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Cytosolic arginine sensor for mTORC1 subunit 2

Functions as a negative regulator of the TORC1 signaling pathway through the GATOR complex. As part of homodimers or heterodimers with CASTOR1, directly binds and inhibits the GATOR subcomplex GATOR2 and thereby mTORC1. Does not directly bind arginine, but binding of arginine to CASTOR1 disrupts the interaction of CASTOR2-containing heterodimers with GATOR2 which can in turn activate mTORC1 and the TORC1 signaling pathway.

AlphaFold DB , UniProt , Accession A6NHX0, Species HUMAN (Homo sapiens, Human), Gene CASTOR2, Length 329 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	85.1	Confident	94.8	Very high	111 Å²	111	39 Å²	39	55%	0.547	18%	0.179	S	C	.	.				0	158	0	-71.3	173.2	-77.7	0	0	107.9	F143 T144	M1-F143 HydrophobicContact CB-CD1 3.57Å; M1-F143 HydrophobicContact CB-CE1 3.43Å; M1-F143 VanDerWaalsContact CB-CE1 3.43Å; M1-F143 HydrophobicContact CB-CZ 4.48Å; M1-F143 HydrophobicContact CE-CE1 4.15Å; M1-F143 HydrophobicContact CE-CZ 4.11Å; M1-F143 HydrophobicContact CG-CE1 4.35Å; M1-F143 HydrophobicContact SD-CE1 4.09Å; M1-F143 HydrophobicContact SD-CZ 4.44Å; M1-T144 PolarHBondContact O-N 2.93Å; M1-T144 VanDerWaalsContact O-N 3.14Å
2	E	91.1	Very high	95.1	Very high	73 Å²	73	35.8 Å²	35.8	34%	0.341	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	141.1	175.2	-64.4	179.4	-178.6	0	0	109.9	H4 V82 T144 L146	E2-H4 IonicContact OE2-CD2 2.59Å; E2-H4 IonicContact OE2-CE1 3.21Å; E2-H4 IonicContact OE2-NE2 2.96Å; E2-H4 PolarHBondContact OE2-NE2 3.1Å; E2-V82 HydrophobicContact CB-CB 4.41Å; E2-V82 PolarHBondContact N-O 3.43Å; E2-V82 PolarHBondContact O-N 3.1Å; E2-T144 WeakPolarHBondContact CA-O 3.28Å; E2-L146 HydrophobicContact CB-CD1 4.44Å; E2-L146 HydrophobicContact CG-CD1 4.25Å
3	L	94	Very high	95.4	Very high	1 Å²	1	33 Å²	33	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.1	169.7	-178.2	77.2	0	0	0	107.5	L79 V81 L139 F143 T144 I145 L146	L3-L79 HydrophobicContact CD1-CB 4.12Å; L3-V81 HydrophobicContact CD1-CG2 3.64Å; L3-L139 HydrophobicContact CD2-CB 4.26Å; L3-L139 HydrophobicContact CD2-CD1 3.57Å; L3-F143 HydrophobicContact CB-CB 3.82Å; L3-F143 HydrophobicContact CB-CD1 3.98Å; L3-F143 HydrophobicContact CB-CG 3.95Å; L3-T144 PolarHBondContact N-O 2.76Å; L3-I145 HydrophobicContact CB-CG1 4.47Å; L3-I145 HydrophobicContact CD2-CD1 4.36Å; L3-I145 HydrophobicContact CD2-CG1 4.32Å; L3-I145 HydrophobicContact CD2-CG2 4.38Å; L3-I145 WeakPolarHBondContact O-CA 3.3Å; L3-L146 PolarHBondContact O-N 3.3Å
4	H	94.7	Very high	95.6	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.125	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.8	-178.7	-72.1	-139.1	0	0	0	109.1	E2 L6 L79 N80 L146	E2-H4 IonicContact OE2-CD2 2.59Å; E2-H4 IonicContact OE2-CE1 3.21Å; E2-H4 IonicContact OE2-NE2 2.96Å; E2-H4 PolarHBondContact OE2-NE2 3.1Å; H4-L6 HydrophobicContact CB-CD2 4.3Å; H4-L79 CarbonylContact O-C 3.58Å; H4-L79 WeakPolarHBondContact O-CA 3.29Å; H4-N80 PolarHBondContact N-O 3.43Å; H4-N80 PolarHBondContact O-N 2.93Å; H4-L146 CarbonylContact C-O 3.49Å; H4-L146 WeakPolarHBondContact CA-O 3.5Å
5	I	96.5	Very high	95.7	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	111.4	166.7	-56.2	155.9	0	0	0	106.6	L77 L79 L132 T136 I145 L146 R147 V148 A156	I5-L77 HydrophobicContact CG2-CD1 4.27Å; I5-L79 HydrophobicContact CB-CD2 4.15Å; I5-L79 HydrophobicContact CG1-CD2 3.66Å; I5-L79 HydrophobicContact CG2-CD2 4.19Å; I5-L132 HydrophobicContact CD1-CD1 3.86Å; I5-L132 HydrophobicContact CG1-CD1 4.15Å; I5-L132 HydrophobicContact CG2-CD1 4.28Å; I5-T136 HydrophobicContact CD1-CG2 4.06Å; I5-I145 HydrophobicContact CD1-CG2 3.63Å; I5-I145 HydrophobicContact CG1-CG2 4.1Å; I5-L146 PolarHBondContact N-O 3.07Å; I5-R147 HydrophobicContact CB-CB 4.45Å; I5-R147 HydrophobicContact CB-CG 4.31Å; I5-R147 HydrophobicContact CG2-CG 4.48Å; I5-R147 WeakPolarHBondContact O-CA 3.26Å; I5-V148 PolarHBondContact O-N 3.15Å; I5-A156 HydrophobicContact CD1-CB 4Å
6	L	96.2	Very high	95.7	Very high	15 Å²	15	29.1 Å²	29.1	8%	0.079	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	157.3	-178.9	-53.3	-175.7	0	0	0	110.9	H4 H8 A78 N80 F124 V148	H4-L6 HydrophobicContact CB-CD2 4.3Å; L6-H8 PolarHBondContact O-N 3.05Å; L6-A78 HydrophobicContact CB-CB 4.35Å; L6-A78 WeakPolarHBondContact CB-O 3.48Å; L6-A78 HydrophobicContact CD1-CB 3.98Å; L6-A78 HydrophobicContact CG-CB 4.39Å; L6-A78 WeakPolarHBondContact CG-O 3.22Å; L6-A78 PolarHBondContact N-O 3.33Å; L6-N80 HydrophobicContact CD1-CB 4.5Å; L6-N80 HydrophobicContact CD2-CB 4.45Å; L6-F124 HydrophobicContact CD1-CD1 3.92Å; L6-F124 HydrophobicContact CD1-CE1 3.65Å; L6-V148 HydrophobicContact CD2-CG2 4.11Å
7	E	94.4	Very high	95.5	Very high	76 Å²	76	28.9 Å²	28.9	36%	0.355	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-10.8	-178.5	62.4	-172.9	180	0	0	113.9	R9 V148 N150 G151	E7-R9 PolarHBondContact O-N 2.86Å; E7-V148 WeakPolarHBondContact CB-O 3.33Å; E7-V148 HydrophobicContact CG-CG1 4.39Å; E7-N150 VanDerWaalsContact OE2-CA 3.26Å; E7-N150 WeakPolarHBondContact OE2-CA 3.37Å; E7-N150 PolarHBondContact OE2-N 3.44Å; E7-G151 PolarHBondContact OE2-N 3.11Å; E7-G151 VanDerWaalsContact OE2-N 3.15Å
8	H	95.6	Very high	95.4	Very high	11 Å²	11	35.7 Å²	35.7	5%	0.051	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	113.1	-176.7	-48.6	-57.1	0	0	0	110.9	L6 L10 F41 D56 E235	L6-H8 PolarHBondContact O-N 3.05Å; H8-L10 HydrophobicContact CB-CD2 3.67Å; H8-L10 HydrophobicContact CB-CG 4.19Å; H8-F41 HydrophobicContact CB-CB 4.17Å; H8-F41 HydrophobicContact CB-CD2 4.31Å; H8-F41 AromaticContact CD2-CD2 3.81Å; H8-D56 HydrophobicContact CB-CB 4.5Å; H8-E235 IonicContact CD2-OE1 3.06Å; H8-E235 IonicContact CE1-OE1 3.89Å; H8-E235 IonicContact NE2-OE1 2.82Å; H8-E235 PolarHBondContact NE2-OE1 3.12Å
9	R	98	Very high	95.4	Very high	85 Å²	85	34.2 Å²	34.2	32%	0.321	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	114.5	166.2	-66.5	179	78.3	-125.9	-7.8	107.8	E7 D56 E57 T75 L77 E129	E7-R9 PolarHBondContact O-N 2.86Å; R9-D56 CarbonylContact O-C 3.56Å; R9-D56 VanDerWaalsContact O-CA 3.26Å; R9-D56 WeakPolarHBondContact O-CA 3.12Å; R9-E57 HydrophobicContact CB-CG 3.9Å; R9-E57 IonicContact CZ-OE1 3.46Å; R9-E57 IonicContact CZ-OE2 3.28Å; R9-E57 IonicContact NH1-OE1 2.97Å; R9-E57 PolarHBondContact NH1-OE1 3.46Å; R9-E57 IonicContact NH1-OE2 2.93Å; R9-E57 PolarHBondContact NH1-OE2 3.38Å; R9-E57 IonicContact NH2-OE1 3.18Å; R9-E57 WeakPolarHBondContact O-CG 3.5Å; R9-E57 PolarHBondContact O-N 3.5Å; R9-T75 HydrophobicContact CB-CG2 3.84Å; R9-T75 HydrophobicContact CG-CG2 4.39Å; R9-L77 HydrophobicContact CG-CD2 3.92Å; R9-E129 IonicContact CZ-OE1 3.44Å; R9-E129 IonicContact CZ-OE2 2.77Å; R9-E129 IonicContact NE-OE1 3.15Å; R9-E129 PolarHBondContact NE-OE1 2.75Å; R9-E129 IonicContact NE-OE2 2.67Å; R9-E129 PolarHBondContact NE-OE2 3.04Å; R9-E129 VanDerWaalsContact NE-OE2 3.17Å; R9-E129 IonicContact NH2-OE1 2.75Å; R9-E129 IonicContact NH2-OE2 2.79Å; R9-E129 PolarHBondContact NH2-OE2 2.72Å
10	L	98.8	Very high	95.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	143.9	-167.1	-55.3	178.1	0	0	0	111.9	H8 F41 I54 V55 D56 W76 A78 L126	H8-L10 HydrophobicContact CB-CD2 3.67Å; H8-L10 HydrophobicContact CB-CG 4.19Å; L10-F41 HydrophobicContact CD1-CD1 3.94Å; L10-F41 HydrophobicContact CD1-CD2 4.25Å; L10-F41 HydrophobicContact CD1-CE1 3.78Å; L10-F41 HydrophobicContact CD1-CE2 4.1Å; L10-F41 HydrophobicContact CD1-CG 4.18Å; L10-F41 HydrophobicContact CD1-CZ 3.86Å; L10-F41 HydrophobicContact CD2-CB 3.61Å; L10-F41 HydrophobicContact CD2-CD1 3.61Å; L10-F41 HydrophobicContact CD2-CD2 4.16Å; L10-F41 HydrophobicContact CD2-CE1 4.32Å; L10-F41 HydrophobicContact CD2-CG 3.52Å; L10-F41 HydrophobicContact CG-CD1 4.45Å; L10-I54 HydrophobicContact CB-CG2 4.44Å; L10-I54 HydrophobicContact CD1-CG2 4.12Å; L10-V55 CarbonylContact C-O 3.58Å; L10-V55 WeakPolarHBondContact CA-O 3.45Å; L10-D56 HydrophobicContact CD2-CB 3.91Å; L10-W76 HydrophobicContact CB-CB 4.17Å; L10-W76 PolarHBondContact N-O 3.01Å; L10-W76 PolarHBondContact O-N 3.46Å; L10-A78 HydrophobicContact CD1-CB 3.95Å; L10-L126 HydrophobicContact CD1-CD1 4.39Å; L10-L126 HydrophobicContact CD1-CD2 3.79Å; L10-L126 HydrophobicContact CD1-CG 3.93Å
11	Q	98.5	Very high	95.4	Very high	28 Å²	28	35.1 Å²	35.1	13%	0.131	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.4	166.8	-61.3	-59	-35.2	0	0	109.1	I54 V55 F60 T75	Q11-I54 WeakPolarHBondContact O-CA 3.37Å; Q11-V55 PolarHBondContact N-O 2.82Å; Q11-V55 PolarHBondContact O-N 3.34Å; Q11-F60 HydrophobicContact CB-CD2 3.73Å; Q11-F60 HydrophobicContact CB-CE2 4.11Å; Q11-F60 HydrophobicContact CB-CG 4.24Å; Q11-F60 HydrophobicContact CG-CB 4.36Å; Q11-F60 HydrophobicContact CG-CD1 4.4Å; Q11-F60 HydrophobicContact CG-CD2 3.96Å; Q11-F60 HydrophobicContact CG-CE2 4.38Å; Q11-F60 HydrophobicContact CG-CG 3.98Å; Q11-T75 PolarHBondContact NE2-OG1 3.31Å
12	V	98.6	Very high	96	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.9	171.6	-177.2	0	0	0	0	107.8	T52 I53 I54 A72 W76 F115 L126 F276 F302	V12-T52 HydrophobicContact CG1-CG2 4.14Å; V12-I53 CarbonylContact C-O 3.53Å; V12-I53 WeakPolarHBondContact CA-O 3.18Å; V12-I54 HydrophobicContact CG2-CG1 4.37Å; V12-I54 HydrophobicContact CG2-CG2 4.48Å; V12-A72 HydrophobicContact CB-CB 4.24Å; V12-A72 WeakPolarHBondContact O-CB 3.33Å; V12-A72 PolarHBondContact O-N 3.18Å; V12-W76 HydrophobicContact CG2-CG 4.26Å; V12-F115 HydrophobicContact CG1-CE1 4.31Å; V12-F115 HydrophobicContact CG1-CE2 4.3Å; V12-F115 HydrophobicContact CG1-CZ 3.93Å; V12-L126 HydrophobicContact CG2-CD2 4.32Å; V12-F276 HydrophobicContact CG1-CE1 4.04Å; V12-F276 HydrophobicContact CG1-CZ 4.32Å; V12-F302 HydrophobicContact CG1-CD2 4.29Å
13	A	98.4	Very high	96.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	159.9	-176.4	0	0	0	0	0	112	T52 I53 L69 S70 V71	A13-T52 CarbonylContact O-C 3.56Å; A13-T52 WeakPolarHBondContact O-CA 3.22Å; A13-I53 PolarHBondContact N-O 2.79Å; A13-I53 PolarHBondContact O-N 3.48Å; A13-L69 HydrophobicContact CB-CD1 3.76Å; A13-L69 HydrophobicContact CB-CG 4.36Å; A13-S70 CarbonylContact C-O 3.52Å; A13-S70 WeakPolarHBondContact CA-O 3.37Å; A13-S70 WeakPolarHBondContact CB-O 3.47Å; A13-V71 HydrophobicContact CB-CG2 4.14Å
14	S	98.4	Very high	96.4	Very high	7 Å²	7	32.8 Å²	32.8	5%	0.049	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137	175.2	169.7	0	0	0	0	111	D50 Y51 S70	S14-D50 WeakPolarHBondContact OG-CB 3.44Å; S14-D50 VanDerWaalsContact OG-CG 3.31Å; S14-D50 PolarHBondContact OG-OD2 2.93Å; S14-Y51 CarbonylContact C-O 3.4Å; S14-Y51 VanDerWaalsContact CA-O 3.24Å; S14-Y51 WeakPolarHBondContact CA-O 3.43Å; S14-S70 PolarHBondContact N-O 2.91Å; S14-S70 PolarHBondContact O-N 3.42Å
15	V	97.9	Very high	96.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.6	175.7	174.1	0	0	0	0	108.7	I20 F23 D50 Y51 I53 L69	V15-I20 HydrophobicContact CG1-CD1 4.17Å; V15-F23 HydrophobicContact CB-CD2 4.33Å; V15-F23 HydrophobicContact CB-CE2 4.35Å; V15-F23 HydrophobicContact CG1-CD2 3.38Å; V15-F23 HydrophobicContact CG1-CE2 3.5Å; V15-F23 VanDerWaalsContact CG1-CE2 3.5Å; V15-F23 HydrophobicContact CG1-CG 4.15Å; V15-F23 HydrophobicContact CG1-CZ 4.34Å; V15-F23 HydrophobicContact CG2-CD1 4.03Å; V15-F23 HydrophobicContact CG2-CD2 3.93Å; V15-F23 HydrophobicContact CG2-CE1 4.04Å; V15-F23 HydrophobicContact CG2-CE2 3.92Å; V15-F23 HydrophobicContact CG2-CG 3.99Å; V15-F23 HydrophobicContact CG2-CZ 3.97Å; V15-D50 WeakPolarHBondContact O-CB 3.22Å; V15-Y51 PolarHBondContact N-O 3.26Å; V15-Y51 PolarHBondContact O-N 2.83Å; V15-I53 HydrophobicContact CG2-CD1 3.83Å; V15-L69 HydrophobicContact CG2-CD1 3.52Å
16	A	94.6	Very high	96.5	Very high	29 Å²	29	40.1 Å²	40.1	24%	0.24	20%	0.197	C	C	.	.			trans	-60.3	143.1	174	0	0	0	0	0	111	E18 S19 I20	A16-E18 VanDerWaalsContact C-N 3.28Å; A16-E18 HydrophobicContact CB-CG 4.44Å; A16-E18 PolarHBondContact O-N 3.39Å; A16-S19 WeakPolarHBondContact O-CA 3.43Å; A16-S19 PolarHBondContact O-N 3.31Å; A16-I20 PolarHBondContact O-N 3.24Å
17	K	93.4	Very high	96.6	Very high	26 Å²	26	39.4 Å²	39.4	11%	0.113	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-60.5	-39.3	-171.3	-65.5	-163.1	66.8	146.4	0	112.7	S19 I20 E46 T47 P48 Y51	K17-S19 PolarHBondContact O-N 3.49Å; K17-I20 WeakPolarHBondContact O-CG2 3.42Å; K17-I20 PolarHBondContact O-N 3Å; K17-E46 WeakPolarHBondContact CE-OE1 3.2Å; K17-E46 IonicContact NZ-OE1 3.02Å; K17-E46 PolarHBondContact NZ-OE1 3.09Å; K17-T47 PolarHBondContact NZ-O 3.38Å; K17-P48 VanDerWaalsContact CD-O 3.29Å; K17-P48 WeakPolarHBondContact CD-O 3.34Å; K17-Y51 HydrophobicContact CB-CE2 4.31Å; K17-Y51 HydrophobicContact CG-CD2 4.41Å; K17-Y51 HydrophobicContact CG-CE2 4.22Å
18	E	93.5	Very high	96.7	Very high	151 Å²	151	38.3 Å²	38.3	71%	0.706	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-66.7	-24.5	177	62.3	-88.4	-149.7	0	0	113	A16 P21	A16-E18 VanDerWaalsContact C-N 3.28Å; A16-E18 HydrophobicContact CB-CG 4.44Å; A16-E18 PolarHBondContact O-N 3.39Å; E18-P21 WeakPolarHBondContact O-CD 3.45Å
19	S	95.7	Very high	96.8	Very high	8 Å²	8	39.7 Å²	39.7	6%	0.056	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-94	-5.9	-177.3	-58.7	0	0	0	0	112.9	A16 K17 P21 L22 F23 H68	A16-S19 WeakPolarHBondContact O-CA 3.43Å; A16-S19 PolarHBondContact O-N 3.31Å; K17-S19 PolarHBondContact O-N 3.49Å; S19-P21 WeakPolarHBondContact O-CD 3.36Å; S19-P21 VanDerWaalsContact O-N 3.11Å; S19-L22 VanDerWaalsContact O-CB 3.3Å; S19-L22 WeakPolarHBondContact O-CB 3.46Å; S19-L22 PolarHBondContact O-N 2.83Å; S19-F23 WeakPolarHBondContact O-CD2 3.46Å; S19-H68 WeakPolarHBondContact OG-CB 3.26Å; S19-H68 PolarHBondContact OG-ND1 3.38Å
20	I	95.3	Very high	96.7	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-50.3	-36.2	179.2	-160.4	60.8	0	0	0	114	V15 A16 K17 L22 F23 T24 L27 Y51 F208	V15-I20 HydrophobicContact CG1-CD1 4.17Å; A16-I20 PolarHBondContact O-N 3.24Å; K17-I20 WeakPolarHBondContact O-CG2 3.42Å; K17-I20 PolarHBondContact O-N 3Å; I20-L22 PolarHBondContact O-N 3.47Å; I20-L22 VanDerWaalsContact O-N 3.12Å; I20-F23 PolarHBondContact O-N 3Å; I20-T24 WeakPolarHBondContact O-CG2 3.31Å; I20-T24 PolarHBondContact O-N 3.31Å; I20-L27 HydrophobicContact CD1-CD1 3.5Å; I20-L27 VanDerWaalsContact CD1-CD1 3.5Å; I20-L27 HydrophobicContact CG1-CD1 4.46Å; I20-Y51 HydrophobicContact CB-CD2 4.03Å; I20-Y51 HydrophobicContact CB-CE2 3.65Å; I20-Y51 HydrophobicContact CD1-CD1 4.08Å; I20-Y51 HydrophobicContact CD1-CD2 3.69Å; I20-Y51 HydrophobicContact CD1-CE1 4.32Å; I20-Y51 HydrophobicContact CD1-CE2 3.97Å; I20-Y51 HydrophobicContact CD1-CG 3.75Å; I20-Y51 HydrophobicContact CG1-CD2 3.96Å; I20-Y51 HydrophobicContact CG1-CE1 4.27Å; I20-Y51 HydrophobicContact CG1-CE2 3.69Å; I20-Y51 HydrophobicContact CG1-CG 4.36Å; I20-Y51 HydrophobicContact CG2-CE2 4.02Å; I20-F208 HydrophobicContact CG1-CD1 3.95Å
