96.8	Very high	25 Å²	25	52.3 Å²	52.3	12%	0.117	26%	0.264	C	S	.	.	H	α-helix	trans	-67.6	-40.5	177.9	-61.9	-53.3	-33.4	0	0	112.3	V28 I31 I66 D77 C78 V79 L83 A84 V85	V28-Q81 HydrophobicContact CG1-CG 4.13Å; V28-Q81 PolarHBondContact O-NE2 3.35Å; V28-Q81 PolarHBondContact O-OE1 2.87Å; I31-Q81 HydrophobicContact CG2-CB 3.99Å; I31-Q81 HydrophobicContact CG2-CG 3.66Å; I66-Q81 HydrophobicContact CD1-CB 3.86Å; D77-Q81 WeakPolarHBondContact O-CG 3.22Å; D77-Q81 PolarHBondContact O-N 2.89Å; C78-Q81 PolarHBondContact O-N 2.92Å; V79-Q81 VanDerWaalsContact C-N 3.32Å; V79-Q81 PolarHBondContact O-N 3.33Å; Q81-L83 PolarHBondContact O-N 3.38Å; Q81-A84 PolarHBondContact O-N 3.3Å; Q81-V85 WeakPolarHBondContact O-CB 3.19Å; Q81-V85 WeakPolarHBondContact O-CG2 3.33Å; Q81-V85 PolarHBondContact O-N 3.44Å
82	A	98.8	Very high	97.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-45.1	179.1	0	0	0	0	0	111.2	I66 C78 V79 V85 A86 A104 V148 A150	I66-A82 HydrophobicContact CD1-CB 4Å; I66-A82 HydrophobicContact CG1-CB 4.46Å; C78-A82 WeakPolarHBondContact O-CB 3.31Å; C78-A82 PolarHBondContact O-N 3.46Å; V79-A82 PolarHBondContact O-N 3.03Å; A82-V85 PolarHBondContact O-N 3.34Å; A82-A86 WeakPolarHBondContact O-CB 3.37Å; A82-A86 PolarHBondContact O-N 2.84Å; A82-A104 HydrophobicContact CB-CB 4.06Å; A82-V148 HydrophobicContact CB-CG1 4.17Å; A82-V148 VanDerWaalsContact O-CG1 3.27Å; A82-V148 WeakPolarHBondContact O-CG1 3.47Å; A82-A150 HydrophobicContact CB-CB 4.2Å
83	L	98.8	Very high	97.9	Very high	45 Å²	45	43 Å²	43	24%	0.236	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-35.6	176.6	-65.5	177.2	0	0	0	112.4	V79 Q81 R87 L100 A104	V79-L83 HydrophobicContact CG1-CD1 3.94Å; V79-L83 HydrophobicContact CG1-CG 4.37Å; V79-L83 WeakPolarHBondContact O-CG 3.21Å; V79-L83 PolarHBondContact O-N 2.87Å; Q81-L83 PolarHBondContact O-N 3.38Å; L83-R87 WeakPolarHBondContact O-CG 3.41Å; L83-R87 PolarHBondContact O-N 2.82Å; L83-L100 HydrophobicContact CD2-CD1 3.65Å; L83-L100 HydrophobicContact CD2-CD2 4.09Å; L83-A104 HydrophobicContact CD2-CB 4.43Å
84	A	98.7	Very high	97.9	Very high	21 Å²	21	51.9 Å²	51.9	17%	0.174	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-41.9	175.9	0	0	0	0	0	111.9	R32 Q80 Q81 G88	R32-A84 HydrophobicContact CG-CB 4.16Å; Q80-A84 VanDerWaalsContact O-CB 3.29Å; Q80-A84 WeakPolarHBondContact O-CB 3.28Å; Q80-A84 PolarHBondContact O-N 3.36Å; Q81-A84 PolarHBondContact O-N 3.3Å; A84-G88 PolarHBondContact O-N 2.74Å
85	V	98.8	Very high	97.7	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-45.7	173.4	169.5	0	0	0	0	110.8	R32 V35 L36 I64 I66 Q81 A82 R87 G88 L89 V148	R32-V85 HydrophobicContact CB-CG2 4.26Å; R32-V85 HydrophobicContact CG-CG2 4.03Å; V35-V85 HydrophobicContact CB-CG2 4.24Å; V35-V85 HydrophobicContact CG1-CG1 3.75Å; V35-V85 HydrophobicContact CG1-CG2 4.14Å; L36-V85 HydrophobicContact CD2-CG1 4.17Å; L36-V85 WeakPolarHBondContact CD2-O 3.38Å; I64-V85 HydrophobicContact CD1-CG1 3.83Å; I64-V85 HydrophobicContact CG2-CG1 4.3Å; I66-V85 HydrophobicContact CD1-CG2 4.44Å; Q81-V85 WeakPolarHBondContact O-CB 3.19Å; Q81-V85 WeakPolarHBondContact O-CG2 3.33Å; Q81-V85 PolarHBondContact O-N 3.44Å; A82-V85 PolarHBondContact O-N 3.34Å; V85-R87 PolarHBondContact O-N 2.75Å; V85-G88 PolarHBondContact O-N 2.88Å; V85-L89 VanDerWaalsContact O-CB 3.26Å; V85-L89 WeakPolarHBondContact O-CB 3.33Å; V85-L89 PolarHBondContact O-N 2.87Å; V85-V148 HydrophobicContact CG1-CG1 4.44Å
86	A	98.8	Very high	97.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-48.9	178.8	0	0	0	0	0	111.9	A82 T90 V98 L100 V135 V148	A82-A86 WeakPolarHBondContact O-CB 3.37Å; A82-A86 PolarHBondContact O-N 2.84Å; A86-T90 WeakPolarHBondContact O-CG2 3.38Å; A86-T90 PolarHBondContact O-N 2.9Å; A86-T90 PolarHBondContact O-OG1 3.3Å; A86-V98 HydrophobicContact CB-CB 4.48Å; A86-V98 HydrophobicContact CB-CG1 3.88Å; A86-L100 HydrophobicContact CB-CD2 4.03Å; A86-V135 HydrophobicContact CB-CG2 4.26Å; A86-V148 HydrophobicContact CB-CB 4.27Å; A86-V148 HydrophobicContact CB-CG1 4.28Å; A86-V148 HydrophobicContact CB-CG2 4.41Å
87	R	98.6	Very high	97.8	Very high	119 Å²	119	41.5 Å²	41.5	45%	0.449	20%	0.199	S	C	.	.	H	α-helix	trans	-63	-53.3	176	-73.1	-172.7	-66.4	-90	-2.5	111.7	L83 V85 L89 T90 E91 V135	L83-R87 WeakPolarHBondContact O-CG 3.41Å; L83-R87 PolarHBondContact O-N 2.82Å; V85-R87 PolarHBondContact O-N 2.75Å; R87-L89 VanDerWaalsContact C-N 3.26Å; R87-L89 PolarHBondContact O-N 3.3Å; R87-T90 PolarHBondContact O-N 2.88Å; R87-T90 PolarHBondContact O-OG1 3.26Å; R87-E91 WeakPolarHBondContact O-CG 3.33Å; R87-E91 PolarHBondContact O-N 2.98Å; R87-V135 HydrophobicContact CG-CG1 4.34Å
88	G	98.6	Very high	97.9	Very high	7 Å²	7	39 Å²	39	7%	0.072	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-36.2	-177.5	0	0	0	0	0	113	A84 V85 E91 T92	A84-G88 PolarHBondContact O-N 2.74Å; V85-G88 PolarHBondContact O-N 2.88Å; G88-E91 PolarHBondContact O-N 2.6Å; G88-T92 WeakPolarHBondContact O-CB 3.11Å; G88-T92 VanDerWaalsContact O-CG2 3.27Å; G88-T92 WeakPolarHBondContact O-CG2 3.1Å; G88-T92 PolarHBondContact O-N 3.45Å; G88-T92 PolarHBondContact O-OG1 3.45Å
89	L	98.5	Very high	97.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-47.8	175.7	177	56.8	0	0	0	111.2	L36 C39 I64 V85 R87 E91 T92 V93 A96 V98 T146	L36-L89 HydrophobicContact CD2-CB 3.99Å; L36-L89 VanDerWaalsContact CD2-N 3.29Å; C39-L89 HydrophobicContact CB-CD1 3.76Å; I64-L89 HydrophobicContact CD1-CD2 4.43Å; V85-L89 VanDerWaalsContact O-CB 3.26Å; V85-L89 WeakPolarHBondContact O-CB 3.33Å; V85-L89 PolarHBondContact O-N 2.87Å; R87-L89 VanDerWaalsContact C-N 3.26Å; R87-L89 PolarHBondContact O-N 3.3Å; L89-E91 VanDerWaalsContact C-N 3.3Å; L89-E91 PolarHBondContact O-N 2.59Å; L89-T92 PolarHBondContact O-N 2.89Å; L89-T92 PolarHBondContact O-OG1 3.12Å; L89-V93 HydrophobicContact CD1-CB 4.16Å; L89-V93 HydrophobicContact CD1-CG2 3.83Å; L89-V93 WeakPolarHBondContact O-CB 3.34Å; L89-V93 PolarHBondContact O-N 3.2Å; L89-A96 HydrophobicContact CD1-CB 4.39Å; L89-A96 HydrophobicContact CG-CB 4.1Å; L89-V98 HydrophobicContact CD2-CG2 4.12Å; L89-T146 HydrophobicContact CD2-CG2 4.14Å
90	T	98.1	Very high	97.9	Very high	25 Å²	25	38.5 Å²	38.5	15%	0.153	18%	0.182	C	C	.	.	H	α-helix	trans	-70.8	-25.4	-179.3	62	0	0	0	0	113.5	A86 R87 V98 V135	A86-T90 WeakPolarHBondContact O-CG2 3.38Å; A86-T90 PolarHBondContact O-N 2.9Å; A86-T90 PolarHBondContact O-OG1 3.3Å; R87-T90 PolarHBondContact O-N 2.88Å; R87-T90 PolarHBondContact O-OG1 3.26Å; T90-V98 HydrophobicContact CG2-CG2 4.07Å; T90-V135 HydrophobicContact CG2-CB 4.48Å; T90-V135 HydrophobicContact CG2-CG1 4.08Å
91	E	97.9	Very high	97.9	Very high	147 Å²	147	34.5 Å²	34.5	69%	0.687	16%	0.163	S	C	*	.	H	α-helix	trans	-77	-40.9	174.3	-72.2	167.6	-177.1	0	0	112	R87 G88 L89	R87-E91 WeakPolarHBondContact O-CG 3.33Å; R87-E91 PolarHBondContact O-N 2.98Å; G88-E91 PolarHBondContact O-N 2.6Å; L89-E91 VanDerWaalsContact C-N 3.3Å; L89-E91 PolarHBondContact O-N 2.59Å
92	T	97.1	Very high	97.8	Very high	72 Å²	72	33.7 Å²	33.7	44%	0.442	16%	0.162	S	C	.	.	H	α-helix	trans	-85.8	-33.2	-175.9	55.2	0	0	0	0	113.4	G88 L89	G88-T92 WeakPolarHBondContact O-CB 3.11Å; G88-T92 VanDerWaalsContact O-CG2 3.27Å; G88-T92 WeakPolarHBondContact O-CG2 3.1Å; G88-T92 PolarHBondContact O-N 3.45Å; G88-T92 PolarHBondContact O-OG1 3.45Å; L89-T92 PolarHBondContact O-N 2.89Å; L89-T92 PolarHBondContact O-OG1 3.12Å
93	V	96.9	Very high	97.8	Very high	12 Å²	12	34.9 Å²	34.9	7%	0.073	17%	0.166	C	C	.	.	S	Bend	trans	-110.9	97.9	-179.8	-176.9	0	0	0	0	109.6	Q40 C43 L89 G95 A96 Y143	Q40-V93 HydrophobicContact CG-CG2 4.04Å; C43-V93 HydrophobicContact CB-CG1 3.78Å; C43-V93 HydrophobicContact CB-CG2 4.19Å; L89-V93 HydrophobicContact CD1-CB 4.16Å; L89-V93 HydrophobicContact CD1-CG2 3.83Å; L89-V93 WeakPolarHBondContact O-CB 3.34Å; L89-V93 PolarHBondContact O-N 3.2Å; V93-G95 PolarHBondContact O-N 3.43Å; V93-A96 HydrophobicContact CB-CB 3.91Å; V93-A96 HydrophobicContact CG1-CB 3.95Å; V93-A96 VanDerWaalsContact O-CB 3.32Å; V93-A96 WeakPolarHBondContact O-CB 3.26Å; V93-A96 PolarHBondContact O-N 2.93Å; V93-Y143 HydrophobicContact CG1-CD2 4.44Å; V93-Y143 HydrophobicContact CG1-CE1 4.2Å; V93-Y143 HydrophobicContact CG1-CE2 4.06Å
94	R	94.4	Very high	97.8	Very high	219 Å²	219	32.9 Å²	32.9	83%	0.826	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	114.5	-178.2	-176.1	176.9	-177	162.1	1.3	111.4	Y143	R94-Y143 WeakPolarHBondContact O-CE2 3.45Å
95	G	93.4	Very high	97.7	Very high	4 Å²	4	32.4 Å²	32.4	4%	0.041	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	4.2	179.2	0	0	0	0	0	114.4	V93	V93-G95 PolarHBondContact O-N 3.43Å
96	A	97.4	Very high	97.3	Very high	2 Å²	2	36.3 Å²	36.3	2%	0.017	18%	0.183	C	C	.	.			trans	-68.1	147.1	163.2	0	0	0	0	0	110.2	L89 V93 P137	L89-A96 HydrophobicContact CD1-CB 4.39Å; L89-A96 HydrophobicContact CG-CB 4.1Å; V93-A96 HydrophobicContact CB-CB 3.91Å; V93-A96 HydrophobicContact CG1-CB 3.95Å; V93-A96 VanDerWaalsContact O-CB 3.32Å; V93-A96 WeakPolarHBondContact O-CB 3.26Å; V93-A96 PolarHBondContact O-N 2.93Å; A96-P137 WeakPolarHBondContact O-CD 3.4Å
97	S	98.1	Very high	96.9	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.007	22%	0.219	C	C	.	.			trans	-139.2	140.5	-174.5	-59.4	0	0	0	0	109	P137 P138 P139 T146	S97-P137 WeakPolarHBondContact CB-O 3.33Å; S97-P137 PolarHBondContact OG-O 3.46Å; S97-P138 PolarHBondContact OG-O 3.36Å; S97-P139 WeakPolarHBondContact OG-CA 3.29Å; S97-T146 PolarHBondContact O-N 3.18Å
98	V	98.6	Very high	96.7	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.7	-173.6	172	0	0	0	0	111.5	A86 L89 T90 L100 A133 D134 V135 T146 V148	A86-V98 HydrophobicContact CB-CB 4.48Å; A86-V98 HydrophobicContact CB-CG1 3.88Å; L89-V98 HydrophobicContact CD2-CG2 4.12Å; T90-V98 HydrophobicContact CG2-CG2 4.07Å; V98-L100 HydrophobicContact CG1-CD2 4.14Å; V98-A133 CarbonylContact O-C 3.52Å; V98-D134 PolarHBondContact O-N 2.68Å; V98-V135 HydrophobicContact CB-CB 4.21Å; V98-V135 PolarHBondContact N-O 2.9Å; V98-V135 PolarHBondContact O-N 3.19Å; V98-V135 VanDerWaalsContact O-N 3.08Å; V98-T146 CarbonylContact C-O 3.57Å; V98-T146 WeakPolarHBondContact CA-O 3.41Å; V98-V148 HydrophobicContact CB-CG2 4.48Å; V98-V148 HydrophobicContact CG1-CB 3.78Å; V98-V148 HydrophobicContact CG1-CG2 3.53Å; V98-V148 HydrophobicContact CG2-CG2 4.08Å
99	F	98.4	Very high	96.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	145.3	157.2	75.1	-91	0	0	0	110.8	L63 F101 L112 R115 R116 M119 D134 L145 T146 G147 V148	L63-F99 HydrophobicContact CD2-CZ 4.06Å; F99-F101 HydrophobicContact CE2-CB 4.41Å; F99-F101 AromaticContact CE2-CD1 4Å; F99-F101 HydrophobicContact CE2-CD1 4Å; F99-L112 HydrophobicContact CE2-CD1 4.35Å; F99-L112 HydrophobicContact CZ-CD1 4.41Å; F99-R115 HydrophobicContact CD2-CB 3.82Å; F99-R115 HydrophobicContact CE2-CB 3.67Å; F99-R116 HydrophobicContact CZ-CG 4.41Å; F99-M119 HydrophobicContact CB-CE 3.77Å; F99-M119 HydrophobicContact CB-CG 4.31Å; F99-M119 HydrophobicContact CD1-CG 4.06Å; F99-M119 HydrophobicContact CG-CE 4.45Å; F99-M119 HydrophobicContact CG-CG 4.04Å; F99-D134 VanDerWaalsContact CA-OD2 3.24Å; F99-D134 WeakPolarHBondContact CA-OD2 3.32Å; F99-L145 HydrophobicContact CD1-CD1 4.26Å; F99-L145 HydrophobicContact CD1-CD2 3.61Å; F99-L145 HydrophobicContact CD1-CG 3.72Å; F99-L145 HydrophobicContact CE1-CD2 4.27Å; F99-L145 HydrophobicContact CE1-CG 4.36Å; F99-L145 HydrophobicContact CG-CD2 4.49Å; F99-T146 WeakPolarHBondContact CD1-O 3.32Å; F99-T146 PolarHBondContact N-O 3.35Å; F99-G147 CarbonylContact O-C 3.58Å; F99-G147 WeakPolarHBondContact O-CA 3.5Å; F99-V148 PolarHBondContact O-N 3.05Å
100	L	98.7	Very high	96.4	Very high	20 Å²	20	46.3 Å²	46.3	11%	0.105	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	147.3	178.2	-60	175.1	0	0	0	111	L83 A86 V98 A104 D105 R115 D134 V135 V148	L83-L100 HydrophobicContact CD2-CD1 3.65Å; L83-L100 HydrophobicContact CD2-CD2 4.09Å; A86-L100 HydrophobicContact CB-CD2 4.03Å; V98-L100 HydrophobicContact CG1-CD2 4.14Å; L100-A104 HydrophobicContact CD2-CB 4.44Å; L100-D105 HydrophobicContact CB-CB 4.45Å; L100-R115 WeakPolarHBondContact O-CG 3.14Å; L100-R115 PolarHBondContact O-NE 3.31Å; L100-D134 HydrophobicContact CB-CB 4.5Å; L100-D134 HydrophobicContact CD1-CB 4.29Å; L100-D134 HydrophobicContact CG-CB 4.07Å; L100-D134 PolarHBondContact N-OD2 3.2Å; L100-V135 HydrophobicContact CD1-CG2 4.31Å; L100-V135 HydrophobicContact CG-CG2 4.48Å; L100-V148 VanDerWaalsContact CA-O 3.26Å; L100-V148 WeakPolarHBondContact CA-O 3.34Å; L100-V148 HydrophobicContact CD2-CB 4.41Å
101	F	98.4	Very high	96.2	Very high	5 Å²	5	46.6 Å²	46.6	2%	0.022	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	167.4	174.2	69.4	-91.7	0	0	0	112.3	L63 P65 F99 A104 L112 R115 V148 G149	L63-F101 HydrophobicContact CD2-CE1 4.48Å; P65-F101 HydrophobicContact CB-CE2 4.39Å; P65-F101 HydrophobicContact CB-CZ 3.95Å; F99-F101 HydrophobicContact CE2-CB 4.41Å; F99-F101 AromaticContact CE2-CD1 4Å; F99-F101 HydrophobicContact CE2-CD1 4Å; F101-A104 PolarHBondContact O-N 3.04Å; F101-L112 HydrophobicContact CD1-CD1 3.87Å; F101-L112 HydrophobicContact CD2-CB 3.73Å; F101-L112 HydrophobicContact CD2-CD1 4.15Å; F101-L112 HydrophobicContact CD2-CG 4.45Å; F101-L112 HydrophobicContact CE1-CD1 3.94Å; F101-L112 HydrophobicContact CE2-CB 4Å; F101-L112 HydrophobicContact CE2-CD1 4.23Å; F101-L112 HydrophobicContact CE2-CG 4.45Å; F101-L112 HydrophobicContact CG-CB 4.23Å; F101-L112 HydrophobicContact CG-CD1 3.97Å; F101-L112 HydrophobicContact CZ-CD1 4.12Å; F101-R115 HydrophobicContact CB-CB 4.07Å; F101-R115 HydrophobicContact CB-CG 3.73Å; F101-V148 WeakPolarHBondContact CD1-O 3.2Å; F101-V148 PolarHBondContact N-O 2.95Å; F101-G149 VanDerWaalsContact CE1-N 3.28Å; F101-G149 VanDerWaalsContact O-CA 3.26Å; F101-G149 WeakPolarHBondContact O-CA 3.38Å
102	G	97.5	Very high	96	Very high	9 Å²	9	40.3 Å²	40.3	9%	0.093	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.6	-141.7	179.8	0	0	0	0	0	111.7	A104 D105 Q109 R110 A150	G102-A104 PolarHBondContact O-N 3.43Å; G102-A104 VanDerWaalsContact O-N 3.15Å; G102-D105 PolarHBondContact O-N 2.81Å; G102-Q109 WeakPolarHBondContact O-CA 3.25Å; G102-R110 PolarHBondContact N-O 3.45Å; G102-A150 CarbonylContact C-O 3.48Å; G102-A150 WeakPolarHBondContact CA-O 3.43Å
103	W	97.8	Very high	95.8	Very high	25 Å²	25	38.5 Å²	38.5	10%	0.095	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.7	178	-59.1	-36.5	0	0	0	113.4	P68 E75 V79 A150 S151 P152 V225	P68-W103 HydrophobicContact CG-CH2 4.27Å; P68-W103 HydrophobicContact CG-CZ3 4.14Å; E75-W103 HydrophobicContact CB-CD2 4.3Å; E75-W103 HydrophobicContact CB-CE3 4.05Å; E75-W103 HydrophobicContact CB-CH2 4.19Å; E75-W103 HydrophobicContact CB-CZ2 4.4Å; E75-W103 HydrophobicContact CB-CZ3 4.01Å; E75-W103 HydrophobicContact CG-CB 4.2Å; E75-W103 HydrophobicContact CG-CD2 3.57Å; E75-W103 HydrophobicContact CG-CE3 3.69Å; E75-W103 HydrophobicContact CG-CG 3.84Å; E75-W103 HydrophobicContact CG-CH2 4.47Å; E75-W103 HydrophobicContact CG-CZ2 4.35Å; E75-W103 HydrophobicContact CG-CZ3 4.16Å; V79-W103 HydrophobicContact CG2-CB 3.41Å; V79-W103 VanDerWaalsContact CG2-CB 3.41Å; W103-A150 HydrophobicContact CB-CB 4.22Å; W103-A150 HydrophobicContact CE3-CB 4.11Å; W103-A150 PolarHBondContact N-O 2.76Å; W103-S151 WeakPolarHBondContact CZ3-O 3.24Å; W103-P152 HydrophobicContact CH2-CB 4.48Å; W103-P152 HydrophobicContact CH2-CG 3.81Å; W103-P152 HydrophobicContact CZ2-CG 3.48Å; W103-P152 VanDerWaalsContact CZ2-CG 3.48Å; W103-V225 HydrophobicContact CH2-CG1 4.19Å