21	P	95.5	Very high	96.6	Very high	84 Å²	84	35.8 Å²	35.8	55%	0.545	18%	0.181	S	C	.	.	H	α-helix	trans	-56.7	-32.5	178.1	-26	38.3	0	0	0	113.3	E18 S19 F23 T24	E18-P21 WeakPolarHBondContact O-CD 3.45Å; S19-P21 WeakPolarHBondContact O-CD 3.36Å; S19-P21 VanDerWaalsContact O-N 3.11Å; P21-F23 PolarHBondContact O-N 3.04Å; P21-T24 PolarHBondContact O-N 3.02Å; P21-T24 PolarHBondContact O-OG1 3.49Å
22	L	96.5	Very high	96.5	Very high	100 Å²	100	36 Å²	36	52%	0.524	18%	0.181	S	C	.	.	H	α-helix	trans	-65.4	-26	178.8	-58.2	176.4	0	0	0	112.7	S19 I20 P64	S19-L22 VanDerWaalsContact O-CB 3.3Å; S19-L22 WeakPolarHBondContact O-CB 3.46Å; S19-L22 PolarHBondContact O-N 2.83Å; I20-L22 PolarHBondContact O-N 3.47Å; I20-L22 VanDerWaalsContact O-N 3.12Å; L22-P64 WeakPolarHBondContact O-CG 3.11Å
23	F	97.6	Very high	96.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-102.6	-9.7	-175.3	-61.1	-93	0	0	0	113	V15 S19 I20 P21 Y25 G26 L27 P64 H68 L69	V15-F23 HydrophobicContact CB-CD2 4.33Å; V15-F23 HydrophobicContact CB-CE2 4.35Å; V15-F23 HydrophobicContact CG1-CD2 3.38Å; V15-F23 HydrophobicContact CG1-CE2 3.5Å; V15-F23 VanDerWaalsContact CG1-CE2 3.5Å; V15-F23 HydrophobicContact CG1-CG 4.15Å; V15-F23 HydrophobicContact CG1-CZ 4.34Å; V15-F23 HydrophobicContact CG2-CD1 4.03Å; V15-F23 HydrophobicContact CG2-CD2 3.93Å; V15-F23 HydrophobicContact CG2-CE1 4.04Å; V15-F23 HydrophobicContact CG2-CE2 3.92Å; V15-F23 HydrophobicContact CG2-CG 3.99Å; V15-F23 HydrophobicContact CG2-CZ 3.97Å; S19-F23 WeakPolarHBondContact O-CD2 3.46Å; I20-F23 PolarHBondContact O-N 3Å; P21-F23 PolarHBondContact O-N 3.04Å; F23-Y25 VanDerWaalsContact C-N 3.31Å; F23-Y25 PolarHBondContact O-N 3.45Å; F23-G26 PolarHBondContact O-N 3.03Å; F23-G26 VanDerWaalsContact O-N 3.14Å; F23-L27 HydrophobicContact CB-CD1 3.9Å; F23-L27 HydrophobicContact CB-CG 4.24Å; F23-L27 WeakPolarHBondContact O-CG 3.35Å; F23-L27 PolarHBondContact O-N 2.86Å; F23-P64 HydrophobicContact CD1-CG 3.78Å; F23-P64 HydrophobicContact CE1-CG 3.95Å; F23-P64 HydrophobicContact CG-CG 4.38Å; F23-H68 HydrophobicContact CE2-CB 4.18Å; F23-H68 HydrophobicContact CZ-CB 4.36Å; F23-L69 HydrophobicContact CD1-CD1 4.45Å; F23-L69 HydrophobicContact CE1-CB 3.82Å; F23-L69 HydrophobicContact CE1-CD1 3.83Å; F23-L69 HydrophobicContact CE1-CD2 4.25Å; F23-L69 HydrophobicContact CE1-CG 4.18Å; F23-L69 HydrophobicContact CZ-CB 3.8Å; F23-L69 HydrophobicContact CZ-CD1 4.32Å
24	T	96.2	Very high	95.8	Very high	36 Å²	36	44.2 Å²	44.2	22%	0.221	23%	0.232	C	C	.	.	H	α-helix	trans	-54.2	-40.1	-174	51.6	0	0	0	0	114	I20 P21 G26 L27 I28 F208	I20-T24 WeakPolarHBondContact O-CG2 3.31Å; I20-T24 PolarHBondContact O-N 3.31Å; P21-T24 PolarHBondContact O-N 3.02Å; P21-T24 PolarHBondContact O-OG1 3.49Å; T24-G26 PolarHBondContact O-N 3.09Å; T24-L27 PolarHBondContact O-N 3.02Å; T24-I28 VanDerWaalsContact O-CB 3.28Å; T24-I28 WeakPolarHBondContact O-CB 3.26Å; T24-I28 WeakPolarHBondContact O-CG1 3.35Å; T24-I28 PolarHBondContact O-N 3.14Å; T24-F208 HydrophobicContact CG2-CB 4.4Å; T24-F208 HydrophobicContact CG2-CD1 4.29Å; T24-F208 HydrophobicContact CG2-CG 4.17Å
25	Y	96.3	Very high	95.4	Very high	181 Å²	181	48.8 Å²	48.8	71%	0.71	26%	0.264	S	S	*	.	H	α-helix	trans	-59.2	-49.8	178.7	179.4	-93.6	0	0	0	112	F23 K29	F23-Y25 VanDerWaalsContact C-N 3.31Å; F23-Y25 PolarHBondContact O-N 3.45Å; Y25-K29 PolarHBondContact O-N 2.89Å; Y25-K29 VanDerWaalsContact O-N 3.11Å
26	G	97.4	Very high	95.3	Very high	2 Å²	2	55.3 Å²	55.3	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-63.5	-47	176.9	0	0	0	0	0	111.7	F23 T24 I28 K29 L30 E62	F23-G26 PolarHBondContact O-N 3.03Å; F23-G26 VanDerWaalsContact O-N 3.14Å; T24-G26 PolarHBondContact O-N 3.09Å; G26-I28 PolarHBondContact O-N 2.87Å; G26-K29 WeakPolarHBondContact O-CB 3.29Å; G26-K29 PolarHBondContact O-N 3.01Å; G26-K29 VanDerWaalsContact O-N 3.12Å; G26-L30 VanDerWaalsContact O-CG 3.32Å; G26-L30 WeakPolarHBondContact O-CG 3.42Å; G26-L30 PolarHBondContact O-N 3.14Å; G26-E62 WeakPolarHBondContact CA-O 3.37Å
27	L	97.9	Very high	95.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-37.9	179.9	-64.7	174.9	0	0	0	112.8	I20 F23 T24 K29 L30 A31 F42 L44 I53 L63 F208	I20-L27 HydrophobicContact CD1-CD1 3.5Å; I20-L27 VanDerWaalsContact CD1-CD1 3.5Å; I20-L27 HydrophobicContact CG1-CD1 4.46Å; F23-L27 HydrophobicContact CB-CD1 3.9Å; F23-L27 HydrophobicContact CB-CG 4.24Å; F23-L27 WeakPolarHBondContact O-CG 3.35Å; F23-L27 PolarHBondContact O-N 2.86Å; T24-L27 PolarHBondContact O-N 3.02Å; L27-K29 VanDerWaalsContact C-N 3.33Å; L27-L30 HydrophobicContact CD2-CD1 4.41Å; L27-L30 PolarHBondContact O-N 2.78Å; L27-A31 VanDerWaalsContact O-CB 3.28Å; L27-A31 WeakPolarHBondContact O-CB 3.37Å; L27-A31 PolarHBondContact O-N 3.5Å; L27-F42 HydrophobicContact CD2-CE2 3.89Å; L27-F42 HydrophobicContact CD2-CZ 3.96Å; L27-L44 HydrophobicContact CD1-CD1 4.42Å; L27-L44 HydrophobicContact CD2-CD1 4.32Å; L27-I53 HydrophobicContact CD2-CD1 3.87Å; L27-I53 HydrophobicContact CD2-CG1 4.24Å; L27-L63 HydrophobicContact CD2-CD2 3.97Å; L27-L63 HydrophobicContact CG-CD2 4.43Å; L27-F208 HydrophobicContact CB-CE1 3.93Å; L27-F208 HydrophobicContact CB-CZ 3.77Å; L27-F208 HydrophobicContact CD1-CE1 3.75Å; L27-F208 HydrophobicContact CD1-CZ 4.46Å; L27-F208 HydrophobicContact CG-CE1 4.5Å
28	I	97	Very high	95.4	Very high	52 Å²	52	61.6 Å²	61.6	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-64.5	-41.6	174.2	-74.8	167.9	0	0	0	110.4	T24 G26 A31 F32 M204 F208	T24-I28 VanDerWaalsContact O-CB 3.28Å; T24-I28 WeakPolarHBondContact O-CB 3.26Å; T24-I28 WeakPolarHBondContact O-CG1 3.35Å; T24-I28 PolarHBondContact O-N 3.14Å; G26-I28 PolarHBondContact O-N 2.87Å; I28-A31 PolarHBondContact O-N 2.98Å; I28-F32 HydrophobicContact CB-CD2 4.34Å; I28-F32 HydrophobicContact CG1-CD2 4.42Å; I28-F32 HydrophobicContact CG2-CD2 4.14Å; I28-F32 WeakPolarHBondContact O-CB 3.5Å; I28-F32 WeakPolarHBondContact O-CD2 3.49Å; I28-F32 PolarHBondContact O-N 2.96Å; I28-M204 HydrophobicContact CG1-CE 4.34Å; I28-M204 HydrophobicContact CG2-CE 4.09Å; I28-F208 HydrophobicContact CG1-CE2 3.94Å
29	K	96.4	Very high	95.6	Very high	40 Å²	40	55.3 Å²	55.3	17%	0.174	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-43.8	178	-169.8	177.4	172.6	-164.3	0	111.5	Y25 G26 L27 L33 K36 E62	Y25-K29 PolarHBondContact O-N 2.89Å; Y25-K29 VanDerWaalsContact O-N 3.11Å; G26-K29 WeakPolarHBondContact O-CB 3.29Å; G26-K29 PolarHBondContact O-N 3.01Å; G26-K29 VanDerWaalsContact O-N 3.12Å; L27-K29 VanDerWaalsContact C-N 3.33Å; K29-L33 HydrophobicContact CG-CB 4.39Å; K29-L33 CarbonylContact O-C 3.54Å; K29-L33 WeakPolarHBondContact O-CA 3.28Å; K29-L33 WeakPolarHBondContact O-CB 3.45Å; K29-L33 PolarHBondContact O-N 3.44Å; K29-L33 VanDerWaalsContact O-N 3.13Å; K29-K36 HydrophobicContact CD-CB 4.43Å; K29-K36 VanDerWaalsContact CE-C 3.49Å; K29-K36 WeakPolarHBondContact CE-O 3.49Å; K29-K36 HydrophobicContact CG-CB 4.07Å; K29-K36 PolarHBondContact NZ-O 3.01Å; K29-E62 HydrophobicContact CD-CG 4.47Å; K29-E62 VanDerWaalsContact CD-OE2 3.26Å; K29-E62 WeakPolarHBondContact CD-OE2 3.32Å; K29-E62 WeakPolarHBondContact CE-OE1 3.35Å; K29-E62 WeakPolarHBondContact CE-OE2 3.48Å; K29-E62 IonicContact NZ-OE1 3.56Å; K29-E62 PolarHBondContact NZ-OE1 3.17Å; K29-E62 IonicContact NZ-OE2 3.83Å; K29-E62 PolarHBondContact NZ-OE2 3.4Å
30	L	97.5	Very high	95.6	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-46.8	176.8	-67	170	0	0	0	112.5	G26 L27 T37 C39 F42 V55 G59 E62 L63	G26-L30 VanDerWaalsContact O-CG 3.32Å; G26-L30 WeakPolarHBondContact O-CG 3.42Å; G26-L30 PolarHBondContact O-N 3.14Å; L27-L30 HydrophobicContact CD2-CD1 4.41Å; L27-L30 PolarHBondContact O-N 2.78Å; L30-T37 HydrophobicContact CD2-CG2 4.46Å; L30-C39 HydrophobicContact CD2-CB 3.69Å; L30-F42 HydrophobicContact CB-CD1 4.06Å; L30-F42 HydrophobicContact CB-CD2 4.08Å; L30-F42 HydrophobicContact CB-CE1 4.15Å; L30-F42 HydrophobicContact CB-CE2 4.16Å; L30-F42 HydrophobicContact CB-CG 4.03Å; L30-F42 HydrophobicContact CB-CZ 4.19Å; L30-F42 HydrophobicContact CD1-CD2 3.88Å; L30-F42 HydrophobicContact CD1-CE2 3.85Å; L30-V55 HydrophobicContact CD1-CG2 4.32Å; L30-V55 HydrophobicContact CD2-CG2 4.34Å; L30-G59 VanDerWaalsContact CD2-CA 3.45Å; L30-E62 HydrophobicContact CD1-CB 4.37Å; L30-E62 HydrophobicContact CD2-CB 4.11Å; L30-E62 HydrophobicContact CD2-CG 3.84Å; L30-E62 HydrophobicContact CG-CB 4.12Å; L30-E62 HydrophobicContact CG-CG 4.32Å; L30-L63 HydrophobicContact CD1-CD2 4.12Å
31	A	96.5	Very high	95.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-78	-37.7	-173.9	0	0	0	0	0	113.6	L27 I28 F42 L196 M207 F231	L27-A31 VanDerWaalsContact O-CB 3.28Å; L27-A31 WeakPolarHBondContact O-CB 3.37Å; L27-A31 PolarHBondContact O-N 3.5Å; I28-A31 PolarHBondContact O-N 2.98Å; A31-F42 HydrophobicContact CB-CE1 3.92Å; A31-L196 VanDerWaalsContact O-CD2 3.28Å; A31-L196 WeakPolarHBondContact O-CD2 3.36Å; A31-M207 HydrophobicContact CB-CE 4.17Å; A31-F231 HydrophobicContact CB-CE1 3.95Å; A31-F231 HydrophobicContact CB-CZ 4.23Å
32	F	95.5	Very high	95.9	Very high	32 Å²	32	56.6 Å²	56.6	14%	0.14	28%	0.28	C	S	.	.	H	α-helix	trans	-121.1	-14.3	-165.8	-54.9	-77.9	0	0	0	114.7	I28 L196 A200 L203 M204 M207	I28-F32 HydrophobicContact CB-CD2 4.34Å; I28-F32 HydrophobicContact CG1-CD2 4.42Å; I28-F32 HydrophobicContact CG2-CD2 4.14Å; I28-F32 WeakPolarHBondContact O-CB 3.5Å; I28-F32 WeakPolarHBondContact O-CD2 3.49Å; I28-F32 PolarHBondContact O-N 2.96Å; F32-L196 HydrophobicContact CD1-CD1 4.05Å; F32-L196 HydrophobicContact CD1-CD2 4.04Å; F32-L196 HydrophobicContact CD1-CG 3.98Å; F32-L196 HydrophobicContact CE1-CD1 3.95Å; F32-L196 HydrophobicContact CE1-CG 4.39Å; F32-A200 HydrophobicContact CD1-CB 3.88Å; F32-A200 HydrophobicContact CE1-CB 3.96Å; F32-L203 HydrophobicContact CE1-CB 4.05Å; F32-L203 HydrophobicContact CE1-CD2 3.62Å; F32-L203 HydrophobicContact CE1-CG 4.2Å; F32-L203 HydrophobicContact CZ-CB 4.01Å; F32-L203 HydrophobicContact CZ-CD2 3.82Å; F32-L203 HydrophobicContact CZ-CG 4.02Å; F32-M204 HydrophobicContact CB-CE 4.46Å; F32-M204 HydrophobicContact CD1-CE 4.29Å; F32-M204 HydrophobicContact CD2-CE 3.48Å; F32-M204 VanDerWaalsContact CD2-CE 3.48Å; F32-M204 HydrophobicContact CD2-CG 4.35Å; F32-M204 HydrophobicContact CE1-CE 4.43Å; F32-M204 HydrophobicContact CE2-CE 3.68Å; F32-M204 HydrophobicContact CE2-CG 3.56Å; F32-M204 HydrophobicContact CG-CE 3.83Å; F32-M204 HydrophobicContact CZ-CE 4.16Å; F32-M204 HydrophobicContact CZ-CG 3.69Å; F32-M207 HydrophobicContact CE2-SD 4.35Å; F32-M207 HydrophobicContact CZ-SD 4.03Å
33	L	93.9	Very high	96	Very high	78 Å²	78	51.9 Å²	51.9	41%	0.408	26%	0.255	S	S	.	.			trans	-121.8	58.6	-172.5	-53.4	177.2	0	0	0	111.1	K29 S35 K36	K29-L33 HydrophobicContact CG-CB 4.39Å; K29-L33 CarbonylContact O-C 3.54Å; K29-L33 WeakPolarHBondContact O-CA 3.28Å; K29-L33 WeakPolarHBondContact O-CB 3.45Å; K29-L33 PolarHBondContact O-N 3.44Å; K29-L33 VanDerWaalsContact O-N 3.13Å; L33-S35 PolarHBondContact O-N 2.89Å; L33-K36 HydrophobicContact CB-CB 4.01Å; L33-K36 HydrophobicContact CB-CG 3.93Å; L33-K36 WeakPolarHBondContact O-CA 3.42Å; L33-K36 WeakPolarHBondContact O-CB 3.46Å; L33-K36 PolarHBondContact O-N 3.29Å
34	S	88	Confident	96.1	Very high	95 Å²	95	51.9 Å²	51.9	66%	0.664	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-26.7	179.5	60.9	0	0	0	0	114.2	K36	S34-K36 PolarHBondContact O-N 2.93Å
35	S	91.1	Very high	96.2	Very high	102 Å²	102	50.2 Å²	50.2	71%	0.713	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.6	174.6	63.6	0	0	0	0	114.7	L33	L33-S35 PolarHBondContact O-N 2.89Å
36	K	94.5	Very high	96.3	Very high	137 Å²	137	41.7 Å²	41.7	60%	0.596	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-9.2	-175.1	-59	-59.6	-177.8	-174.5	0	113.5	K29 L33 S34	K29-K36 HydrophobicContact CD-CB 4.43Å; K29-K36 VanDerWaalsContact CE-C 3.49Å; K29-K36 WeakPolarHBondContact CE-O 3.49Å; K29-K36 HydrophobicContact CG-CB 4.07Å; K29-K36 PolarHBondContact NZ-O 3.01Å; L33-K36 HydrophobicContact CB-CB 4.01Å; L33-K36 HydrophobicContact CB-CG 3.93Å; L33-K36 WeakPolarHBondContact O-CA 3.42Å; L33-K36 WeakPolarHBondContact O-CB 3.46Å; L33-K36 PolarHBondContact O-N 3.29Å; S34-K36 PolarHBondContact O-N 2.93Å
37	T	95.2	Very high	96.2	Very high	16 Å²	16	41.6 Å²	41.6	10%	0.098	21%	0.21	C	C	.	.			trans	-130.5	155.1	176.9	-177.2	0	0	0	0	109.8	L30 C39 E62	L30-T37 HydrophobicContact CD2-CG2 4.46Å; T37-C39 HydrophobicContact CG2-CB 3.92Å; T37-C39 WeakPolarHBondContact OG1-CB 3.35Å; T37-C39 PolarHBondContact OG1-N 3.38Å; T37-E62 WeakPolarHBondContact CB-OE1 3.39Å; T37-E62 PolarHBondContact OG1-OE1 3.09Å
38	R	95.9	Very high	96	Very high	171 Å²	171	44 Å²	44	65%	0.645	23%	0.226	S	C	*	.			trans	-91.9	-3	171.5	-66	-170.6	-64.8	-176.5	0.6	112.8	K40 E58	R38-K40 PolarHBondContact O-N 3.28Å; R38-E58 HydrophobicContact CB-CB 4.08Å; R38-E58 HydrophobicContact CB-CG 4.03Å; R38-E58 IonicContact CZ-OE1 3.86Å; R38-E58 IonicContact CZ-OE2 3.86Å; R38-E58 IonicContact NE-OE1 3.23Å; R38-E58 IonicContact NE-OE2 2.8Å; R38-E58 PolarHBondContact NE-OE2 2.64Å; R38-E58 IonicContact NH2-OE1 3.43Å; R38-E58 PolarHBondContact NH2-OE1 3.34Å; R38-E58 IonicContact NH2-OE2 3.17Å; R38-E58 PolarHBondContact NH2-OE2 2.93Å
39	C	97.7	Very high	95.9	Very high	20 Å²	20	44.4 Å²	44.4	14%	0.135	23%	0.226	C	C	.	.			trans	-50.7	131.3	176.8	-172.7	0	0	0	0	111.5	L30 T37 F41 D56	L30-C39 HydrophobicContact CD2-CB 3.69Å; T37-C39 HydrophobicContact CG2-CB 3.92Å; T37-C39 WeakPolarHBondContact OG1-CB 3.35Å; T37-C39 PolarHBondContact OG1-N 3.38Å; C39-F41 PolarHBondContact SG-O 3.31Å; C39-F41 VanDerWaalsContact SG-O 3.34Å; C39-D56 WeakPolarHBondContact CA-OD2 3.46Å
40	K	96.6	Very high	95.9	Very high	121 Å²	121	42.5 Å²	42.5	53%	0.526	22%	0.218	S	C	.	.			trans	-117.9	-18.5	175.7	-62.1	-55.6	-179.5	-176.6	0	112.7	R38 D56 I234 E235	R38-K40 PolarHBondContact O-N 3.28Å; K40-D56 WeakPolarHBondContact CA-OD2 3.27Å; K40-D56 PolarHBondContact N-OD2 3.19Å; K40-I234 CarbonylContact O-C 3.54Å; K40-I234 WeakPolarHBondContact O-CA 3.34Å; K40-E235 PolarHBondContact O-N 2.88Å
41	F	98.2	Very high	96	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	109.9	177.2	-160.5	-67.4	0	0	0	109.5	H8 L10 C39 I54 V55 D56 A78 L117 F124 I234	H8-F41 HydrophobicContact CB-CB 4.17Å; H8-F41 HydrophobicContact CB-CD2 4.31Å; H8-F41 AromaticContact CD2-CD2 3.81Å; L10-F41 HydrophobicContact CD1-CD1 3.94Å; L10-F41 HydrophobicContact CD1-CD2 4.25Å; L10-F41 HydrophobicContact CD1-CE1 3.78Å; L10-F41 HydrophobicContact CD1-CE2 4.1Å; L10-F41 HydrophobicContact CD1-CG 4.18Å; L10-F41 HydrophobicContact CD1-CZ 3.86Å; L10-F41 HydrophobicContact CD2-CB 3.61Å; L10-F41 HydrophobicContact CD2-CD1 3.61Å; L10-F41 HydrophobicContact CD2-CD2 4.16Å; L10-F41 HydrophobicContact CD2-CE1 4.32Å; L10-F41 HydrophobicContact CD2-CG 3.52Å; L10-F41 HydrophobicContact CG-CD1 4.45Å; C39-F41 PolarHBondContact SG-O 3.31Å; C39-F41 VanDerWaalsContact SG-O 3.34Å; F41-I54 HydrophobicContact CD1-CG2 4.22Å; F41-I54 HydrophobicContact CE1-CG2 3.77Å; F41-V55 CarbonylContact O-C 3.55Å; F41-V55 VanDerWaalsContact O-CA 3.26Å; F41-V55 WeakPolarHBondContact O-CA 3.26Å; F41-D56 HydrophobicContact CB-CB 4.23Å; F41-D56 PolarHBondContact N-OD2 2.89Å; F41-D56 PolarHBondContact O-N 3.03Å; F41-A78 HydrophobicContact CE2-CB 4Å; F41-L117 HydrophobicContact CE1-CD2 3.86Å; F41-L117 HydrophobicContact CZ-CD2 3.93Å; F41-F124 AromaticContact CE2-CD1 3.91Å; F41-F124 HydrophobicContact CE2-CD1 3.91Å; F41-F124 HydrophobicContact CE2-CD2 4.32Å; F41-F124 HydrophobicContact CE2-CE1 4.02Å; F41-F124 HydrophobicContact CE2-CE2 4.44Å; F41-F124 HydrophobicContact CE2-CG 4.06Å; F41-F124 HydrophobicContact CE2-CZ 4.29Å; F41-F124 HydrophobicContact CZ-CB 4.39Å; F41-F124 HydrophobicContact CZ-CD1 4.35Å; F41-F124 HydrophobicContact CZ-CD2 4.14Å; F41-F124 HydrophobicContact CZ-CG 4.03Å; F41-I234 HydrophobicContact CD1-CD1 4.13Å; F41-I234 HydrophobicContact CD1-CG1 4.04Å; F41-I234 HydrophobicContact CD2-CB 4.44Å; F41-I234 HydrophobicContact CD2-CD1 4.26Å; F41-I234 HydrophobicContact CD2-CG1 4.13Å; F41-I234 HydrophobicContact CD2-CG2 3.47Å; F41-I234 VanDerWaalsContact CD2-CG2 3.47Å; F41-I234 HydrophobicContact CE1-CD1 3.66Å; F41-I234 HydrophobicContact CE1-CG1 4.1Å; F41-I234 HydrophobicContact CE2-CD1 3.81Å; F41-I234 HydrophobicContact CE2-CG1 4.2Å; F41-I234 HydrophobicContact CE2-CG2 3.75Å; F41-I234 HydrophobicContact CG-CD1 4.41Å; F41-I234 HydrophobicContact CG-CG1 4.05Å; F41-I234 HydrophobicContact CG-CG2 4.08Å; F41-I234 HydrophobicContact CZ-CD1 3.49Å; F41-I234 VanDerWaalsContact CZ-CD1 3.49Å; F41-I234 HydrophobicContact CZ-CG1 4.19Å
42	F	98.5	Very high	96.1	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.009	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	132.8	175.6	170.7	-116.3	0	0	0	110.7	L27 L30 A31 L44 I53 I54 V55 F231 S232 L233	L27-F42 HydrophobicContact CD2-CE2 3.89Å; L27-F42 HydrophobicContact CD2-CZ 3.96Å; L30-F42 HydrophobicContact CB-CD1 4.06Å; L30-F42 HydrophobicContact CB-CD2 4.08Å; L30-F42 HydrophobicContact CB-CE1 4.15Å; L30-F42 HydrophobicContact CB-CE2 4.16Å; L30-F42 HydrophobicContact CB-CG 4.03Å; L30-F42 HydrophobicContact CB-CZ 4.19Å; L30-F42 HydrophobicContact CD1-CD2 3.88Å; L30-F42 HydrophobicContact CD1-CE2 3.85Å; A31-F42 HydrophobicContact CB-CE1 3.92Å; F42-L44 HydrophobicContact CE1-CB 4.48Å; F42-L44 HydrophobicContact CE2-CB 4.32Å; F42-L44 HydrophobicContact CZ-CB 3.82Å; F42-I53 HydrophobicContact CD2-CG2 4.42Å; F42-I53 HydrophobicContact CE2-CG2 4.13Å; F42-I54 CarbonylContact C-O 3.59Å; F42-I54 WeakPolarHBondContact CA-O 3.48Å; F42-V55 HydrophobicContact CD2-CB 4.44Å; F42-V55 HydrophobicContact CD2-CG2 4.26Å; F42-F231 HydrophobicContact CD1-CD1 4.13Å; F42-F231 AromaticContact CD1-CE1 3.82Å; F42-F231 HydrophobicContact CD1-CE1 3.82Å; F42-F231 AromaticContact CE1-CD1 3.73Å; F42-F231 HydrophobicContact CE1-CD1 3.73Å; F42-F231 AromaticContact CE1-CE1 3.69Å; F42-F231 HydrophobicContact CE1-CE1 3.69Å; F42-S232 CarbonylContact O-C 3.51Å; F42-S232 WeakPolarHBondContact O-CA 3.47Å; F42-L233 HydrophobicContact CD1-CB 4.48Å; F42-L233 PolarHBondContact N-O 3.35Å; F42-L233 CarbonylContact O-C 3.57Å; F42-L233 PolarHBondContact O-N 3.16Å
43	S	98.7	Very high	96.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139.8	169.4	-167.4	0	0	0	0	110.1	I53 I54 F231 S232	S43-I53 CarbonylContact O-C 3.57Å; S43-I53 WeakPolarHBondContact O-CA 3.49Å; S43-I54 PolarHBondContact N-O 3.38Å; S43-I54 PolarHBondContact O-N 3.38Å; S43-F231 CarbonylContact C-O 3.54Å; S43-F231 VanDerWaalsContact CA-O 3.29Å; S43-F231 WeakPolarHBondContact CA-O 3.34Å; S43-F231 PolarHBondContact OG-O 2.85Å; S43-S232 PolarHBondContact OG-OG 3.3Å
44	L	98.6	Very high	96.5	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	119.7	173.6	-178.7	75.8	0	0	0	108.5	L27 F42 Y51 T52 I53 M207 F208 S230 F231	L27-L44 HydrophobicContact CD1-CD1 4.42Å; L27-L44 HydrophobicContact CD2-CD1 4.32Å; F42-L44 HydrophobicContact CE1-CB 4.48Å; F42-L44 HydrophobicContact CE2-CB 4.32Å; F42-L44 HydrophobicContact CZ-CB 3.82Å; L44-Y51 HydrophobicContact CD1-CD1 4.01Å; L44-Y51 HydrophobicContact CD1-CG 4.45Å; L44-Y51 HydrophobicContact CD2-CD1 4.25Å; L44-Y51 HydrophobicContact CG-CD1 4.21Å; L44-T52 CarbonylContact C-O 3.55Å; L44-T52 WeakPolarHBondContact CA-O 3.5Å; L44-I53 HydrophobicContact CD1-CD1 4.41Å; L44-I53 HydrophobicContact CD1-CG1 3.57Å; L44-M207 HydrophobicContact CB-CE 4.39Å; L44-M207 HydrophobicContact CD2-CB 4.46Å; L44-M207 HydrophobicContact CD2-CE 3.38Å; L44-M207 HydrophobicContact CD2-CG 4.49Å; L44-F208 HydrophobicContact CD2-CE1 4.05Å; L44-S230 WeakPolarHBondContact O-CA 3.42Å; L44-F231 PolarHBondContact N-O 2.91Å; L44-F231 PolarHBondContact O-N 2.84Å
45	T	98.5	Very high	97	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	116	175.4	-51.4	0	0	0	0	109.8	Y51 T52 F228 F229 S230 I299 T301	T45-Y51 CarbonylContact O-C 3.5Å; T45-Y51 WeakPolarHBondContact O-CA 3.36Å; T45-T52 PolarHBondContact N-O 2.85Å; T45-T52 PolarHBondContact O-N 3.44Å; T45-F228 HydrophobicContact CG2-CE1 4.4Å; T45-F228 HydrophobicContact CG2-CE2 3.88Å; T45-F228 HydrophobicContact CG2-CZ 3.77Å; T45-F229 CarbonylContact C-O 3.59Å; T45-F229 WeakPolarHBondContact CA-O 3.49Å; T45-S230 PolarHBondContact OG1-OG 2.86Å; T45-I299 HydrophobicContact CG2-CG2 4.12Å; T45-T301 HydrophobicContact CG2-CG2 3.83Å
46	E	98	Very high	97.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.5	170.8	-172.6	-172.3	176.5	0	0	110	K17 Y51 S210 R227 F228 F229	K17-E46 WeakPolarHBondContact CE-OE1 3.2Å; K17-E46 IonicContact NZ-OE1 3.02Å; K17-E46 PolarHBondContact NZ-OE1 3.09Å; E46-Y51 HydrophobicContact CB-CD1 3.78Å; E46-Y51 HydrophobicContact CB-CE1 3.57Å; E46-Y51 HydrophobicContact CG-CD1 3.97Å; E46-Y51 HydrophobicContact CG-CE1 3.48Å; E46-Y51 VanDerWaalsContact CG-CE1 3.48Å; E46-Y51 HydrophobicContact CG-CE2 4.42Å; E46-Y51 PolarHBondContact OE1-OH 3.15Å; E46-S210 PolarHBondContact OE1-OG 3.45Å; E46-S210 PolarHBondContact OE2-OG 3.18Å; E46-R227 HydrophobicContact CG-CG 4.23Å; E46-R227 WeakPolarHBondContact OE1-CG 3.41Å; E46-R227 IonicContact OE1-NE 2.64Å; E46-R227 IonicContact OE2-CZ 3.98Å; E46-R227 VanDerWaalsContact OE2-CZ 3.22Å; E46-R227 IonicContact OE2-NE 3.79Å; E46-R227 PolarHBondContact OE2-NE 2.88Å; E46-R227 IonicContact OE2-NH2 2.76Å; E46-R227 PolarHBondContact OE2-NH2 2.84Å; E46-F228 WeakPolarHBondContact O-CA 3.28Å; E46-F229 HydrophobicContact CB-CB 4.36Å; E46-F229 PolarHBondContact N-O 2.77Å; E46-F229 PolarHBondContact O-N 2.78Å; E46-F229 VanDerWaalsContact O-N 3.09Å
47	T	96.3	Very high	97.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.119	C	C	.	.			trans	-119.3	178.6	170.6	70.4	0	0	0	0	110.1	K17 E49 D50 R227 F228 T301	K17-T47 PolarHBondContact NZ-O 3.38Å; T47-E49 PolarHBondContact O-N 3.18Å; T47-E49 PolarHBondContact OG1-N 3.39Å; T47-E49 VanDerWaalsContact OG1-N 3.15Å; T47-E49 PolarHBondContact OG1-OE2 2.59Å; T47-D50 PolarHBondContact N-O 2.82Å; T47-D50 PolarHBondContact OG1-N 2.87Å; T47-D50 VanDerWaalsContact OG1-N 3.09Å; T47-D50 PolarHBondContact OG1-O 3.35Å; T47-D50 VanDerWaalsContact OG1-O 3.13Å; T47-D50 PolarHBondContact OG1-OD1 2.83Å; T47-D50 VanDerWaalsContact OG1-OD1 3.07Å; T47-R227 CarbonylContact C-O 3.57Å; T47-F228 HydrophobicContact CG2-CD2 4.42Å; T47-T301 HydrophobicContact CG2-CG2 3.77Å
48	P	94.1	Very high	97.6	Very high	50 Å²	50	28 Å²	28	33%	0.325	13%	0.128	S	C	.	.	S	Bend	trans	-62.1	-26.2	168.2	-22.4	36	0	0	0	112.7	K17 I226 R227	K17-P48 VanDerWaalsContact CD-O 3.29Å; K17-P48 WeakPolarHBondContact CD-O 3.34Å; P48-I226 HydrophobicContact CG-CB 4Å; P48-R227 WeakPolarHBondContact CD-O 3.46Å
49	E	94.8	Very high	97.7	Very high	61 Å²	61	19.9 Å²	19.9	29%	0.285	10%	0.098	S	C	.	.	S	Bend	trans	-97.7	-28.9	-170.8	-62.7	79.7	-161.5	0	0	115	T47 R268 K303 F304	T47-E49 PolarHBondContact O-N 3.18Å; T47-E49 PolarHBondContact OG1-N 3.39Å; T47-E49 VanDerWaalsContact OG1-N 3.15Å; T47-E49 PolarHBondContact OG1-OE2 2.59Å; E49-R268 IonicContact OE1-CZ 2.74Å; E49-R268 VanDerWaalsContact OE1-CZ 3.28Å; E49-R268 IonicContact OE1-NH1 3.29Å; E49-R268 PolarHBondContact OE1-NH1 3.23Å; E49-R268 IonicContact OE1-NH2 2.75Å; E49-R268 PolarHBondContact OE1-NH2 2.79Å; E49-R268 IonicContact OE2-CZ 2.76Å; E49-R268 IonicContact OE2-NH1 3.22Å; E49-R268 IonicContact OE2-NH2 2.79Å; E49-R268 PolarHBondContact OE2-NH2 2.67Å; E49-K303 HydrophobicContact CB-CD 3.8Å; E49-K303 PolarHBondContact O-NZ 2.8Å; E49-K303 VanDerWaalsContact O-NZ 3.14Å; E49-F304 HydrophobicContact CG-CE2 3.95Å
50	D	96.6	Very high	97.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.104	C	C	.	.			trans	-169.7	179.8	-176.8	60.5	9.2	0	0	0	113	S14 V15 T47 K303	S14-D50 WeakPolarHBondContact OG-CB 3.44Å; S14-D50 VanDerWaalsContact OG-CG 3.31Å; S14-D50 PolarHBondContact OG-OD2 2.93Å; V15-D50 WeakPolarHBondContact O-CB 3.22Å; T47-D50 PolarHBondContact N-O 2.82Å; T47-D50 PolarHBondContact OG1-N 2.87Å; T47-D50 VanDerWaalsContact OG1-N 3.09Å; T47-D50 PolarHBondContact OG1-O 3.35Å; T47-D50 VanDerWaalsContact OG1-O 3.13Å; T47-D50 PolarHBondContact OG1-OD1 2.83Å; T47-D50 VanDerWaalsContact OG1-OD1 3.07Å; D50-K303 WeakPolarHBondContact OD2-CD 3.46Å; D50-K303 WeakPolarHBondContact OD2-CE 3.46Å; D50-K303 IonicContact OD2-NZ 2.85Å
51	Y	98.3	Very high	97.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.6	160.1	-67.4	-92.7	0	0	0	109.1	S14 V15 K17 I20 L44 T45 E46 M207	S14-Y51 CarbonylContact C-O 3.4Å; S14-Y51 VanDerWaalsContact CA-O 3.24Å; S14-Y51 WeakPolarHBondContact CA-O 3.43Å; V15-Y51 PolarHBondContact N-O 3.26Å; V15-Y51 PolarHBondContact O-N 2.83Å; K17-Y51 HydrophobicContact CB-CE2 4.31Å; K17-Y51 HydrophobicContact CG-CD2 4.41Å; K17-Y51 HydrophobicContact CG-CE2 4.22Å; I20-Y51 HydrophobicContact CB-CD2 4.03Å; I20-Y51 HydrophobicContact CB-CE2 3.65Å; I20-Y51 HydrophobicContact CD1-CD1 4.08Å; I20-Y51 HydrophobicContact CD1-CD2 3.69Å; I20-Y51 HydrophobicContact CD1-CE1 4.32Å; I20-Y51 HydrophobicContact CD1-CE2 3.97Å; I20-Y51 HydrophobicContact CD1-CG 3.75Å; I20-Y51 HydrophobicContact CG1-CD2 3.96Å; I20-Y51 HydrophobicContact CG1-CE1 4.27Å; I20-Y51 HydrophobicContact CG1-CE2 3.69Å; I20-Y51 HydrophobicContact CG1-CG 4.36Å; I20-Y51 HydrophobicContact CG2-CE2 4.02Å; L44-Y51 HydrophobicContact CD1-CD1 4.01Å; L44-Y51 HydrophobicContact CD1-CG 4.45Å; L44-Y51 HydrophobicContact CD2-CD1 4.25Å; L44-Y51 HydrophobicContact CG-CD1 4.21Å; T45-Y51 CarbonylContact O-C 3.5Å; T45-Y51 WeakPolarHBondContact O-CA 3.36Å; E46-Y51 HydrophobicContact CB-CD1 3.78Å; E46-Y51 HydrophobicContact CB-CE1 3.57Å; E46-Y51 HydrophobicContact CG-CD1 3.97Å; E46-Y51 HydrophobicContact CG-CE1 3.48Å; E46-Y51 VanDerWaalsContact CG-CE1 3.48Å; E46-Y51 HydrophobicContact CG-CE2 4.42Å; E46-Y51 PolarHBondContact OE1-OH 3.15Å; Y51-M207 WeakPolarHBondContact CE1-O 3.27Å; Y51-M207 PolarHBondContact OH-O 2.77Å
52	T	98.7	Very high	97.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.6	168.1	-61.7	0	0	0	0	109.8	V12 A13 L44 T45 I54 T301 F302	V12-T52 HydrophobicContact CG1-CG2 4.14Å; A13-T52 CarbonylContact O-C 3.56Å; A13-T52 WeakPolarHBondContact O-CA 3.22Å; L44-T52 CarbonylContact C-O 3.55Å; L44-T52 WeakPolarHBondContact CA-O 3.5Å; T45-T52 PolarHBondContact N-O 2.85Å; T45-T52 PolarHBondContact O-N 3.44Å; T52-I54 HydrophobicContact CG2-CG1 4.46Å; T52-T301 WeakPolarHBondContact OG1-CB 3.35Å; T52-F302 HydrophobicContact CG2-CB 4.24Å; T52-F302 WeakPolarHBondContact OG1-CB 3.49Å; T52-F302 PolarHBondContact OG1-N 3.35Å
53	I	98.8	Very high	97.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.7	175.9	-60	162.1	0	0	0	108	V12 A13 V15 L27 F42 S43 L44 V55 L63	V12-I53 CarbonylContact C-O 3.53Å; V12-I53 WeakPolarHBondContact CA-O 3.18Å; A13-I53 PolarHBondContact N-O 2.79Å; A13-I53 PolarHBondContact O-N 3.48Å; V15-I53 HydrophobicContact CG2-CD1 3.83Å; L27-I53 HydrophobicContact CD2-CD1 3.87Å; L27-I53 HydrophobicContact CD2-CG1 4.24Å; F42-I53 HydrophobicContact CD2-CG2 4.42Å; F42-I53 HydrophobicContact CE2-CG2 4.13Å; S43-I53 CarbonylContact O-C 3.57Å; S43-I53 WeakPolarHBondContact O-CA 3.49Å; L44-I53 HydrophobicContact CD1-CD1 4.41Å; L44-I53 HydrophobicContact CD1-CG1 3.57Å; I53-V55 HydrophobicContact CG2-CB 3.97Å; I53-V55 HydrophobicContact CG2-CG1 3.98Å; I53-L63 HydrophobicContact CD1-CD1 4.05Å; I53-L63 HydrophobicContact CD1-CD2 4.26Å; I53-L63 HydrophobicContact CG2-CD1 4.21Å
54	I	98.8	Very high	97.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.6	168.1	-52.4	168.6	0	0	0	105.9	L10 Q11 V12 F41 F42 S43 T52 F115 L117 L126	L10-I54 HydrophobicContact CB-CG2 4.44Å; L10-I54 HydrophobicContact CD1-CG2 4.12Å; Q11-I54 WeakPolarHBondContact O-CA 3.37Å; V12-I54 HydrophobicContact CG2-CG1 4.37Å; V12-I54 HydrophobicContact CG2-CG2 4.48Å; F41-I54 HydrophobicContact CD1-CG2 4.22Å; F41-I54 HydrophobicContact CE1-CG2 3.77Å; F42-I54 CarbonylContact C-O 3.59Å; F42-I54 WeakPolarHBondContact CA-O 3.48Å; S43-I54 PolarHBondContact N-O 3.38Å; S43-I54 PolarHBondContact O-N 3.38Å; T52-I54 HydrophobicContact CG2-CG1 4.46Å; I54-F115 HydrophobicContact CD1-CD1 4.32Å; I54-F115 HydrophobicContact CD1-CE1 3.73Å; I54-F115 HydrophobicContact CG1-CE1 4.33Å; I54-L117 HydrophobicContact CD1-CB 4.25Å; I54-L117 HydrophobicContact CD1-CD1 4.23Å; I54-L117 HydrophobicContact CD1-CD2 4.08Å; I54-L117 HydrophobicContact CD1-CG 4.42Å; I54-L126 HydrophobicContact CG2-CD2 3.76Å
55	V	98.7	Very high	97.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	145.7	-172.5	68.7	0	0	0	0	111.2	L10 Q11 L30 F41 F42 I53 G59 F60 L63	L10-V55 CarbonylContact C-O 3.58Å; L10-V55 WeakPolarHBondContact CA-O 3.45Å; Q11-V55 PolarHBondContact N-O 2.82Å; Q11-V55 PolarHBondContact O-N 3.34Å; L30-V55 HydrophobicContact CD1-CG2 4.32Å; L30-V55 HydrophobicContact CD2-CG2 4.34Å; F41-V55 CarbonylContact O-C 3.55Å; F41-V55 VanDerWaalsContact O-CA 3.26Å; F41-V55 WeakPolarHBondContact O-CA 3.26Å; F42-V55 HydrophobicContact CD2-CB 4.44Å; F42-V55 HydrophobicContact CD2-CG2 4.26Å; I53-V55 HydrophobicContact CG2-CB 3.97Å; I53-V55 HydrophobicContact CG2-CG1 3.98Å; V55-G59 VanDerWaalsContact CG2-C 3.44Å; V55-G59 VanDerWaalsContact CG2-CA 3.48Å; V55-F60 HydrophobicContact CG1-CB 3.88Å; V55-F60 HydrophobicContact CG1-CD2 3.93Å; V55-F60 HydrophobicContact CG1-CG 4.42Å; V55-L63 HydrophobicContact CG1-CD1 4.37Å
56	D	98.5	Very high	97.1	Very high	10 Å²	10	34.7 Å²	34.7	5%	0.053	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	168.4	171.2	65.7	43.5	0	0	0	113.1	H8 R9 L10 C39 K40 F41 E58 G59 F60	H8-D56 HydrophobicContact CB-CB 4.5Å; R9-D56 CarbonylContact O-C 3.56Å; R9-D56 VanDerWaalsContact O-CA 3.26Å; R9-D56 WeakPolarHBondContact O-CA 3.12Å; L10-D56 HydrophobicContact CD2-CB 3.91Å; C39-D56 WeakPolarHBondContact CA-OD2 3.46Å; K40-D56 WeakPolarHBondContact CA-OD2 3.27Å; K40-D56 PolarHBondContact N-OD2 3.19Å; F41-D56 HydrophobicContact CB-CB 4.23Å; F41-D56 PolarHBondContact N-OD2 2.89Å; F41-D56 PolarHBondContact O-N 3.03Å; D56-E58 PolarHBondContact O-N 2.93Å; D56-E58 WeakPolarHBondContact OD1-CB 3.44Å; D56-E58 PolarHBondContact OD1-N 3.38Å; D56-G59 PolarHBondContact O-N 2.87Å; D56-G59 PolarHBondContact OD1-N 3.2Å; D56-F60 WeakPolarHBondContact O-CB 3.46Å; D56-F60 PolarHBondContact O-N 2.84Å