104	A	98.3	Very high	95.6	Very high	3 Å²	3	44.5 Å²	44.5	3%	0.025	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-19.5	177.4	0	0	0	0	0	113.4	A82 L83 L100 F101 G102 A106	A82-A104 HydrophobicContact CB-CB 4.06Å; L83-A104 HydrophobicContact CD2-CB 4.43Å; L100-A104 HydrophobicContact CD2-CB 4.44Å; F101-A104 PolarHBondContact O-N 3.04Å; G102-A104 PolarHBondContact O-N 3.43Å; G102-A104 VanDerWaalsContact O-N 3.15Å; A104-A106 PolarHBondContact O-N 3.44Å
105	D	97.8	Very high	95.7	Very high	10 Å²	10	34.4 Å²	34.4	5%	0.053	21%	0.205	C	C	.	.	S	Bend	trans	-81.8	62.6	172	176.7	38.9	0	0	0	110.1	L100 G102 A107 L108 Q109 R110	L100-D105 HydrophobicContact CB-CB 4.45Å; G102-D105 PolarHBondContact O-N 2.81Å; D105-A107 PolarHBondContact O-N 3.44Å; D105-L108 PolarHBondContact O-N 2.89Å; D105-L108 VanDerWaalsContact O-N 3.09Å; D105-Q109 VanDerWaalsContact O-CA 3.27Å; D105-Q109 WeakPolarHBondContact O-CA 3.48Å; D105-Q109 PolarHBondContact O-N 3.29Å; D105-R110 IonicContact OD1-CZ 3.87Å; D105-R110 IonicContact OD1-NE 2.73Å; D105-R110 IonicContact OD1-NH2 3.33Å; D105-R110 PolarHBondContact OD1-NH2 3.35Å; D105-R110 VanDerWaalsContact OD2-CB 3.24Å; D105-R110 WeakPolarHBondContact OD2-CB 3.47Å; D105-R110 WeakPolarHBondContact OD2-CG 3.33Å; D105-R110 IonicContact OD2-CZ 2.89Å; D105-R110 PolarHBondContact OD2-N 2.96Å; D105-R110 IonicContact OD2-NE 3.43Å; D105-R110 PolarHBondContact OD2-NE 3.06Å; D105-R110 IonicContact OD2-NH2 3.32Å; D105-R110 PolarHBondContact OD2-NH2 2.98Å
106	A	89.9	Confident	95.8	Very high	82 Å²	82	34.8 Å²	34.8	68%	0.678	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-30.3	-163.1	0	0	0	0	0	115.7	A104	A104-A106 PolarHBondContact O-N 3.44Å
107	A	89.9	Confident	95.6	Very high	93 Å²	93	42.7 Å²	42.7	77%	0.769	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-37.3	-177.6	0	0	0	0	0	113.5	D105	D105-A107 PolarHBondContact O-N 3.44Å
108	L	94.4	Very high	95.5	Very high	103 Å²	103	46.4 Å²	46.4	54%	0.539	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	-9.1	-171.2	-65.4	175.9	0	0	0	113.7	D105 R110	D105-L108 PolarHBondContact O-N 2.89Å; D105-L108 VanDerWaalsContact O-N 3.09Å; L108-R110 HydrophobicContact CB-CG 3.7Å; L108-R110 PolarHBondContact O-N 3.42Å; L108-R110 VanDerWaalsContact O-N 3.12Å
109	Q	94.6	Very high	95.3	Very high	104 Å²	104	47 Å²	47	49%	0.486	26%	0.259	S	S	.	.			trans	42.1	43.3	-174.7	-64.3	-165.9	-14.6	0	0	113.2	G102 D105 G111	G102-Q109 WeakPolarHBondContact O-CA 3.25Å; D105-Q109 VanDerWaalsContact O-CA 3.27Å; D105-Q109 WeakPolarHBondContact O-CA 3.48Å; D105-Q109 PolarHBondContact O-N 3.29Å; Q109-G111 PolarHBondContact O-N 3.17Å
110	R	96	Very high	95.1	Very high	37 Å²	37	47.2 Å²	47.2	14%	0.14	26%	0.261	C	S	.	.			trans	-71.9	126.5	-176.2	-64.6	166.4	-73.8	-172.7	-8.4	109.4	G102 D105 L108 R114 R115 E118	G102-R110 PolarHBondContact N-O 3.45Å; D105-R110 IonicContact OD1-CZ 3.87Å; D105-R110 IonicContact OD1-NE 2.73Å; D105-R110 IonicContact OD1-NH2 3.33Å; D105-R110 PolarHBondContact OD1-NH2 3.35Å; D105-R110 VanDerWaalsContact OD2-CB 3.24Å; D105-R110 WeakPolarHBondContact OD2-CB 3.47Å; D105-R110 WeakPolarHBondContact OD2-CG 3.33Å; D105-R110 IonicContact OD2-CZ 2.89Å; D105-R110 PolarHBondContact OD2-N 2.96Å; D105-R110 IonicContact OD2-NE 3.43Å; D105-R110 PolarHBondContact OD2-NE 3.06Å; D105-R110 IonicContact OD2-NH2 3.32Å; D105-R110 PolarHBondContact OD2-NH2 2.98Å; L108-R110 HydrophobicContact CB-CG 3.7Å; L108-R110 PolarHBondContact O-N 3.42Å; L108-R110 VanDerWaalsContact O-N 3.12Å; R110-R114 HydrophobicContact CB-CB 4.41Å; R110-R114 HydrophobicContact CB-CG 4.25Å; R110-R114 HydrophobicContact CG-CG 4.39Å; R110-R115 HydrophobicContact CB-CG 3.84Å; R110-E118 WeakPolarHBondContact CD-OE1 3.39Å; R110-E118 IonicContact CZ-OE2 3.46Å; R110-E118 IonicContact NE-OE2 3.77Å; R110-E118 IonicContact NH1-OE1 2.87Å; R110-E118 IonicContact NH1-OE2 2.74Å; R110-E118 PolarHBondContact NH1-OE2 2.84Å
111	G	94	Very high	94.9	Very high	31 Å²	31	46.5 Å²	46.5	32%	0.32	26%	0.257	S	S	.	.			trans	-60.4	164.9	174.1	0	0	0	0	0	113.7	Q109 A113 R114 R115	Q109-G111 PolarHBondContact O-N 3.17Å; G111-A113 PolarHBondContact O-N 2.88Å; G111-R114 PolarHBondContact O-N 2.91Å; G111-R115 PolarHBondContact O-N 3.39Å; G111-R115 VanDerWaalsContact O-N 3.11Å
112	L	94.8	Very high	94.5	Very high	15 Å²	15	50.8 Å²	50.8	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-43.5	-173.2	175.9	60.5	0	0	0	112.8	L63 F99 F101 R114 R115 R116	L63-L112 HydrophobicContact CD1-CD1 4.24Å; L63-L112 HydrophobicContact CD1-CD2 3.87Å; L63-L112 HydrophobicContact CD2-CD1 3.6Å; F99-L112 HydrophobicContact CE2-CD1 4.35Å; F99-L112 HydrophobicContact CZ-CD1 4.41Å; F101-L112 HydrophobicContact CD1-CD1 3.87Å; F101-L112 HydrophobicContact CD2-CB 3.73Å; F101-L112 HydrophobicContact CD2-CD1 4.15Å; F101-L112 HydrophobicContact CD2-CG 4.45Å; F101-L112 HydrophobicContact CE1-CD1 3.94Å; F101-L112 HydrophobicContact CE2-CB 4Å; F101-L112 HydrophobicContact CE2-CD1 4.23Å; F101-L112 HydrophobicContact CE2-CG 4.45Å; F101-L112 HydrophobicContact CG-CB 4.23Å; F101-L112 HydrophobicContact CG-CD1 3.97Å; F101-L112 HydrophobicContact CZ-CD1 4.12Å; L112-R114 VanDerWaalsContact C-N 3.32Å; L112-R114 PolarHBondContact O-N 2.88Å; L112-R115 PolarHBondContact O-N 3.22Å; L112-R116 HydrophobicContact CD1-CG 3.84Å; L112-R116 HydrophobicContact CG-CG 4.28Å; L112-R116 WeakPolarHBondContact O-CB 3.34Å; L112-R116 WeakPolarHBondContact O-CG 3.35Å; L112-R116 PolarHBondContact O-N 2.87Å
113	A	91.7	Very high	94.2	Very high	34 Å²	34	58.7 Å²	58.7	28%	0.281	30%	0.303	S	S	.	.	H	α-helix	trans	-58.3	-43.5	178	0	0	0	0	0	112.8	G111 K117 Q188	G111-A113 PolarHBondContact O-N 2.88Å; A113-K117 PolarHBondContact O-N 2.68Å; A113-Q188 VanDerWaalsContact CB-CD 3.49Å; A113-Q188 HydrophobicContact CB-CG 4.37Å
114	R	93.9	Very high	93.4	Very high	137 Å²	137	67.7 Å²	67.7	52%	0.517	34%	0.343	S	S	.	.	H	α-helix	trans	-65	-47.5	179	178.3	171.1	170.8	179.6	2.7	110.9	R110 G111 L112 K117 E118	R110-R114 HydrophobicContact CB-CB 4.41Å; R110-R114 HydrophobicContact CB-CG 4.25Å; R110-R114 HydrophobicContact CG-CG 4.39Å; G111-R114 PolarHBondContact O-N 2.91Å; L112-R114 VanDerWaalsContact C-N 3.32Å; L112-R114 PolarHBondContact O-N 2.88Å; R114-K117 WeakPolarHBondContact O-CB 3.02Å; R114-K117 PolarHBondContact O-N 2.76Å; R114-E118 WeakPolarHBondContact CG-OE1 3.35Å; R114-E118 IonicContact CZ-OE1 3.79Å; R114-E118 IonicContact NE-OE1 2.87Å; R114-E118 PolarHBondContact NE-OE1 2.73Å; R114-E118 IonicContact NH2-OE1 3.32Å; R114-E118 WeakPolarHBondContact O-CG 3.23Å; R114-E118 PolarHBondContact O-N 3.49Å
115	R	96.4	Very high	92.7	Very high	8 Å²	8	72.8 Å²	72.8	3%	0.03	38%	0.378	C	S	.	.	H	α-helix	trans	-63.3	-42.4	178.5	-66.9	-64.9	-66	146.3	-10.9	112.3	F99 L100 F101 R110 G111 L112 K117 E118 M119 D134	F99-R115 HydrophobicContact CD2-CB 3.82Å; F99-R115 HydrophobicContact CE2-CB 3.67Å; L100-R115 WeakPolarHBondContact O-CG 3.14Å; L100-R115 PolarHBondContact O-NE 3.31Å; F101-R115 HydrophobicContact CB-CB 4.07Å; F101-R115 HydrophobicContact CB-CG 3.73Å; R110-R115 HydrophobicContact CB-CG 3.84Å; G111-R115 PolarHBondContact O-N 3.39Å; G111-R115 VanDerWaalsContact O-N 3.11Å; L112-R115 PolarHBondContact O-N 3.22Å; R115-K117 VanDerWaalsContact C-N 3.31Å; R115-K117 PolarHBondContact O-N 2.86Å; R115-E118 IonicContact CZ-OE2 2.81Å; R115-E118 IonicContact NH1-OE2 3.11Å; R115-E118 PolarHBondContact NH1-OE2 3.47Å; R115-E118 PolarHBondContact O-N 2.94Å; R115-M119 VanDerWaalsContact CZ-CE 3.49Å; R115-M119 WeakPolarHBondContact O-CG 3.47Å; R115-M119 PolarHBondContact O-N 2.85Å; R115-D134 IonicContact CZ-OD2 3.99Å; R115-D134 VanDerWaalsContact NH2-CG 3.33Å; R115-D134 IonicContact NH2-OD1 3.39Å; R115-D134 PolarHBondContact NH2-OD1 3.05Å; R115-D134 IonicContact NH2-OD2 3.32Å; R115-D134 PolarHBondContact NH2-OD2 2.97Å
116	R	95.5	Very high	92.1	Very high	12 Å²	12	74.1 Å²	74.1	5%	0.045	39%	0.387	C	S	.	.	H	α-helix	trans	-56.3	-43.1	172.4	-78.6	-171	-65.6	173.9	-6.5	112.2	F99 L112 M119 G120 W121 F122	F99-R116 HydrophobicContact CZ-CG 4.41Å; L112-R116 HydrophobicContact CD1-CG 3.84Å; L112-R116 HydrophobicContact CG-CG 4.28Å; L112-R116 WeakPolarHBondContact O-CB 3.34Å; L112-R116 WeakPolarHBondContact O-CG 3.35Å; L112-R116 PolarHBondContact O-N 2.87Å; R116-M119 PolarHBondContact O-N 2.83Å; R116-G120 PolarHBondContact O-N 2.92Å; R116-W121 HydrophobicContact CB-CB 3.74Å; R116-W121 HydrophobicContact CB-CD2 4.35Å; R116-W121 HydrophobicContact CB-CE3 4.49Å; R116-W121 HydrophobicContact CB-CG 4.05Å; R116-W121 HydrophobicContact CG-CB 4.05Å; R116-W121 HydrophobicContact CG-CD2 3.99Å; R116-W121 HydrophobicContact CG-CE3 4.38Å; R116-W121 HydrophobicContact CG-CG 3.82Å; R116-W121 WeakPolarHBondContact O-CB 3.42Å; R116-W121 PolarHBondContact O-N 3.23Å; R116-F122 HydrophobicContact CB-CE2 3.78Å; R116-F122 HydrophobicContact CB-CZ 4.16Å
117	K	93.7	Very high	92	Very high	167 Å²	167	74.9 Å²	74.9	73%	0.726	38%	0.38	S	S	*	.	H	α-helix	trans	-64.8	-45.3	176.6	-172.4	179.5	179.4	-178.7	0	112	A113 R114 R115 M119 G120	A113-K117 PolarHBondContact O-N 2.68Å; R114-K117 WeakPolarHBondContact O-CB 3.02Å; R114-K117 PolarHBondContact O-N 2.76Å; R115-K117 VanDerWaalsContact C-N 3.31Å; R115-K117 PolarHBondContact O-N 2.86Å; K117-M119 VanDerWaalsContact C-N 3.29Å; K117-M119 PolarHBondContact O-N 2.95Å; K117-G120 PolarHBondContact O-N 2.87Å; K117-G120 VanDerWaalsContact O-N 3.12Å
118	E	95	Very high	92	Very high	79 Å²	79	71.6 Å²	71.6	37%	0.369	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-37.5	177.9	-71.7	172	-175.8	0	0	112	R110 R114 R115 G120	R110-E118 WeakPolarHBondContact CD-OE1 3.39Å; R110-E118 IonicContact CZ-OE2 3.46Å; R110-E118 IonicContact NE-OE2 3.77Å; R110-E118 IonicContact NH1-OE1 2.87Å; R110-E118 IonicContact NH1-OE2 2.74Å; R110-E118 PolarHBondContact NH1-OE2 2.84Å; R114-E118 WeakPolarHBondContact CG-OE1 3.35Å; R114-E118 IonicContact CZ-OE1 3.79Å; R114-E118 IonicContact NE-OE1 2.87Å; R114-E118 PolarHBondContact NE-OE1 2.73Å; R114-E118 IonicContact NH2-OE1 3.32Å; R114-E118 WeakPolarHBondContact O-CG 3.23Å; R114-E118 PolarHBondContact O-N 3.49Å; R115-E118 IonicContact CZ-OE2 2.81Å; R115-E118 IonicContact NH1-OE2 3.11Å; R115-E118 PolarHBondContact NH1-OE2 3.47Å; R115-E118 PolarHBondContact O-N 2.94Å; E118-G120 VanDerWaalsContact C-N 3.29Å; E118-G120 PolarHBondContact O-N 2.94Å
119	M	95.2	Very high	91.5	Very high	12 Å²	12	76 Å²	76	6%	0.059	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-4.1	177.1	-64.3	-58.2	166.4	0	0	114.1	M58 F99 R115 R116 K117 L131 L145	M58-M119 HydrophobicContact CE-CB 3.99Å; M58-M119 VanDerWaalsContact CE-O 3.23Å; M58-M119 WeakPolarHBondContact CE-O 3.47Å; M58-M119 HydrophobicContact SD-CB 4.46Å; F99-M119 HydrophobicContact CB-CE 3.77Å; F99-M119 HydrophobicContact CB-CG 4.31Å; F99-M119 HydrophobicContact CD1-CG 4.06Å; F99-M119 HydrophobicContact CG-CE 4.45Å; F99-M119 HydrophobicContact CG-CG 4.04Å; R115-M119 VanDerWaalsContact CZ-CE 3.49Å; R115-M119 WeakPolarHBondContact O-CG 3.47Å; R115-M119 PolarHBondContact O-N 2.85Å; R116-M119 PolarHBondContact O-N 2.83Å; K117-M119 VanDerWaalsContact C-N 3.29Å; K117-M119 PolarHBondContact O-N 2.95Å; M119-L131 WeakPolarHBondContact O-CD1 3.46Å; M119-L131 WeakPolarHBondContact O-CD2 3.46Å; M119-L131 HydrophobicContact SD-CD2 4.45Å; M119-L145 HydrophobicContact CB-CD2 4.09Å; M119-L145 HydrophobicContact CG-CD2 3.94Å; M119-L145 HydrophobicContact SD-CD2 3.94Å
120	G	93.8	Very high	91.3	Very high	6 Å²	6	74.3 Å²	74.3	6%	0.062	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	27.2	-177.5	0	0	0	0	0	114.4	R116 K117 E118 F122 R123	R116-G120 PolarHBondContact O-N 2.92Å; K117-G120 PolarHBondContact O-N 2.87Å; K117-G120 VanDerWaalsContact O-N 3.12Å; E118-G120 VanDerWaalsContact C-N 3.29Å; E118-G120 PolarHBondContact O-N 2.94Å; G120-F122 PolarHBondContact O-N 2.69Å; G120-F122 VanDerWaalsContact O-N 3.16Å; G120-R123 VanDerWaalsContact O-CB 3.26Å; G120-R123 WeakPolarHBondContact O-CB 3.48Å; G120-R123 WeakPolarHBondContact O-CG 3.32Å; G120-R123 PolarHBondContact O-N 3.16Å
121	W	93.3	Very high	91.1	Very high	5 Å²	5	73.8 Å²	73.8	2%	0.019	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-23.9	-175.3	-168.8	95.2	0	0	0	115.7	H55 P56 M58 D62 R116	H55-W121 AromaticContact CE1-CH2 3.63Å; H55-W121 AromaticContact ND1-CH2 3.91Å; P56-W121 HydrophobicContact CB-CD2 4.39Å; P56-W121 HydrophobicContact CB-CE3 3.81Å; P56-W121 HydrophobicContact CB-CH2 3.69Å; P56-W121 HydrophobicContact CB-CZ2 4.29Å; P56-W121 HydrophobicContact CB-CZ3 3.44Å; P56-W121 VanDerWaalsContact CB-CZ3 3.44Å; P56-W121 HydrophobicContact CG-CE3 4.42Å; P56-W121 HydrophobicContact CG-CH2 4.14Å; P56-W121 HydrophobicContact CG-CZ3 3.74Å; P56-W121 WeakPolarHBondContact O-CH2 3.39Å; P56-W121 WeakPolarHBondContact O-CZ2 3.3Å; M58-W121 HydrophobicContact CB-CG 4.45Å; M58-W121 HydrophobicContact CE-CB 3.5Å; M58-W121 VanDerWaalsContact CE-CB 3.5Å; M58-W121 HydrophobicContact CE-CG 4.01Å; M58-W121 VanDerWaalsContact CE-N 3.28Å; D62-W121 PolarHBondContact OD1-NE1 3.13Å; D62-W121 WeakPolarHBondContact OD2-CZ2 3.37Å; R116-W121 HydrophobicContact CB-CB 3.74Å; R116-W121 HydrophobicContact CB-CD2 4.35Å; R116-W121 HydrophobicContact CB-CE3 4.49Å; R116-W121 HydrophobicContact CB-CG 4.05Å; R116-W121 HydrophobicContact CG-CB 4.05Å; R116-W121 HydrophobicContact CG-CD2 3.99Å; R116-W121 HydrophobicContact CG-CE3 4.38Å; R116-W121 HydrophobicContact CG-CG 3.82Å; R116-W121 WeakPolarHBondContact O-CB 3.42Å; R116-W121 PolarHBondContact O-N 3.23Å
122	F	91.6	Very high	91.1	Very high	95 Å²	95	77.6 Å²	77.6	42%	0.417	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	3.3	176.8	-53.2	-82.4	0	0	0	113.3	P56 R116 G120 L190	P56-F122 HydrophobicContact CG-CD1 4.27Å; R116-F122 HydrophobicContact CB-CE2 3.78Å; R116-F122 HydrophobicContact CB-CZ 4.16Å; G120-F122 PolarHBondContact O-N 2.69Å; G120-F122 VanDerWaalsContact O-N 3.16Å; F122-L190 HydrophobicContact CD1-CD2 4.47Å; F122-L190 HydrophobicContact CE1-CD1 4.43Å; F122-L190 HydrophobicContact CE1-CD2 4.13Å
123	R	90.3	Very high	91.2	Very high	175 Å²	175	77.7 Å²	77.7	66%	0.66	38%	0.383	S	S	*	.	S	Bend	trans	-80.6	140	176.2	-63	179.6	-179.8	176.4	1.5	109.2	G120 S125	G120-R123 VanDerWaalsContact O-CB 3.26Å; G120-R123 WeakPolarHBondContact O-CB 3.48Å; G120-R123 WeakPolarHBondContact O-CG 3.32Å; G120-R123 PolarHBondContact O-N 3.16Å; R123-S125 PolarHBondContact O-N 3.26Å
124	K	82.3	Confident	91.5	Very high	214 Å²	214	79.3 Å²	79.3	93%	0.93	39%	0.387	S	S	*	.	S	Bend	trans	-61.6	-31.6	176.6	-69.1	-173.2	176	-174.1	0	113.4
125	S	82.5	Confident	91.7	Very high	109 Å²	109	74.3 Å²	74.3	76%	0.762	37%	0.372	S	S	*	.	S	Bend	trans	-144.1	81.5	-179.2	-52.8	0	0	0	0	109.2	R123	R123-S125 PolarHBondContact O-N 3.26Å