57	E	97.8	Very high	96.9	Very high	84 Å²	84	43.3 Å²	43.3	39%	0.393	23%	0.233	S	C	.	.	H	α-helix	trans	-56.2	-36.2	-178.9	-67.8	-171.8	128.7	0	0	113.3	R9 L61	R9-E57 HydrophobicContact CB-CG 3.9Å; R9-E57 IonicContact CZ-OE1 3.46Å; R9-E57 IonicContact CZ-OE2 3.28Å; R9-E57 IonicContact NH1-OE1 2.97Å; R9-E57 PolarHBondContact NH1-OE1 3.46Å; R9-E57 IonicContact NH1-OE2 2.93Å; R9-E57 PolarHBondContact NH1-OE2 3.38Å; R9-E57 IonicContact NH2-OE1 3.18Å; R9-E57 WeakPolarHBondContact O-CG 3.5Å; R9-E57 PolarHBondContact O-N 3.5Å; E57-L61 WeakPolarHBondContact O-CG 3.47Å; E57-L61 PolarHBondContact O-N 3.17Å
58	E	97.5	Very high	96.9	Very high	65 Å²	65	46.7 Å²	46.7	30%	0.304	25%	0.248	S	C	.	.	H	α-helix	trans	-71.1	-40.9	179.1	-71.6	-69.5	151.2	0	0	111.6	R38 D56	R38-E58 HydrophobicContact CB-CB 4.08Å; R38-E58 HydrophobicContact CB-CG 4.03Å; R38-E58 IonicContact CZ-OE1 3.86Å; R38-E58 IonicContact CZ-OE2 3.86Å; R38-E58 IonicContact NE-OE1 3.23Å; R38-E58 IonicContact NE-OE2 2.8Å; R38-E58 PolarHBondContact NE-OE2 2.64Å; R38-E58 IonicContact NH2-OE1 3.43Å; R38-E58 PolarHBondContact NH2-OE1 3.34Å; R38-E58 IonicContact NH2-OE2 3.17Å; R38-E58 PolarHBondContact NH2-OE2 2.93Å; D56-E58 PolarHBondContact O-N 2.93Å; D56-E58 WeakPolarHBondContact OD1-CB 3.44Å; D56-E58 PolarHBondContact OD1-N 3.38Å
59	G	98	Very high	97	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-73.4	-29.6	176.2	0	0	0	0	0	113.2	L30 V55 D56 L61 E62	L30-G59 VanDerWaalsContact CD2-CA 3.45Å; V55-G59 VanDerWaalsContact CG2-C 3.44Å; V55-G59 VanDerWaalsContact CG2-CA 3.48Å; D56-G59 PolarHBondContact O-N 2.87Å; D56-G59 PolarHBondContact OD1-N 3.2Å; G59-L61 PolarHBondContact O-N 3.37Å; G59-E62 VanDerWaalsContact O-CB 3.28Å; G59-E62 WeakPolarHBondContact O-CB 3.47Å; G59-E62 PolarHBondContact O-N 3.05Å
60	F	98.1	Very high	97.2	Very high	59 Å²	59	45.5 Å²	45.5	26%	0.259	25%	0.246	S	C	.	.	H	α-helix	trans	-60.8	-33.3	175	-170.5	-104.6	0	0	0	112	Q11 V55 D56 E62 L63 L69 V71	Q11-F60 HydrophobicContact CB-CD2 3.73Å; Q11-F60 HydrophobicContact CB-CE2 4.11Å; Q11-F60 HydrophobicContact CB-CG 4.24Å; Q11-F60 HydrophobicContact CG-CB 4.36Å; Q11-F60 HydrophobicContact CG-CD1 4.4Å; Q11-F60 HydrophobicContact CG-CD2 3.96Å; Q11-F60 HydrophobicContact CG-CE2 4.38Å; Q11-F60 HydrophobicContact CG-CG 3.98Å; V55-F60 HydrophobicContact CG1-CB 3.88Å; V55-F60 HydrophobicContact CG1-CD2 3.93Å; V55-F60 HydrophobicContact CG1-CG 4.42Å; D56-F60 WeakPolarHBondContact O-CB 3.46Å; D56-F60 PolarHBondContact O-N 2.84Å; F60-E62 PolarHBondContact O-N 3.49Å; F60-L63 HydrophobicContact CD2-CD1 4.04Å; F60-L63 HydrophobicContact CE2-CD1 4.31Å; F60-L63 WeakPolarHBondContact O-CB 3.43Å; F60-L63 PolarHBondContact O-N 2.9Å; F60-L63 VanDerWaalsContact O-N 3.07Å; F60-L69 HydrophobicContact CE2-CD2 4.22Å; F60-L69 HydrophobicContact CZ-CD2 4.27Å; F60-V71 HydrophobicContact CE2-CG1 4.36Å; F60-V71 HydrophobicContact CE2-CG2 4.02Å; F60-V71 HydrophobicContact CZ-CG1 4.41Å; F60-V71 HydrophobicContact CZ-CG2 3.88Å
61	L	97.4	Very high	97.2	Very high	129 Å²	129	48.2 Å²	48.2	68%	0.675	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-19.1	174.6	-61.8	174.2	0	0	0	113.5	E57 G59 L63	E57-L61 WeakPolarHBondContact O-CG 3.47Å; E57-L61 PolarHBondContact O-N 3.17Å; G59-L61 PolarHBondContact O-N 3.37Å; L61-L63 VanDerWaalsContact C-N 3.29Å
62	E	97.5	Very high	97.2	Very high	39 Å²	39	48.5 Å²	48.5	18%	0.182	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-13.6	176.9	-53	-64.6	-172.8	0	0	112.6	G26 K29 L30 T37 G59 F60	G26-E62 WeakPolarHBondContact CA-O 3.37Å; K29-E62 HydrophobicContact CD-CG 4.47Å; K29-E62 VanDerWaalsContact CD-OE2 3.26Å; K29-E62 WeakPolarHBondContact CD-OE2 3.32Å; K29-E62 WeakPolarHBondContact CE-OE1 3.35Å; K29-E62 WeakPolarHBondContact CE-OE2 3.48Å; K29-E62 IonicContact NZ-OE1 3.56Å; K29-E62 PolarHBondContact NZ-OE1 3.17Å; K29-E62 IonicContact NZ-OE2 3.83Å; K29-E62 PolarHBondContact NZ-OE2 3.4Å; L30-E62 HydrophobicContact CD1-CB 4.37Å; L30-E62 HydrophobicContact CD2-CB 4.11Å; L30-E62 HydrophobicContact CD2-CG 3.84Å; L30-E62 HydrophobicContact CG-CB 4.12Å; L30-E62 HydrophobicContact CG-CG 4.32Å; T37-E62 WeakPolarHBondContact CB-OE1 3.39Å; T37-E62 PolarHBondContact OG1-OE1 3.09Å; G59-E62 VanDerWaalsContact O-CB 3.28Å; G59-E62 WeakPolarHBondContact O-CB 3.47Å; G59-E62 PolarHBondContact O-N 3.05Å; F60-E62 PolarHBondContact O-N 3.49Å
63	L	97.6	Very high	97.1	Very high	13 Å²	13	56.1 Å²	56.1	7%	0.068	31%	0.306	C	S	.	.	S	Bend	trans	-87	132.2	177.9	-56.1	-179.6	0	0	0	110.2	L27 L30 I53 V55 F60 L61 L69	L27-L63 HydrophobicContact CD2-CD2 3.97Å; L27-L63 HydrophobicContact CG-CD2 4.43Å; L30-L63 HydrophobicContact CD1-CD2 4.12Å; I53-L63 HydrophobicContact CD1-CD1 4.05Å; I53-L63 HydrophobicContact CD1-CD2 4.26Å; I53-L63 HydrophobicContact CG2-CD1 4.21Å; V55-L63 HydrophobicContact CG1-CD1 4.37Å; F60-L63 HydrophobicContact CD2-CD1 4.04Å; F60-L63 HydrophobicContact CE2-CD1 4.31Å; F60-L63 WeakPolarHBondContact O-CB 3.43Å; F60-L63 PolarHBondContact O-N 2.9Å; F60-L63 VanDerWaalsContact O-N 3.07Å; L61-L63 VanDerWaalsContact C-N 3.29Å; L63-L69 HydrophobicContact CB-CD2 4.43Å
64	P	95.8	Very high	97	Very high	52 Å²	52	57 Å²	57	34%	0.338	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.7	140.3	176.1	27.9	-34.9	0	0	0	111.1	L22 F23 S66	L22-P64 WeakPolarHBondContact O-CG 3.11Å; F23-P64 HydrophobicContact CD1-CG 3.78Å; F23-P64 HydrophobicContact CE1-CG 3.95Å; F23-P64 HydrophobicContact CG-CG 4.38Å; P64-S66 PolarHBondContact O-N 2.8Å
65	S	93.4	Very high	96.9	Very high	129 Å²	129	58.5 Å²	58.5	90%	0.902	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-62.7	122	165.6	-52.2	0	0	0	0	109.3
66	S	94	Very high	96.9	Very high	36 Å²	36	58.6 Å²	58.6	25%	0.252	32%	0.322	S	S	.	.			trans	-154.7	145.6	-174.1	175.9	0	0	0	0	109.9	P64 H68 L69	P64-S66 PolarHBondContact O-N 2.8Å; S66-H68 PolarHBondContact O-N 3.32Å; S66-H68 PolarHBondContact OG-CD2 3.24Å; S66-H68 PolarHBondContact OG-N 3.29Å; S66-L69 PolarHBondContact O-N 2.88Å; S66-L69 VanDerWaalsContact O-N 3.16Å
67	E	94.5	Very high	96.9	Very high	181 Å²	181	58.6 Å²	58.6	85%	0.846	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-16.1	171.9	65.9	-174.8	156.7	0	0	112.9	L69	E67-L69 VanDerWaalsContact C-N 3.31Å
68	H	95.4	Very high	96.9	Very high	71 Å²	71	54.6 Å²	54.6	33%	0.329	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	0.3	176.7	-56.6	-69	0	0	0	113.7	S19 F23 S66	S19-H68 WeakPolarHBondContact OG-CB 3.26Å; S19-H68 PolarHBondContact OG-ND1 3.38Å; F23-H68 HydrophobicContact CE2-CB 4.18Å; F23-H68 HydrophobicContact CZ-CB 4.36Å; S66-H68 PolarHBondContact O-N 3.32Å; S66-H68 PolarHBondContact OG-CD2 3.24Å; S66-H68 PolarHBondContact OG-N 3.29Å
69	L	97.5	Very high	96.9	Very high	25 Å²	25	51.5 Å²	51.5	13%	0.131	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	106.4	175.5	-172.1	68.1	0	0	0	109.4	A13 V15 F23 F60 L63 S66 E67 V71	A13-L69 HydrophobicContact CB-CD1 3.76Å; A13-L69 HydrophobicContact CB-CG 4.36Å; V15-L69 HydrophobicContact CG2-CD1 3.52Å; F23-L69 HydrophobicContact CD1-CD1 4.45Å; F23-L69 HydrophobicContact CE1-CB 3.82Å; F23-L69 HydrophobicContact CE1-CD1 3.83Å; F23-L69 HydrophobicContact CE1-CD2 4.25Å; F23-L69 HydrophobicContact CE1-CG 4.18Å; F23-L69 HydrophobicContact CZ-CB 3.8Å; F23-L69 HydrophobicContact CZ-CD1 4.32Å; F60-L69 HydrophobicContact CE2-CD2 4.22Å; F60-L69 HydrophobicContact CZ-CD2 4.27Å; L63-L69 HydrophobicContact CB-CD2 4.43Å; S66-L69 PolarHBondContact O-N 2.88Å; S66-L69 VanDerWaalsContact O-N 3.16Å; E67-L69 VanDerWaalsContact C-N 3.31Å; L69-V71 HydrophobicContact CD2-CG2 4.16Å; L69-V71 HydrophobicContact CG-CG2 4.01Å
70	S	97.9	Very high	96.7	Very high	62 Å²	62	53 Å²	53	43%	0.434	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.9	170	-63.1	0	0	0	0	109.1	A13 S14	A13-S70 CarbonylContact C-O 3.52Å; A13-S70 WeakPolarHBondContact CA-O 3.37Å; A13-S70 WeakPolarHBondContact CB-O 3.47Å; S14-S70 PolarHBondContact N-O 2.91Å; S14-S70 PolarHBondContact O-N 3.42Å
71	V	98	Very high	96.4	Very high	56 Å²	56	50.6 Å²	50.6	34%	0.339	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.4	179	-170.5	0	0	0	0	108.7	A13 F60 L69	A13-V71 HydrophobicContact CB-CG2 4.14Å; F60-V71 HydrophobicContact CE2-CG1 4.36Å; F60-V71 HydrophobicContact CE2-CG2 4.02Å; F60-V71 HydrophobicContact CZ-CG1 4.41Å; F60-V71 HydrophobicContact CZ-CG2 3.88Å; L69-V71 HydrophobicContact CD2-CG2 4.16Å; L69-V71 HydrophobicContact CG-CG2 4.01Å
72	A	97.3	Very high	95.8	Very high	6 Å²	6	47 Å²	47	5%	0.05	27%	0.271	C	S	.	.			trans	-63	135	173.1	0	0	0	0	0	109.3	V12 A74 F276 F302	V12-A72 HydrophobicContact CB-CB 4.24Å; V12-A72 WeakPolarHBondContact O-CB 3.33Å; V12-A72 PolarHBondContact O-N 3.18Å; A72-A74 PolarHBondContact O-N 3Å; A72-F276 HydrophobicContact CB-CD1 4.27Å; A72-F276 HydrophobicContact CB-CD2 4.05Å; A72-F276 HydrophobicContact CB-CE1 3.98Å; A72-F276 HydrophobicContact CB-CE2 3.75Å; A72-F276 HydrophobicContact CB-CG 4.31Å; A72-F276 HydrophobicContact CB-CZ 3.71Å; A72-F302 HydrophobicContact CB-CE2 4.39Å
73	D	95.9	Very high	94.5	Very high	161 Å²	161	49.3 Å²	49.3	86%	0.861	29%	0.291	S	S	*	.	S	Bend	trans	-77.9	58.6	-179.4	-171.9	28.7	0	0	0	111.9
74	A	96.8	Very high	92.3	Very high	18 Å²	18	52 Å²	52	15%	0.149	32%	0.322	C	S	.	.	S	Bend	trans	-162	143.5	176.9	0	0	0	0	0	110.8	A72 W76 R128	A72-A74 PolarHBondContact O-N 3Å; A74-W76 HydrophobicContact CB-CZ2 4.27Å; A74-W76 VanDerWaalsContact O-CD1 3.25Å; A74-W76 PolarHBondContact O-NE1 3.32Å; A74-R128 HydrophobicContact CB-CG 3.87Å
75	T	98.3	Very high	89.6	Confident	32 Å²	32	52.9 Å²	52.9	20%	0.196	34%	0.341	C	S	.	.			trans	-88.6	134.1	160.3	-57	0	0	0	0	108.8	R9 Q11 E129	R9-T75 HydrophobicContact CB-CG2 3.84Å; R9-T75 HydrophobicContact CG-CG2 4.39Å; Q11-T75 PolarHBondContact NE2-OG1 3.31Å; T75-E129 PolarHBondContact O-N 2.88Å
76	W	98.6	Very high	86.7	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.008	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	149.1	-176.8	-57.3	79.8	0	0	0	110.7	L10 V12 A74 F115 L126 V127 R128 F276	L10-W76 HydrophobicContact CB-CB 4.17Å; L10-W76 PolarHBondContact N-O 3.01Å; L10-W76 PolarHBondContact O-N 3.46Å; V12-W76 HydrophobicContact CG2-CG 4.26Å; A74-W76 HydrophobicContact CB-CZ2 4.27Å; A74-W76 VanDerWaalsContact O-CD1 3.25Å; A74-W76 PolarHBondContact O-NE1 3.32Å; W76-F115 HydrophobicContact CE3-CB 4.21Å; W76-F115 HydrophobicContact CH2-CB 4.2Å; W76-F115 HydrophobicContact CZ3-CB 3.85Å; W76-L126 HydrophobicContact CB-CB 4.25Å; W76-L126 HydrophobicContact CB-CD2 4.27Å; W76-L126 HydrophobicContact CB-CG 4.45Å; W76-L126 HydrophobicContact CE3-CB 3.95Å; W76-V127 CarbonylContact C-O 3.57Å; W76-V127 VanDerWaalsContact CA-O 3.3Å; W76-V127 WeakPolarHBondContact CA-O 3.44Å; W76-R128 HydrophobicContact CD2-CG 4.22Å; W76-R128 HydrophobicContact CE3-CG 3.95Å; W76-R128 HydrophobicContact CH2-CG 3.83Å; W76-R128 HydrophobicContact CZ2-CG 4.09Å; W76-R128 HydrophobicContact CZ3-CG 3.75Å; W76-F276 HydrophobicContact CH2-CB 4.35Å; W76-F276 HydrophobicContact CH2-CD1 4.13Å; W76-F276 HydrophobicContact CZ2-CB 4.18Å; W76-F276 AromaticContact CZ2-CD1 3.68Å; W76-F276 HydrophobicContact CZ2-CD1 3.68Å; W76-F276 HydrophobicContact CZ2-CE1 4.47Å; W76-F276 HydrophobicContact CZ2-CG 4.22Å
77	L	98.2	Very high	83.7	Confident	10 Å²	10	53.1 Å²	53.1	5%	0.052	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.3	170.4	-62.1	176.6	0	0	0	108.2	I5 R9 L126 V127 E129 L132	I5-L77 HydrophobicContact CG2-CD1 4.27Å; R9-L77 HydrophobicContact CG-CD2 3.92Å; L77-L126 WeakPolarHBondContact O-CA 3.44Å; L77-V127 HydrophobicContact CB-CG2 4.42Å; L77-V127 PolarHBondContact N-O 2.74Å; L77-V127 PolarHBondContact O-N 2.83Å; L77-E129 HydrophobicContact CD1-CB 4.25Å; L77-E129 HydrophobicContact CD1-CG 4.11Å; L77-E129 HydrophobicContact CG-CB 4.14Å; L77-E129 HydrophobicContact CG-CG 4.35Å; L77-L132 HydrophobicContact CD1-CB 4.4Å; L77-L132 HydrophobicContact CD1-CD1 4.2Å; L77-L132 HydrophobicContact CD1-CD2 3.72Å; L77-L132 HydrophobicContact CD1-CG 4.32Å
78	A	97.9	Very high	81	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.5	174	0	0	0	0	0	110.5	L6 L10 F41 F124 L126	L6-A78 HydrophobicContact CB-CB 4.35Å; L6-A78 WeakPolarHBondContact CB-O 3.48Å; L6-A78 HydrophobicContact CD1-CB 3.98Å; L6-A78 HydrophobicContact CG-CB 4.39Å; L6-A78 WeakPolarHBondContact CG-O 3.22Å; L6-A78 PolarHBondContact N-O 3.33Å; L10-A78 HydrophobicContact CD1-CB 3.95Å; F41-A78 HydrophobicContact CE2-CB 4Å; A78-F124 HydrophobicContact CB-CD1 4.22Å; A78-L126 HydrophobicContact CB-CD1 4.36Å
79	L	96.7	Very high	78	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.2	168.8	-44.1	174.8	0	0	0	108.9	L3 H4 I5 I125 V127 V135	L3-L79 HydrophobicContact CD1-CB 4.12Å; H4-L79 CarbonylContact O-C 3.58Å; H4-L79 WeakPolarHBondContact O-CA 3.29Å; I5-L79 HydrophobicContact CB-CD2 4.15Å; I5-L79 HydrophobicContact CG1-CD2 3.66Å; I5-L79 HydrophobicContact CG2-CD2 4.19Å; L79-I125 HydrophobicContact CB-CB 4.2Å; L79-I125 HydrophobicContact CB-CD1 4.45Å; L79-I125 WeakPolarHBondContact CB-O 3.36Å; L79-I125 WeakPolarHBondContact CG-O 3.28Å; L79-I125 PolarHBondContact N-O 2.86Å; L79-I125 PolarHBondContact O-N 2.95Å; L79-V127 HydrophobicContact CD1-CG1 3.77Å; L79-V127 HydrophobicContact CD1-CG2 3.95Å; L79-V127 HydrophobicContact CD2-CG2 4.11Å; L79-V127 HydrophobicContact CG-CG1 4.47Å; L79-V127 HydrophobicContact CG-CG2 4.01Å; L79-V135 HydrophobicContact CD1-CG1 3.73Å
80	N	93.1	Very high	75	Confident	32 Å²	32	58.6 Å²	58.6	17%	0.171	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	136.4	173.9	-171.4	21.1	0	0	0	110	H4 L6 T122	H4-N80 PolarHBondContact N-O 3.43Å; H4-N80 PolarHBondContact O-N 2.93Å; L6-N80 HydrophobicContact CD1-CB 4.5Å; L6-N80 HydrophobicContact CD2-CB 4.45Å; N80-T122 PolarHBondContact OD1-OG1 3.25Å
81	V	92.2	Very high	72	Confident	9 Å²	9	61 Å²	61	6%	0.055	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	121	177.9	177.1	0	0	0	0	109.2	L3 I99 V103 I125 F143	L3-V81 HydrophobicContact CD1-CG2 3.64Å; V81-I99 HydrophobicContact CB-CG2 4.04Å; V81-I99 HydrophobicContact CG1-CG2 4.23Å; V81-I99 HydrophobicContact CG2-CG2 3.88Å; V81-V103 HydrophobicContact CG2-CG2 3.85Å; V81-I125 HydrophobicContact CG2-CD1 4.35Å; V81-F143 HydrophobicContact CG1-CE1 3.79Å; V81-F143 HydrophobicContact CG1-CZ 4.45Å; V81-F143 HydrophobicContact CG2-CE1 4.43Å
82	V	84.8	Confident	69.4	Low	54 Å²	54	64.4 Å²	64.4	33%	0.327	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	113.7	176.6	-174.4	0	0	0	0	109.1	E2 G84	E2-V82 HydrophobicContact CB-CB 4.41Å; E2-V82 PolarHBondContact N-O 3.43Å; E2-V82 PolarHBondContact O-N 3.1Å; V82-G84 PolarHBondContact O-N 3.09Å; V82-G84 VanDerWaalsContact O-N 3.14Å
83	S	71.6	Confident	67	Low	86 Å²	86	65.8 Å²	65.8	60%	0.601	43%	0.431	S	S	*	.			trans	-78.6	94.2	170	-73	0	0	0	0	109.1	G85	S83-G85 PolarHBondContact O-N 3.45Å
84	G	50.2	Low	65.2	Low	71 Å²	71	61.1 Å²	61.1	73%	0.732	41%	0.406	S	S	*	.			trans	-65.3	94.8	170.3	0	0	0	0	0	110.7	V82	V82-G84 PolarHBondContact O-N 3.09Å; V82-G84 VanDerWaalsContact O-N 3.14Å
85	G	40.1	Very low	64	Low	70 Å²	70	60.4 Å²	60.4	72%	0.722	40%	0.4	S	S	*	.			trans	179.6	93.5	178.6	0	0	0	0	0	114.9	S83	S83-G85 PolarHBondContact O-N 3.45Å
86	G	32	Very low	63.2	Low	74 Å²	74	58.9 Å²	58.9	76%	0.763	39%	0.391	S	S	*	.	S	Bend	trans	62	114.7	139.8	0	0	0	0	0	119.4
87	S	30.3	Very low	62.5	Low	95 Å²	95	59.5 Å²	59.5	66%	0.664	40%	0.395	S	S	*	.			trans	75.3	116	165.8	-166.6	0	0	0	0	115.1	S89	S87-S89 WeakPolarHBondContact CB-OG 3.45Å; S87-S89 PolarHBondContact O-N 3.05Å; S87-S89 WeakPolarHBondContact OG-CB 3.39Å; S87-S89 PolarHBondContact OG-N 3.29Å; S87-S89 PolarHBondContact OG-OG 3.29Å
88	F	38.3	Very low	62	Low	227 Å²	227	64.7 Å²	64.7	100%	0.996	42%	0.417	S	S	*	.			trans	-61.6	27	163.5	-87	-93.4	0	0	0	113.2	S90	F88-S90 PolarHBondContact O-N 3.15Å
89	S	33	Very low	61.6	Low	79 Å²	79	65 Å²	65	55%	0.552	42%	0.418	S	S	*	.			trans	-87.2	102.4	177.9	53.3	0	0	0	0	109.9	S87	S87-S89 WeakPolarHBondContact CB-OG 3.45Å; S87-S89 PolarHBondContact O-N 3.05Å; S87-S89 WeakPolarHBondContact OG-CB 3.39Å; S87-S89 PolarHBondContact OG-N 3.29Å; S87-S89 PolarHBondContact OG-OG 3.29Å
90	S	32.8	Very low	61.3	Low	86 Å²	86	65 Å²	65	60%	0.601	42%	0.418	S	S	*	.			trans	69.9	106	172.8	70.8	0	0	0	0	115.8	F88 Q92	F88-S90 PolarHBondContact O-N 3.15Å; S90-Q92 PolarHBondContact O-N 2.89Å
91	S	35.3	Very low	61.2	Low	112 Å²	112	70.8 Å²	70.8	78%	0.783	44%	0.442	S	S	*	.			trans	-50.4	77.1	156.6	51.9	0	0	0	0	110.9
92	Q	44	Very low	61.2	Low	128 Å²	128	71.2 Å²	71.2	60%	0.598	45%	0.446	S	S	*	.			trans	-78.9	123.6	165.9	-71.9	-65.8	-28.9	0	0	106.7	S90 I94	S90-Q92 PolarHBondContact O-N 2.89Å; Q92-I94 PolarHBondContact O-N 2.89Å; Q92-I94 VanDerWaalsContact O-N 3.13Å
93	P	46	Very low	61.7	Low	35 Å²	35	68.7 Å²	68.7	23%	0.227	43%	0.43	C	S	.	.			trans	-53	125.6	-176.7	20.9	-31.5	0	0	0	110.2	G95 K98 Y297	P93-G95 VanDerWaalsContact C-N 3.31Å; P93-G95 PolarHBondContact O-N 2.79Å; P93-G95 VanDerWaalsContact O-N 3.14Å; P93-K98 WeakPolarHBondContact O-CE 3.22Å; P93-K98 PolarHBondContact O-NZ 3.32Å; P93-Y297 HydrophobicContact CB-CE2 4.17Å; P93-Y297 WeakPolarHBondContact CB-OH 3.24Å
94	I	59.5	Low	62.8	Low	64 Å²	64	64.7 Å²	64.7	33%	0.328	40%	0.402	S	S	.	.			trans	-74.7	98.8	166.2	-56.3	172	0	0	0	102.6	Q92	Q92-I94 PolarHBondContact O-N 2.89Å; Q92-I94 VanDerWaalsContact O-N 3.13Å
95	G	71.6	Confident	64.9	Low	2 Å²	2	61.6 Å²	61.6	2%	0.021	37%	0.369	C	S	.	.			trans	-105	157.3	174.5	0	0	0	0	0	109.5	P93 T97 K98 D123 A296	P93-G95 VanDerWaalsContact C-N 3.31Å; P93-G95 PolarHBondContact O-N 2.79Å; P93-G95 VanDerWaalsContact O-N 3.14Å; G95-T97 PolarHBondContact O-N 3.35Å; G95-K98 WeakPolarHBondContact O-CB 3.43Å; G95-K98 PolarHBondContact O-N 2.83Å; G95-D123 VanDerWaalsContact CA-OD2 3.24Å; G95-D123 WeakPolarHBondContact CA-OD2 3.3Å; G95-D123 PolarHBondContact N-OD2 2.77Å; G95-A296 CarbonylContact C-O 3.53Å; G95-A296 WeakPolarHBondContact CA-O 3.24Å
96	V	80.9	Confident	67.5	Low	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-54	-26.7	-173.6	-57.6	0	0	0	0	113.6	K98 I99 A100 M116 S118 D123 A296 Y298	V96-K98 VanDerWaalsContact C-N 3.26Å; V96-K98 PolarHBondContact O-N 2.71Å; V96-I99 CarbonylContact O-C 3.58Å; V96-I99 WeakPolarHBondContact O-CG1 3.28Å; V96-I99 PolarHBondContact O-N 3.04Å; V96-I99 VanDerWaalsContact O-N 3.17Å; V96-A100 PolarHBondContact O-N 3.35Å; V96-M116 HydrophobicContact CB-CE 4.22Å; V96-M116 HydrophobicContact CG1-CE 3.38Å; V96-S118 WeakPolarHBondContact CG1-OG 3.28Å; V96-D123 PolarHBondContact N-OD2 2.87Å; V96-D123 VanDerWaalsContact N-OD2 3.12Å; V96-A296 HydrophobicContact CG2-CB 4.05Å; V96-A296 PolarHBondContact N-O 3Å; V96-Y298 VanDerWaalsContact CG1-CB 3.48Å; V96-Y298 HydrophobicContact CG2-CD2 4.21Å; V96-Y298 HydrophobicContact CG2-CG 4.49Å
97	T	83.9	Confident	70.5	Confident	15 Å²	15	56.1 Å²	56.1	9%	0.092	31%	0.308	C	S	.	.	H	α-helix	trans	-52.5	-39.8	172.4	-52.6	0	0	0	0	112.9	G95 I99 A100 A290 I294 A296	G95-T97 PolarHBondContact O-N 3.35Å; T97-I99 VanDerWaalsContact C-N 3.32Å; T97-I99 PolarHBondContact O-N 3.27Å; T97-A100 WeakPolarHBondContact O-CB 3.14Å; T97-A100 PolarHBondContact O-N 3.17Å; T97-A290 HydrophobicContact CG2-CB 3.55Å; T97-A290 WeakPolarHBondContact O-CB 3.45Å; T97-I294 WeakPolarHBondContact CB-O 3.22Å; T97-I294 WeakPolarHBondContact CG2-O 3.18Å; T97-I294 PolarHBondContact OG1-O 3.22Å; T97-A296 PolarHBondContact OG1-N 3.16Å
98	K	87.2	Confident	73.6	Confident	120 Å²	120	52 Å²	52	52%	0.522	28%	0.279	S	S	.	.	H	α-helix	trans	-70.3	-29.5	-178.5	-70.8	-179.1	178.1	164.8	0	112.7	P93 G95 V96	P93-K98 WeakPolarHBondContact O-CE 3.22Å; P93-K98 PolarHBondContact O-NZ 3.32Å; G95-K98 WeakPolarHBondContact O-CB 3.43Å; G95-K98 PolarHBondContact O-N 2.83Å; V96-K98 VanDerWaalsContact C-N 3.26Å; V96-K98 PolarHBondContact O-N 2.71Å
99	I	90.6	Very high	76.2	Confident	6 Å²	6	43 Å²	43	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	-99.8	-1.2	179	61.4	168.2	0	0	0	112.7	V81 V96 T97 K101 S102 V103 I104 M116 D123 I125	V81-I99 HydrophobicContact CB-CG2 4.04Å; V81-I99 HydrophobicContact CG1-CG2 4.23Å; V81-I99 HydrophobicContact CG2-CG2 3.88Å; V96-I99 CarbonylContact O-C 3.58Å; V96-I99 WeakPolarHBondContact O-CG1 3.28Å; V96-I99 PolarHBondContact O-N 3.04Å; V96-I99 VanDerWaalsContact O-N 3.17Å; T97-I99 VanDerWaalsContact C-N 3.32Å; T97-I99 PolarHBondContact O-N 3.27Å; I99-K101 PolarHBondContact O-N 2.96Å; I99-S102 PolarHBondContact O-N 3.43Å; I99-V103 HydrophobicContact CB-CB 4.26Å; I99-V103 HydrophobicContact CB-CG2 4.21Å; I99-V103 WeakPolarHBondContact O-CA 3.48Å; I99-V103 PolarHBondContact O-N 3.47Å; I99-I104 HydrophobicContact CD1-CD1 4.2Å; I99-I104 HydrophobicContact CD1-CG1 4.37Å; I99-I104 HydrophobicContact CG1-CG1 4.23Å; I99-I104 PolarHBondContact O-N 3.34Å; I99-I104 VanDerWaalsContact O-N 3.15Å; I99-M116 HydrophobicContact CD1-CE 4.09Å; I99-D123 HydrophobicContact CD1-CB 4.28Å; I99-I125 HydrophobicContact CD1-CD1 3.68Å; I99-I125 HydrophobicContact CD1-CG1 3.76Å
100	A	90.5	Very high	79	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	I	π-helix	trans	-56.1	-49.7	-176.2	0	0	0	0	0	111.7	V96 T97 I104 A105 A290	V96-A100 PolarHBondContact O-N 3.35Å; T97-A100 WeakPolarHBondContact O-CB 3.14Å; T97-A100 PolarHBondContact O-N 3.17Å; A100-I104 PolarHBondContact O-N 3.46Å; A100-A105 VanDerWaalsContact O-CB 3.28Å; A100-A105 WeakPolarHBondContact O-CB 3.44Å; A100-A105 PolarHBondContact O-N 3.11Å; A100-A290 HydrophobicContact CB-CB 3.87Å
101	K	90.7	Very high	81.9	Confident	153 Å²	153	42 Å²	42	67%	0.665	22%	0.222	S	C	*	.	I	π-helix	trans	-76.3	-33.9	-178	-71.3	179.5	177.9	171.3	0	113.8	I99 P106	I99-K101 PolarHBondContact O-N 2.96Å; K101-P106 VanDerWaalsContact O-CD 3.31Å; K101-P106 WeakPolarHBondContact O-CD 3.26Å
102	S	91.8	Very high	84.7	Confident	19 Å²	19	37 Å²	37	13%	0.133	19%	0.187	C	C	.	.	I	π-helix	trans	-93.1	-25.4	-171.6	57.6	0	0	0	0	113.4	I99 L139 F143	I99-S102 PolarHBondContact O-N 3.43Å; S102-L139 WeakPolarHBondContact O-CD2 3.21Å; S102-F143 WeakPolarHBondContact O-CE2 3.39Å
103	V	95.1	Very high	87.2	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.16	C	C	.	.	I	π-helix	trans	-124.2	-59.1	-176.2	-177.9	0	0	0	0	111.3	V81 I99 P106 L107 I125 L139 F143	V81-V103 HydrophobicContact CG2-CG2 3.85Å; I99-V103 HydrophobicContact CB-CB 4.26Å; I99-V103 HydrophobicContact CB-CG2 4.21Å; I99-V103 WeakPolarHBondContact O-CA 3.48Å; I99-V103 PolarHBondContact O-N 3.47Å; V103-P106 WeakPolarHBondContact O-CD 3.4Å; V103-L107 HydrophobicContact CG1-CD1 3.91Å; V103-L107 WeakPolarHBondContact O-CB 3.42Å; V103-L107 VanDerWaalsContact O-CG 3.26Å; V103-L107 WeakPolarHBondContact O-CG 3.36Å; V103-L107 PolarHBondContact O-N 3.4Å; V103-L107 VanDerWaalsContact O-N 3.09Å; V103-I125 HydrophobicContact CG1-CG1 4.43Å; V103-L139 HydrophobicContact CG1-CD1 4Å; V103-F143 HydrophobicContact CG2-CE2 3.79Å; V103-F143 HydrophobicContact CG2-CZ 3.72Å
104	I	95.4	Very high	89.7	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	16%	0.155	C	C	.	.	I	π-helix	trans	-65.7	-48.4	-169.2	-53.8	-58.3	0	0	0	111.7	I99 A100 L107 A108 M116 I125 V282 A283	I99-I104 HydrophobicContact CD1-CD1 4.2Å; I99-I104 HydrophobicContact CD1-CG1 4.37Å; I99-I104 HydrophobicContact CG1-CG1 4.23Å; I99-I104 PolarHBondContact O-N 3.34Å; I99-I104 VanDerWaalsContact O-N 3.15Å; A100-I104 PolarHBondContact O-N 3.46Å; I104-L107 PolarHBondContact O-N 3.2Å; I104-A108 WeakPolarHBondContact O-CB 3.35Å; I104-A108 PolarHBondContact O-N 3.44Å; I104-M116 HydrophobicContact CD1-CE 4.19Å; I104-M116 HydrophobicContact CD1-SD 3.81Å; I104-I125 HydrophobicContact CD1-CG1 4.32Å; I104-I125 HydrophobicContact CD1-CG2 4.41Å; I104-V282 HydrophobicContact CD1-CG1 4.44Å; I104-V282 HydrophobicContact CG2-CB 3.95Å; I104-V282 HydrophobicContact CG2-CG1 3.85Å; I104-A283 HydrophobicContact CG2-CB 3.95Å
105	A	94.5	Very high	91.5	Very high	6 Å²	6	28 Å²	28	5%	0.05	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-46.9	179.9	0	0	0	0	0	112.8	A100 L107 A108 D109 R173 E287	A100-A105 VanDerWaalsContact O-CB 3.28Å; A100-A105 WeakPolarHBondContact O-CB 3.44Å; A100-A105 PolarHBondContact O-N 3.11Å; A105-L107 VanDerWaalsContact C-N 3.34Å; A105-L107 PolarHBondContact O-N 2.78Å; A105-A108 PolarHBondContact O-N 3.02Å; A105-D109 PolarHBondContact O-N 3.3Å; A105-R173 PolarHBondContact O-NH2 2.97Å; A105-E287 HydrophobicContact CB-CG 4.17Å; A105-E287 WeakPolarHBondContact CB-OE1 3.16Å
106	P	94.2	Very high	92.7	Very high	29 Å²	29	27.9 Å²	27.9	19%	0.188	14%	0.141	C	C	.	.	H	α-helix	trans	-57.2	-41.6	173.7	-29.8	37	0	0	0	114.2	K101 V103 D109 Q110 T138 L139	K101-P106 VanDerWaalsContact O-CD 3.31Å; K101-P106 WeakPolarHBondContact O-CD 3.26Å; V103-P106 WeakPolarHBondContact O-CD 3.4Å; P106-D109 PolarHBondContact O-N 2.94Å; P106-Q110 PolarHBondContact O-N 3.45Å; P106-T138 HydrophobicContact CB-CG2 3.83Å; P106-T138 WeakPolarHBondContact O-CG2 3.41Å; P106-L139 HydrophobicContact CB-CD2 4.03Å
107	L	95.4	Very high	93.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.8	-42.1	176.1	-68.3	-179.4	0	0	0	111.5	V103 I104 A105 D109 Q110 N111 I112 V114 V127 V135 T138 L139	V103-L107 HydrophobicContact CG1-CD1 3.91Å; V103-L107 WeakPolarHBondContact O-CB 3.42Å; V103-L107 VanDerWaalsContact O-CG 3.26Å; V103-L107 WeakPolarHBondContact O-CG 3.36Å; V103-L107 PolarHBondContact O-N 3.4Å; V103-L107 VanDerWaalsContact O-N 3.09Å; I104-L107 PolarHBondContact O-N 3.2Å; A105-L107 VanDerWaalsContact C-N 3.34Å; A105-L107 PolarHBondContact O-N 2.78Å; L107-D109 VanDerWaalsContact C-N 3.35Å; L107-D109 PolarHBondContact O-N 3.12Å; L107-Q110 CarbonylContact O-C 3.57Å; L107-Q110 PolarHBondContact O-N 2.86Å; L107-N111 PolarHBondContact O-N 3.18Å; L107-I112 HydrophobicContact CB-CB 4.17Å; L107-I112 HydrophobicContact CD2-CB 4.32Å; L107-I112 HydrophobicContact CD2-CD1 3.67Å; L107-I112 HydrophobicContact CD2-CG2 4.31Å; L107-I112 WeakPolarHBondContact O-CB 3.33Å; L107-I112 PolarHBondContact O-N 3.06Å; L107-V114 HydrophobicContact CB-CG1 4.3Å; L107-V114 HydrophobicContact CD1-CG1 3.65Å; L107-V127 HydrophobicContact CD1-CG1 4.4Å; L107-V135 HydrophobicContact CD2-CB 4.23Å; L107-V135 HydrophobicContact CD2-CG1 4.14Å; L107-V135 HydrophobicContact CD2-CG2 4.02Å; L107-T138 HydrophobicContact CD2-CG2 4.21Å; L107-L139 HydrophobicContact CD1-CD1 4.32Å; L107-L139 HydrophobicContact CD2-CD1 4.09Å; L107-L139 HydrophobicContact CD2-CD2 4.38Å; L107-L139 HydrophobicContact CD2-CG 4.12Å; L107-L139 HydrophobicContact CG-CD1 4.3Å; L107-L139 HydrophobicContact CG-CD2 4.35Å
108	A	94.8	Very high	94.1	Very high	8 Å²	8	27.2 Å²	27.2	7%	0.066	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-39.5	175.1	0	0	0	0	0	112.4	I104 A105 Q110 N111 A283	I104-A108 WeakPolarHBondContact O-CB 3.35Å; I104-A108 PolarHBondContact O-N 3.44Å; A105-A108 PolarHBondContact O-N 3.02Å; A108-Q110 PolarHBondContact O-N 2.93Å; A108-N111 PolarHBondContact O-N 3.5Å; A108-A283 HydrophobicContact CB-CB 3.83Å
109	D	92.9	Very high	94.5	Very high	38 Å²	38	21.6 Å²	21.6	20%	0.203	11%	0.113	C	C	.	.	H	α-helix	trans	-59.7	-30.4	175.2	-83.3	-36.3	0	0	0	113.4	A105 P106 L107 N111 V171 R173	A105-D109 PolarHBondContact O-N 3.3Å; P106-D109 PolarHBondContact O-N 2.94Å; L107-D109 VanDerWaalsContact C-N 3.35Å; L107-D109 PolarHBondContact O-N 3.12Å; D109-N111 VanDerWaalsContact C-N 3.34Å; D109-V171 WeakPolarHBondContact OD1-CG2 3.33Å; D109-R173 IonicContact OD1-CZ 3.09Å; D109-R173 IonicContact OD1-NH2 3.75Å; D109-R173 PolarHBondContact OD1-NH2 3.4Å; D109-R173 IonicContact OD2-NH2 2.65Å; D109-R173 PolarHBondContact OD2-NH2 2.92Å; D109-R173 VanDerWaalsContact OD2-NH2 3.09Å
110	Q	92	Very high	94.6	Very high	34 Å²	34	24.4 Å²	24.4	16%	0.159	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	11.1	176.4	-60.5	-54.9	-47	0	0	113.2	P106 L107 A108 I112 T138 F165 V166	P106-Q110 PolarHBondContact O-N 3.45Å; L107-Q110 CarbonylContact O-C 3.57Å; L107-Q110 PolarHBondContact O-N 2.86Å; A108-Q110 PolarHBondContact O-N 2.93Å; Q110-I112 VanDerWaalsContact C-N 3.26Å; Q110-I112 HydrophobicContact CB-CD1 3.92Å; Q110-I112 HydrophobicContact CB-CG1 4.09Å; Q110-I112 PolarHBondContact O-N 3.5Å; Q110-T138 HydrophobicContact CG-CG2 3.8Å; Q110-T138 WeakPolarHBondContact CG-OG1 3.42Å; Q110-F165 HydrophobicContact CG-CD1 4.48Å; Q110-V166 PolarHBondContact NE2-O 2.89Å; Q110-V166 VanDerWaalsContact OE1-N 3.17Å; Q110-V166 PolarHBondContact OE1-O 3.33Å
111	N	93.2	Very high	94.5	Very high	111 Å²	111	27.3 Å²	27.3	59%	0.594	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	43.7	-176.1	-55.6	-72.8	0	0	0	112.4	L107 A108 D109 C279	L107-N111 PolarHBondContact O-N 3.18Å; A108-N111 PolarHBondContact O-N 3.5Å; D109-N111 VanDerWaalsContact C-N 3.34Å; N111-C279 HydrophobicContact CB-CB 4.41Å; N111-C279 PolarHBondContact O-SG 3.41Å
112	I	95.3	Very high	94.6	Very high	8 Å²	8	20.8 Å²	20.8	4%	0.041	11%	0.11	C	C	.	.			trans	-98.4	118.2	173	-58.7	168.2	0	0	0	107.7	L107 Q110 D131 F134 V135	L107-I112 HydrophobicContact CB-CB 4.17Å; L107-I112 HydrophobicContact CD2-CB 4.32Å; L107-I112 HydrophobicContact CD2-CD1 3.67Å; L107-I112 HydrophobicContact CD2-CG2 4.31Å; L107-I112 WeakPolarHBondContact O-CB 3.33Å; L107-I112 PolarHBondContact O-N 3.06Å; Q110-I112 VanDerWaalsContact C-N 3.26Å; Q110-I112 HydrophobicContact CB-CD1 3.92Å; Q110-I112 HydrophobicContact CB-CG1 4.09Å; Q110-I112 PolarHBondContact O-N 3.5Å; I112-D131 HydrophobicContact CG2-CB 4.4Å; I112-F134 HydrophobicContact CD1-CB 3.8Å; I112-F134 HydrophobicContact CG1-CB 4.39Å; I112-V135 HydrophobicContact CD1-CG2 4.2Å; I112-V135 HydrophobicContact CG2-CG2 3.84Å
113	S	96	Very high	94.7	Very high	5 Å²	5	20 Å²	20	4%	0.035	10%	0.104	C	C	.	.			trans	-72	139.7	175.1	-179.8	0	0	0	0	110.3	F276 C279	S113-F276 WeakPolarHBondContact CB-O 3.3Å; S113-F276 PolarHBondContact OG-O 3.14Å; S113-C279 PolarHBondContact N-SG 3.13Å; S113-C279 VanDerWaalsContact N-SG 3.42Å