126	P	85.2	Confident	91.7	Very high	38 Å²	38	75.8 Å²	75.8	25%	0.247	39%	0.389	C	S	.	.			trans	-69.2	137.7	175.9	29.1	-32.1	0	0	0	110.1	L128	P126-L128 HydrophobicContact CG-CD2 4.25Å; P126-L128 PolarHBondContact O-N 3.48Å
127	D	88.3	Confident	91.7	Very high	98 Å²	98	77.6 Å²	77.6	52%	0.524	40%	0.402	S	S	.	.			trans	-75.9	91.2	169	-178.6	1.6	0	0	0	109.2	R129 A130	D127-R129 PolarHBondContact O-N 3.08Å; D127-R129 WeakPolarHBondContact OD1-CB 3.26Å; D127-R129 PolarHBondContact OD1-N 3.48Å; D127-R129 VanDerWaalsContact OD1-N 3.09Å; D127-A130 HydrophobicContact CB-CB 4.18Å; D127-A130 PolarHBondContact O-N 2.93Å; D127-A130 VanDerWaalsContact O-N 3.14Å
128	L	89.7	Confident	91.8	Very high	24 Å²	24	73.7 Å²	73.7	13%	0.126	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-57.9	-27.4	-179.3	-68.6	-176.7	0	0	0	113	M58 P126 A130 L131 P139 E141	M58-L128 HydrophobicContact CG-CD2 4.09Å; M58-L128 HydrophobicContact SD-CD2 4.19Å; P126-L128 HydrophobicContact CG-CD2 4.25Å; P126-L128 PolarHBondContact O-N 3.48Å; L128-A130 VanDerWaalsContact C-N 3.33Å; L128-L131 HydrophobicContact CD2-CD1 3.91Å; L128-L131 PolarHBondContact O-N 2.8Å; L128-P139 HydrophobicContact CB-CB 4.15Å; L128-P139 HydrophobicContact CD2-CB 4.31Å; L128-E141 HydrophobicContact CD1-CG 4.39Å
129	R	84.6	Confident	91.8	Very high	195 Å²	195	70.2 Å²	70.2	74%	0.736	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-76.7	-24.6	-178	-58	-178.9	-171.1	-168.6	3.8	112.2	D127 L131 E141	D127-R129 PolarHBondContact O-N 3.08Å; D127-R129 WeakPolarHBondContact OD1-CB 3.26Å; D127-R129 PolarHBondContact OD1-N 3.48Å; D127-R129 VanDerWaalsContact OD1-N 3.09Å; R129-L131 VanDerWaalsContact C-N 3.31Å; R129-E141 IonicContact NH2-OE1 3.79Å
130	A	88.6	Confident	91.7	Very high	70 Å²	70	76 Å²	76	58%	0.579	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-83	-8.2	174.3	0	0	0	0	0	112.9	D127 L128	D127-A130 HydrophobicContact CB-CB 4.18Å; D127-A130 PolarHBondContact O-N 2.93Å; D127-A130 VanDerWaalsContact O-N 3.14Å; L128-A130 VanDerWaalsContact C-N 3.33Å
131	L	93.2	Very high	91.6	Very high	26 Å²	26	80.8 Å²	80.8	14%	0.136	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-84.1	136.8	178.9	-60.8	-177.9	0	0	0	111.5	M58 M119 L128 R129 P139 L145	M58-L131 HydrophobicContact SD-CD1 3.83Å; M119-L131 WeakPolarHBondContact O-CD1 3.46Å; M119-L131 WeakPolarHBondContact O-CD2 3.46Å; M119-L131 HydrophobicContact SD-CD2 4.45Å; L128-L131 HydrophobicContact CD2-CD1 3.91Å; L128-L131 PolarHBondContact O-N 2.8Å; R129-L131 VanDerWaalsContact C-N 3.31Å; L131-P139 HydrophobicContact CB-CG 4.22Å; L131-L145 HydrophobicContact CD1-CD2 4.06Å
132	T	93.8	Very high	91.7	Very high	110 Å²	110	83.9 Å²	83.9	68%	0.675	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-96.5	116.2	171.2	-55.6	0	0	0	0	109
133	A	96.8	Very high	91.9	Very high	17 Å²	17	81.4 Å²	81.4	14%	0.14	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-75	146.5	169.7	0	0	0	0	0	110.3	V98 L145	V98-A133 CarbonylContact O-C 3.52Å; A133-L145 HydrophobicContact CB-CD1 4.35Å
134	D	97.8	Very high	92.2	Very high	69 Å²	69	73.2 Å²	73.2	37%	0.369	39%	0.39	S	S	.	.	S	Bend	trans	-79.6	-30.7	174	-59.4	-40.2	0	0	0	110.9	V98 F99 L100 R115	V98-D134 PolarHBondContact O-N 2.68Å; F99-D134 VanDerWaalsContact CA-OD2 3.24Å; F99-D134 WeakPolarHBondContact CA-OD2 3.32Å; L100-D134 HydrophobicContact CB-CB 4.5Å; L100-D134 HydrophobicContact CD1-CB 4.29Å; L100-D134 HydrophobicContact CG-CB 4.07Å; L100-D134 PolarHBondContact N-OD2 3.2Å; R115-D134 IonicContact CZ-OD2 3.99Å; R115-D134 VanDerWaalsContact NH2-CG 3.33Å; R115-D134 IonicContact NH2-OD1 3.39Å; R115-D134 PolarHBondContact NH2-OD1 3.05Å; R115-D134 IonicContact NH2-OD2 3.32Å; R115-D134 PolarHBondContact NH2-OD2 2.97Å
135	V	98.2	Very high	92.9	Very high	32 Å²	32	63 Å²	63	19%	0.194	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-135.5	135.8	175.3	-168.6	0	0	0	0	109.7	A86 R87 T90 V98 L100	A86-V135 HydrophobicContact CB-CG2 4.26Å; R87-V135 HydrophobicContact CG-CG1 4.34Å; T90-V135 HydrophobicContact CG2-CB 4.48Å; T90-V135 HydrophobicContact CG2-CG1 4.08Å; V98-V135 HydrophobicContact CB-CB 4.21Å; V98-V135 PolarHBondContact N-O 2.9Å; V98-V135 PolarHBondContact O-N 3.19Å; V98-V135 VanDerWaalsContact O-N 3.08Å; L100-V135 HydrophobicContact CD1-CG2 4.31Å; L100-V135 HydrophobicContact CG-CG2 4.48Å
136	G	97.1	Very high	93.7	Very high	39 Å²	39	58 Å²	58	40%	0.402	31%	0.311	S	S	.	.	S	Bend	trans	89.1	-177	-179.8	0	0	0	0	0	114.1
137	P	95.8	Very high	94.3	Very high	49 Å²	49	56.2 Å²	56.2	32%	0.318	30%	0.299	S	S	.	.	S	Bend	trans	-69	173.3	177.3	30.7	-37.3	0	0	0	112.3	A96 S97	A96-P137 WeakPolarHBondContact O-CD 3.4Å; S97-P137 WeakPolarHBondContact CB-O 3.33Å; S97-P137 PolarHBondContact OG-O 3.46Å
138	P	95.1	Very high	94.8	Very high	85 Å²	85	51.6 Å²	51.6	55%	0.552	27%	0.274	S	S	*	.	S	Bend	trans	-54.3	141	168.3	-26.9	35.7	0	0	0	112.5	S97	S97-P138 PolarHBondContact OG-O 3.36Å
139	P	95.4	Very high	95.2	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.039	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-55.3	145.1	-178.2	-28.4	37.7	0	0	0	113.9	S97 L128 L131 L145	S97-P139 WeakPolarHBondContact OG-CA 3.29Å; L128-P139 HydrophobicContact CB-CB 4.15Å; L128-P139 HydrophobicContact CD2-CB 4.31Å; L131-P139 HydrophobicContact CB-CG 4.22Å; P139-L145 HydrophobicContact CB-CB 4.16Å; P139-L145 HydrophobicContact CG-CB 4.05Å; P139-L145 HydrophobicContact CG-CD1 3.71Å; P139-L145 HydrophobicContact CG-CG 4.28Å
140	R	91.8	Very high	95.9	Very high	135 Å²	135	41.1 Å²	41.1	51%	0.509	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-121.6	142.7	-179.7	-63.3	-177.1	177.6	-165.7	-4.3	110.4	R142 Y143 G144	R140-R142 PolarHBondContact O-N 2.87Å; R140-Y143 PolarHBondContact O-N 3.11Å; R140-Y143 VanDerWaalsContact O-N 3.13Å; R140-G144 WeakPolarHBondContact O-CA 3.09Å; R140-G144 PolarHBondContact O-N 3.39Å
141	E	93.3	Very high	96.3	Very high	105 Å²	105	38.7 Å²	38.7	49%	0.491	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-30.4	-176.5	-65.5	167.7	-154.8	0	0	114.7	M48 R49 L128 R129	M48-E141 VanDerWaalsContact CB-O 3.28Å; M48-E141 WeakPolarHBondContact CB-O 3.39Å; R49-E141 HydrophobicContact CG-CB 3.8Å; L128-E141 HydrophobicContact CD1-CG 4.39Å; R129-E141 IonicContact NH2-OE1 3.79Å
142	R	94.2	Very high	96.3	Very high	70 Å²	70	38.2 Å²	38.2	26%	0.264	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-44.9	179.1	174.8	170.8	169.6	62.3	9.4	113	C43 A44 D47 M48 R140	C43-R142 PolarHBondContact O-NH2 3.35Å; A44-R142 PolarHBondContact O-NH2 3.13Å; D47-R142 VanDerWaalsContact CG-NH1 3.34Å; D47-R142 IonicContact OD2-CZ 2.86Å; D47-R142 IonicContact OD2-NH1 3.72Å; D47-R142 PolarHBondContact OD2-NH1 3.2Å; M48-R142 WeakPolarHBondContact CB-O 3.45Å; M48-R142 PolarHBondContact N-O 3.29Å; R140-R142 PolarHBondContact O-N 2.87Å
143	Y	95.5	Very high	96.4	Very high	44 Å²	44	33.8 Å²	33.8	17%	0.173	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-23.5	-175.3	-57	-53.6	0	0	0	112.4	C43 G59 S60 V93 R94 R140	C43-Y143 HydrophobicContact CB-CD1 4.04Å; C43-Y143 HydrophobicContact CB-CE1 3.98Å; C43-Y143 WeakPolarHBondContact O-CE1 3.32Å; G59-Y143 CarbonylContact C-O 3.57Å; G59-Y143 WeakPolarHBondContact CA-O 3.32Å; S60-Y143 PolarHBondContact N-O 2.96Å; S60-Y143 PolarHBondContact OG-O 3.22Å; V93-Y143 HydrophobicContact CG1-CD2 4.44Å; V93-Y143 HydrophobicContact CG1-CE1 4.2Å; V93-Y143 HydrophobicContact CG1-CE2 4.06Å; R94-Y143 WeakPolarHBondContact O-CE2 3.45Å; R140-Y143 PolarHBondContact O-N 3.11Å; R140-Y143 VanDerWaalsContact O-N 3.13Å
144	G	96.1	Very high	96.2	Very high	3 Å²	3	33.7 Å²	33.7	3%	0.031	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	71.2	-138.9	-172.7	0	0	0	0	0	112.4	M58 R140	M58-G144 CarbonylContact O-C 3.1Å; M58-G144 WeakPolarHBondContact O-CA 3.22Å; R140-G144 WeakPolarHBondContact O-CA 3.09Å; R140-G144 PolarHBondContact O-N 3.39Å
145	L	97.7	Very high	96	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.162	C	C	.	.			trans	-133.6	125.7	-178.3	175.8	70.5	0	0	0	109.9	M58 F99 M119 L131 A133 P139	M58-L145 CarbonylContact C-O 3.5Å; M58-L145 HydrophobicContact CG-CB 4.09Å; M58-L145 PolarHBondContact O-N 2.9Å; M58-L145 HydrophobicContact SD-CB 3.66Å; M58-L145 HydrophobicContact SD-CD2 3.54Å; M58-L145 VanDerWaalsContact SD-CD2 3.54Å; M58-L145 HydrophobicContact SD-CG 4.11Å; F99-L145 HydrophobicContact CD1-CD1 4.26Å; F99-L145 HydrophobicContact CD1-CD2 3.61Å; F99-L145 HydrophobicContact CD1-CG 3.72Å; F99-L145 HydrophobicContact CE1-CD2 4.27Å; F99-L145 HydrophobicContact CE1-CG 4.36Å; F99-L145 HydrophobicContact CG-CD2 4.49Å; M119-L145 HydrophobicContact CB-CD2 4.09Å; M119-L145 HydrophobicContact CG-CD2 3.94Å; M119-L145 HydrophobicContact SD-CD2 3.94Å; L131-L145 HydrophobicContact CD1-CD2 4.06Å; A133-L145 HydrophobicContact CB-CD1 4.35Å; P139-L145 HydrophobicContact CB-CB 4.16Å; P139-L145 HydrophobicContact CG-CB 4.05Å; P139-L145 HydrophobicContact CG-CD1 3.71Å; P139-L145 HydrophobicContact CG-CG 4.28Å
146	T	98.6	Very high	95.7	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.025	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.5	179	-58.9	0	0	0	0	110.8	V61 I64 L89 S97 V98 F99 V148	V61-T146 HydrophobicContact CB-CG2 4.33Å; V61-T146 HydrophobicContact CG1-CG2 4.09Å; V61-T146 WeakPolarHBondContact O-CA 3.3Å; V61-T146 VanDerWaalsContact O-CB 3.26Å; V61-T146 WeakPolarHBondContact O-CB 3.26Å; V61-T146 VanDerWaalsContact O-CG2 3.3Å; V61-T146 WeakPolarHBondContact O-CG2 3.29Å; V61-T146 PolarHBondContact O-OG1 2.93Å; I64-T146 HydrophobicContact CD1-CG2 3.98Å; I64-T146 HydrophobicContact CG1-CG2 4.02Å; L89-T146 HydrophobicContact CD2-CG2 4.14Å; S97-T146 PolarHBondContact O-N 3.18Å; V98-T146 CarbonylContact C-O 3.57Å; V98-T146 WeakPolarHBondContact CA-O 3.41Å; F99-T146 WeakPolarHBondContact CD1-O 3.32Å; F99-T146 PolarHBondContact N-O 3.35Å; T146-V148 HydrophobicContact CG2-CG2 3.84Å
147	G	98.6	Very high	95.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	127.1	165.6	0	0	0	0	0	110.9	D62 L63 I64 F99	D62-G147 PolarHBondContact O-N 3.11Å; L63-G147 CarbonylContact C-O 3.53Å; L63-G147 WeakPolarHBondContact CA-O 3.39Å; I64-G147 PolarHBondContact N-O 3.26Å; F99-G147 CarbonylContact O-C 3.58Å; F99-G147 WeakPolarHBondContact O-CA 3.5Å
148	V	98.9	Very high	95.4	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.2	174	-174.6	0	0	0	0	109.4	I64 A82 V85 A86 V98 F99 L100 F101 T146	I64-V148 HydrophobicContact CB-CG1 4.32Å; I64-V148 HydrophobicContact CB-CG2 4.13Å; I64-V148 HydrophobicContact CD1-CG2 3.94Å; I64-V148 HydrophobicContact CG1-CG2 4.28Å; I64-V148 WeakPolarHBondContact O-CA 3.34Å; A82-V148 HydrophobicContact CB-CG1 4.17Å; A82-V148 VanDerWaalsContact O-CG1 3.27Å; A82-V148 WeakPolarHBondContact O-CG1 3.47Å; V85-V148 HydrophobicContact CG1-CG1 4.44Å; A86-V148 HydrophobicContact CB-CB 4.27Å; A86-V148 HydrophobicContact CB-CG1 4.28Å; A86-V148 HydrophobicContact CB-CG2 4.41Å; V98-V148 HydrophobicContact CB-CG2 4.48Å; V98-V148 HydrophobicContact CG1-CB 3.78Å; V98-V148 HydrophobicContact CG1-CG2 3.53Å; V98-V148 HydrophobicContact CG2-CG2 4.08Å; F99-V148 PolarHBondContact O-N 3.05Å; L100-V148 VanDerWaalsContact CA-O 3.26Å; L100-V148 WeakPolarHBondContact CA-O 3.34Å; L100-V148 HydrophobicContact CD2-CB 4.41Å; F101-V148 WeakPolarHBondContact CD1-O 3.2Å; F101-V148 PolarHBondContact N-O 2.95Å; T146-V148 HydrophobicContact CG2-CG2 3.84Å
149	G	98.5	Very high	95.5	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	170.8	-175.2	0	0	0	0	0	113.6	I64 P65 I66 F101	I64-G149 PolarHBondContact O-N 3.14Å; P65-G149 CarbonylContact C-O 3.48Å; I66-G149 PolarHBondContact N-O 3.22Å; F101-G149 VanDerWaalsContact CE1-N 3.28Å; F101-G149 VanDerWaalsContact O-CA 3.26Å; F101-G149 WeakPolarHBondContact O-CA 3.38Å
150	A	98.3	Very high	95.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.5	172.7	0	0	0	0	0	109.3	I66 C78 V79 A82 G102 W103	I66-A150 VanDerWaalsContact O-CA 3.27Å; I66-A150 WeakPolarHBondContact O-CA 3.49Å; C78-A150 HydrophobicContact CB-CB 3.77Å; V79-A150 HydrophobicContact CG2-CB 4.17Å; A82-A150 HydrophobicContact CB-CB 4.2Å; G102-A150 CarbonylContact C-O 3.48Å; G102-A150 WeakPolarHBondContact CA-O 3.43Å; W103-A150 HydrophobicContact CB-CB 4.22Å; W103-A150 HydrophobicContact CE3-CB 4.11Å; W103-A150 PolarHBondContact N-O 2.76Å
151	S	96.7	Very high	95.8	Very high	19 Å²	19	17.1 Å²	17.1	13%	0.133	8%	0.084	C	C	.	.			trans	-160.2	173.3	178.6	68.2	0	0	0	0	110	I66 Y67 P68 W103	I66-S151 PolarHBondContact O-N 2.95Å; Y67-S151 VanDerWaalsContact CE1-OG 3.3Å; Y67-S151 WeakPolarHBondContact CE1-OG 3.35Å; P68-S151 WeakPolarHBondContact CD-O 3.48Å; W103-S151 WeakPolarHBondContact CZ3-O 3.24Å
152	P	95.1	Very high	96	Very high	15 Å²	15	16.8 Å²	16.8	10%	0.097	9%	0.085	C	C	.	.	S	Bend	trans	-54.6	158	159.5	-22.7	36	0	0	0	110.5	Y67 W103 V154 F223 Y230	Y67-P152 WeakPolarHBondContact CD1-O 3.5Å; W103-P152 HydrophobicContact CH2-CB 4.48Å; W103-P152 HydrophobicContact CH2-CG 3.81Å; W103-P152 HydrophobicContact CZ2-CG 3.48Å; W103-P152 VanDerWaalsContact CZ2-CG 3.48Å; P152-V154 PolarHBondContact O-N 2.77Å; P152-F223 HydrophobicContact CB-CE2 4.37Å; P152-F223 HydrophobicContact CB-CZ 4.04Å; P152-Y230 HydrophobicContact CB-CD1 3.86Å; P152-Y230 HydrophobicContact CB-CE1 4.04Å; P152-Y230 HydrophobicContact CB-CG 4.19Å; P152-Y230 HydrophobicContact CG-CD1 3.61Å; P152-Y230 HydrophobicContact CG-CE1 3.27Å; P152-Y230 HydrophobicContact CG-CE2 4.36Å; P152-Y230 HydrophobicContact CG-CG 4.29Å
153	Y	94.3	Very high	96.1	Very high	18 Å²	18	14.8 Å²	14.8	7%	0.071	8%	0.081	C	C	.	.			trans	-53.7	138.5	-179.2	-157.4	-77.2	0	0	0	111.5	Y67 L69 S206 P263 C266	Y67-Y153 HydrophobicContact CD2-CD2 4.19Å; Y67-Y153 HydrophobicContact CD2-CE2 4.34Å; Y67-Y153 HydrophobicContact CD2-CG 4.46Å; Y67-Y153 HydrophobicContact CG-CD2 4.24Å; Y67-Y153 HydrophobicContact CG-CG 4.43Å; L69-Y153 HydrophobicContact CD1-CD2 4.34Å; L69-Y153 HydrophobicContact CD1-CE2 4.15Å; Y153-S206 WeakPolarHBondContact O-CB 3.3Å; Y153-S206 PolarHBondContact O-OG 2.87Å; Y153-P263 HydrophobicContact CD1-CB 4.24Å; Y153-P263 HydrophobicContact CD1-CG 3.67Å; Y153-P263 HydrophobicContact CD2-CB 4.4Å; Y153-P263 HydrophobicContact CE1-CG 4.33Å; Y153-P263 HydrophobicContact CG-CB 4.07Å; Y153-P263 HydrophobicContact CG-CG 3.85Å; Y153-C266 HydrophobicContact CE2-CB 4.06Å; Y153-C266 VanDerWaalsContact OH-CB 3.3Å; Y153-C266 WeakPolarHBondContact OH-CB 3.23Å; Y153-C266 PolarHBondContact OH-SG 2.96Å
154	V	93.9	Very high	96.2	Very high	15 Å²	15	19 Å²	19	9%	0.091	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.2	176.5	-179.8	0	0	0	0	108.5	Y67 P152 N203 V204 E205	Y67-V154 HydrophobicContact CE1-CB 4.05Å; Y67-V154 HydrophobicContact CE1-CG2 3.72Å; Y67-V154 WeakPolarHBondContact OH-CB 3.4Å; P152-V154 PolarHBondContact O-N 2.77Å; V154-N203 HydrophobicContact CG1-CB 4.14Å; V154-V204 WeakPolarHBondContact CA-O 3.43Å; V154-E205 HydrophobicContact CG1-CG 4.37Å; V154-E205 HydrophobicContact CG2-CG 4.14Å