114	V	97.8	Very high	94.7	Very high	21 Å²	21	20.6 Å²	20.6	13%	0.127	11%	0.107	C	C	.	.			trans	-128.8	147.1	178.1	-59.9	0	0	0	0	109.4	L107 I125 L126 V127 V282	L107-V114 HydrophobicContact CB-CG1 4.3Å; L107-V114 HydrophobicContact CD1-CG1 3.65Å; V114-I125 HydrophobicContact CB-CG2 3.98Å; V114-I125 HydrophobicContact CG1-CG2 3.89Å; V114-L126 WeakPolarHBondContact CA-O 3.46Å; V114-V127 HydrophobicContact CG1-CG1 4.2Å; V114-V282 HydrophobicContact CG2-CB 4.2Å; V114-V282 HydrophobicContact CG2-CG2 3.87Å
115	F	97.9	Very high	94.9	Very high	10 Å²	10	20.6 Å²	20.6	4%	0.044	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.6	173.6	-167	-82.3	0	0	0	108.3	V12 I54 W76 L126 F276 S300 T301	V12-F115 HydrophobicContact CG1-CE1 4.31Å; V12-F115 HydrophobicContact CG1-CE2 4.3Å; V12-F115 HydrophobicContact CG1-CZ 3.93Å; I54-F115 HydrophobicContact CD1-CD1 4.32Å; I54-F115 HydrophobicContact CD1-CE1 3.73Å; I54-F115 HydrophobicContact CG1-CE1 4.33Å; W76-F115 HydrophobicContact CE3-CB 4.21Å; W76-F115 HydrophobicContact CH2-CB 4.2Å; W76-F115 HydrophobicContact CZ3-CB 3.85Å; F115-L126 HydrophobicContact CB-CB 4.03Å; F115-L126 HydrophobicContact CD1-CD2 4.29Å; F115-L126 PolarHBondContact N-O 2.8Å; F115-L126 WeakPolarHBondContact O-CA 3.45Å; F115-L126 VanDerWaalsContact O-CB 3.28Å; F115-L126 WeakPolarHBondContact O-CB 3.4Å; F115-L126 PolarHBondContact O-N 3.17Å; F115-F276 HydrophobicContact CD2-CD1 4.06Å; F115-F276 AromaticContact CD2-CE1 3.91Å; F115-F276 HydrophobicContact CD2-CE1 3.91Å; F115-F276 HydrophobicContact CE2-CD1 4.25Å; F115-F276 AromaticContact CE2-CE1 3.67Å; F115-F276 HydrophobicContact CE2-CE1 3.67Å; F115-S300 VanDerWaalsContact CE1-CB 3.49Å; F115-S300 WeakPolarHBondContact CE1-O 3.49Å; F115-S300 VanDerWaalsContact CZ-CB 3.46Å; F115-S300 WeakPolarHBondContact CZ-O 3.21Å; F115-T301 WeakPolarHBondContact CE2-O 3.38Å
116	M	97.6	Very high	95	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.4	-168.4	-67.8	-60.1	-65.8	0	0	112.1	V96 I99 I104 D123 I125 V282 Y298 S300	V96-M116 HydrophobicContact CB-CE 4.22Å; V96-M116 HydrophobicContact CG1-CE 3.38Å; I99-M116 HydrophobicContact CD1-CE 4.09Å; I104-M116 HydrophobicContact CD1-CE 4.19Å; I104-M116 HydrophobicContact CD1-SD 3.81Å; M116-D123 HydrophobicContact CE-CB 4.5Å; M116-I125 HydrophobicContact CE-CG1 3.97Å; M116-I125 HydrophobicContact SD-CB 4.11Å; M116-I125 HydrophobicContact SD-CG1 3.88Å; M116-I125 HydrophobicContact SD-CG2 3.94Å; M116-V282 HydrophobicContact CG-CB 4.39Å; M116-V282 HydrophobicContact CG-CG1 3.77Å; M116-V282 HydrophobicContact CG-CG2 3.77Å; M116-Y298 HydrophobicContact CB-CD1 3.71Å; M116-Y298 HydrophobicContact CB-CG 4.3Å; M116-Y298 HydrophobicContact CG-CD1 4.15Å; M116-S300 PolarHBondContact N-OG 3.17Å; M116-S300 VanDerWaalsContact N-OG 3.14Å; M116-S300 WeakPolarHBondContact O-CB 3.27Å; M116-S300 PolarHBondContact O-N 3.2Å
117	L	97.8	Very high	95.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	94.6	167.8	179.2	68.9	0	0	0	109.5	F41 I54 T119 F124 I234 I299	F41-L117 HydrophobicContact CE1-CD2 3.86Å; F41-L117 HydrophobicContact CZ-CD2 3.93Å; I54-L117 HydrophobicContact CD1-CB 4.25Å; I54-L117 HydrophobicContact CD1-CD1 4.23Å; I54-L117 HydrophobicContact CD1-CD2 4.08Å; I54-L117 HydrophobicContact CD1-CG 4.42Å; L117-T119 HydrophobicContact CG-CG2 4.32Å; L117-F124 HydrophobicContact CB-CB 4.35Å; L117-F124 HydrophobicContact CD2-CD2 4.41Å; L117-F124 PolarHBondContact N-O 3.06Å; L117-F124 PolarHBondContact O-N 3.17Å; L117-I234 HydrophobicContact CD2-CD1 3.79Å; L117-I299 HydrophobicContact CD1-CG2 4.48Å
118	S	95.9	Very high	95.3	Very high	1 Å²	1	20 Å²	20	1%	0.007	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131.9	168	-58.5	0	0	0	0	110.9	V96 D123 Y298	V96-S118 WeakPolarHBondContact CG1-OG 3.28Å; S118-D123 WeakPolarHBondContact CB-OD1 3.39Å; S118-D123 PolarHBondContact OG-OD1 2.78Å; S118-Y298 VanDerWaalsContact CB-N 3.35Å; S118-Y298 WeakPolarHBondContact CB-O 3.44Å; S118-Y298 PolarHBondContact N-O 3.12Å; S118-Y298 PolarHBondContact OG-N 2.96Å; S118-Y298 PolarHBondContact OG-O 3.4Å; S118-Y298 VanDerWaalsContact OG-O 3.12Å
119	T	94.6	Very high	95.4	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.018	11%	0.111	C	C	.	.			trans	-117.6	169.7	173.8	65.9	0	0	0	0	109.7	L117 Q121 T122 F124 I234 S239 Y297	L117-T119 HydrophobicContact CG-CG2 4.32Å; T119-Q121 PolarHBondContact O-N 3.37Å; T119-Q121 PolarHBondContact OG1-N 2.86Å; T119-T122 PolarHBondContact N-O 3.37Å; T119-T122 PolarHBondContact OG1-N 3.28Å; T119-T122 PolarHBondContact OG1-O 2.91Å; T119-F124 HydrophobicContact CG2-CD2 3.99Å; T119-F124 HydrophobicContact CG2-CE2 3.76Å; T119-I234 HydrophobicContact CG2-CD1 4.14Å; T119-S239 WeakPolarHBondContact CA-OG 3.49Å; T119-Y297 VanDerWaalsContact O-CE1 3.31Å; T119-Y297 WeakPolarHBondContact O-CE1 3.48Å
120	Y	92.3	Very high	95.5	Very high	64 Å²	64	28.2 Å²	28.2	25%	0.251	13%	0.129	S	C	.	.	S	Bend	trans	-55.1	-34.3	172.8	-176.6	-90.1	0	0	0	112.4	V188 S239	Y120-V188 HydrophobicContact CD2-CG1 4.25Å; Y120-S239 PolarHBondContact N-OG 2.79Å
121	Q	89.6	Confident	95.7	Very high	61 Å²	61	27.7 Å²	27.7	29%	0.285	13%	0.127	S	C	.	.	S	Bend	trans	-87.1	-42.1	-174.4	-63.4	76.3	21	0	0	113	T119 S190 Y237 I238	T119-Q121 PolarHBondContact O-N 3.37Å; T119-Q121 PolarHBondContact OG1-N 2.86Å; Q121-S190 PolarHBondContact NE2-OG 2.78Å; Q121-Y237 HydrophobicContact CG-CD1 4.06Å; Q121-Y237 HydrophobicContact CG-CG 4.17Å; Q121-I238 PolarHBondContact NE2-O 3.26Å
122	T	91.8	Very high	95.8	Very high	16 Å²	16	23.6 Å²	23.6	10%	0.098	11%	0.105	C	C	.	.			trans	-161	169.3	-176.1	-161.7	0	0	0	0	113	N80 T119 F124	N80-T122 PolarHBondContact OD1-OG1 3.25Å; T119-T122 PolarHBondContact N-O 3.37Å; T119-T122 PolarHBondContact OG1-N 3.28Å; T119-T122 PolarHBondContact OG1-O 2.91Å; T122-F124 HydrophobicContact CG2-CD1 4.36Å; T122-F124 HydrophobicContact CG2-CD2 4.21Å; T122-F124 HydrophobicContact CG2-CE1 3.86Å; T122-F124 HydrophobicContact CG2-CE2 3.67Å; T122-F124 HydrophobicContact CG2-CZ 3.48Å; T122-F124 VanDerWaalsContact CG2-CZ 3.48Å
123	D	93.8	Very high	95.7	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	125.3	168.9	-63.1	-53.6	0	0	0	110.8	G95 V96 I99 M116 S118	G95-D123 VanDerWaalsContact CA-OD2 3.24Å; G95-D123 WeakPolarHBondContact CA-OD2 3.3Å; G95-D123 PolarHBondContact N-OD2 2.77Å; V96-D123 PolarHBondContact N-OD2 2.87Å; V96-D123 VanDerWaalsContact N-OD2 3.12Å; I99-D123 HydrophobicContact CD1-CB 4.28Å; M116-D123 HydrophobicContact CE-CB 4.5Å; S118-D123 WeakPolarHBondContact CB-OD1 3.39Å; S118-D123 PolarHBondContact OG-OD1 2.78Å
124	F	96.9	Very high	95.6	Very high	13 Å²	13	27.8 Å²	27.8	6%	0.057	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.3	168.3	-60.4	-78.3	0	0	0	110.2	L6 F41 A78 L117 T119 T122 L126 I234	L6-F124 HydrophobicContact CD1-CD1 3.92Å; L6-F124 HydrophobicContact CD1-CE1 3.65Å; F41-F124 AromaticContact CE2-CD1 3.91Å; F41-F124 HydrophobicContact CE2-CD1 3.91Å; F41-F124 HydrophobicContact CE2-CD2 4.32Å; F41-F124 HydrophobicContact CE2-CE1 4.02Å; F41-F124 HydrophobicContact CE2-CE2 4.44Å; F41-F124 HydrophobicContact CE2-CG 4.06Å; F41-F124 HydrophobicContact CE2-CZ 4.29Å; F41-F124 HydrophobicContact CZ-CB 4.39Å; F41-F124 HydrophobicContact CZ-CD1 4.35Å; F41-F124 HydrophobicContact CZ-CD2 4.14Å; F41-F124 HydrophobicContact CZ-CG 4.03Å; A78-F124 HydrophobicContact CB-CD1 4.22Å; L117-F124 HydrophobicContact CB-CB 4.35Å; L117-F124 HydrophobicContact CD2-CD2 4.41Å; L117-F124 PolarHBondContact N-O 3.06Å; L117-F124 PolarHBondContact O-N 3.17Å; T119-F124 HydrophobicContact CG2-CD2 3.99Å; T119-F124 HydrophobicContact CG2-CE2 3.76Å; T122-F124 HydrophobicContact CG2-CD1 4.36Å; T122-F124 HydrophobicContact CG2-CD2 4.21Å; T122-F124 HydrophobicContact CG2-CE1 3.86Å; T122-F124 HydrophobicContact CG2-CE2 3.67Å; T122-F124 HydrophobicContact CG2-CZ 3.48Å; T122-F124 VanDerWaalsContact CG2-CZ 3.48Å; F124-L126 HydrophobicContact CB-CD1 3.86Å; F124-I234 HydrophobicContact CD2-CD1 3.98Å; F124-I234 HydrophobicContact CE1-CG2 4.39Å; F124-I234 HydrophobicContact CE2-CD1 3.53Å; F124-I234 HydrophobicContact CE2-CG2 4.25Å; F124-I234 HydrophobicContact CZ-CB 4.45Å; F124-I234 HydrophobicContact CZ-CD1 4.16Å; F124-I234 HydrophobicContact CZ-CG2 3.76Å
125	I	97.6	Very high	95.4	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	108.5	172.3	-49.1	90.5	0	0	0	107.3	L79 V81 I99 V103 I104 V114 M116 V127	L79-I125 HydrophobicContact CB-CB 4.2Å; L79-I125 HydrophobicContact CB-CD1 4.45Å; L79-I125 WeakPolarHBondContact CB-O 3.36Å; L79-I125 WeakPolarHBondContact CG-O 3.28Å; L79-I125 PolarHBondContact N-O 2.86Å; L79-I125 PolarHBondContact O-N 2.95Å; V81-I125 HydrophobicContact CG2-CD1 4.35Å; I99-I125 HydrophobicContact CD1-CD1 3.68Å; I99-I125 HydrophobicContact CD1-CG1 3.76Å; V103-I125 HydrophobicContact CG1-CG1 4.43Å; I104-I125 HydrophobicContact CD1-CG1 4.32Å; I104-I125 HydrophobicContact CD1-CG2 4.41Å; V114-I125 HydrophobicContact CB-CG2 3.98Å; V114-I125 HydrophobicContact CG1-CG2 3.89Å; M116-I125 HydrophobicContact CE-CG1 3.97Å; M116-I125 HydrophobicContact SD-CB 4.11Å; M116-I125 HydrophobicContact SD-CG1 3.88Å; M116-I125 HydrophobicContact SD-CG2 3.94Å; I125-V127 HydrophobicContact CG2-CG1 4.41Å
126	L	98.5	Very high	95.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.6	176.9	-77	62	0	0	0	109.3	L10 V12 I54 W76 L77 A78 V114 F115 F124	L10-L126 HydrophobicContact CD1-CD1 4.39Å; L10-L126 HydrophobicContact CD1-CD2 3.79Å; L10-L126 HydrophobicContact CD1-CG 3.93Å; V12-L126 HydrophobicContact CG2-CD2 4.32Å; I54-L126 HydrophobicContact CG2-CD2 3.76Å; W76-L126 HydrophobicContact CB-CB 4.25Å; W76-L126 HydrophobicContact CB-CD2 4.27Å; W76-L126 HydrophobicContact CB-CG 4.45Å; W76-L126 HydrophobicContact CE3-CB 3.95Å; L77-L126 WeakPolarHBondContact O-CA 3.44Å; A78-L126 HydrophobicContact CB-CD1 4.36Å; V114-L126 WeakPolarHBondContact CA-O 3.46Å; F115-L126 HydrophobicContact CB-CB 4.03Å; F115-L126 HydrophobicContact CD1-CD2 4.29Å; F115-L126 PolarHBondContact N-O 2.8Å; F115-L126 WeakPolarHBondContact O-CA 3.45Å; F115-L126 VanDerWaalsContact O-CB 3.28Å; F115-L126 WeakPolarHBondContact O-CB 3.4Å; F115-L126 PolarHBondContact O-N 3.17Å; F124-L126 HydrophobicContact CB-CD1 3.86Å
127	V	98.1	Very high	95	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.9	174.1	-64.4	0	0	0	0	109.5	W76 L77 L79 L107 V114 I125 E129 V135	W76-V127 CarbonylContact C-O 3.57Å; W76-V127 VanDerWaalsContact CA-O 3.3Å; W76-V127 WeakPolarHBondContact CA-O 3.44Å; L77-V127 HydrophobicContact CB-CG2 4.42Å; L77-V127 PolarHBondContact N-O 2.74Å; L77-V127 PolarHBondContact O-N 2.83Å; L79-V127 HydrophobicContact CD1-CG1 3.77Å; L79-V127 HydrophobicContact CD1-CG2 3.95Å; L79-V127 HydrophobicContact CD2-CG2 4.11Å; L79-V127 HydrophobicContact CG-CG1 4.47Å; L79-V127 HydrophobicContact CG-CG2 4.01Å; L107-V127 HydrophobicContact CD1-CG1 4.4Å; V114-V127 HydrophobicContact CG1-CG1 4.2Å; I125-V127 HydrophobicContact CG2-CG1 4.41Å; V127-E129 PolarHBondContact O-N 3.47Å; V127-V135 HydrophobicContact CB-CG2 3.99Å; V127-V135 HydrophobicContact CG1-CG2 3.86Å; V127-V135 HydrophobicContact CG2-CG2 4.14Å
128	R	97.7	Very high	94.7	Very high	22 Å²	22	30.9 Å²	30.9	8%	0.083	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	137	175.9	-61.1	-179.6	-68.6	-153	-6.1	109.3	A74 W76 R130 D131 L132 D277	A74-R128 HydrophobicContact CB-CG 3.87Å; W76-R128 HydrophobicContact CD2-CG 4.22Å; W76-R128 HydrophobicContact CE3-CG 3.95Å; W76-R128 HydrophobicContact CH2-CG 3.83Å; W76-R128 HydrophobicContact CZ2-CG 4.09Å; W76-R128 HydrophobicContact CZ3-CG 3.75Å; R128-R130 HydrophobicContact CB-CG 4.09Å; R128-R130 PolarHBondContact O-N 3.36Å; R128-D131 HydrophobicContact CB-CB 4.43Å; R128-D131 IonicContact CZ-OD2 3.76Å; R128-D131 VanDerWaalsContact CZ-OD2 3.23Å; R128-D131 IonicContact NE-OD2 2.68Å; R128-D131 PolarHBondContact NE-OD2 3.24Å; R128-D131 IonicContact NH2-OD2 3.65Å; R128-D131 PolarHBondContact NH2-OD2 2.97Å; R128-D131 WeakPolarHBondContact O-CA 3.43Å; R128-D131 PolarHBondContact O-N 3.37Å; R128-L132 PolarHBondContact O-N 2.79Å; R128-D277 IonicContact CZ-OD1 3.02Å; R128-D277 IonicContact NH1-OD1 2.73Å; R128-D277 PolarHBondContact NH1-OD1 2.93Å
129	E	96.7	Very high	94.6	Very high	66 Å²	66	30.9 Å²	30.9	31%	0.308	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-55.2	-38.2	-179.5	-178.4	169.2	-145.4	0	0	111.9	R9 T75 L77 V127 D131 L132	R9-E129 IonicContact CZ-OE1 3.44Å; R9-E129 IonicContact CZ-OE2 2.77Å; R9-E129 IonicContact NE-OE1 3.15Å; R9-E129 PolarHBondContact NE-OE1 2.75Å; R9-E129 IonicContact NE-OE2 2.67Å; R9-E129 PolarHBondContact NE-OE2 3.04Å; R9-E129 VanDerWaalsContact NE-OE2 3.17Å; R9-E129 IonicContact NH2-OE1 2.75Å; R9-E129 IonicContact NH2-OE2 2.79Å; R9-E129 PolarHBondContact NH2-OE2 2.72Å; T75-E129 PolarHBondContact O-N 2.88Å; L77-E129 HydrophobicContact CD1-CB 4.25Å; L77-E129 HydrophobicContact CD1-CG 4.11Å; L77-E129 HydrophobicContact CG-CB 4.14Å; L77-E129 HydrophobicContact CG-CG 4.35Å; V127-E129 PolarHBondContact O-N 3.47Å; E129-D131 PolarHBondContact O-N 3.37Å; E129-L132 VanDerWaalsContact O-CB 3.27Å; E129-L132 WeakPolarHBondContact O-CB 3.41Å; E129-L132 PolarHBondContact O-N 2.85Å
130	R	95.3	Very high	94.5	Very high	154 Å²	154	33.4 Å²	33.4	58%	0.581	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-63.3	-25.4	175.8	70.7	-177.4	-177.1	-164.9	-1	114.4	R128	R128-R130 HydrophobicContact CB-CG 4.09Å; R128-R130 PolarHBondContact O-N 3.36Å
131	D	95.1	Very high	94.3	Very high	23 Å²	23	35 Å²	35	12%	0.123	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-92.9	-7	-177.8	-62.9	-22.5	0	0	0	112	I112 R128 E129 P133 F134 V135	I112-D131 HydrophobicContact CG2-CB 4.4Å; R128-D131 HydrophobicContact CB-CB 4.43Å; R128-D131 IonicContact CZ-OD2 3.76Å; R128-D131 VanDerWaalsContact CZ-OD2 3.23Å; R128-D131 IonicContact NE-OD2 2.68Å; R128-D131 PolarHBondContact NE-OD2 3.24Å; R128-D131 IonicContact NH2-OD2 3.65Å; R128-D131 PolarHBondContact NH2-OD2 2.97Å; R128-D131 WeakPolarHBondContact O-CA 3.43Å; R128-D131 PolarHBondContact O-N 3.37Å; E129-D131 PolarHBondContact O-N 3.37Å; D131-P133 VanDerWaalsContact C-N 3.33Å; D131-F134 WeakPolarHBondContact O-CA 3.39Å; D131-F134 WeakPolarHBondContact O-CB 3.34Å; D131-F134 PolarHBondContact O-N 2.78Å; D131-V135 WeakPolarHBondContact O-CG2 3.22Å; D131-V135 PolarHBondContact O-N 2.76Å
132	L	94.8	Very high	94.2	Very high	25 Å²	25	37.5 Å²	37.5	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-51.2	-40.2	-179.1	-174.7	67.6	0	0	0	114.4	I5 L77 R128 E129 F134 V135 T136	I5-L132 HydrophobicContact CD1-CD1 3.86Å; I5-L132 HydrophobicContact CG1-CD1 4.15Å; I5-L132 HydrophobicContact CG2-CD1 4.28Å; L77-L132 HydrophobicContact CD1-CB 4.4Å; L77-L132 HydrophobicContact CD1-CD1 4.2Å; L77-L132 HydrophobicContact CD1-CD2 3.72Å; L77-L132 HydrophobicContact CD1-CG 4.32Å; R128-L132 PolarHBondContact O-N 2.79Å; E129-L132 VanDerWaalsContact O-CB 3.27Å; E129-L132 WeakPolarHBondContact O-CB 3.41Å; E129-L132 PolarHBondContact O-N 2.85Å; L132-F134 VanDerWaalsContact C-N 3.27Å; L132-F134 PolarHBondContact O-N 2.92Å; L132-V135 PolarHBondContact O-N 2.81Å; L132-T136 HydrophobicContact CD1-CG2 4.12Å; L132-T136 HydrophobicContact CG-CG2 4.22Å; L132-T136 WeakPolarHBondContact O-CG2 3.17Å; L132-T136 PolarHBondContact O-N 2.99Å; L132-T136 PolarHBondContact O-OG1 2.89Å
133	P	93.4	Very high	94.2	Very high	27 Å²	27	37.1 Å²	37.1	18%	0.175	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-35.1	176	-22.1	33.6	0	0	0	113.4	D131 T136 H137 L159 I161	D131-P133 VanDerWaalsContact C-N 3.33Å; P133-T136 WeakPolarHBondContact CA-OG1 3.11Å; P133-T136 PolarHBondContact O-OG1 3.12Å; P133-H137 PolarHBondContact O-N 2.88Å; P133-L159 HydrophobicContact CB-CB 4.26Å; P133-L159 HydrophobicContact CB-CD1 3.92Å; P133-L159 HydrophobicContact CG-CD1 3.66Å; P133-I161 HydrophobicContact CB-CD1 3.24Å; P133-I161 HydrophobicContact CB-CG1 4.02Å; P133-I161 HydrophobicContact CG-CD1 4.2Å
134	F	93.4	Very high	94.2	Very high	74 Å²	74	41.1 Å²	41.1	33%	0.325	21%	0.212	S	C	.	.	H	α-helix	trans	-75.4	-40	176.6	-60.4	-80.3	0	0	0	111.2	I112 D131 L132 T138 I161 F165	I112-F134 HydrophobicContact CD1-CB 3.8Å; I112-F134 HydrophobicContact CG1-CB 4.39Å; D131-F134 WeakPolarHBondContact O-CA 3.39Å; D131-F134 WeakPolarHBondContact O-CB 3.34Å; D131-F134 PolarHBondContact O-N 2.78Å; L132-F134 VanDerWaalsContact C-N 3.27Å; L132-F134 PolarHBondContact O-N 2.92Å; F134-T138 VanDerWaalsContact O-CB 3.26Å; F134-T138 WeakPolarHBondContact O-CB 3.47Å; F134-T138 PolarHBondContact O-N 3.45Å; F134-T138 PolarHBondContact O-OG1 2.72Å; F134-I161 HydrophobicContact CE1-CG2 4.26Å; F134-I161 HydrophobicContact CZ-CD1 4.45Å; F134-F165 HydrophobicContact CB-CE1 4.22Å; F134-F165 AromaticContact CD1-CE1 3.72Å; F134-F165 HydrophobicContact CD1-CE1 3.72Å; F134-F165 AromaticContact CD1-CZ 3.66Å; F134-F165 HydrophobicContact CD1-CZ 3.66Å; F134-F165 HydrophobicContact CE1-CZ 4.39Å; F134-F165 HydrophobicContact CG-CE1 4.47Å
135	V	94.9	Very high	94.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-57.6	-51.3	174.5	171.4	0	0	0	0	110.8	L79 L107 I112 V127 D131 L132 H137 T138 L139	L79-V135 HydrophobicContact CD1-CG1 3.73Å; L107-V135 HydrophobicContact CD2-CB 4.23Å; L107-V135 HydrophobicContact CD2-CG1 4.14Å; L107-V135 HydrophobicContact CD2-CG2 4.02Å; I112-V135 HydrophobicContact CD1-CG2 4.2Å; I112-V135 HydrophobicContact CG2-CG2 3.84Å; V127-V135 HydrophobicContact CB-CG2 3.99Å; V127-V135 HydrophobicContact CG1-CG2 3.86Å; V127-V135 HydrophobicContact CG2-CG2 4.14Å; D131-V135 WeakPolarHBondContact O-CG2 3.22Å; D131-V135 PolarHBondContact O-N 2.76Å; L132-V135 PolarHBondContact O-N 2.81Å; V135-H137 PolarHBondContact O-N 2.84Å; V135-T138 PolarHBondContact O-N 3.4Å; V135-L139 HydrophobicContact CG1-CD1 4Å; V135-L139 WeakPolarHBondContact O-CG 3.29Å; V135-L139 PolarHBondContact O-N 2.71Å
136	T	94.2	Very high	94	Very high	10 Å²	10	42.6 Å²	42.6	6%	0.061	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-46.6	-178.1	49.4	0	0	0	0	111.6	I5 L132 P133 T138 L139 S140 I145	I5-T136 HydrophobicContact CD1-CG2 4.06Å; L132-T136 HydrophobicContact CD1-CG2 4.12Å; L132-T136 HydrophobicContact CG-CG2 4.22Å; L132-T136 WeakPolarHBondContact O-CG2 3.17Å; L132-T136 PolarHBondContact O-N 2.99Å; L132-T136 PolarHBondContact O-OG1 2.89Å; P133-T136 WeakPolarHBondContact CA-OG1 3.11Å; P133-T136 PolarHBondContact O-OG1 3.12Å; T136-T138 PolarHBondContact O-N 3.2Å; T136-L139 PolarHBondContact O-N 3.14Å; T136-S140 WeakPolarHBondContact O-CB 3.23Å; T136-S140 PolarHBondContact O-N 3.08Å; T136-I145 HydrophobicContact CG2-CD1 4.31Å; T136-I145 HydrophobicContact CG2-CG2 4.34Å; T136-I145 VanDerWaalsContact O-CD1 3.22Å; T136-I145 WeakPolarHBondContact O-CD1 3.31Å
137	H	92.1	Very high	93.8	Very high	65 Å²	65	48.2 Å²	48.2	30%	0.301	24%	0.242	S	C	.	.	H	α-helix	trans	-57.7	-50.3	174.2	-178	90	0	0	0	111.8	P133 V135 L139 S140 I161 F165	P133-H137 PolarHBondContact O-N 2.88Å; V135-H137 PolarHBondContact O-N 2.84Å; H137-L139 VanDerWaalsContact C-N 3.3Å; H137-L139 PolarHBondContact O-N 2.51Å; H137-S140 PolarHBondContact O-N 2.99Å; H137-S140 PolarHBondContact O-OG 3.05Å; H137-I161 PolarHBondContact CE1-O 2.65Å; H137-I161 PolarHBondContact ND1-O 2.88Å; H137-F165 HydrophobicContact CB-CE1 3.85Å; H137-F165 HydrophobicContact CB-CE2 4.08Å; H137-F165 HydrophobicContact CB-CZ 3.38Å; H137-F165 AromaticContact CD2-CD1 3.53Å; H137-F165 AromaticContact CD2-CD2 3.62Å; H137-F165 AromaticContact CD2-CE1 3.29Å; H137-F165 WeakPolarHBondContact CD2-CE1 3.47Å; H137-F165 AromaticContact CD2-CE2 3.37Å; H137-F165 WeakPolarHBondContact CD2-CE2 3.13Å; H137-F165 AromaticContact CD2-CG 3.7Å; H137-F165 AromaticContact CD2-CZ 3.22Å; H137-F165 WeakPolarHBondContact CD2-CZ 3.24Å; H137-F165 AromaticContact CE1-CE2 3.89Å; H137-F165 AromaticContact CG-CE1 3.74Å; H137-F165 AromaticContact CG-CE2 3.5Å; H137-F165 VanDerWaalsContact CG-CE2 3.5Å; H137-F165 AromaticContact CG-CZ 3.25Å; H137-F165 AromaticContact ND1-CE2 3.82Å; H137-F165 AromaticContact NE2-CD2 3.54Å; H137-F165 AromaticContact NE2-CE2 3.64Å; H137-F165 AromaticContact NE2-CG 3.8Å
138	T	92.5	Very high	93.6	Very high	20 Å²	20	49 Å²	49	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-38.4	-175.6	-58.5	0	0	0	0	112.7	P106 L107 Q110 F134 V135 T136	P106-T138 HydrophobicContact CB-CG2 3.83Å; P106-T138 WeakPolarHBondContact O-CG2 3.41Å; L107-T138 HydrophobicContact CD2-CG2 4.21Å; Q110-T138 HydrophobicContact CG-CG2 3.8Å; Q110-T138 WeakPolarHBondContact CG-OG1 3.42Å; F134-T138 VanDerWaalsContact O-CB 3.26Å; F134-T138 WeakPolarHBondContact O-CB 3.47Å; F134-T138 PolarHBondContact O-N 3.45Å; F134-T138 PolarHBondContact O-OG1 2.72Å; V135-T138 PolarHBondContact O-N 3.4Å; T136-T138 PolarHBondContact O-N 3.2Å
139	L	93.7	Very high	93.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-98.4	-9.3	-174.2	-58.7	178.8	0	0	0	113.7	L3 S102 V103 P106 L107 V135 T136 H137 S141 E142 F143 I145	L3-L139 HydrophobicContact CD2-CB 4.26Å; L3-L139 HydrophobicContact CD2-CD1 3.57Å; S102-L139 WeakPolarHBondContact O-CD2 3.21Å; V103-L139 HydrophobicContact CG1-CD1 4Å; P106-L139 HydrophobicContact CB-CD2 4.03Å; L107-L139 HydrophobicContact CD1-CD1 4.32Å; L107-L139 HydrophobicContact CD2-CD1 4.09Å; L107-L139 HydrophobicContact CD2-CD2 4.38Å; L107-L139 HydrophobicContact CD2-CG 4.12Å; L107-L139 HydrophobicContact CG-CD1 4.3Å; L107-L139 HydrophobicContact CG-CD2 4.35Å; V135-L139 HydrophobicContact CG1-CD1 4Å; V135-L139 WeakPolarHBondContact O-CG 3.29Å; V135-L139 PolarHBondContact O-N 2.71Å; T136-L139 PolarHBondContact O-N 3.14Å; H137-L139 VanDerWaalsContact C-N 3.3Å; H137-L139 PolarHBondContact O-N 2.51Å; L139-S141 PolarHBondContact O-N 2.9Å; L139-S141 VanDerWaalsContact O-N 3.15Å; L139-E142 PolarHBondContact O-N 2.89Å; L139-E142 VanDerWaalsContact O-N 3.1Å; L139-F143 HydrophobicContact CB-CD2 4.23Å; L139-F143 PolarHBondContact O-N 2.83Å; L139-I145 HydrophobicContact CB-CD1 4.2Å
140	S	92.1	Very high	93	Very high	56 Å²	56	54.4 Å²	54.4	39%	0.392	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.3	-175.8	62.5	0	0	0	0	114.8	T136 H137	T136-S140 WeakPolarHBondContact O-CB 3.23Å; T136-S140 PolarHBondContact O-N 3.08Å; H137-S140 PolarHBondContact O-N 2.99Å; H137-S140 PolarHBondContact O-OG 3.05Å
141	S	88.3	Confident	92.7	Very high	98 Å²	98	49.7 Å²	49.7	69%	0.685	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-27.9	175.9	58.8	0	0	0	0	113.3	L139	L139-S141 PolarHBondContact O-N 2.9Å; L139-S141 VanDerWaalsContact O-N 3.15Å
142	E	88.1	Confident	92.5	Very high	113 Å²	113	55.3 Å²	55.3	53%	0.528	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-23.3	-174.8	-63.2	-60.4	147.8	0	0	112.7	L139	L139-E142 PolarHBondContact O-N 2.89Å; L139-E142 VanDerWaalsContact O-N 3.1Å
143	F	91.8	Very high	92.4	Very high	9 Å²	9	57.7 Å²	57.7	4%	0.039	32%	0.321	C	S	.	.			trans	-128.9	140.8	-172.5	-64.4	-88.9	0	0	0	113	M1 L3 V81 S102 V103 L139 I145	M1-F143 HydrophobicContact CB-CD1 3.57Å; M1-F143 HydrophobicContact CB-CE1 3.43Å; M1-F143 VanDerWaalsContact CB-CE1 3.43Å; M1-F143 HydrophobicContact CB-CZ 4.48Å; M1-F143 HydrophobicContact CE-CE1 4.15Å; M1-F143 HydrophobicContact CE-CZ 4.11Å; M1-F143 HydrophobicContact CG-CE1 4.35Å; M1-F143 HydrophobicContact SD-CE1 4.09Å; M1-F143 HydrophobicContact SD-CZ 4.44Å; L3-F143 HydrophobicContact CB-CB 3.82Å; L3-F143 HydrophobicContact CB-CD1 3.98Å; L3-F143 HydrophobicContact CB-CG 3.95Å; V81-F143 HydrophobicContact CG1-CE1 3.79Å; V81-F143 HydrophobicContact CG1-CZ 4.45Å; V81-F143 HydrophobicContact CG2-CE1 4.43Å; S102-F143 WeakPolarHBondContact O-CE2 3.39Å; V103-F143 HydrophobicContact CG2-CE2 3.79Å; V103-F143 HydrophobicContact CG2-CZ 3.72Å; L139-F143 HydrophobicContact CB-CD2 4.23Å; L139-F143 PolarHBondContact O-N 2.83Å; F143-I145 HydrophobicContact CB-CG1 4.26Å; F143-I145 PolarHBondContact O-N 2.94Å
144	T	93.1	Very high	92.5	Very high	87 Å²	87	59.5 Å²	59.5	53%	0.534	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	112.3	154.4	-56.7	0	0	0	0	107.2	M1 E2 L3 L146	M1-T144 PolarHBondContact O-N 2.93Å; M1-T144 VanDerWaalsContact O-N 3.14Å; E2-T144 WeakPolarHBondContact CA-O 3.28Å; L3-T144 PolarHBondContact N-O 2.76Å; T144-L146 HydrophobicContact CG2-CD2 4Å; T144-L146 HydrophobicContact CG2-CG 4.31Å
145	I	94.5	Very high	92.4	Very high	20 Å²	20	59.7 Å²	59.7	10%	0.103	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.9	-178.2	-50.6	-176.2	0	0	0	109.6	L3 I5 T136 L139 F143 A156	L3-I145 HydrophobicContact CB-CG1 4.47Å; L3-I145 HydrophobicContact CD2-CD1 4.36Å; L3-I145 HydrophobicContact CD2-CG1 4.32Å; L3-I145 HydrophobicContact CD2-CG2 4.38Å; L3-I145 WeakPolarHBondContact O-CA 3.3Å; I5-I145 HydrophobicContact CD1-CG2 3.63Å; I5-I145 HydrophobicContact CG1-CG2 4.1Å; T136-I145 HydrophobicContact CG2-CD1 4.31Å; T136-I145 HydrophobicContact CG2-CG2 4.34Å; T136-I145 VanDerWaalsContact O-CD1 3.22Å; T136-I145 WeakPolarHBondContact O-CD1 3.31Å; L139-I145 HydrophobicContact CB-CD1 4.2Å; F143-I145 HydrophobicContact CB-CG1 4.26Å; F143-I145 PolarHBondContact O-N 2.94Å; I145-A156 HydrophobicContact CB-CB 4.12Å; I145-A156 HydrophobicContact CG2-CB 3.69Å; I145-A156 WeakPolarHBondContact O-CB 3.35Å; I145-A156 PolarHBondContact O-N 3.41Å
146	L	94.8	Very high	92	Very high	25 Å²	25	60.7 Å²	60.7	13%	0.131	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	151.3	-180	-57.1	176.9	0	0	0	109.3	E2 L3 H4 I5 T144 T153 V154	E2-L146 HydrophobicContact CB-CD1 4.44Å; E2-L146 HydrophobicContact CG-CD1 4.25Å; L3-L146 PolarHBondContact O-N 3.3Å; H4-L146 CarbonylContact C-O 3.49Å; H4-L146 WeakPolarHBondContact CA-O 3.5Å; I5-L146 PolarHBondContact N-O 3.07Å; T144-L146 HydrophobicContact CG2-CD2 4Å; T144-L146 HydrophobicContact CG2-CG 4.31Å; L146-T153 HydrophobicContact CB-CG2 3.48Å; L146-T153 VanDerWaalsContact CB-CG2 3.48Å; L146-T153 HydrophobicContact CD1-CG2 3.53Å; L146-T153 HydrophobicContact CD2-CG2 4.47Å; L146-T153 HydrophobicContact CG-CG2 3.99Å; L146-V154 CarbonylContact C-O 3.57Å; L146-V154 VanDerWaalsContact CA-O 3.28Å; L146-V154 WeakPolarHBondContact CA-O 3.45Å
147	R	95	Very high	91.3	Very high	118 Å²	118	67.8 Å²	67.8	45%	0.445	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.6	175.2	-173.7	176.3	-178.5	-137.1	-0.3	108.9	I5 V149 V154 A156	I5-R147 HydrophobicContact CB-CB 4.45Å; I5-R147 HydrophobicContact CB-CG 4.31Å; I5-R147 HydrophobicContact CG2-CG 4.48Å; I5-R147 WeakPolarHBondContact O-CA 3.26Å; R147-V149 HydrophobicContact CG-CG2 4.03Å; R147-V154 HydrophobicContact CB-CG2 4.32Å; R147-V154 PolarHBondContact N-O 3.45Å; R147-V154 WeakPolarHBondContact O-CG2 3.17Å; R147-V154 PolarHBondContact O-N 3.41Å; R147-A156 HydrophobicContact CB-CB 4.49Å
148	V	93.7	Very high	90.1	Very high	17 Å²	17	70.7 Å²	70.7	10%	0.103	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.1	171	-175.4	0	0	0	0	108.1	I5 L6 E7 E152	I5-V148 PolarHBondContact O-N 3.15Å; L6-V148 HydrophobicContact CD2-CG2 4.11Å; E7-V148 WeakPolarHBondContact CB-O 3.33Å; E7-V148 HydrophobicContact CG-CG1 4.39Å; V148-E152 CarbonylContact C-O 3.47Å; V148-E152 WeakPolarHBondContact CA-O 3.49Å
149	V	92.1	Very high	88.9	Confident	52 Å²	52	74 Å²	74	32%	0.315	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	116.3	177	-178	0	0	0	0	108.3	R147 G151 E152 V154	R147-V149 HydrophobicContact CG-CG2 4.03Å; V149-G151 PolarHBondContact O-N 3.32Å; V149-E152 PolarHBondContact N-O 3.02Å; V149-E152 PolarHBondContact O-N 2.8Å; V149-V154 HydrophobicContact CG2-CG2 3.97Å
150	N	90.1	Very high	87.4	Confident	149 Å²	149	76.8 Å²	76.8	80%	0.797	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	39.5	-174.9	-56.5	-49	0	0	0	112.4	E7 E152	E7-N150 VanDerWaalsContact OE2-CA 3.26Å; E7-N150 WeakPolarHBondContact OE2-CA 3.37Å; E7-N150 PolarHBondContact OE2-N 3.44Å; N150-E152 PolarHBondContact O-N 3.27Å
151	G	88.2	Confident	86.2	Confident	54 Å²	54	76.6 Å²	76.6	56%	0.557	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	-0.5	-175.9	0	0	0	0	0	116	E7 V149	E7-G151 PolarHBondContact OE2-N 3.11Å; E7-G151 VanDerWaalsContact OE2-N 3.15Å; V149-G151 PolarHBondContact O-N 3.32Å
152	E	92.3	Very high	85	Confident	141 Å²	141	77 Å²	77	66%	0.659	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.4	175	-65.7	-172.6	171	0	0	111.5	V148 V149 N150	V148-E152 CarbonylContact C-O 3.47Å; V148-E152 WeakPolarHBondContact CA-O 3.49Å; V149-E152 PolarHBondContact N-O 3.02Å; V149-E152 PolarHBondContact O-N 2.8Å; N150-E152 PolarHBondContact O-N 3.27Å
153	T	92.6	Very high	83.6	Confident	75 Å²	75	78 Å²	78	46%	0.46	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116.2	178.1	-50.3	0	0	0	0	110.6	L146	L146-T153 HydrophobicContact CB-CG2 3.48Å; L146-T153 VanDerWaalsContact CB-CG2 3.48Å; L146-T153 HydrophobicContact CD1-CG2 3.53Å; L146-T153 HydrophobicContact CD2-CG2 4.47Å; L146-T153 HydrophobicContact CG-CG2 3.99Å
154	V	94.2	Very high	82.3	Confident	66 Å²	66	81 Å²	81	40%	0.4	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	160.6	176.4	-60.6	0	0	0	0	110.9	L146 R147 V149 A156	L146-V154 CarbonylContact C-O 3.57Å; L146-V154 VanDerWaalsContact CA-O 3.28Å; L146-V154 WeakPolarHBondContact CA-O 3.45Å; R147-V154 HydrophobicContact CB-CG2 4.32Å; R147-V154 PolarHBondContact N-O 3.45Å; R147-V154 WeakPolarHBondContact O-CG2 3.17Å; R147-V154 PolarHBondContact O-N 3.41Å; V149-V154 HydrophobicContact CG2-CG2 3.97Å; V154-A156 PolarHBondContact O-N 3.34Å
155	A	91.7	Very high	81.1	Confident	78 Å²	78	79.2 Å²	79.2	65%	0.645	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	135.1	172.8	0	0	0	0	0	110.3	E157	A155-E157 PolarHBondContact O-N 2.93Å
156	A	87.6	Confident	79.7	Confident	22 Å²	22	82.3 Å²	82.3	18%	0.182	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-68	134.2	173.5	0	0	0	0	0	110	I5 I145 R147 V154 N158	I5-A156 HydrophobicContact CD1-CB 4Å; I145-A156 HydrophobicContact CB-CB 4.12Å; I145-A156 HydrophobicContact CG2-CB 3.69Å; I145-A156 WeakPolarHBondContact O-CB 3.35Å; I145-A156 PolarHBondContact O-N 3.41Å; R147-A156 HydrophobicContact CB-CB 4.49Å; V154-A156 PolarHBondContact O-N 3.34Å; A156-N158 PolarHBondContact O-N 3.23Å
157	E	78.4	Confident	78.3	Confident	159 Å²	159	89.7 Å²	89.7	74%	0.743	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-62.3	129	175	-68.5	-176.6	177.8	0	0	109.8	A155 L159	A155-E157 PolarHBondContact O-N 2.93Å; E157-L159 PolarHBondContact O-N 2.95Å; E157-L159 VanDerWaalsContact O-N 3.12Å