155	M	92.1	Very high	96.2	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.015	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	148.6	174.1	171.7	-176.8	75.7	0	0	109.6	C157 V204 A233 A235 I238 L258 T262	M155-C157 HydrophobicContact CE-CB 4.26Å; M155-V204 HydrophobicContact CB-CB 4.26Å; M155-V204 HydrophobicContact CE-CB 3.91Å; M155-V204 HydrophobicContact CE-CG1 4.06Å; M155-V204 HydrophobicContact CE-CG2 3.71Å; M155-V204 PolarHBondContact N-O 2.91Å; M155-V204 VanDerWaalsContact N-O 3.07Å; M155-V204 WeakPolarHBondContact O-CB 3.47Å; M155-V204 PolarHBondContact O-N 2.73Å; M155-A233 VanDerWaalsContact CE-O 3.3Å; M155-A233 WeakPolarHBondContact CE-O 3.45Å; M155-A235 HydrophobicContact CE-CB 4.39Å; M155-I238 HydrophobicContact CE-CD1 4.37Å; M155-L258 HydrophobicContact CG-CD2 3.99Å; M155-L258 HydrophobicContact SD-CD2 3.67Å; M155-T262 HydrophobicContact SD-CG2 4.07Å
156	N	92.1	Very high	96.1	Very high	36 Å²	36	24.4 Å²	24.4	19%	0.193	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.1	168.4	-61.4	-25.6	0	0	0	110.1	C202 N203 L258 V259	N156-C202 CarbonylContact C-O 3.56Å; N156-C202 VanDerWaalsContact CA-O 3.29Å; N156-C202 WeakPolarHBondContact CA-O 3.41Å; N156-N203 PolarHBondContact OD1-OD1 2.9Å; N156-L258 WeakPolarHBondContact O-CD2 3.23Å; N156-V259 HydrophobicContact CB-CB 3.8Å; N156-V259 PolarHBondContact O-N 2.94Å
157	C	92.6	Very high	96.1	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	120.1	-179.5	178.2	0	0	0	0	108.9	M155 C202 V204 I238 L258	M155-C157 HydrophobicContact CE-CB 4.26Å; C157-C202 PolarHBondContact N-O 3.01Å; C157-C202 WeakPolarHBondContact O-CA 3.43Å; C157-C202 WeakPolarHBondContact O-CB 3.43Å; C157-C202 PolarHBondContact O-N 3.06Å; C157-V204 HydrophobicContact CB-CG2 4.3Å; C157-I238 HydrophobicContact CB-CD1 4.13Å; C157-L258 HydrophobicContact CB-CD2 4.06Å
158	N	94.6	Very high	96	Very high	9 Å²	9	27.9 Å²	27.9	5%	0.048	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.9	-178.6	-66.1	2.9	0	0	0	109.5	E199 I200 A201 C202 T256 A257	N158-E199 VanDerWaalsContact CB-CD 3.44Å; N158-E199 HydrophobicContact CB-CG 3.88Å; N158-E199 WeakPolarHBondContact CB-OE1 3.49Å; N158-E199 PolarHBondContact ND2-OE1 2.96Å; N158-I200 WeakPolarHBondContact CA-O 3.44Å; N158-A201 WeakPolarHBondContact OD1-CA 3.5Å; N158-C202 PolarHBondContact OD1-N 2.89Å; N158-T256 CarbonylContact O-C 3.48Å; N158-T256 VanDerWaalsContact O-CA 3.28Å; N158-T256 WeakPolarHBondContact O-CA 3.27Å; N158-A257 PolarHBondContact N-O 3.32Å; N158-A257 PolarHBondContact O-N 2.88Å
159	V	96.7	Very high	96	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117.9	178.3	-172.6	0	0	0	0	109.2	I200 I238 M239 V242 V253 T256	V159-I200 PolarHBondContact N-O 2.82Å; V159-I200 WeakPolarHBondContact O-CB 3.49Å; V159-I200 PolarHBondContact O-N 2.7Å; V159-I238 HydrophobicContact CG2-CG2 4.26Å; V159-M239 HydrophobicContact CG2-CB 4.43Å; V159-V242 HydrophobicContact CB-CB 4.2Å; V159-V242 HydrophobicContact CB-CG1 3.96Å; V159-V242 HydrophobicContact CB-CG2 4.08Å; V159-V242 HydrophobicContact CG1-CB 3.91Å; V159-V242 HydrophobicContact CG1-CG1 3.53Å; V159-V242 HydrophobicContact CG1-CG2 4.36Å; V159-V242 HydrophobicContact CG2-CB 4.43Å; V159-V242 HydrophobicContact CG2-CG2 4.12Å; V159-V253 HydrophobicContact CG1-CG1 3.7Å; V159-V253 HydrophobicContact CG1-CG2 4.32Å; V159-T256 HydrophobicContact CG2-CG2 4.07Å
160	S	97	Very high	95.9	Very high	19 Å²	19	35.9 Å²	35.9	13%	0.133	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129	179.1	-85.5	0	0	0	0	110.9	E199 K254 G255	S160-E199 PolarHBondContact OG-OE2 3.09Å; S160-K254 PolarHBondContact O-N 3.11Å; S160-G255 PolarHBondContact N-O 3.06Å
161	I	97.6	Very high	95.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.7	178.1	57.6	167	0	0	0	111.1	T163 V168 I172 V198 I200 V242 A246 V251 G252 V253	I161-T163 HydrophobicContact CD1-CG2 3.67Å; I161-T163 HydrophobicContact CG1-CG2 3.93Å; I161-T163 PolarHBondContact O-N 3.2Å; I161-V168 HydrophobicContact CD1-CG1 4.19Å; I161-I172 HydrophobicContact CD1-CD1 3.7Å; I161-V198 HydrophobicContact CD1-CB 4.14Å; I161-V198 HydrophobicContact CD1-CG1 4.08Å; I161-V198 HydrophobicContact CG1-CB 3.86Å; I161-V198 HydrophobicContact CG1-CG1 4.15Å; I161-V198 WeakPolarHBondContact CG1-O 3.37Å; I161-V198 PolarHBondContact N-O 3.38Å; I161-I200 HydrophobicContact CD1-CD1 4.23Å; I161-I200 HydrophobicContact CG2-CG1 4.39Å; I161-V242 HydrophobicContact CG2-CG1 3.63Å; I161-A246 HydrophobicContact CG2-CB 4.09Å; I161-V251 HydrophobicContact CB-CG1 3.98Å; I161-G252 CarbonylContact C-O 3.58Å; I161-G252 WeakPolarHBondContact CA-O 3.38Å; I161-V253 HydrophobicContact CG2-CG2 4.3Å
162	D	96.7	Very high	95.8	Very high	97 Å²	97	38 Å²	38	52%	0.519	21%	0.207	S	C	.	.	S	Bend	trans	-81.2	65	-173.2	-166.4	16.7	0	0	0	112.9	G252 K254	D162-G252 PolarHBondContact N-O 2.87Å; D162-K254 HydrophobicContact CB-CD 4.44Å; D162-K254 HydrophobicContact CB-CG 3.94Å; D162-K254 WeakPolarHBondContact OD1-CE 3.4Å; D162-K254 IonicContact OD1-NZ 3.13Å; D162-K254 PolarHBondContact OD1-NZ 2.79Å; D162-K254 VanDerWaalsContact OD1-NZ 3.13Å
163	T	97.1	Very high	95.8	Very high	28 Å²	28	37.5 Å²	37.5	17%	0.172	20%	0.204	C	C	.	.			trans	-150.1	155.4	173.9	-176	0	0	0	0	110.1	I161 D165 V168 A197 V198 V251	I161-T163 HydrophobicContact CD1-CG2 3.67Å; I161-T163 HydrophobicContact CG1-CG2 3.93Å; I161-T163 PolarHBondContact O-N 3.2Å; T163-D165 PolarHBondContact OG1-N 3.42Å; T163-V168 HydrophobicContact CG2-CB 4.23Å; T163-V168 HydrophobicContact CG2-CG1 4.26Å; T163-A197 CarbonylContact O-C 3.51Å; T163-A197 VanDerWaalsContact O-C 3.3Å; T163-A197 WeakPolarHBondContact O-CA 3.24Å; T163-V198 HydrophobicContact CG2-CB 4.19Å; T163-V198 HydrophobicContact CG2-CG2 4.16Å; T163-V198 WeakPolarHBondContact O-CG2 3.4Å; T163-V198 PolarHBondContact O-N 3.07Å; T163-V251 HydrophobicContact CG2-CG1 3.98Å; T163-V251 HydrophobicContact CG2-CG2 4.43Å
164	L	96.7	Very high	95.9	Very high	134 Å²	134	39 Å²	39	70%	0.702	22%	0.22	S	C	*	.	S	Bend	trans	-96.4	-7.5	167.4	-64.2	176.5	0	0	0	111.9	V166 G196	L164-V166 PolarHBondContact O-N 3.16Å; L164-G196 VanDerWaalsContact CD2-C 3.44Å; L164-G196 WeakPolarHBondContact CD2-O 3.42Å
165	D	96.9	Very high	95.9	Very high	84 Å²	84	40 Å²	40	45%	0.449	23%	0.23	S	C	.	.			trans	-82.1	98.8	-178	-172.6	-0.4	0	0	0	111.1	T163 A167 V168	T163-D165 PolarHBondContact OG1-N 3.42Å; D165-A167 PolarHBondContact O-N 3.1Å; D165-A167 VanDerWaalsContact O-N 3.13Å; D165-A167 WeakPolarHBondContact OD1-CA 3.27Å; D165-A167 WeakPolarHBondContact OD1-CB 3.34Å; D165-A167 PolarHBondContact OD1-N 3.08Å; D165-V168 HydrophobicContact CB-CG2 4.05Å; D165-V168 WeakPolarHBondContact O-CB 3.47Å; D165-V168 PolarHBondContact O-N 3.15Å; D165-V168 VanDerWaalsContact O-N 3.08Å
166	V	96.4	Very high	96	Very high	31 Å²	31	40 Å²	40	19%	0.188	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-22.6	176.2	178.9	0	0	0	0	111.9	L164 G169 R170 P193 V198	L164-V166 PolarHBondContact O-N 3.16Å; V166-G169 PolarHBondContact O-N 3.47Å; V166-R170 HydrophobicContact CG1-CG 4.2Å; V166-R170 WeakPolarHBondContact O-CB 3.32Å; V166-R170 VanDerWaalsContact O-CG 3.3Å; V166-R170 WeakPolarHBondContact O-CG 3.45Å; V166-R170 PolarHBondContact O-N 3.03Å; V166-P193 HydrophobicContact CG2-CB 4.31Å; V166-V198 HydrophobicContact CG2-CG2 3.98Å
167	A	97.4	Very high	95.9	Very high	58 Å²	58	43 Å²	43	48%	0.479	24%	0.238	S	C	.	.	H	α-helix	trans	-65.1	-39.7	175.6	0	0	0	0	0	111.9	D165 R170 S171	D165-A167 PolarHBondContact O-N 3.1Å; D165-A167 VanDerWaalsContact O-N 3.13Å; D165-A167 WeakPolarHBondContact OD1-CA 3.27Å; D165-A167 WeakPolarHBondContact OD1-CB 3.34Å; D165-A167 PolarHBondContact OD1-N 3.08Å; A167-R170 PolarHBondContact O-N 3.21Å; A167-S171 PolarHBondContact O-N 3.36Å
168	V	97.1	Very high	95.5	Very high	19 Å²	19	48.1 Å²	48.1	12%	0.115	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-49.7	173	173.2	0	0	0	0	109.9	I161 T163 D165 R170 S171 I172 Q249 V251	I161-V168 HydrophobicContact CD1-CG1 4.19Å; T163-V168 HydrophobicContact CG2-CB 4.23Å; T163-V168 HydrophobicContact CG2-CG1 4.26Å; D165-V168 HydrophobicContact CB-CG2 4.05Å; D165-V168 WeakPolarHBondContact O-CB 3.47Å; D165-V168 PolarHBondContact O-N 3.15Å; D165-V168 VanDerWaalsContact O-N 3.08Å; V168-R170 VanDerWaalsContact C-N 3.35Å; V168-R170 PolarHBondContact O-N 2.95Å; V168-S171 VanDerWaalsContact O-CB 3.32Å; V168-S171 WeakPolarHBondContact O-CB 3.43Å; V168-S171 PolarHBondContact O-N 3.1Å; V168-I172 HydrophobicContact CG1-CD1 3.94Å; V168-I172 WeakPolarHBondContact O-CG1 3.3Å; V168-I172 PolarHBondContact O-N 3Å; V168-Q249 HydrophobicContact CG1-CB 4.4Å; V168-V251 HydrophobicContact CG1-CG2 4.2Å
169	G	97.4	Very high	95	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-39.5	178.4	0	0	0	0	0	113.2	V166 S171 I172 A173 A191	V166-G169 PolarHBondContact O-N 3.47Å; G169-S171 VanDerWaalsContact C-N 3.31Å; G169-S171 PolarHBondContact O-N 3.07Å; G169-I172 PolarHBondContact O-N 2.91Å; G169-A173 VanDerWaalsContact O-CB 3.3Å; G169-A173 WeakPolarHBondContact O-CB 3.41Å; G169-A173 PolarHBondContact O-N 3.11Å; G169-A191 WeakPolarHBondContact O-CB 3.26Å
170	R	96.9	Very high	94.5	Very high	168 Å²	168	54.8 Å²	54.8	63%	0.634	31%	0.308	S	S	*	.	H	α-helix	trans	-63.1	-37.7	175.6	-76.3	175.6	-174.5	167	6.7	112.2	V166 A167 V168 A173 A174 A191	V166-R170 HydrophobicContact CG1-CG 4.2Å; V166-R170 WeakPolarHBondContact O-CB 3.32Å; V166-R170 VanDerWaalsContact O-CG 3.3Å; V166-R170 WeakPolarHBondContact O-CG 3.45Å; V166-R170 PolarHBondContact O-N 3.03Å; A167-R170 PolarHBondContact O-N 3.21Å; V168-R170 VanDerWaalsContact C-N 3.35Å; V168-R170 PolarHBondContact O-N 2.95Å; R170-A173 PolarHBondContact O-N 3.41Å; R170-A174 WeakPolarHBondContact O-CB 3.26Å; R170-A174 PolarHBondContact O-N 2.67Å; R170-A191 HydrophobicContact CG-CB 4.19Å
171	S	96.9	Very high	94	Very high	64 Å²	64	60.4 Å²	60.4	45%	0.448	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-47.9	174.6	-173.5	0	0	0	0	111.1	A167 V168 G169 A174 A175	A167-S171 PolarHBondContact O-N 3.36Å; V168-S171 VanDerWaalsContact O-CB 3.32Å; V168-S171 WeakPolarHBondContact O-CB 3.43Å; V168-S171 PolarHBondContact O-N 3.1Å; G169-S171 VanDerWaalsContact C-N 3.31Å; G169-S171 PolarHBondContact O-N 3.07Å; S171-A174 WeakPolarHBondContact O-CB 3.36Å; S171-A174 PolarHBondContact O-N 3.22Å; S171-A175 PolarHBondContact O-N 3.34Å; S171-A175 VanDerWaalsContact O-N 3.13Å
172	I	96.6	Very high	93.2	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-47.6	176.3	-65.7	164.7	0	0	0	110.7	I161 V168 G169 A174 A175 L176 I200 V242 L245 A246	I161-I172 HydrophobicContact CD1-CD1 3.7Å; V168-I172 HydrophobicContact CG1-CD1 3.94Å; V168-I172 WeakPolarHBondContact O-CG1 3.3Å; V168-I172 PolarHBondContact O-N 3Å; G169-I172 PolarHBondContact O-N 2.91Å; I172-A174 VanDerWaalsContact C-N 3.27Å; I172-A174 PolarHBondContact O-N 3.35Å; I172-A175 PolarHBondContact O-N 3.17Å; I172-A175 VanDerWaalsContact O-N 3.11Å; I172-L176 HydrophobicContact CG2-CD1 3.99Å; I172-L176 PolarHBondContact O-N 3.18Å; I172-L176 VanDerWaalsContact O-N 3.08Å; I172-I200 HydrophobicContact CB-CD1 4.29Å; I172-I200 HydrophobicContact CG2-CD1 4.22Å; I172-I200 HydrophobicContact CG2-CG1 4.28Å; I172-V242 HydrophobicContact CG2-CG1 4.43Å; I172-V242 HydrophobicContact CG2-CG2 4.43Å; I172-L245 HydrophobicContact CG1-CB 4.01Å; I172-L245 HydrophobicContact CG2-CB 4.13Å; I172-L245 HydrophobicContact CG2-CD1 4.1Å; I172-A246 HydrophobicContact CD1-CB 3.94Å
173	A	95.9	Very high	92.9	Very high	3 Å²	3	59.5 Å²	59.5	3%	0.025	36%	0.357	C	S	.	.	H	α-helix	trans	-59.5	-36.9	176.8	0	0	0	0	0	112	G169 R170 R177 V189 A191	G169-A173 VanDerWaalsContact O-CB 3.3Å; G169-A173 WeakPolarHBondContact O-CB 3.41Å; G169-A173 PolarHBondContact O-N 3.11Å; R170-A173 PolarHBondContact O-N 3.41Å; A173-R177 WeakPolarHBondContact O-CG 3.27Å; A173-V189 HydrophobicContact CB-CB 4.41Å; A173-V189 HydrophobicContact CB-CG1 3.95Å; A173-V189 HydrophobicContact CB-CG2 3.69Å; A173-V189 WeakPolarHBondContact O-CG1 3.42Å; A173-A191 HydrophobicContact CB-CB 4.22Å
174	A	94.9	Very high	92.6	Very high	49 Å²	49	58.8 Å²	58.8	41%	0.405	35%	0.352	S	S	.	.	H	α-helix	trans	-65.4	-40	175.7	0	0	0	0	0	112.1	R170 S171 I172	R170-A174 WeakPolarHBondContact O-CB 3.26Å; R170-A174 PolarHBondContact O-N 2.67Å; S171-A174 WeakPolarHBondContact O-CB 3.36Å; S171-A174 PolarHBondContact O-N 3.22Å; I172-A174 VanDerWaalsContact C-N 3.27Å; I172-A174 PolarHBondContact O-N 3.35Å
175	A	95	Very high	92.3	Very high	36 Å²	36	54.4 Å²	54.4	30%	0.298	33%	0.332	S	S	.	.	H	α-helix	trans	-71.9	-24.4	179.6	0	0	0	0	0	114.1	S171 I172 V180 L245	S171-A175 PolarHBondContact O-N 3.34Å; S171-A175 VanDerWaalsContact O-N 3.13Å; I172-A175 PolarHBondContact O-N 3.17Å; I172-A175 VanDerWaalsContact O-N 3.11Å; A175-V180 WeakPolarHBondContact O-CG2 3.46Å; A175-L245 HydrophobicContact CB-CD1 3.87Å; A175-L245 HydrophobicContact CB-CD2 4.03Å
176	L	93.4	Very high	92	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-81.7	-23.2	179	-75.2	169.2	0	0	0	114.4	I172 E178 L184 V189 I200 R241 V242 L245	I172-L176 HydrophobicContact CG2-CD1 3.99Å; I172-L176 PolarHBondContact O-N 3.18Å; I172-L176 VanDerWaalsContact O-N 3.08Å; L176-E178 PolarHBondContact O-N 3.1Å; L176-L184 HydrophobicContact CD2-CD1 3.99Å; L176-L184 HydrophobicContact CD2-CG 4.43Å; L176-L184 PolarHBondContact O-N 2.94Å; L176-V189 HydrophobicContact CB-CG1 4.21Å; L176-V189 HydrophobicContact CD1-CG2 4.46Å; L176-I200 HydrophobicContact CD1-CG2 3.86Å; L176-R241 HydrophobicContact CD2-CB 3.78Å; L176-V242 HydrophobicContact CD1-CG2 3.64Å; L176-L245 HydrophobicContact CD2-CD1 4.12Å; L176-L245 HydrophobicContact CG-CD1 4.03Å
177	R	89.3	Confident	91.8	Very high	99 Å²	99	49.1 Å²	49.1	37%	0.374	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-61.5	135.9	-174.1	-74.9	169.3	-168.6	-85.7	-5	111.2	A173 S179 V180 G183 V189	A173-R177 WeakPolarHBondContact O-CG 3.27Å; R177-S179 PolarHBondContact O-N 3.19Å; R177-V180 WeakPolarHBondContact O-CG2 3.15Å; R177-V180 PolarHBondContact O-N 2.92Å; R177-G183 WeakPolarHBondContact O-CA 3.17Å; R177-V189 HydrophobicContact CG-CG1 3.71Å; R177-V189 PolarHBondContact NH2-O 2.88Å
178	E	86.1	Confident	91.6	Very high	109 Å²	109	47.6 Å²	47.6	51%	0.509	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-25.1	176.5	68	178.5	-177	0	0	114.7	L176 V180 L184 G186	L176-E178 PolarHBondContact O-N 3.1Å; E178-V180 PolarHBondContact O-N 2.97Å; E178-L184 WeakPolarHBondContact CB-O 3.49Å; E178-G186 PolarHBondContact OE2-N 3.47Å
179	S	83.3	Confident	91.5	Very high	99 Å²	99	46.9 Å²	46.9	69%	0.692	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-9.3	-178.3	59.1	0	0	0	0	114.3	R177	R177-S179 PolarHBondContact O-N 3.19Å
180	V	86.8	Confident	91.3	Very high	50 Å²	50	48.6 Å²	48.6	30%	0.303	29%	0.29	S	S	.	.	S	Bend	trans	-108.2	149.2	179.8	-52	0	0	0	0	111.6	A175 R177 E178 G182 G183	A175-V180 WeakPolarHBondContact O-CG2 3.46Å; R177-V180 WeakPolarHBondContact O-CG2 3.15Å; R177-V180 PolarHBondContact O-N 2.92Å; E178-V180 PolarHBondContact O-N 2.97Å; V180-G182 PolarHBondContact O-N 3.22Å; V180-G183 PolarHBondContact O-N 3.42Å
181	P	84.9	Confident	91.3	Very high	137 Å²	137	41.2 Å²	41.2	89%	0.89	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	124.8	173	-25.2	34.8	0	0	0	111.5	G183	P181-G183 VanDerWaalsContact C-N 3.3Å
182	G	82.6	Confident	91.3	Very high	62 Å²	62	38.9 Å²	38.9	64%	0.639	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.1	5.7	-177.2	0	0	0	0	0	115.2	V180	V180-G182 PolarHBondContact O-N 3.22Å
183	G	88.9	Confident	91.2	Very high	15 Å²	15	41.8 Å²	41.8	16%	0.155	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-68.5	165	168.7	0	0	0	0	0	112.5	R177 V180 P181 P185	R177-G183 WeakPolarHBondContact O-CA 3.17Å; V180-G183 PolarHBondContact O-N 3.42Å; P181-G183 VanDerWaalsContact C-N 3.3Å; G183-P185 WeakPolarHBondContact O-CD 3.45Å
184	L	90.8	Very high	91.1	Very high	14 Å²	14	42.2 Å²	42.2	7%	0.073	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-92.6	119.5	-179.3	-66.4	178.7	0	0	0	110.5	L176 E178 G186 V187 L237 I238 R241	L176-L184 HydrophobicContact CD2-CD1 3.99Å; L176-L184 HydrophobicContact CD2-CG 4.43Å; L176-L184 PolarHBondContact O-N 2.94Å; E178-L184 WeakPolarHBondContact CB-O 3.49Å; L184-G186 PolarHBondContact O-N 3.43Å; L184-V187 HydrophobicContact CB-CB 3.92Å; L184-V187 HydrophobicContact CB-CG2 3.5Å; L184-V187 HydrophobicContact CD1-CG2 4.21Å; L184-V187 WeakPolarHBondContact O-CB 3.46Å; L184-V187 PolarHBondContact O-N 2.95Å; L184-V187 VanDerWaalsContact O-N 3.16Å; L184-L237 HydrophobicContact CD1-CG 4.49Å; L184-L237 HydrophobicContact CD2-CD2 3.86Å; L184-L237 HydrophobicContact CD2-CG 4.09Å; L184-I238 HydrophobicContact CD1-CG1 3.9Å; L184-R241 HydrophobicContact CD1-CB 4.42Å; L184-R241 HydrophobicContact CD1-CG 4.24Å; L184-R241 HydrophobicContact CD2-CG 4.36Å
185	P	90.6	Very high	90.9	Very high	41 Å²	41	47.2 Å²	47.2	27%	0.266	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	136.5	177	-31.9	41.1	0	0	0	113	G183 V187 V207 P212 W220	G183-P185 WeakPolarHBondContact O-CD 3.45Å; P185-V187 PolarHBondContact O-N 3.06Å; P185-V207 HydrophobicContact CB-CG1 4.39Å; P185-P212 HydrophobicContact CB-CG 4.16Å; P185-P212 HydrophobicContact CG-CB 4.41Å; P185-P212 HydrophobicContact CG-CG 3.68Å; P185-W220 HydrophobicContact CB-CH2 4.09Å; P185-W220 HydrophobicContact CB-CZ3 4.48Å; P185-W220 HydrophobicContact CG-CH2 4.35Å
186	G	90.9	Very high	90.8	Very high	2 Å²	2	48.1 Å²	48.1	2%	0.021	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	-2.7	-178.9	0	0	0	0	0	115.1	E178 L184 E205	E178-G186 PolarHBondContact OE2-N 3.47Å; L184-G186 PolarHBondContact O-N 3.43Å; G186-E205 PolarHBondContact O-N 3.12Å
187	V	92.7	Very high	90.9	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	114.1	179.6	178.1	0	0	0	0	111	L184 P185 V189 C202 V204 A233 I238	L184-V187 HydrophobicContact CB-CB 3.92Å; L184-V187 HydrophobicContact CB-CG2 3.5Å; L184-V187 HydrophobicContact CD1-CG2 4.21Å; L184-V187 WeakPolarHBondContact O-CB 3.46Å; L184-V187 PolarHBondContact O-N 2.95Å; L184-V187 VanDerWaalsContact O-N 3.16Å; P185-V187 PolarHBondContact O-N 3.06Å; V187-V189 HydrophobicContact CG1-CB 4.46Å; V187-C202 HydrophobicContact CG1-CB 4.15Å; V187-V204 HydrophobicContact CG2-CG1 4.31Å; V187-A233 HydrophobicContact CG2-CB 4.14Å; V187-I238 HydrophobicContact CG2-CD1 4.26Å; V187-I238 HydrophobicContact CG2-CG1 4.42Å
188	Q	92.6	Very high	91.3	Very high	25 Å²	25	43.5 Å²	43.5	12%	0.117	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.2	167.5	-59.1	177.5	7.1	0	0	108.8	A113 C202 N203 E205	A113-Q188 VanDerWaalsContact CB-CD 3.49Å; A113-Q188 HydrophobicContact CB-CG 4.37Å; Q188-C202 CarbonylContact O-C 3.6Å; Q188-C202 VanDerWaalsContact O-CA 3.26Å; Q188-C202 WeakPolarHBondContact O-CA 3.5Å; Q188-N203 HydrophobicContact CB-CB 4.3Å; Q188-N203 PolarHBondContact N-O 3.32Å; Q188-N203 PolarHBondContact O-N 2.87Å; Q188-E205 PolarHBondContact NE2-OE1 3.33Å; Q188-E205 PolarHBondContact NE2-OE2 3.23Å
189	V	94.5	Very high	91.8	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.024	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.1	-168.3	56.6	0	0	0	0	112.5	A173 L176 R177 V187 I200 A201	A173-V189 HydrophobicContact CB-CB 4.41Å; A173-V189 HydrophobicContact CB-CG1 3.95Å; A173-V189 HydrophobicContact CB-CG2 3.69Å; A173-V189 WeakPolarHBondContact O-CG1 3.42Å; L176-V189 HydrophobicContact CB-CG1 4.21Å; L176-V189 HydrophobicContact CD1-CG2 4.46Å; R177-V189 HydrophobicContact CG-CG1 3.71Å; R177-V189 PolarHBondContact NH2-O 2.88Å; V187-V189 HydrophobicContact CG1-CB 4.46Å; V189-I200 HydrophobicContact CG2-CG2 3.39Å; V189-A201 CarbonylContact C-O 3.48Å; V189-A201 WeakPolarHBondContact CA-O 3.23Å
190	L	94.7	Very high	92.5	Very high	36 Å²	36	34.1 Å²	34.1	19%	0.188	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	153.5	167.8	-63.6	176.6	0	0	0	109.3	P56 F122 L192 I200 A201	P56-L190 HydrophobicContact CG-CD1 4.43Å; F122-L190 HydrophobicContact CD1-CD2 4.47Å; F122-L190 HydrophobicContact CE1-CD1 4.43Å; F122-L190 HydrophobicContact CE1-CD2 4.13Å; L190-L192 HydrophobicContact CB-CD1 4.47Å; L190-L192 HydrophobicContact CB-CD2 4.47Å; L190-L192 HydrophobicContact CB-CG 4.23Å; L190-I200 CarbonylContact O-C 3.51Å; L190-I200 WeakPolarHBondContact O-CA 3.4Å; L190-A201 PolarHBondContact N-O 3.35Å; L190-A201 PolarHBondContact O-N 2.85Å
191	A	96.8	Very high	92.9	Very high	14 Å²	14	32.2 Å²	32.2	12%	0.116	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.3	169.5	0	0	0	0	0	108.1	G169 R170 A173 V198 E199 I200	G169-A191 WeakPolarHBondContact O-CB 3.26Å; R170-A191 HydrophobicContact CG-CB 4.19Å; A173-A191 HydrophobicContact CB-CB 4.22Å; A191-V198 HydrophobicContact CB-CG1 4.38Å; A191-E199 WeakPolarHBondContact CA-O 3.36Å; A191-I200 HydrophobicContact CB-CD1 4.11Å
192	L	95.4	Very high	93.4	Very high	15 Å²	15	25.7 Å²	25.7	8%	0.079	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	143.8	-171.3	-59.2	173.5	0	0	0	109.9	Y17 H55 L190 V198 E199 A201	Y17-L192 HydrophobicContact CD1-CD1 4.25Å; Y17-L192 HydrophobicContact CE1-CB 4.19Å; Y17-L192 HydrophobicContact CE1-CD1 3.52Å; H55-L192 HydrophobicContact CB-CD1 4.41Å; L190-L192 HydrophobicContact CB-CD1 4.47Å; L190-L192 HydrophobicContact CB-CD2 4.47Å; L190-L192 HydrophobicContact CB-CG 4.23Å; L192-V198 CarbonylContact O-C 3.58Å; L192-V198 WeakPolarHBondContact O-CA 3.26Å; L192-E199 PolarHBondContact N-O 3.19Å; L192-E199 PolarHBondContact O-N 2.85Å; L192-A201 HydrophobicContact CD1-CB 4.46Å
193	P	95	Very high	94	Very high	62 Å²	62	24.6 Å²	24.6	40%	0.403	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	131.7	163.7	29.8	-31.8	0	0	0	108.9	V54 V166 A197	V54-P193 HydrophobicContact CB-CG 4.38Å; V54-P193 HydrophobicContact CG1-CG 4.37Å; V54-P193 WeakPolarHBondContact CG2-O 3.48Å; V166-P193 HydrophobicContact CG2-CB 4.31Å; P193-A197 WeakPolarHBondContact CA-O 3.42Å
194	H	94.4	Very high	94.2	Very high	11 Å²	11	23.9 Å²	23.9	5%	0.051	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	130.5	-177.3	-179.4	-91.2	0	0	0	109.7	D14 Y17 G196 A197 E199	D14-H194 IonicContact OD1-CD2 3.78Å; D14-H194 IonicContact OD1-NE2 2.77Å; D14-H194 IonicContact OD2-CD2 2.76Å; D14-H194 IonicContact OD2-CE1 3.2Å; D14-H194 IonicContact OD2-NE2 2.68Å; D14-H194 PolarHBondContact OD2-NE2 2.86Å; Y17-H194 AromaticContact CE1-CD2 3.8Å; Y17-H194 AromaticContact CZ-CD2 3.83Å; H194-G196 VanDerWaalsContact C-N 3.27Å; H194-G196 PolarHBondContact O-N 3.05Å; H194-G196 VanDerWaalsContact O-N 3.09Å; H194-A197 PolarHBondContact N-O 3.38Å; H194-A197 CarbonylContact O-C 3.43Å; H194-A197 WeakPolarHBondContact O-CA 3.42Å; H194-A197 PolarHBondContact O-N 3.43Å; H194-E199 HydrophobicContact CB-CB 3.79Å; H194-E199 IonicContact ND1-OE2 3.78Å
195	E	90.9	Very high	94.3	Very high	154 Å²	154	25.6 Å²	25.6	72%	0.72	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	40.2	175.5	-69.5	-172.4	172.4	0	0	115.2	D16 A197	D16-E195 PolarHBondContact OD2-N 3.15Å; E195-A197 VanDerWaalsContact C-N 3.25Å; E195-A197 PolarHBondContact O-N 2.81Å
196	G	92.3	Very high	94.4	Very high	55 Å²	55	24.3 Å²	24.3	57%	0.567	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.7	25.6	-179.1	0	0	0	0	0	113.6	L164 H194	L164-G196 VanDerWaalsContact CD2-C 3.44Å; L164-G196 WeakPolarHBondContact CD2-O 3.42Å; H194-G196 VanDerWaalsContact C-N 3.27Å; H194-G196 PolarHBondContact O-N 3.05Å; H194-G196 VanDerWaalsContact O-N 3.09Å
197	A	95.5	Very high	94.4	Very high	5 Å²	5	25.9 Å²	25.9	4%	0.041	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	-173.8	175.3	0	0	0	0	0	110.3	T163 P193 H194 E195 K254	T163-A197 CarbonylContact O-C 3.51Å; T163-A197 VanDerWaalsContact O-C 3.3Å; T163-A197 WeakPolarHBondContact O-CA 3.24Å; P193-A197 WeakPolarHBondContact CA-O 3.42Å; H194-A197 PolarHBondContact N-O 3.38Å; H194-A197 CarbonylContact O-C 3.43Å; H194-A197 WeakPolarHBondContact O-CA 3.42Å; H194-A197 PolarHBondContact O-N 3.43Å; E195-A197 VanDerWaalsContact C-N 3.25Å; E195-A197 PolarHBondContact O-N 2.81Å; A197-K254 HydrophobicContact CB-CD 4.09Å
198	V	97.2	Very high	94.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.9	166	173.6	0	0	0	0	108	I161 T163 V166 A191 L192 I200	I161-V198 HydrophobicContact CD1-CB 4.14Å; I161-V198 HydrophobicContact CD1-CG1 4.08Å; I161-V198 HydrophobicContact CG1-CB 3.86Å; I161-V198 HydrophobicContact CG1-CG1 4.15Å; I161-V198 WeakPolarHBondContact CG1-O 3.37Å; I161-V198 PolarHBondContact N-O 3.38Å; T163-V198 HydrophobicContact CG2-CB 4.19Å; T163-V198 HydrophobicContact CG2-CG2 4.16Å; T163-V198 WeakPolarHBondContact O-CG2 3.4Å; T163-V198 PolarHBondContact O-N 3.07Å; V166-V198 HydrophobicContact CG2-CG2 3.98Å; A191-V198 HydrophobicContact CB-CG1 4.38Å; L192-V198 CarbonylContact O-C 3.58Å; L192-V198 WeakPolarHBondContact O-CA 3.26Å; V198-I200 HydrophobicContact CG1-CD1 4.45Å
199	E	97.3	Very high	93.7	Very high	11 Å²	11	29.5 Å²	29.5	5%	0.051	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.7	176	-178.3	159.6	100	0	0	110.6	Y17 N158 S160 A191 L192 H194 A201	Y17-E199 PolarHBondContact OH-OE1 3.35Å; N158-E199 VanDerWaalsContact CB-CD 3.44Å; N158-E199 HydrophobicContact CB-CG 3.88Å; N158-E199 WeakPolarHBondContact CB-OE1 3.49Å; N158-E199 PolarHBondContact ND2-OE1 2.96Å; S160-E199 PolarHBondContact OG-OE2 3.09Å; A191-E199 WeakPolarHBondContact CA-O 3.36Å; L192-E199 PolarHBondContact N-O 3.19Å; L192-E199 PolarHBondContact O-N 2.85Å; H194-E199 HydrophobicContact CB-CB 3.79Å; H194-E199 IonicContact ND1-OE2 3.78Å; E199-A201 PolarHBondContact O-N 2.86Å
200	I	97.6	Very high	92.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	88.9	170.4	-50.9	-56.9	0	0	0	107.5	N158 V159 I161 I172 L176 V189 L190 A191 V198 V242	N158-I200 WeakPolarHBondContact CA-O 3.44Å; V159-I200 PolarHBondContact N-O 2.82Å; V159-I200 WeakPolarHBondContact O-CB 3.49Å; V159-I200 PolarHBondContact O-N 2.7Å; I161-I200 HydrophobicContact CD1-CD1 4.23Å; I161-I200 HydrophobicContact CG2-CG1 4.39Å; I172-I200 HydrophobicContact CB-CD1 4.29Å; I172-I200 HydrophobicContact CG2-CD1 4.22Å; I172-I200 HydrophobicContact CG2-CG1 4.28Å; L176-I200 HydrophobicContact CD1-CG2 3.86Å; V189-I200 HydrophobicContact CG2-CG2 3.39Å; L190-I200 CarbonylContact O-C 3.51Å; L190-I200 WeakPolarHBondContact O-CA 3.4Å; A191-I200 HydrophobicContact CB-CD1 4.11Å; V198-I200 HydrophobicContact CG1-CD1 4.45Å; I200-V242 HydrophobicContact CB-CG2 4.36Å; I200-V242 HydrophobicContact CG1-CG1 4.11Å; I200-V242 HydrophobicContact CG2-CG2 4.08Å
201	A	95.6	Very high	91	Very high	10 Å²	10	33 Å²	33	8%	0.083	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	119.2	-177.9	0	0	0	0	0	110.7	N158 V189 L190 L192 E199	N158-A201 WeakPolarHBondContact OD1-CA 3.5Å; V189-A201 CarbonylContact C-O 3.48Å; V189-A201 WeakPolarHBondContact CA-O 3.23Å; L190-A201 PolarHBondContact N-O 3.35Å; L190-A201 PolarHBondContact O-N 2.85Å; L192-A201 HydrophobicContact CD1-CB 4.46Å; E199-A201 PolarHBondContact O-N 2.86Å
202	C	95.3	Very high	89.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.6	-175.7	-50.4	0	0	0	0	111.8	N156 C157 N158 V187 Q188 V204	N156-C202 CarbonylContact C-O 3.56Å; N156-C202 VanDerWaalsContact CA-O 3.29Å; N156-C202 WeakPolarHBondContact CA-O 3.41Å; C157-C202 PolarHBondContact N-O 3.01Å; C157-C202 WeakPolarHBondContact O-CA 3.43Å; C157-C202 WeakPolarHBondContact O-CB 3.43Å; C157-C202 PolarHBondContact O-N 3.06Å; N158-C202 PolarHBondContact OD1-N 2.89Å; V187-C202 HydrophobicContact CG1-CB 4.15Å; Q188-C202 CarbonylContact O-C 3.6Å; Q188-C202 VanDerWaalsContact O-CA 3.26Å; Q188-C202 WeakPolarHBondContact O-CA 3.5Å; C202-V204 HydrophobicContact CB-CG2 4.35Å
203	N	94.4	Very high	87.9	Confident	40 Å²	40	37.1 Å²	37.1	21%	0.214	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	130.4	157.3	-64.9	6.7	0	0	0	107.5	V154 N156 Q188	V154-N203 HydrophobicContact CG1-CB 4.14Å; N156-N203 PolarHBondContact OD1-OD1 2.9Å; Q188-N203 HydrophobicContact CB-CB 4.3Å; Q188-N203 PolarHBondContact N-O 3.32Å; Q188-N203 PolarHBondContact O-N 2.87Å
204	V	94.3	Very high	86	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	94.1	-175.2	-167.9	0	0	0	0	107.8	V154 M155 C157 V187 C202 H232 A233 I238	V154-V204 WeakPolarHBondContact CA-O 3.43Å; M155-V204 HydrophobicContact CB-CB 4.26Å; M155-V204 HydrophobicContact CE-CB 3.91Å; M155-V204 HydrophobicContact CE-CG1 4.06Å; M155-V204 HydrophobicContact CE-CG2 3.71Å; M155-V204 PolarHBondContact N-O 2.91Å; M155-V204 VanDerWaalsContact N-O 3.07Å; M155-V204 WeakPolarHBondContact O-CB 3.47Å; M155-V204 PolarHBondContact O-N 2.73Å; C157-V204 HydrophobicContact CB-CG2 4.3Å; V187-V204 HydrophobicContact CG2-CG1 4.31Å; C202-V204 HydrophobicContact CB-CG2 4.35Å; V204-H232 HydrophobicContact CG1-CB 4.07Å; V204-A233 HydrophobicContact CG1-CB 4.02Å; V204-I238 HydrophobicContact CB-CD1 4.47Å; V204-I238 HydrophobicContact CG1-CD1 4.27Å; V204-I238 HydrophobicContact CG2-CD1 3.35Å
205	E	93.4	Very high	83.9	Confident	49 Å²	49	42.2 Å²	42.2	23%	0.229	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	140.9	177.1	-64.2	-173.6	162.9	0	0	110.3	V154 G186 Q188	V154-E205 HydrophobicContact CG1-CG 4.37Å; V154-E205 HydrophobicContact CG2-CG 4.14Å; G186-E205 PolarHBondContact O-N 3.12Å; Q188-E205 PolarHBondContact NE2-OE1 3.33Å; Q188-E205 PolarHBondContact NE2-OE2 3.23Å
206	S	92.3	Very high	82.2	Confident	14 Å²	14	41 Å²	41	10%	0.098	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-78.5	126.4	173.3	-57.7	0	0	0	0	110.5	Y153 F223 C231	Y153-S206 WeakPolarHBondContact O-CB 3.3Å; Y153-S206 PolarHBondContact O-OG 2.87Å; S206-F223 WeakPolarHBondContact OG-CE1 3.33Å; S206-F223 VanDerWaalsContact OG-CZ 3.32Å; S206-F223 WeakPolarHBondContact OG-CZ 3.36Å; S206-C231 CarbonylContact C-O 3.59Å; S206-C231 VanDerWaalsContact CA-O 3.31Å; S206-C231 WeakPolarHBondContact CA-O 3.3Å
207	V	90.3	Very high	80.8	Confident	35 Å²	35	42.4 Å²	42.4	21%	0.212	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142	179.3	-60.3	0	0	0	0	110.4	P185 W220 Y230 C231	P185-V207 HydrophobicContact CB-CG1 4.39Å; V207-W220 HydrophobicContact CG2-CZ3 4.11Å; V207-Y230 WeakPolarHBondContact O-CA 3.32Å; V207-C231 WeakPolarHBondContact CG2-O 3.5Å; V207-C231 PolarHBondContact N-O 2.9Å; V207-C231 PolarHBondContact O-N 3.35Å
208	A	89.4	Confident	79.4	Confident	77 Å²	77	46.3 Å²	46.3	64%	0.636	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	140	177.1	0	0	0	0	0	111	Y230	A208-Y230 HydrophobicContact CB-CD1 4.29Å; A208-Y230 HydrophobicContact CB-CE1 3.95Å
209	G	80.6	Confident	78.6	Confident	27 Å²	27	51.8 Å²	51.8	28%	0.278	36%	0.359	S	S	.	.	S	Bend	trans	101.1	-147.2	170	0	0	0	0	0	115.9	R222 P229	G209-R222 PolarHBondContact O-NH1 3.15Å; G209-R222 VanDerWaalsContact O-NH1 3.07Å; G209-R222 PolarHBondContact O-NH2 2.69Å; G209-R222 VanDerWaalsContact O-NH2 3.17Å; G209-P229 PolarHBondContact N-O 3.09Å
210	A	66.9	Low	78.1	Confident	81 Å²	81	51.8 Å²	51.8	67%	0.669	36%	0.359	S	S	*	.	S	Bend	trans	-85.6	146.7	-177.4	0	0	0	0	0	110.8
211	A	67.1	Low	77.7	Confident	33 Å²	33	53.8 Å²	53.8	27%	0.273	37%	0.372	S	S	.	.			trans	-59.2	133.2	175	0	0	0	0	0	109.6	G213 W220	A211-G213 VanDerWaalsContact C-N 3.31Å; A211-G213 PolarHBondContact O-N 2.83Å; A211-W220 HydrophobicContact CB-CB 3.7Å; A211-W220 HydrophobicContact CB-CD2 4.16Å; A211-W220 HydrophobicContact CB-CG 3.71Å
212	P	66.5	Low	77.4	Confident	67 Å²	67	58.9 Å²	58.9	44%	0.435	39%	0.389	S	S	.	.			trans	-75.9	89.2	169.9	27	-23.5	0	0	0	107.3	P185 W220	P185-P212 HydrophobicContact CB-CG 4.16Å; P185-P212 HydrophobicContact CG-CB 4.41Å; P185-P212 HydrophobicContact CG-CG 3.68Å; P212-W220 HydrophobicContact CG-CH2 3.79Å; P212-W220 HydrophobicContact CG-CZ2 3.96Å; P212-W220 HydrophobicContact CG-CZ3 4.13Å
213	G	60.5	Low	77.1	Confident	49 Å²	49	60.5 Å²	60.5	51%	0.505	40%	0.396	S	S	.	.			trans	-144.4	142.7	-178.3	0	0	0	0	0	112.2	A211	A211-G213 VanDerWaalsContact C-N 3.31Å; A211-G213 PolarHBondContact O-N 2.83Å
214	G	55.1	Low	77	Confident	36 Å²	36	61.8 Å²	61.8	37%	0.371	41%	0.405	S	S	.	.			trans	-73.7	169.9	167.2	0	0	0	0	0	111	T216 D217	G214-T216 PolarHBondContact O-N 2.87Å; G214-D217 PolarHBondContact N-OD2 2.98Å; G214-D217 VanDerWaalsContact N-OD2 3.09Å; G214-D217 PolarHBondContact O-N 2.9Å
215	P	49.3	Very low	76.9	Confident	143 Å²	143	62 Å²	62	93%	0.929	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-9	-176.9	22.6	-32.6	0	0	0	115.5
216	T	55.7	Low	76.8	Confident	128 Å²	128	64.3 Å²	64.3	79%	0.785	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-8.7	-177.6	52.6	0	0	0	0	114.5	G214	G214-T216 PolarHBondContact O-N 2.87Å
217	D	63.3	Low	76.7	Confident	85 Å²	85	66.9 Å²	66.9	46%	0.455	45%	0.449	S	S	.	.	S	Bend	trans	-81.1	140.2	-178.2	-63.5	-37.6	0	0	0	110.5	G214	G214-D217 PolarHBondContact N-OD2 2.98Å; G214-D217 VanDerWaalsContact N-OD2 3.09Å; G214-D217 PolarHBondContact O-N 2.9Å
218	P	65.3	Low	76.8	Confident	87 Å²	87	72 Å²	72	57%	0.565	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-58.1	137.6	172.6	22.7	-30.2	0	0	0	109.6	W220	P218-W220 PolarHBondContact O-N 3.37Å
219	P	80	Confident	76.9	Confident	116 Å²	116	70.9 Å²	70.9	75%	0.753	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-61.6	133.5	-175.8	25.6	-33.7	0	0	0	109.8
220	W	88.5	Confident	77.4	Confident	11 Å²	11	70.4 Å²	70.4	4%	0.042	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-62.6	136.5	173.4	-72.1	24.2	0	0	0	109.2	P185 V207 A211 P212 P218 R222 C231 H232 A233 L237	P185-W220 HydrophobicContact CB-CH2 4.09Å; P185-W220 HydrophobicContact CB-CZ3 4.48Å; P185-W220 HydrophobicContact CG-CH2 4.35Å; V207-W220 HydrophobicContact CG2-CZ3 4.11Å; A211-W220 HydrophobicContact CB-CB 3.7Å; A211-W220 HydrophobicContact CB-CD2 4.16Å; A211-W220 HydrophobicContact CB-CG 3.71Å; P212-W220 HydrophobicContact CG-CH2 3.79Å; P212-W220 HydrophobicContact CG-CZ2 3.96Å; P212-W220 HydrophobicContact CG-CZ3 4.13Å; P218-W220 PolarHBondContact O-N 3.37Å; W220-R222 VanDerWaalsContact O-CG 3.24Å; W220-R222 WeakPolarHBondContact O-CG 3.17Å; W220-R222 PolarHBondContact O-N 3.35Å; W220-C231 HydrophobicContact CB-CB 4.13Å; W220-H232 WeakPolarHBondContact CB-O 3.27Å; W220-A233 VanDerWaalsContact CE3-N 3.33Å; W220-A233 HydrophobicContact CH2-CB 3.84Å; W220-A233 HydrophobicContact CZ2-CB 3.96Å; W220-A233 HydrophobicContact CZ3-CB 4.17Å; W220-L237 HydrophobicContact CZ2-CD2 3.97Å
221	P	88.6	Confident	78.6	Confident	42 Å²	42	66.6 Å²	66.6	27%	0.273	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-53	141.4	173.5	-26	34	0	0	0	111.2	C231 H232 P234	P221-C231 WeakPolarHBondContact O-CA 3.49Å; P221-C231 VanDerWaalsContact O-CB 3.27Å; P221-C231 WeakPolarHBondContact O-CB 3.36Å; P221-H232 WeakPolarHBondContact CD-O 3.36Å; P221-H232 PolarHBondContact O-N 3.33Å; P221-P234 HydrophobicContact CG-CB 4.39Å
222	R	89	Confident	79.8	Confident	116 Å²	116	65.1 Å²	65.1	44%	0.438	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148	-174.3	-52.4	178.3	64.4	76.7	-1.6	110.8	G209 W220 Y230 C231 Q264	G209-R222 PolarHBondContact O-NH1 3.15Å; G209-R222 VanDerWaalsContact O-NH1 3.07Å; G209-R222 PolarHBondContact O-NH2 2.69Å; G209-R222 VanDerWaalsContact O-NH2 3.17Å; W220-R222 VanDerWaalsContact O-CG 3.24Å; W220-R222 WeakPolarHBondContact O-CG 3.17Å; W220-R222 PolarHBondContact O-N 3.35Å; R222-Y230 VanDerWaalsContact CA-O 3.25Å; R222-Y230 WeakPolarHBondContact CA-O 3.48Å; R222-C231 HydrophobicContact CG-CB 4.11Å; R222-Q264 PolarHBondContact O-NE2 3.24Å; R222-Q264 VanDerWaalsContact O-NE2 3.09Å
223	F	89.8	Confident	81	Confident	34 Å²	34	61.9 Å²	61.9	15%	0.149	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	170.9	169.1	64.3	-80.8	0	0	0	109.3	P152 S206 V225 Y230 P263	P152-F223 HydrophobicContact CB-CE2 4.37Å; P152-F223 HydrophobicContact CB-CZ 4.04Å; S206-F223 WeakPolarHBondContact OG-CE1 3.33Å; S206-F223 VanDerWaalsContact OG-CZ 3.32Å; S206-F223 WeakPolarHBondContact OG-CZ 3.36Å; F223-V225 HydrophobicContact CD2-CG2 3.9Å; F223-V225 HydrophobicContact CE2-CG2 3.69Å; F223-Y230 HydrophobicContact CE2-CD2 4.29Å; F223-Y230 HydrophobicContact CE2-CG 4.25Å; F223-Y230 HydrophobicContact CZ-CG 4.2Å; F223-Y230 PolarHBondContact N-O 3.26Å; F223-Y230 PolarHBondContact O-N 3.4Å; F223-P263 HydrophobicContact CD1-CG 4.32Å; F223-P263 HydrophobicContact CE1-CG 4.29Å
224	V	90.6	Very high	82.5	Confident	67 Å²	67	60.6 Å²	60.6	41%	0.406	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.2	-176.9	177.6	0	0	0	0	109.1	G227 R228	V224-G227 VanDerWaalsContact CG1-CA 3.41Å; V224-R228 WeakPolarHBondContact CA-O 3.3Å
225	V	92.4	Very high	84.2	Confident	6 Å²	6	60 Å²	60	4%	0.036	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.7	168.8	-176.2	0	0	0	0	107	P68 W103 F223 G227 R228 Y230	P68-V225 HydrophobicContact CB-CG1 4.12Å; P68-V225 HydrophobicContact CB-CG2 4.32Å; P68-V225 HydrophobicContact CG-CB 4.37Å; P68-V225 HydrophobicContact CG-CG1 3.79Å; P68-V225 HydrophobicContact CG-CG2 3.6Å; W103-V225 HydrophobicContact CH2-CG1 4.19Å; F223-V225 HydrophobicContact CD2-CG2 3.9Å; F223-V225 HydrophobicContact CE2-CG2 3.69Å; V225-G227 PolarHBondContact O-N 3.17Å; V225-R228 PolarHBondContact N-O 2.97Å; V225-R228 WeakPolarHBondContact O-CB 3.37Å; V225-R228 PolarHBondContact O-N 3.37Å; V225-Y230 HydrophobicContact CB-CD2 4.21Å; V225-Y230 HydrophobicContact CB-CE2 3.92Å; V225-Y230 HydrophobicContact CG2-CD2 4.07Å; V225-Y230 HydrophobicContact CG2-CE2 4.2Å
226	D	92.9	Very high	86.2	Confident	97 Å²	97	56.6 Å²	56.6	52%	0.519	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	42.3	-178.5	-63.6	-34	0	0	0	113.6	G74 E75 R228	G74-D226 VanDerWaalsContact CA-OD1 3.27Å; G74-D226 WeakPolarHBondContact CA-OD1 3.49Å; G74-D226 WeakPolarHBondContact CA-OD2 3.23Å; E75-D226 PolarHBondContact N-OD2 2.87Å; D226-R228 PolarHBondContact O-N 3.24Å; D226-R228 VanDerWaalsContact O-N 3.15Å
227	G	89.9	Confident	87.9	Confident	68 Å²	68	52.4 Å²	52.4	70%	0.701	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-0.6	-177.9	0	0	0	0	0	115.1	V224 V225	V224-G227 VanDerWaalsContact CG1-CA 3.41Å; V225-G227 PolarHBondContact O-N 3.17Å
228	R	91.5	Very high	89.3	Confident	142 Å²	142	48.3 Å²	48.3	54%	0.536	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	124.9	176.7	-61.6	176.9	178.5	168.5	0.6	110.5	E75 V224 V225 D226 Y230	E75-R228 IonicContact OE2-NH1 3.47Å; E75-R228 PolarHBondContact OE2-NH1 3.38Å; V224-R228 WeakPolarHBondContact CA-O 3.3Å; V225-R228 PolarHBondContact N-O 2.97Å; V225-R228 WeakPolarHBondContact O-CB 3.37Å; V225-R228 PolarHBondContact O-N 3.37Å; D226-R228 PolarHBondContact O-N 3.24Å; D226-R228 VanDerWaalsContact O-N 3.15Å; R228-Y230 HydrophobicContact CB-CE2 3.89Å; R228-Y230 VanDerWaalsContact O-CD2 3.29Å; R228-Y230 WeakPolarHBondContact O-CD2 3.32Å
229	P	91.3	Very high	90.7	Very high	53 Å²	53	48 Å²	48	34%	0.344	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	135.4	178.1	30.9	-33.7	0	0	0	111.5	G209	G209-P229 PolarHBondContact N-O 3.09Å
230	Y	92.2	Very high	91.4	Very high	18 Å²	18	45 Å²	45	7%	0.071	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	151.1	172.4	-69.6	-85.8	0	0	0	110.1	P152 V207 A208 R222 F223 V225 R228	P152-Y230 HydrophobicContact CB-CD1 3.86Å; P152-Y230 HydrophobicContact CB-CE1 4.04Å; P152-Y230 HydrophobicContact CB-CG 4.19Å; P152-Y230 HydrophobicContact CG-CD1 3.61Å; P152-Y230 HydrophobicContact CG-CE1 3.27Å; P152-Y230 HydrophobicContact CG-CE2 4.36Å; P152-Y230 HydrophobicContact CG-CG 4.29Å; V207-Y230 WeakPolarHBondContact O-CA 3.32Å; A208-Y230 HydrophobicContact CB-CD1 4.29Å; A208-Y230 HydrophobicContact CB-CE1 3.95Å; R222-Y230 VanDerWaalsContact CA-O 3.25Å; R222-Y230 WeakPolarHBondContact CA-O 3.48Å; F223-Y230 HydrophobicContact CE2-CD2 4.29Å; F223-Y230 HydrophobicContact CE2-CG 4.25Å; F223-Y230 HydrophobicContact CZ-CG 4.2Å; F223-Y230 PolarHBondContact N-O 3.26Å; F223-Y230 PolarHBondContact O-N 3.4Å; V225-Y230 HydrophobicContact CB-CD2 4.21Å; V225-Y230 HydrophobicContact CB-CE2 3.92Å; V225-Y230 HydrophobicContact CG2-CD2 4.07Å; V225-Y230 HydrophobicContact CG2-CE2 4.2Å; R228-Y230 HydrophobicContact CB-CE2 3.89Å; R228-Y230 VanDerWaalsContact O-CD2 3.29Å; R228-Y230 WeakPolarHBondContact O-CD2 3.32Å
231	C	92.2	Very high	91.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	161.6	172.2	64.4	0	0	0	0	110.8	S206 V207 W220 P221 R222	S206-C231 CarbonylContact C-O 3.59Å; S206-C231 VanDerWaalsContact CA-O 3.31Å; S206-C231 WeakPolarHBondContact CA-O 3.3Å; V207-C231 WeakPolarHBondContact CG2-O 3.5Å; V207-C231 PolarHBondContact N-O 2.9Å; V207-C231 PolarHBondContact O-N 3.35Å; W220-C231 HydrophobicContact CB-CB 4.13Å; P221-C231 WeakPolarHBondContact O-CA 3.49Å; P221-C231 VanDerWaalsContact O-CB 3.27Å; P221-C231 WeakPolarHBondContact O-CB 3.36Å; R222-C231 HydrophobicContact CG-CB 4.11Å
232	H	92.1	Very high	92	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.009	26%	0.259	C	S	.	.			trans	-142.3	155.8	179.2	65.2	83.5	0	0	0	110.8	V204 W220 P221	V204-H232 HydrophobicContact CG1-CB 4.07Å; W220-H232 WeakPolarHBondContact CB-O 3.27Å; P221-H232 WeakPolarHBondContact CD-O 3.36Å; P221-H232 PolarHBondContact O-N 3.33Å
233	A	91.7	Very high	92.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.254	C	S	.	.			trans	-59.9	131.1	175.8	0	0	0	0	0	109.6	M155 V187 V204 W220 L237 I238	M155-A233 VanDerWaalsContact CE-O 3.3Å; M155-A233 WeakPolarHBondContact CE-O 3.45Å; V187-A233 HydrophobicContact CG2-CB 4.14Å; V204-A233 HydrophobicContact CG1-CB 4.02Å; W220-A233 VanDerWaalsContact CE3-N 3.33Å; W220-A233 HydrophobicContact CH2-CB 3.84Å; W220-A233 HydrophobicContact CZ2-CB 3.96Å; W220-A233 HydrophobicContact CZ3-CB 4.17Å; A233-L237 HydrophobicContact CB-CD2 4.47Å; A233-I238 HydrophobicContact CB-CD1 4.3Å; A233-I238 HydrophobicContact CB-CG1 4.26Å
234	P	91.1	Very high	92.7	Very high	22 Å²	22	44.8 Å²	44.8	14%	0.143	27%	0.267	C	S	.	.			trans	-71.6	147.8	175.8	25.6	-29.3	0	0	0	110.5	P221 A236 L237 I238	P221-P234 HydrophobicContact CG-CB 4.39Å; P234-A236 PolarHBondContact O-N 2.7Å; P234-L237 HydrophobicContact CG-CB 3.73Å; P234-L237 WeakPolarHBondContact O-CB 3.32Å; P234-L237 PolarHBondContact O-N 3.4Å; P234-I238 PolarHBondContact O-N 3.27Å
235	A	90.9	Very high	93	Very high	22 Å²	22	42.4 Å²	42.4	18%	0.182	25%	0.252	C	S	.	.	H	α-helix	trans	-54.6	-38	178.1	0	0	0	0	0	112.6	M155 L237 I238 M239 L258	M155-A235 HydrophobicContact CE-CB 4.39Å; A235-L237 VanDerWaalsContact C-N 3.31Å; A235-L237 PolarHBondContact O-N 3.26Å; A235-I238 PolarHBondContact O-N 2.95Å; A235-M239 WeakPolarHBondContact O-CB 3.14Å; A235-M239 PolarHBondContact O-N 2.92Å; A235-L258 HydrophobicContact CB-CD2 3.78Å; A235-L258 HydrophobicContact CB-CG 4.47Å
236	A	90.8	Very high	93.2	Very high	73 Å²	73	42.1 Å²	42.1	60%	0.603	25%	0.25	S	S	*	.	H	α-helix	trans	-60.9	-37	176.2	0	0	0	0	0	113.1	P234 A240	P234-A236 PolarHBondContact O-N 2.7Å; A236-A240 WeakPolarHBondContact O-CB 3.44Å; A236-A240 PolarHBondContact O-N 3.45Å
237	L	91.7	Very high	93.4	Very high	39 Å²	39	39.8 Å²	39.8	20%	0.204	25%	0.248	C	C	.	.	H	α-helix	trans	-67.8	-44.7	175.6	175.3	62.5	0	0	0	110.7	L184 W220 A233 P234 A235 M239 A240 R241	L184-L237 HydrophobicContact CD1-CG 4.49Å; L184-L237 HydrophobicContact CD2-CD2 3.86Å; L184-L237 HydrophobicContact CD2-CG 4.09Å; W220-L237 HydrophobicContact CZ2-CD2 3.97Å; A233-L237 HydrophobicContact CB-CD2 4.47Å; P234-L237 HydrophobicContact CG-CB 3.73Å; P234-L237 WeakPolarHBondContact O-CB 3.32Å; P234-L237 PolarHBondContact O-N 3.4Å; A235-L237 VanDerWaalsContact C-N 3.31Å; A235-L237 PolarHBondContact O-N 3.26Å; L237-M239 PolarHBondContact O-N 2.85Å; L237-A240 PolarHBondContact O-N 2.88Å; L237-R241 HydrophobicContact CD1-CG 4.09Å; L237-R241 WeakPolarHBondContact O-CB 3.32Å; L237-R241 VanDerWaalsContact O-CG 3.29Å; L237-R241 WeakPolarHBondContact O-CG 3.35Å; L237-R241 PolarHBondContact O-N 2.81Å
238	I	93.8	Very high	93.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-47.4	177.7	-62.8	168.4	0	0	0	110.1	M155 C157 V159 L184 V187 V204 A233 P234 A235 A240 R241 V242	M155-I238 HydrophobicContact CE-CD1 4.37Å; C157-I238 HydrophobicContact CB-CD1 4.13Å; V159-I238 HydrophobicContact CG2-CG2 4.26Å; L184-I238 HydrophobicContact CD1-CG1 3.9Å; V187-I238 HydrophobicContact CG2-CD1 4.26Å; V187-I238 HydrophobicContact CG2-CG1 4.42Å; V204-I238 HydrophobicContact CB-CD1 4.47Å; V204-I238 HydrophobicContact CG1-CD1 4.27Å; V204-I238 HydrophobicContact CG2-CD1 3.35Å; A233-I238 HydrophobicContact CB-CD1 4.3Å; A233-I238 HydrophobicContact CB-CG1 4.26Å; P234-I238 PolarHBondContact O-N 3.27Å; A235-I238 PolarHBondContact O-N 2.95Å; I238-A240 PolarHBondContact O-N 3.31Å; I238-R241 PolarHBondContact O-N 2.9Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.16Å; I238-V242 PolarHBondContact O-N 3.48Å
239	M	94.2	Very high	94	Very high	79 Å²	79	39.8 Å²	39.8	39%	0.389	24%	0.237	S	C	.	.	H	α-helix	trans	-58.3	-47.5	176.2	179.8	-179.4	179	0	0	111.9	V159 A235 L237 R241 V242 A243 V253 T256	V159-M239 HydrophobicContact CG2-CB 4.43Å; A235-M239 WeakPolarHBondContact O-CB 3.14Å; A235-M239 PolarHBondContact O-N 2.92Å; L237-M239 PolarHBondContact O-N 2.85Å; M239-R241 VanDerWaalsContact C-N 3.33Å; M239-R241 PolarHBondContact O-N 3.44Å; M239-V242 PolarHBondContact O-N 3.22Å; M239-A243 WeakPolarHBondContact O-CB 3.49Å; M239-A243 PolarHBondContact O-N 3.36Å; M239-V253 HydrophobicContact CE-CG1 4.4Å; M239-T256 HydrophobicContact CB-CG2 4.47Å; M239-T256 WeakPolarHBondContact CG-OG1 3.21Å; M239-T256 PolarHBondContact SD-OG1 3.1Å
240	A	93.5	Very high	94.2	Very high	54 Å²	54	40.9 Å²	40.9	45%	0.446	26%	0.257	S	S	.	.	H	α-helix	trans	-60.8	-43	179	0	0	0	0	0	111.8	A236 L237 I238 A243 E244	A236-A240 WeakPolarHBondContact O-CB 3.44Å; A236-A240 PolarHBondContact O-N 3.45Å; L237-A240 PolarHBondContact O-N 2.88Å; I238-A240 PolarHBondContact O-N 3.31Å; A240-A243 PolarHBondContact O-N 3.32Å; A240-E244 WeakPolarHBondContact O-CB 3.3Å; A240-E244 PolarHBondContact O-N 2.95Å
241	R	94.8	Very high	94.4	Very high	69 Å²	69	40.9 Å²	40.9	26%	0.26	26%	0.259	S	S	.	.	H	α-helix	trans	-67.9	-40	177.8	-66.8	-60.2	-63.5	162.9	-1.2	112.5	L176 L184 L237 I238 M239 E244 L245	L176-R241 HydrophobicContact CD2-CB 3.78Å; L184-R241 HydrophobicContact CD1-CB 4.42Å; L184-R241 HydrophobicContact CD1-CG 4.24Å; L184-R241 HydrophobicContact CD2-CG 4.36Å; L237-R241 HydrophobicContact CD1-CG 4.09Å; L237-R241 WeakPolarHBondContact O-CB 3.32Å; L237-R241 VanDerWaalsContact O-CG 3.29Å; L237-R241 WeakPolarHBondContact O-CG 3.35Å; L237-R241 PolarHBondContact O-N 2.81Å; I238-R241 PolarHBondContact O-N 2.9Å; M239-R241 VanDerWaalsContact C-N 3.33Å; M239-R241 PolarHBondContact O-N 3.44Å; R241-E244 IonicContact CZ-OE1 2.72Å; R241-E244 IonicContact CZ-OE2 3.01Å; R241-E244 IonicContact NH1-OE1 3.78Å; R241-E244 PolarHBondContact NH1-OE1 3.23Å; R241-E244 IonicContact NH1-OE2 3.06Å; R241-E244 PolarHBondContact NH1-OE2 3.07Å; R241-L245 WeakPolarHBondContact O-CB 3.43Å; R241-L245 WeakPolarHBondContact O-CD1 3.46Å; R241-L245 VanDerWaalsContact O-CG 3.25Å; R241-L245 WeakPolarHBondContact O-CG 3.19Å; R241-L245 PolarHBondContact O-N 2.98Å; R241-L245 VanDerWaalsContact O-N 3.09Å
242	V	96.6	Very high	94.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-45.6	172.9	172.1	0	0	0	0	110.6	V159 I161 I172 L176 I200 I238 M239 E244 L245 A246 V253	V159-V242 HydrophobicContact CB-CB 4.2Å; V159-V242 HydrophobicContact CB-CG1 3.96Å; V159-V242 HydrophobicContact CB-CG2 4.08Å; V159-V242 HydrophobicContact CG1-CB 3.91Å; V159-V242 HydrophobicContact CG1-CG1 3.53Å; V159-V242 HydrophobicContact CG1-CG2 4.36Å; V159-V242 HydrophobicContact CG2-CB 4.43Å; V159-V242 HydrophobicContact CG2-CG2 4.12Å; I161-V242 HydrophobicContact CG2-CG1 3.63Å; I172-V242 HydrophobicContact CG2-CG1 4.43Å; I172-V242 HydrophobicContact CG2-CG2 4.43Å; L176-V242 HydrophobicContact CD1-CG2 3.64Å; I200-V242 HydrophobicContact CB-CG2 4.36Å; I200-V242 HydrophobicContact CG1-CG1 4.11Å; I200-V242 HydrophobicContact CG2-CG2 4.08Å; I238-V242 HydrophobicContact CG2-CG2 4.42Å; I238-V242 WeakPolarHBondContact O-CG2 3.16Å; I238-V242 PolarHBondContact O-N 3.48Å; M239-V242 PolarHBondContact O-N 3.22Å; V242-E244 VanDerWaalsContact C-N 3.35Å; V242-E244 PolarHBondContact O-N 2.64Å; V242-L245 PolarHBondContact O-N 3.01Å; V242-A246 WeakPolarHBondContact O-CB 3.31Å; V242-A246 PolarHBondContact O-N 2.77Å; V242-V253 HydrophobicContact CG1-CG2 4.33Å
243	A	96.6	Very high	94.7	Very high	41 Å²	41	44.9 Å²	44.9	34%	0.339	29%	0.291	S	S	.	.	H	α-helix	trans	-60.7	-43	180	0	0	0	0	0	112.3	M239 A240 G247 V253	M239-A243 WeakPolarHBondContact O-CB 3.49Å; M239-A243 PolarHBondContact O-N 3.36Å; A240-A243 PolarHBondContact O-N 3.32Å; A243-G247 PolarHBondContact O-N 3.25Å; A243-V253 HydrophobicContact CB-CG2 3.74Å
244	E	96.1	Very high	94.7	Very high	88 Å²	88	50.2 Å²	50.2	41%	0.411	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-50.9	175.4	-176.3	-171.3	147.8	0	0	111.9	A240 R241 V242 A246 G247 Q248	A240-E244 WeakPolarHBondContact O-CB 3.3Å; A240-E244 PolarHBondContact O-N 2.95Å; R241-E244 IonicContact CZ-OE1 2.72Å; R241-E244 IonicContact CZ-OE2 3.01Å; R241-E244 IonicContact NH1-OE1 3.78Å; R241-E244 PolarHBondContact NH1-OE1 3.23Å; R241-E244 IonicContact NH1-OE2 3.06Å; R241-E244 PolarHBondContact NH1-OE2 3.07Å; V242-E244 VanDerWaalsContact C-N 3.35Å; V242-E244 PolarHBondContact O-N 2.64Å; E244-A246 VanDerWaalsContact C-N 3.33Å; E244-A246 PolarHBondContact O-N 2.95Å; E244-G247 PolarHBondContact O-N 3.05Å; E244-Q248 WeakPolarHBondContact O-CG 3.33Å; E244-Q248 PolarHBondContact O-N 3.15Å
245	L	96.4	Very high	94.5	Very high	18 Å²	18	50.5 Å²	50.5	9%	0.094	32%	0.322	C	S	.	.	H	α-helix	trans	-67.5	-32.3	-178.4	-68.1	168.4	0	0	0	112.9	I172 A175 L176 R241 V242 Q249	I172-L245 HydrophobicContact CG1-CB 4.01Å; I172-L245 HydrophobicContact CG2-CB 4.13Å; I172-L245 HydrophobicContact CG2-CD1 4.1Å; A175-L245 HydrophobicContact CB-CD1 3.87Å; A175-L245 HydrophobicContact CB-CD2 4.03Å; L176-L245 HydrophobicContact CD2-CD1 4.12Å; L176-L245 HydrophobicContact CG-CD1 4.03Å; R241-L245 WeakPolarHBondContact O-CB 3.43Å; R241-L245 WeakPolarHBondContact O-CD1 3.46Å; R241-L245 VanDerWaalsContact O-CG 3.25Å; R241-L245 WeakPolarHBondContact O-CG 3.19Å; R241-L245 PolarHBondContact O-N 2.98Å; R241-L245 VanDerWaalsContact O-N 3.09Å; V242-L245 PolarHBondContact O-N 3.01Å; L245-Q249 PolarHBondContact O-NE2 2.77Å
246	A	96.9	Very high	94.2	Very high	0 Å²	0	52 Å²	52	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-71.2	-43.8	173	0	0	0	0	0	111	I161 I172 V242 E244 Q248 Q249 G250 V251	I161-A246 HydrophobicContact CG2-CB 4.09Å; I172-A246 HydrophobicContact CD1-CB 3.94Å; V242-A246 WeakPolarHBondContact O-CB 3.31Å; V242-A246 PolarHBondContact O-N 2.77Å; E244-A246 VanDerWaalsContact C-N 3.33Å; E244-A246 PolarHBondContact O-N 2.95Å; A246-Q248 VanDerWaalsContact C-N 3.31Å; A246-Q248 PolarHBondContact O-N 3Å; A246-Q249 CarbonylContact O-C 3.59Å; A246-Q249 WeakPolarHBondContact O-CA 3.43Å; A246-Q249 PolarHBondContact O-N 2.93Å; A246-G250 PolarHBondContact O-N 3.03Å; A246-V251 CarbonylContact C-O 3.3Å; A246-V251 HydrophobicContact CB-CB 4.27Å; A246-V251 HydrophobicContact CB-CG1 4.43Å; A246-V251 WeakPolarHBondContact CB-O 3.39Å; A246-V251 PolarHBondContact O-N 2.76Å
247	G	97.3	Very high	93.9	Very high	47 Å²	47	50.8 Å²	50.8	49%	0.485	32%	0.318	S	S	.	.	H	α-helix	trans	-61.1	-36.6	177.9	0	0	0	0	0	113.2	A243 E244 Q249 G250 V251	A243-G247 PolarHBondContact O-N 3.25Å; E244-G247 PolarHBondContact O-N 3.05Å; G247-Q249 PolarHBondContact O-N 2.72Å; G247-Q249 VanDerWaalsContact O-N 3.15Å; G247-G250 PolarHBondContact O-N 3.09Å; G247-V251 PolarHBondContact N-O 3.13Å
248	Q	96.6	Very high	93.4	Very high	133 Å²	133	52.1 Å²	52.1	62%	0.621	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.5	171.7	-71.5	169.3	9.4	0	0	113.4	E244 A246	E244-Q248 WeakPolarHBondContact O-CG 3.33Å; E244-Q248 PolarHBondContact O-N 3.15Å; A246-Q248 VanDerWaalsContact C-N 3.31Å; A246-Q248 PolarHBondContact O-N 3Å
249	Q	96.6	Very high	92.8	Very high	78 Å²	78	52.7 Å²	52.7	36%	0.364	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	10.1	177.7	-65.1	177.5	80	0	0	112.4	V168 L245 A246 G247 V251	V168-Q249 HydrophobicContact CG1-CB 4.4Å; L245-Q249 PolarHBondContact O-NE2 2.77Å; A246-Q249 CarbonylContact O-C 3.59Å; A246-Q249 WeakPolarHBondContact O-CA 3.43Å; A246-Q249 PolarHBondContact O-N 2.93Å; G247-Q249 PolarHBondContact O-N 2.72Å; G247-Q249 VanDerWaalsContact O-N 3.15Å; Q249-V251 VanDerWaalsContact C-N 3.31Å; Q249-V251 PolarHBondContact O-N 3.46Å
250	G	96.6	Very high	92.4	Very high	75 Å²	75	49.7 Å²	49.7	77%	0.773	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	20.6	179.8	0	0	0	0	0	114.5	A246 G247	A246-G250 PolarHBondContact O-N 3.03Å; G247-G250 PolarHBondContact O-N 3.09Å
251	V	96.8	Very high	92.3	Very high	19 Å²	19	48.1 Å²	48.1	12%	0.115	30%	0.301	C	S	.	.			trans	-111.1	136.7	-178.7	176	0	0	0	0	110.4	I161 T163 V168 A246 G247 Q249	I161-V251 HydrophobicContact CB-CG1 3.98Å; T163-V251 HydrophobicContact CG2-CG1 3.98Å; T163-V251 HydrophobicContact CG2-CG2 4.43Å; V168-V251 HydrophobicContact CG1-CG2 4.2Å; A246-V251 CarbonylContact C-O 3.3Å; A246-V251 HydrophobicContact CB-CB 4.27Å; A246-V251 HydrophobicContact CB-CG1 4.43Å; A246-V251 WeakPolarHBondContact CB-O 3.39Å; A246-V251 PolarHBondContact O-N 2.76Å; G247-V251 PolarHBondContact N-O 3.13Å; Q249-V251 VanDerWaalsContact C-N 3.31Å; Q249-V251 PolarHBondContact O-N 3.46Å
252	G	95.3	Very high	92	Very high	40 Å²	40	46 Å²	46	41%	0.412	30%	0.296	S	S	.	.			trans	-87.2	167.9	175.7	0	0	0	0	0	113.6	I161 D162	I161-G252 CarbonylContact C-O 3.58Å; I161-G252 WeakPolarHBondContact CA-O 3.38Å; D162-G252 PolarHBondContact N-O 2.87Å
253	V	95	Very high	91.6	Very high	45 Å²	45	46.4 Å²	46.4	27%	0.273	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.1	169.3	172.9	0	0	0	0	109	V159 I161 M239 V242 A243	V159-V253 HydrophobicContact CG1-CG1 3.7Å; V159-V253 HydrophobicContact CG1-CG2 4.32Å; I161-V253 HydrophobicContact CG2-CG2 4.3Å; M239-V253 HydrophobicContact CE-CG1 4.4Å; V242-V253 HydrophobicContact CG1-CG2 4.33Å; A243-V253 HydrophobicContact CB-CG2 3.74Å
254	K	90.7	Very high	91.3	Very high	112 Å²	112	48.1 Å²	48.1	49%	0.487	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-37.7	175.3	-71.8	-173.1	171.4	168.1	0	112.5	S160 D162 A197	S160-K254 PolarHBondContact O-N 3.11Å; D162-K254 HydrophobicContact CB-CD 4.44Å; D162-K254 HydrophobicContact CB-CG 3.94Å; D162-K254 WeakPolarHBondContact OD1-CE 3.4Å; D162-K254 IonicContact OD1-NZ 3.13Å; D162-K254 PolarHBondContact OD1-NZ 2.79Å; D162-K254 VanDerWaalsContact OD1-NZ 3.13Å; A197-K254 HydrophobicContact CB-CD 4.09Å
255	G	87.1	Confident	91	Very high	29 Å²	29	48.5 Å²	48.5	30%	0.299	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175	174.1	-176.9	0	0	0	0	0	113	S160	S160-G255 PolarHBondContact N-O 3.06Å
256	T	85.9	Confident	90.9	Very high	54 Å²	54	47.7 Å²	47.7	33%	0.331	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.4	176.9	-59.2	0	0	0	0	108.8	N158 V159 M239	N158-T256 CarbonylContact O-C 3.48Å; N158-T256 VanDerWaalsContact O-CA 3.28Å; N158-T256 WeakPolarHBondContact O-CA 3.27Å; V159-T256 HydrophobicContact CG2-CG2 4.07Å; M239-T256 HydrophobicContact CB-CG2 4.47Å; M239-T256 WeakPolarHBondContact CG-OG1 3.21Å; M239-T256 PolarHBondContact SD-OG1 3.1Å
257	A	83.1	Confident	90.7	Very high	46 Å²	46	50.9 Å²	50.9	38%	0.38	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	132	176.9	0	0	0	0	0	110.2	N158	N158-A257 PolarHBondContact N-O 3.32Å; N158-A257 PolarHBondContact O-N 2.88Å
258	L	82.4	Confident	90.5	Very high	67 Å²	67	50.4 Å²	50.4	35%	0.351	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	125.1	163.4	-72.9	177.6	0	0	0	108.4	M155 N156 C157 A235 G260 T262	M155-L258 HydrophobicContact CG-CD2 3.99Å; M155-L258 HydrophobicContact SD-CD2 3.67Å; N156-L258 WeakPolarHBondContact O-CD2 3.23Å; C157-L258 HydrophobicContact CB-CD2 4.06Å; A235-L258 HydrophobicContact CB-CD2 3.78Å; A235-L258 HydrophobicContact CB-CG 4.47Å; L258-G260 PolarHBondContact O-N 3.4Å; L258-T262 HydrophobicContact CD1-CG2 4.31Å
259	V	80.4	Confident	90.4	Very high	13 Å²	13	46 Å²	46	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	96.5	173.8	178.4	0	0	0	0	107.8	F12 N156	F12-V259 HydrophobicContact CB-CG1 4.08Å; F12-V259 HydrophobicContact CD1-CG1 3.61Å; F12-V259 HydrophobicContact CD2-CG1 4.17Å; F12-V259 HydrophobicContact CD2-CG2 4.49Å; F12-V259 HydrophobicContact CE1-CG1 4.03Å; F12-V259 HydrophobicContact CE1-CG2 4.31Å; F12-V259 HydrophobicContact CE2-CG2 4.18Å; F12-V259 HydrophobicContact CG-CG1 3.69Å; F12-V259 HydrophobicContact CZ-CG1 4.49Å; F12-V259 HydrophobicContact CZ-CG2 4.08Å; N156-V259 HydrophobicContact CB-CB 3.8Å; N156-V259 PolarHBondContact O-N 2.94Å
260	G	86.2	Confident	90.2	Very high	16 Å²	16	42.5 Å²	42.5	17%	0.165	27%	0.273	C	S	.	.	S	Bend	trans	99.2	-131.6	-171.2	0	0	0	0	0	111.3	L258	L258-G260 PolarHBondContact O-N 3.4Å
261	F	90.7	Very high	90	Very high	20 Å²	20	44.8 Å²	44.8	9%	0.088	26%	0.264	C	S	.	.			trans	-139.3	157.5	-169.7	-54.3	-67.5	0	0	0	111.7	L9 N10 T23 E265 C266 L269	L9-F261 HydrophobicContact CB-CE2 3.77Å; L9-F261 HydrophobicContact CB-CZ 4.33Å; L9-F261 HydrophobicContact CD1-CE2 4.4Å; N10-F261 HydrophobicContact CB-CE2 3.62Å; N10-F261 HydrophobicContact CB-CZ 3.71Å; T23-F261 HydrophobicContact CG2-CD2 4.26Å; T23-F261 HydrophobicContact CG2-CE2 4.27Å; F261-E265 HydrophobicContact CB-CB 4.11Å; F261-E265 HydrophobicContact CD1-CB 4.46Å; F261-C266 HydrophobicContact CB-CB 3.78Å; F261-C266 HydrophobicContact CD2-CB 4.32Å; F261-C266 HydrophobicContact CG-CB 4.35Å; F261-L269 HydrophobicContact CD1-CD1 3.72Å; F261-L269 HydrophobicContact CE1-CD1 3.36Å; F261-L269 HydrophobicContact CG-CD1 4.44Å; F261-L269 HydrophobicContact CZ-CD1 3.8Å
262	T	89.4	Confident	89.8	Confident	24 Å²	24	47.2 Å²	47.2	15%	0.147	28%	0.276	C	S	.	.			trans	-66.1	160.1	156.6	62.5	0	0	0	0	110.4	M155 L258 Q264 E265 C266	M155-T262 HydrophobicContact SD-CG2 4.07Å; L258-T262 HydrophobicContact CD1-CG2 4.31Å; T262-Q264 VanDerWaalsContact C-N 3.26Å; T262-Q264 PolarHBondContact O-N 3.08Å; T262-E265 WeakPolarHBondContact CB-OE2 3.48Å; T262-E265 WeakPolarHBondContact CG2-OE2 3.41Å; T262-E265 PolarHBondContact N-OE2 2.84Å; T262-E265 PolarHBondContact O-N 3.1Å; T262-E265 WeakPolarHBondContact OG1-CB 3.48Å; T262-E265 WeakPolarHBondContact OG1-CG 3.44Å; T262-E265 PolarHBondContact OG1-N 3.49Å; T262-E265 PolarHBondContact OG1-OE2 2.91Å; T262-C266 WeakPolarHBondContact O-CB 3.09Å; T262-C266 PolarHBondContact O-N 3.18Å
263	P	88.6	Confident	89.8	Confident	9 Å²	9	45.3 Å²	45.3	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-54.4	-42.1	177.6	-24.3	31.6	0	0	0	113	Y153 F223 M267	Y153-P263 HydrophobicContact CD1-CB 4.24Å; Y153-P263 HydrophobicContact CD1-CG 3.67Å; Y153-P263 HydrophobicContact CD2-CB 4.4Å; Y153-P263 HydrophobicContact CE1-CG 4.33Å; Y153-P263 HydrophobicContact CG-CB 4.07Å; Y153-P263 HydrophobicContact CG-CG 3.85Å; F223-P263 HydrophobicContact CD1-CG 4.32Å; F223-P263 HydrophobicContact CE1-CG 4.29Å; P263-M267 WeakPolarHBondContact O-CB 3.2Å; P263-M267 PolarHBondContact O-N 3.38Å
264	Q	88.6	Confident	89.6	Confident	77 Å²	77	45.7 Å²	45.7	36%	0.36	26%	0.256	S	S	.	.	H	α-helix	trans	-69.9	-43.9	-178.5	-66	78.3	9	0	0	112.2	R222 T262 M267 G268	R222-Q264 PolarHBondContact O-NE2 3.24Å; R222-Q264 VanDerWaalsContact O-NE2 3.09Å; T262-Q264 VanDerWaalsContact C-N 3.26Å; T262-Q264 PolarHBondContact O-N 3.08Å; Q264-M267 PolarHBondContact O-N 3.01Å; Q264-G268 PolarHBondContact O-N 3.2Å
265	E	91.6	Very high	89.6	Confident	96 Å²	96	45 Å²	45	45%	0.449	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-43.3	174.4	-72.1	162.8	155.1	0	0	111.3	F261 T262 M267 G268 L269	F261-E265 HydrophobicContact CB-CB 4.11Å; F261-E265 HydrophobicContact CD1-CB 4.46Å; T262-E265 WeakPolarHBondContact CB-OE2 3.48Å; T262-E265 WeakPolarHBondContact CG2-OE2 3.41Å; T262-E265 PolarHBondContact N-OE2 2.84Å; T262-E265 PolarHBondContact O-N 3.1Å; T262-E265 WeakPolarHBondContact OG1-CB 3.48Å; T262-E265 WeakPolarHBondContact OG1-CG 3.44Å; T262-E265 PolarHBondContact OG1-N 3.49Å; T262-E265 PolarHBondContact OG1-OE2 2.91Å; E265-M267 VanDerWaalsContact C-N 3.26Å; E265-M267 PolarHBondContact O-N 2.91Å; E265-G268 PolarHBondContact O-N 3.08Å; E265-L269 WeakPolarHBondContact O-CB 3.45Å; E265-L269 VanDerWaalsContact O-CG 3.3Å; E265-L269 WeakPolarHBondContact O-CG 3.19Å; E265-L269 PolarHBondContact O-N 3.08Å
266	C	93.8	Very high	89.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.014	28%	0.279	C	S	.	.	H	α-helix	trans	-58.6	-42.2	177.5	-167.1	0	0	0	0	111.2	L69 Y153 F261 T262 A270	L69-C266 HydrophobicContact CD1-CB 4.16Å; Y153-C266 HydrophobicContact CE2-CB 4.06Å; Y153-C266 VanDerWaalsContact OH-CB 3.3Å; Y153-C266 WeakPolarHBondContact OH-CB 3.23Å; Y153-C266 PolarHBondContact OH-SG 2.96Å; F261-C266 HydrophobicContact CB-CB 3.78Å; F261-C266 HydrophobicContact CD2-CB 4.32Å; F261-C266 HydrophobicContact CG-CB 4.35Å; T262-C266 WeakPolarHBondContact O-CB 3.09Å; T262-C266 PolarHBondContact O-N 3.18Å; C266-A270 WeakPolarHBondContact O-CB 3.4Å; C266-A270 PolarHBondContact O-N 3.34Å
267	M	92.4	Very high	90.1	Very high	67 Å²	67	48.4 Å²	48.4	33%	0.33	28%	0.277	S	S	.	.	H	α-helix	trans	-65.8	-51.1	179	-169.8	174.6	74.7	0	0	111.4	L69 P263 Q264 E265 L269 A270 E271	L69-M267 HydrophobicContact CD1-CB 3.9Å; L69-M267 HydrophobicContact CG-CB 4.17Å; L69-M267 HydrophobicContact CG-CG 4.37Å; P263-M267 WeakPolarHBondContact O-CB 3.2Å; P263-M267 PolarHBondContact O-N 3.38Å; Q264-M267 PolarHBondContact O-N 3.01Å; E265-M267 VanDerWaalsContact C-N 3.26Å; E265-M267 PolarHBondContact O-N 2.91Å; M267-L269 VanDerWaalsContact C-N 3.34Å; M267-L269 PolarHBondContact O-N 3.42Å; M267-A270 WeakPolarHBondContact O-CB 3.33Å; M267-A270 PolarHBondContact O-N 3.3Å; M267-E271 WeakPolarHBondContact O-CG 3.26Å; M267-E271 PolarHBondContact O-N 3.31Å
268	G	93.3	Very high	90.5	Very high	36 Å²	36	47.1 Å²	47.1	37%	0.371	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-40.8	-179.4	0	0	0	0	0	113	Q264 E265 L272	Q264-G268 PolarHBondContact O-N 3.2Å; E265-G268 PolarHBondContact O-N 3.08Å; G268-L272 WeakPolarHBondContact O-CB 3.29Å; G268-L272 PolarHBondContact O-N 3.03Å; G268-L272 VanDerWaalsContact O-N 3.1Å
269	L	93.8	Very high	90.9	Very high	41 Å²	41	44.7 Å²	44.7	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-69.5	-36.7	175.9	-66.4	176.2	0	0	0	112.4	L9 F261 E265 M267 A273 F281	L9-L269 HydrophobicContact CD1-CB 4.31Å; L9-L269 HydrophobicContact CD2-CB 4.41Å; F261-L269 HydrophobicContact CD1-CD1 3.72Å; F261-L269 HydrophobicContact CE1-CD1 3.36Å; F261-L269 HydrophobicContact CG-CD1 4.44Å; F261-L269 HydrophobicContact CZ-CD1 3.8Å; E265-L269 WeakPolarHBondContact O-CB 3.45Å; E265-L269 VanDerWaalsContact O-CG 3.3Å; E265-L269 WeakPolarHBondContact O-CG 3.19Å; E265-L269 PolarHBondContact O-N 3.08Å; M267-L269 VanDerWaalsContact C-N 3.34Å; M267-L269 PolarHBondContact O-N 3.42Å; L269-A273 VanDerWaalsContact O-CB 3.23Å; L269-A273 WeakPolarHBondContact O-CB 3.33Å; L269-A273 PolarHBondContact O-N 3.47Å; L269-F281 HydrophobicContact CB-CE1 4.32Å; L269-F281 HydrophobicContact CD2-CE1 3.88Å; L269-F281 HydrophobicContact CD2-CZ 3.94Å; L269-F281 HydrophobicContact CG-CE1 4.48Å
270	A	93.4	Very high	91.5	Very high	5 Å²	5	48.5 Å²	48.5	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-47.8	174.1	0	0	0	0	0	111.9	L9 V25 L69 C266 M267 L272 A273 L274	L9-A270 HydrophobicContact CD1-CB 4.09Å; V25-A270 HydrophobicContact CB-CB 4.14Å; V25-A270 HydrophobicContact CG1-CB 3.63Å; V25-A270 HydrophobicContact CG2-CB 4.27Å; L69-A270 HydrophobicContact CD2-CB 4.01Å; C266-A270 WeakPolarHBondContact O-CB 3.4Å; C266-A270 PolarHBondContact O-N 3.34Å; M267-A270 WeakPolarHBondContact O-CB 3.33Å; M267-A270 PolarHBondContact O-N 3.3Å; A270-L272 PolarHBondContact O-N 3.19Å; A270-A273 PolarHBondContact O-N 3.04Å; A270-L274 VanDerWaalsContact O-CB 3.26Å; A270-L274 WeakPolarHBondContact O-CB 3.44Å; A270-L274 WeakPolarHBondContact O-CG 3.34Å; A270-L274 PolarHBondContact O-N 3.09Å
271	E	92.6	Very high	91.8	Very high	123 Å²	123	47.9 Å²	47.9	58%	0.575	27%	0.265	S	S	*	.	H	α-helix	trans	-58.9	-47.8	178.7	-73.6	175.3	168.4	0	0	111.1	M267 S275	M267-E271 WeakPolarHBondContact O-CG 3.26Å; M267-E271 PolarHBondContact O-N 3.31Å; E271-S275 WeakPolarHBondContact O-CB 3.29Å; E271-S275 PolarHBondContact O-N 2.98Å; E271-S275 PolarHBondContact O-OG 3.43Å; E271-S275 VanDerWaalsContact O-OG 3.09Å
272	L	92.8	Very high	91.8	Very high	70 Å²	70	49.4 Å²	49.4	37%	0.366	27%	0.27	S	S	.	.	H	α-helix	trans	-56.5	-59.3	174.6	179.4	63.2	0	0	0	111.2	G268 A270 L274 S275 E276 F281	G268-L272 WeakPolarHBondContact O-CB 3.29Å; G268-L272 PolarHBondContact O-N 3.03Å; G268-L272 VanDerWaalsContact O-N 3.1Å; A270-L272 PolarHBondContact O-N 3.19Å; L272-L274 VanDerWaalsContact C-N 3.34Å; L272-L274 PolarHBondContact O-N 3.39Å; L272-S275 PolarHBondContact O-N 2.95Å; L272-S275 PolarHBondContact O-OG 3.34Å; L272-E276 HydrophobicContact CD1-CG 4.34Å; L272-E276 PolarHBondContact O-N 3.04Å; L272-E276 VanDerWaalsContact O-N 3.08Å; L272-F281 HydrophobicContact CD2-CE2 4.15Å; L272-F281 HydrophobicContact CD2-CZ 4.19Å; L272-F281 HydrophobicContact CG-CE2 4.46Å
273	A	93.3	Very high	91.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.4	-43.2	-175.8	0	0	0	0	0	112.8	T7 L9 L269 A270 G277 I278 F281	T7-A273 HydrophobicContact CG2-CB 3.99Å; L9-A273 HydrophobicContact CD2-CB 3.93Å; L269-A273 VanDerWaalsContact O-CB 3.23Å; L269-A273 WeakPolarHBondContact O-CB 3.33Å; L269-A273 PolarHBondContact O-N 3.47Å; A270-A273 PolarHBondContact O-N 3.04Å; A273-G277 PolarHBondContact O-N 3.23Å; A273-I278 HydrophobicContact CB-CB 4.46Å; A273-I278 PolarHBondContact O-N 3.33Å; A273-F281 HydrophobicContact CB-CB 3.92Å; A273-F281 HydrophobicContact CB-CD2 3.48Å; A273-F281 VanDerWaalsContact CB-CD2 3.48Å; A273-F281 HydrophobicContact CB-CE2 4.15Å; A273-F281 HydrophobicContact CB-CG 3.77Å
274	L	91.4	Very high	91.3	Very high	53 Å²	53	58.3 Å²	58.3	28%	0.277	30%	0.303	S	S	.	.	H	α-helix	trans	-71.2	-40.1	-179.7	-67.6	173.8	0	0	0	111.7	T7 A270 L272 E276 G277	T7-L274 HydrophobicContact CG2-CD2 4.03Å; T7-L274 HydrophobicContact CG2-CG 4.19Å; A270-L274 VanDerWaalsContact O-CB 3.26Å; A270-L274 WeakPolarHBondContact O-CB 3.44Å; A270-L274 WeakPolarHBondContact O-CG 3.34Å; A270-L274 PolarHBondContact O-N 3.09Å; L272-L274 VanDerWaalsContact C-N 3.34Å; L272-L274 PolarHBondContact O-N 3.39Å; L274-E276 VanDerWaalsContact C-N 3.27Å; L274-E276 PolarHBondContact O-N 3.34Å; L274-G277 PolarHBondContact O-N 3.41Å; L274-G277 VanDerWaalsContact O-N 3.1Å
275	S	91.3	Very high	90.3	Very high	98 Å²	98	55.7 Å²	55.7	69%	0.685	29%	0.291	S	S	*	.	H	α-helix	trans	-63.7	-32.6	177.5	73.1	0	0	0	0	113	E271 L272	E271-S275 WeakPolarHBondContact O-CB 3.29Å; E271-S275 PolarHBondContact O-N 2.98Å; E271-S275 PolarHBondContact O-OG 3.43Å; E271-S275 VanDerWaalsContact O-OG 3.09Å; L272-S275 PolarHBondContact O-N 2.95Å; L272-S275 PolarHBondContact O-OG 3.34Å
276	E	91.6	Very high	88.6	Confident	125 Å²	125	58.8 Å²	58.8	58%	0.584	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-3.8	176.6	-63.5	-171.6	167.9	0	0	112.8	L272 L274 I278	L272-E276 HydrophobicContact CD1-CG 4.34Å; L272-E276 PolarHBondContact O-N 3.04Å; L272-E276 VanDerWaalsContact O-N 3.08Å; L274-E276 VanDerWaalsContact C-N 3.27Å; L274-E276 PolarHBondContact O-N 3.34Å; E276-I278 VanDerWaalsContact C-N 3.31Å; E276-I278 HydrophobicContact CB-CD1 3.72Å; E276-I278 HydrophobicContact CB-CG1 3.86Å; E276-I278 PolarHBondContact O-N 3.27Å; E276-I278 WeakPolarHBondContact OE2-CD1 3.25Å
277	G	90.8	Very high	86.2	Confident	28 Å²	28	68.6 Å²	68.6	29%	0.289	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	23.2	-179.7	0	0	0	0	0	114.2	Q2 A273 L274 G279	Q2-G277 PolarHBondContact NE2-O 2.84Å; A273-G277 PolarHBondContact O-N 3.23Å; L274-G277 PolarHBondContact O-N 3.41Å; L274-G277 VanDerWaalsContact O-N 3.1Å; G277-G279 PolarHBondContact O-N 3.5Å
278	I	92.4	Very high	83.8	Confident	19 Å²	19	70.7 Å²	70.7	10%	0.097	35%	0.347	C	S	.	.			trans	-80.5	107.7	-177.3	-58	165.1	0	0	0	109.9	T7 A273 E276 F281 E284	T7-I278 VanDerWaalsContact CB-O 3.23Å; T7-I278 WeakPolarHBondContact CB-O 3.27Å; T7-I278 PolarHBondContact OG1-O 3.01Å; A273-I278 HydrophobicContact CB-CB 4.46Å; A273-I278 PolarHBondContact O-N 3.33Å; E276-I278 VanDerWaalsContact C-N 3.31Å; E276-I278 HydrophobicContact CB-CD1 3.72Å; E276-I278 HydrophobicContact CB-CG1 3.86Å; E276-I278 PolarHBondContact O-N 3.27Å; E276-I278 WeakPolarHBondContact OE2-CD1 3.25Å; I278-F281 HydrophobicContact CB-CD2 4.36Å; I278-F281 HydrophobicContact CD1-CD2 4.1Å; I278-F281 HydrophobicContact CD1-CE2 4.41Å; I278-F281 HydrophobicContact CG2-CB 3.97Å; I278-F281 HydrophobicContact CG2-CD2 4.06Å; I278-E284 WeakPolarHBondContact CD1-OE2 3.33Å; I278-E284 WeakPolarHBondContact CG2-OE1 3.4Å
279	G	91.7	Very high	81	Confident	16 Å²	16	76.1 Å²	76.1	17%	0.165	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-28.6	-179.7	0	0	0	0	0	114.4	T7 V8 G277	T7-G279 WeakPolarHBondContact CA-O 3.24Å; V8-G279 PolarHBondContact N-O 2.96Å; G277-G279 PolarHBondContact O-N 3.5Å
280	E	92.6	Very high	78	Confident	94 Å²	94	84.4 Å²	84.4	44%	0.439	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	51.7	-177.7	-64.7	-169.8	111.6	0	0	111.2	W282 R283	E280-W282 PolarHBondContact O-N 3.17Å; E280-W282 VanDerWaalsContact O-N 3.1Å; E280-R283 HydrophobicContact CB-CG 4.18Å; E280-R283 WeakPolarHBondContact O-CB 3.36Å; E280-R283 PolarHBondContact O-N 3.07Å; E280-R283 IonicContact OE1-CZ 3.69Å; E280-R283 IonicContact OE1-NE 2.6Å; E280-R283 PolarHBondContact OE1-NE 3.38Å; E280-R283 IonicContact OE1-NH2 3.92Å; E280-R283 PolarHBondContact OE1-NH2 3.09Å; E280-R283 IonicContact OE2-CZ 3.55Å; E280-R283 IonicContact OE2-NE 3.6Å; E280-R283 PolarHBondContact OE2-NE 2.94Å; E280-R283 IonicContact OE2-NH2 3.82Å; E280-R283 PolarHBondContact OE2-NH2 2.61Å
281	F	92.8	Very high	77.2	Confident	3 Å²	3	88.4 Å²	88.4	1%	0.013	42%	0.421	C	S	.	.	H	α-helix	trans	-57.1	-30.2	-173.8	-171.6	-93.8	0	0	0	113.4	V8 L9 L269 L272 A273 I278 R283 E284 Q285	V8-F281 PolarHBondContact O-N 3.4Å; V8-F281 VanDerWaalsContact O-N 3.15Å; L9-F281 HydrophobicContact CD2-CB 4.03Å; L9-F281 HydrophobicContact CD2-CD1 3.91Å; L9-F281 HydrophobicContact CD2-CG 4.08Å; L269-F281 HydrophobicContact CB-CE1 4.32Å; L269-F281 HydrophobicContact CD2-CE1 3.88Å; L269-F281 HydrophobicContact CD2-CZ 3.94Å; L269-F281 HydrophobicContact CG-CE1 4.48Å; L272-F281 HydrophobicContact CD2-CE2 4.15Å; L272-F281 HydrophobicContact CD2-CZ 4.19Å; L272-F281 HydrophobicContact CG-CE2 4.46Å; A273-F281 HydrophobicContact CB-CB 3.92Å; A273-F281 HydrophobicContact CB-CD2 3.48Å; A273-F281 VanDerWaalsContact CB-CD2 3.48Å; A273-F281 HydrophobicContact CB-CE2 4.15Å; A273-F281 HydrophobicContact CB-CG 3.77Å; I278-F281 HydrophobicContact CB-CD2 4.36Å; I278-F281 HydrophobicContact CD1-CD2 4.1Å; I278-F281 HydrophobicContact CD1-CE2 4.41Å; I278-F281 HydrophobicContact CG2-CB 3.97Å; I278-F281 HydrophobicContact CG2-CD2 4.06Å; F281-R283 PolarHBondContact O-N 3.47Å; F281-R283 VanDerWaalsContact O-N 3.08Å; F281-E284 WeakPolarHBondContact O-CA 3.29Å; F281-E284 WeakPolarHBondContact O-CB 3.19Å; F281-E284 PolarHBondContact O-N 2.97Å; F281-Q285 HydrophobicContact CD1-CG 3.74Å; F281-Q285 HydrophobicContact CE1-CG 3.49Å; F281-Q285 VanDerWaalsContact CE1-CG 3.49Å; F281-Q285 HydrophobicContact CZ-CG 4.49Å; F281-Q285 PolarHBondContact O-N 2.96Å
282	W	89.8	Confident	76.4	Confident	52 Å²	52	86.6 Å²	86.6	20%	0.197	41%	0.412	C	S	.	.	H	α-helix	trans	-53.9	-27.5	173.5	72.8	-88.1	0	0	0	114.2	V8 L9 I11 E280	V8-W282 HydrophobicContact CG1-CG 4.26Å; V8-W282 PolarHBondContact O-N 3.4Å; L9-W282 WeakPolarHBondContact O-CA 3.49Å; L9-W282 PolarHBondContact O-N 2.95Å; I11-W282 HydrophobicContact CD1-CD2 3.68Å; I11-W282 HydrophobicContact CD1-CE3 4.21Å; I11-W282 HydrophobicContact CD1-CG 4Å; I11-W282 HydrophobicContact CD1-CH2 4.42Å; I11-W282 HydrophobicContact CD1-CZ2 3.93Å; I11-W282 HydrophobicContact CG1-CB 4.34Å; I11-W282 HydrophobicContact CG1-CD2 4.01Å; I11-W282 HydrophobicContact CG1-CE3 4.49Å; I11-W282 HydrophobicContact CG1-CG 3.94Å; E280-W282 PolarHBondContact O-N 3.17Å; E280-W282 VanDerWaalsContact O-N 3.1Å
283	R	87.6	Confident	75.5	Confident	138 Å²	138	87.5 Å²	87.5	52%	0.521	42%	0.415	S	S	.	.	H	α-helix	trans	-74.5	-29.7	175.9	-63.5	-173.4	-176.5	-138.6	9.4	112.2	E280 F281	E280-R283 HydrophobicContact CB-CG 4.18Å; E280-R283 WeakPolarHBondContact O-CB 3.36Å; E280-R283 PolarHBondContact O-N 3.07Å; E280-R283 IonicContact OE1-CZ 3.69Å; E280-R283 IonicContact OE1-NE 2.6Å; E280-R283 PolarHBondContact OE1-NE 3.38Å; E280-R283 IonicContact OE1-NH2 3.92Å; E280-R283 PolarHBondContact OE1-NH2 3.09Å; E280-R283 IonicContact OE2-CZ 3.55Å; E280-R283 IonicContact OE2-NE 3.6Å; E280-R283 PolarHBondContact OE2-NE 2.94Å; E280-R283 IonicContact OE2-NH2 3.82Å; E280-R283 PolarHBondContact OE2-NH2 2.61Å; F281-R283 PolarHBondContact O-N 3.47Å; F281-R283 VanDerWaalsContact O-N 3.08Å
284	E	80.6	Confident	74.4	Confident	82 Å²	82	92.6 Å²	92.6	38%	0.383	44%	0.439	S	S	.	.	H	α-helix	trans	-84.3	-32.2	-178.4	-59.2	-169.1	-166.1	0	0	111.7	I278 F281 R286 R287 I288	I278-E284 WeakPolarHBondContact CD1-OE2 3.33Å; I278-E284 WeakPolarHBondContact CG2-OE1 3.4Å; F281-E284 WeakPolarHBondContact O-CA 3.29Å; F281-E284 WeakPolarHBondContact O-CB 3.19Å; F281-E284 PolarHBondContact O-N 2.97Å; E284-R286 PolarHBondContact O-N 2.82Å; E284-R286 VanDerWaalsContact O-N 3.16Å; E284-R287 WeakPolarHBondContact O-CA 3.27Å; E284-R287 WeakPolarHBondContact O-CB 3.36Å; E284-R287 PolarHBondContact O-N 2.83Å; E284-I288 PolarHBondContact O-N 3.42Å
285	Q	67.9	Low	73.4	Confident	21 Å²	21	95.1 Å²	95.1	10%	0.098	45%	0.449	C	S	.	.	H	α-helix	trans	-53.7	-36.7	174	-78.8	-162.9	-42.3	0	0	113.6	L9 F281 R287 I288 H289	L9-Q285 PolarHBondContact O-OE1 3.02Å; L9-Q285 VanDerWaalsContact O-OE1 3.11Å; F281-Q285 HydrophobicContact CD1-CG 3.74Å; F281-Q285 HydrophobicContact CE1-CG 3.49Å; F281-Q285 VanDerWaalsContact CE1-CG 3.49Å; F281-Q285 HydrophobicContact CZ-CG 4.49Å; F281-Q285 PolarHBondContact O-N 2.96Å; Q285-R287 PolarHBondContact O-N 2.87Å; Q285-I288 PolarHBondContact O-N 3.15Å; Q285-H289 PolarHBondContact O-N 3.19Å; Q285-H289 VanDerWaalsContact O-N 3.15Å; Q285-H289 PolarHBondContact O-ND1 3.43Å; Q285-H289 VanDerWaalsContact O-ND1 3.1Å
286	R	56	Low	72.2	Confident	162 Å²	162	94.9 Å²	94.9	61%	0.611	43%	0.434	S	S	*	.	H	α-helix	trans	-62	-21.7	176.5	-68.2	-172	178.9	-166	-1.4	113.1	E284 M290	E284-R286 PolarHBondContact O-N 2.82Å; E284-R286 VanDerWaalsContact O-N 3.16Å; R286-M290 VanDerWaalsContact O-CE 3.26Å; R286-M290 WeakPolarHBondContact O-CE 3.34Å; R286-M290 WeakPolarHBondContact O-CG 3.33Å
287	R	42.9	Very low	70.8	Confident	207 Å²	207	92.8 Å²	92.8	78%	0.781	42%	0.423	S	S	*	.	H	α-helix	trans	-89	-19.3	174.5	-62.2	178.2	86.6	154.5	3.2	113.1	E284 Q285	E284-R287 WeakPolarHBondContact O-CA 3.27Å; E284-R287 WeakPolarHBondContact O-CB 3.36Å; E284-R287 PolarHBondContact O-N 2.83Å; Q285-R287 PolarHBondContact O-N 2.87Å
288	I	40.5	Very low	69.3	Low	111 Å²	111	97.8 Å²	97.8	57%	0.569	43%	0.433	S	S	*	.	H	α-helix	trans	-90.7	-23.6	-177.5	-60.3	171.6	0	0	0	111.4	E284 Q285	E284-I288 PolarHBondContact O-N 3.42Å; Q285-I288 PolarHBondContact O-N 3.15Å
289	H	36.5	Very low	67.3	Low	151 Å²	151	104.3 Å²	104.3	70%	0.699	46%	0.461	S	S	*	.			trans	-108.5	19.1	179.7	-59.9	74.1	0	0	0	113.5	Q285	Q285-H289 PolarHBondContact O-N 3.19Å; Q285-H289 VanDerWaalsContact O-N 3.15Å; Q285-H289 PolarHBondContact O-ND1 3.43Å; Q285-H289 VanDerWaalsContact O-ND1 3.1Å
290	M	29.1	Very low	65.1	Low	215 Å²	215	112.4 Å²	112.4	100%	1.059	49%	0.488	S	S	*	.			trans	-104.2	0	167.5	-85.7	-165.6	-66.5	0	0	110.8	R286	R286-M290 VanDerWaalsContact O-CE 3.26Å; R286-M290 WeakPolarHBondContact O-CE 3.34Å; R286-M290 WeakPolarHBondContact O-CG 3.33Å

Retrieved 290 of 290 residues in 530.7 ms (Link to these results)

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