158	N	67.6	Low	76.6	Confident	126 Å²	126	89.3 Å²	89.3	67%	0.674	53%	0.534	S	S	*	.			trans	-79.6	97.7	175.7	-149.5	-29.1	0	0	0	107.7	A156 G160	A156-N158 PolarHBondContact O-N 3.23Å; N158-G160 PolarHBondContact O-N 2.88Å
159	L	67.8	Low	75.1	Confident	90 Å²	90	96 Å²	96	47%	0.471	56%	0.562	S	S	.	*			trans	-68.6	11.6	-171.3	-69.7	170.6	0	0	0	114.7	P133 E157 I161	P133-L159 HydrophobicContact CB-CB 4.26Å; P133-L159 HydrophobicContact CB-CD1 3.92Å; P133-L159 HydrophobicContact CG-CD1 3.66Å; E157-L159 PolarHBondContact O-N 2.95Å; E157-L159 VanDerWaalsContact O-N 3.12Å; L159-I161 PolarHBondContact O-N 2.76Å
160	G	61	Low	73.7	Confident	58 Å²	58	102.5 Å²	102.5	60%	0.598	59%	0.594	S	S	*	*			trans	66.1	14.8	164.5	0	0	0	0	0	115.5	N158 T162	N158-G160 PolarHBondContact O-N 2.88Å; G160-T162 PolarHBondContact O-N 3.06Å
161	I	66.4	Low	72.9	Confident	51 Å²	51	98.9 Å²	98.9	26%	0.262	58%	0.577	S	S	.	*			trans	-75	119.3	176.4	-50.3	-164.3	0	0	0	108.8	P133 F134 H137 L159 F165	P133-I161 HydrophobicContact CB-CD1 3.24Å; P133-I161 HydrophobicContact CB-CG1 4.02Å; P133-I161 HydrophobicContact CG-CD1 4.2Å; F134-I161 HydrophobicContact CE1-CG2 4.26Å; F134-I161 HydrophobicContact CZ-CD1 4.45Å; H137-I161 PolarHBondContact CE1-O 2.65Å; H137-I161 PolarHBondContact ND1-O 2.88Å; L159-I161 PolarHBondContact O-N 2.76Å; I161-F165 HydrophobicContact CB-CE2 4.17Å; I161-F165 HydrophobicContact CB-CZ 4.42Å; I161-F165 HydrophobicContact CG2-CE2 3.68Å; I161-F165 HydrophobicContact CG2-CZ 4.12Å; I161-F165 WeakPolarHBondContact O-CE2 3.17Å
162	T	63.1	Low	72.4	Confident	106 Å²	106	102.7 Å²	102.7	65%	0.65	58%	0.58	S	S	*	*			trans	-118.3	-12.7	173.8	61.8	0	0	0	0	113.1	G160	G160-T162 PolarHBondContact O-N 3.06Å
163	N	59.1	Low	72.1	Confident	134 Å²	134	97.5 Å²	97.5	72%	0.717	56%	0.555	S	S	*	*	S	Bend	trans	-108.8	137.7	-172.2	-67.5	-16.1	0	0	0	110.8
164	G	65.7	Low	71.9	Confident	74 Å²	74	95.1 Å²	95.1	76%	0.763	54%	0.541	S	S	*	.	S	Bend	trans	104.9	-7.7	177.2	0	0	0	0	0	115.4
165	F	66.3	Low	71.8	Confident	48 Å²	48	92 Å²	92	21%	0.211	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-76.7	135.2	177.6	-63.6	-80.6	0	0	0	111.9	Q110 F134 H137 I161	Q110-F165 HydrophobicContact CG-CD1 4.48Å; F134-F165 HydrophobicContact CB-CE1 4.22Å; F134-F165 AromaticContact CD1-CE1 3.72Å; F134-F165 HydrophobicContact CD1-CE1 3.72Å; F134-F165 AromaticContact CD1-CZ 3.66Å; F134-F165 HydrophobicContact CD1-CZ 3.66Å; F134-F165 HydrophobicContact CE1-CZ 4.39Å; F134-F165 HydrophobicContact CG-CE1 4.47Å; H137-F165 HydrophobicContact CB-CE1 3.85Å; H137-F165 HydrophobicContact CB-CE2 4.08Å; H137-F165 HydrophobicContact CB-CZ 3.38Å; H137-F165 AromaticContact CD2-CD1 3.53Å; H137-F165 AromaticContact CD2-CD2 3.62Å; H137-F165 AromaticContact CD2-CE1 3.29Å; H137-F165 WeakPolarHBondContact CD2-CE1 3.47Å; H137-F165 AromaticContact CD2-CE2 3.37Å; H137-F165 WeakPolarHBondContact CD2-CE2 3.13Å; H137-F165 AromaticContact CD2-CG 3.7Å; H137-F165 AromaticContact CD2-CZ 3.22Å; H137-F165 WeakPolarHBondContact CD2-CZ 3.24Å; H137-F165 AromaticContact CE1-CE2 3.89Å; H137-F165 AromaticContact CG-CE1 3.74Å; H137-F165 AromaticContact CG-CE2 3.5Å; H137-F165 VanDerWaalsContact CG-CE2 3.5Å; H137-F165 AromaticContact CG-CZ 3.25Å; H137-F165 AromaticContact ND1-CE2 3.82Å; H137-F165 AromaticContact NE2-CD2 3.54Å; H137-F165 AromaticContact NE2-CE2 3.64Å; H137-F165 AromaticContact NE2-CG 3.8Å; I161-F165 HydrophobicContact CB-CE2 4.17Å; I161-F165 HydrophobicContact CB-CZ 4.42Å; I161-F165 HydrophobicContact CG2-CE2 3.68Å; I161-F165 HydrophobicContact CG2-CZ 4.12Å; I161-F165 WeakPolarHBondContact O-CE2 3.17Å
166	V	66.5	Low	71.8	Confident	86 Å²	86	92.1 Å²	92.1	52%	0.521	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-83.8	135.9	170.9	-175.2	0	0	0	0	107.3	Q110	Q110-V166 PolarHBondContact NE2-O 2.89Å; Q110-V166 VanDerWaalsContact OE1-N 3.17Å; Q110-V166 PolarHBondContact OE1-O 3.33Å
167	K	65.4	Low	72	Confident	180 Å²	180	92.7 Å²	92.7	78%	0.783	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-54.9	135.9	172.8	-82.1	-175.5	176.9	-179.4	0	109.4	K169	K167-K169 PolarHBondContact O-N 3.37Å
168	P	59.6	Low	72.8	Confident	110 Å²	110	88.6 Å²	88.6	71%	0.714	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-54.2	116.9	173.8	-17.5	27.2	0	0	0	108.2
169	K	61.7	Low	74.1	Confident	156 Å²	156	85 Å²	85	68%	0.678	48%	0.478	S	S	*	.			trans	-107.4	143.5	162.9	-71.8	-174.3	179.4	179.3	0	105.4	K167 V171	K167-K169 PolarHBondContact O-N 3.37Å; K169-V171 VanDerWaalsContact C-N 3.32Å; K169-V171 HydrophobicContact CB-CG2 4.43Å; K169-V171 WeakPolarHBondContact O-CG2 3.33Å; K169-V171 PolarHBondContact O-N 2.8Å
170	L	62.1	Low	75.3	Confident	190 Å²	190	83.8 Å²	83.8	100%	0.995	48%	0.476	S	S	*	.			trans	-60.4	104.1	163.9	-121.4	99.8	0	0	0	106.4
171	V	72.6	Confident	76.9	Confident	72 Å²	72	84.1 Å²	84.1	44%	0.436	47%	0.469	S	S	.	.			trans	-93.9	118.1	177.4	-178.3	0	0	0	0	107.2	D109 K169 R173	D109-V171 WeakPolarHBondContact OD1-CG2 3.33Å; K169-V171 VanDerWaalsContact C-N 3.32Å; K169-V171 HydrophobicContact CB-CG2 4.43Å; K169-V171 WeakPolarHBondContact O-CG2 3.33Å; K169-V171 PolarHBondContact O-N 2.8Å; V171-R173 HydrophobicContact CB-CG 4.42Å; V171-R173 HydrophobicContact CG1-CG 3.97Å; V171-R173 PolarHBondContact O-N 2.96Å
172	Q	78	Confident	78.2	Confident	134 Å²	134	82.1 Å²	82.1	63%	0.626	46%	0.46	S	S	*	.			trans	-66.1	124.2	163.4	-75.5	-176.4	-56.3	0	0	108.2	P174 E327	Q172-P174 WeakPolarHBondContact O-CD 3.43Å; Q172-E327 PolarHBondContact NE2-OE2 2.96Å
173	R	87	Confident	79.7	Confident	32 Å²	32	79.4 Å²	79.4	12%	0.121	45%	0.445	C	S	.	.			trans	-116.6	82.5	179.4	-61.9	-174.7	-160.5	87.4	-3.6	108.7	A105 D109 V171 Q284 E287 S324	A105-R173 PolarHBondContact O-NH2 2.97Å; D109-R173 IonicContact OD1-CZ 3.09Å; D109-R173 IonicContact OD1-NH2 3.75Å; D109-R173 PolarHBondContact OD1-NH2 3.4Å; D109-R173 IonicContact OD2-NH2 2.65Å; D109-R173 PolarHBondContact OD2-NH2 2.92Å; D109-R173 VanDerWaalsContact OD2-NH2 3.09Å; V171-R173 HydrophobicContact CB-CG 4.42Å; V171-R173 HydrophobicContact CG1-CG 3.97Å; V171-R173 PolarHBondContact O-N 2.96Å; R173-Q284 HydrophobicContact CB-CG 3.95Å; R173-E287 IonicContact CZ-OE2 2.86Å; R173-E287 IonicContact NH1-OE1 3.7Å; R173-E287 PolarHBondContact NH1-OE1 3.21Å; R173-E287 IonicContact NH1-OE2 3.67Å; R173-E287 PolarHBondContact NH1-OE2 3.02Å; R173-S324 PolarHBondContact O-OG 2.79Å
174	P	89.1	Confident	81.5	Confident	25 Å²	25	73.1 Å²	73.1	16%	0.162	41%	0.411	C	S	.	.			trans	-64.1	145	175.7	28.4	-34.5	0	0	0	109.5	Q172 I176 Q284 S324 K328	Q172-P174 WeakPolarHBondContact O-CD 3.43Å; P174-I176 HydrophobicContact CG-CG2 4.42Å; P174-I176 WeakPolarHBondContact O-CG2 3.33Å; P174-I176 PolarHBondContact O-N 2.67Å; P174-I176 VanDerWaalsContact O-N 3.09Å; P174-Q284 PolarHBondContact O-OE1 2.87Å; P174-S324 VanDerWaalsContact CA-O 3.24Å; P174-S324 WeakPolarHBondContact CA-O 3.27Å; P174-S324 WeakPolarHBondContact CB-O 3.39Å; P174-K328 HydrophobicContact CB-CG 3.85Å; P174-K328 HydrophobicContact CG-CG 4Å
175	V	90.4	Very high	82.9	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.006	40%	0.395	C	S	.	.			trans	-61.2	115.3	170.8	176	0	0	0	0	109.1	H177 L179 Q284 I285 L321 S324 Q325	V175-H177 WeakPolarHBondContact CG1-O 3.46Å; V175-L179 HydrophobicContact CG1-CD1 4.05Å; V175-L179 HydrophobicContact CG1-CD2 4.01Å; V175-L179 HydrophobicContact CG1-CG 4.04Å; V175-Q284 HydrophobicContact CG2-CB 4.24Å; V175-Q284 VanDerWaalsContact CG2-O 3.28Å; V175-Q284 WeakPolarHBondContact CG2-O 3.5Å; V175-I285 HydrophobicContact CG1-CD1 4.3Å; V175-I285 HydrophobicContact CG2-CD1 3.98Å; V175-L321 HydrophobicContact CG2-CD2 4.2Å; V175-S324 PolarHBondContact N-OG 3.44Å; V175-Q325 HydrophobicContact CB-CG 3.75Å; V175-Q325 HydrophobicContact CG1-CG 4.19Å
176	I	91.7	Very high	84.4	Confident	81 Å²	81	72.6 Å²	72.6	42%	0.415	39%	0.385	S	S	.	.			trans	-98.3	-26	-178.1	67.9	178.7	0	0	0	113.7	P174	P174-I176 HydrophobicContact CG-CG2 4.42Å; P174-I176 WeakPolarHBondContact O-CG2 3.33Å; P174-I176 PolarHBondContact O-N 2.67Å; P174-I176 VanDerWaalsContact O-N 3.09Å
177	H	93.4	Very high	85.7	Confident	33 Å²	33	68.6 Å²	68.6	15%	0.153	36%	0.361	C	S	.	.	S	Bend	trans	-84.4	148.5	-179.8	-69.1	-67.3	0	0	0	112.3	V175 I269 E278	V175-H177 WeakPolarHBondContact CG1-O 3.46Å; H177-I269 HydrophobicContact CB-CG2 3.83Å; H177-E278 IonicContact CD2-OE1 3.66Å; H177-E278 IonicContact CE1-OE1 3.56Å; H177-E278 IonicContact CE1-OE2 3.51Å; H177-E278 PolarHBondContact CE1-OE2 3.21Å; H177-E278 IonicContact NE2-OE1 2.75Å; H177-E278 PolarHBondContact NE2-OE1 3.15Å; H177-E278 IonicContact NE2-OE2 2.68Å; H177-E278 PolarHBondContact NE2-OE2 2.72Å
178	P	93.8	Very high	87.1	Confident	73 Å²	73	60.3 Å²	60.3	47%	0.474	33%	0.325	S	S	.	.			trans	-65	144.3	172.5	30.5	-35.4	0	0	0	109.9	G270 G271	P178-G270 PolarHBondContact O-N 3.24Å; P178-G271 VanDerWaalsContact CG-N 3.25Å
179	L	95.1	Very high	88.7	Confident	52 Å²	52	55.1 Å²	55.1	27%	0.272	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.8	177.8	-55.7	-179.7	0	0	0	109.1	V175 V267 R268 I269 I285 L321	V175-L179 HydrophobicContact CG1-CD1 4.05Å; V175-L179 HydrophobicContact CG1-CD2 4.01Å; V175-L179 HydrophobicContact CG1-CG 4.04Å; L179-V267 HydrophobicContact CB-CG1 4.25Å; L179-V267 HydrophobicContact CD1-CG1 4.33Å; L179-V267 HydrophobicContact CD2-CG1 4.15Å; L179-V267 HydrophobicContact CG-CG1 4.49Å; L179-R268 WeakPolarHBondContact CA-O 3.48Å; L179-I269 HydrophobicContact CD2-CB 4.2Å; L179-I269 HydrophobicContact CD2-CG1 3.65Å; L179-I269 HydrophobicContact CD2-CG2 4.14Å; L179-I285 HydrophobicContact CD2-CD1 3.92Å; L179-L321 HydrophobicContact CD1-CB 3.98Å; L179-L321 HydrophobicContact CD1-CD1 3.71Å; L179-L321 HydrophobicContact CD1-CG 4.4Å
180	S	93.4	Very high	90.3	Very high	63 Å²	63	48.2 Å²	48.2	44%	0.441	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	153	170.6	60.8	0	0	0	0	110.1	R268	S180-R268 PolarHBondContact N-O 3.4Å; S180-R268 PolarHBondContact O-N 2.87Å
181	S	94.2	Very high	91.8	Very high	65 Å²	65	39.3 Å²	39.3	46%	0.455	22%	0.216	S	C	.	.			trans	-129.1	115.8	175.6	171.5	0	0	0	0	108.5	M266	S181-M266 VanDerWaalsContact CA-O 3.31Å; S181-M266 WeakPolarHBondContact CA-O 2.82Å; S181-M266 WeakPolarHBondContact CB-O 3.34Å; S181-M266 PolarHBondContact OG-O 3.49Å; S181-M266 VanDerWaalsContact OG-O 3.12Å
182	P	94.6	Very high	92.7	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.058	21%	0.211	C	C	.	.			trans	-67.2	164.6	171.6	32.2	-38.4	0	0	0	111.6	N184 F186 G224 I226 K265 M266	P182-N184 VanDerWaalsContact C-N 3.32Å; P182-F186 HydrophobicContact CG-CE2 4.23Å; P182-G224 CarbonylContact C-O 3.55Å; P182-G224 WeakPolarHBondContact CA-O 2.84Å; P182-G224 VanDerWaalsContact CB-O 3.27Å; P182-G224 WeakPolarHBondContact CB-O 3.26Å; P182-I226 HydrophobicContact CB-CB 4.29Å; P182-I226 HydrophobicContact CB-CD1 3.95Å; P182-I226 HydrophobicContact CB-CG1 3.65Å; P182-I226 HydrophobicContact CB-CG2 3.95Å; P182-I226 HydrophobicContact CG-CD1 3.72Å; P182-I226 HydrophobicContact CG-CG1 3.82Å; P182-K265 PolarHBondContact O-NZ 3.42Å; P182-M266 WeakPolarHBondContact CD-O 3.26Å; P182-M266 HydrophobicContact CG-CB 3.94Å; P182-M266 HydrophobicContact CG-CG 4.44Å; P182-M266 HydrophobicContact CG-SD 4.17Å
183	S	94.7	Very high	93.3	Very high	49 Å²	49	35 Å²	35	34%	0.343	20%	0.198	S	C	.	.	S	Bend	trans	-76.8	-16.8	176	49.5	0	0	0	0	113.4	G224 H225 K265	S183-G224 PolarHBondContact N-O 2.77Å; S183-G224 WeakPolarHBondContact OG-CA 3.47Å; S183-G224 PolarHBondContact OG-O 2.89Å; S183-H225 PolarHBondContact OG-CE1 3.16Å; S183-H225 PolarHBondContact OG-N 2.89Å; S183-H225 PolarHBondContact OG-ND1 2.94Å; S183-K265 PolarHBondContact O-NZ 3.09Å
184	N	95.6	Very high	93.4	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.011	23%	0.229	C	C	.	.			trans	-48.4	148.1	176.2	-58.2	65.9	0	0	0	112	P182 F186 H225 I226 D243 K265	P182-N184 VanDerWaalsContact C-N 3.32Å; N184-F186 HydrophobicContact CB-CD2 4.06Å; N184-F186 HydrophobicContact CB-CE1 4.09Å; N184-F186 HydrophobicContact CB-CE2 3.37Å; N184-F186 HydrophobicContact CB-CZ 3.38Å; N184-H225 WeakPolarHBondContact OD1-CA 3.35Å; N184-I226 PolarHBondContact ND2-O 2.77Å; N184-I226 PolarHBondContact OD1-N 2.78Å; N184-I226 PolarHBondContact OD1-O 3.31Å; N184-D243 HydrophobicContact CB-CB 4.42Å; N184-K265 PolarHBondContact O-NZ 2.76Å
185	R	96.2	Very high	93.6	Very high	111 Å²	111	40.7 Å²	40.7	42%	0.419	23%	0.231	S	C	.	.			trans	-111.5	130.2	163	-63	179.1	-63	170.6	-0.3	107.1	D243 V244 L263 K265 E311	R185-D243 CarbonylContact O-C 3.55Å; R185-D243 VanDerWaalsContact O-CA 3.27Å; R185-D243 WeakPolarHBondContact O-CA 3.44Å; R185-V244 HydrophobicContact CB-CG2 4Å; R185-V244 WeakPolarHBondContact O-CG2 3.34Å; R185-V244 PolarHBondContact O-N 2.73Å; R185-L263 HydrophobicContact CB-CD1 4.31Å; R185-K265 HydrophobicContact CG-CD 4.41Å; R185-E311 WeakPolarHBondContact CD-OE1 3.42Å; R185-E311 WeakPolarHBondContact CG-OE1 3.28Å
186	F	96.5	Very high	93.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	156.9	-173.4	-66.3	-81.3	0	0	0	111.4	P182 N184 F228 M242 D243 W264 M266 L308	P182-F186 HydrophobicContact CG-CE2 4.23Å; N184-F186 HydrophobicContact CB-CD2 4.06Å; N184-F186 HydrophobicContact CB-CE1 4.09Å; N184-F186 HydrophobicContact CB-CE2 3.37Å; N184-F186 HydrophobicContact CB-CZ 3.38Å; F186-F228 HydrophobicContact CE1-CB 3.83Å; F186-F228 HydrophobicContact CE1-CD1 4.15Å; F186-F228 HydrophobicContact CE1-CG 4.36Å; F186-F228 HydrophobicContact CZ-CB 4.03Å; F186-M242 CarbonylContact C-O 3.52Å; F186-M242 WeakPolarHBondContact CA-O 3.34Å; F186-D243 HydrophobicContact CD1-CB 4.26Å; F186-D243 HydrophobicContact CE1-CB 4.18Å; F186-W264 HydrophobicContact CB-CB 4.18Å; F186-W264 PolarHBondContact N-O 2.9Å; F186-W264 PolarHBondContact O-N 3.13Å; F186-M266 HydrophobicContact CD2-CB 4.01Å; F186-M266 HydrophobicContact CD2-CE 4.34Å; F186-M266 HydrophobicContact CE1-CE 4.13Å; F186-M266 HydrophobicContact CE2-CB 3.61Å; F186-M266 HydrophobicContact CE2-CE 3.72Å; F186-M266 HydrophobicContact CE2-SD 4.29Å; F186-M266 HydrophobicContact CZ-CE 3.61Å; F186-M266 HydrophobicContact CZ-SD 4.37Å; F186-L308 HydrophobicContact CB-CD2 3.91Å; F186-L308 HydrophobicContact CD2-CD2 3.73Å; F186-L308 HydrophobicContact CE2-CD2 4.47Å; F186-L308 HydrophobicContact CG-CD2 3.91Å
187	C	94.8	Very high	93.7	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.014	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.7	168.7	62.4	0	0	0	0	109.1	T189 V241 M242 Q247	C187-T189 HydrophobicContact CB-CG2 4.07Å; C187-V241 WeakPolarHBondContact O-CA 3.46Å; C187-M242 PolarHBondContact N-O 3.43Å; C187-M242 PolarHBondContact O-N 3.27Å; C187-M242 VanDerWaalsContact SG-CG 3.55Å; C187-M242 PolarHBondContact SG-O 3.01Å; C187-Q247 PolarHBondContact SG-OE1 2.8Å
188	V	94.4	Very high	93.8	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.7	169	-174.6	0	0	0	0	106.6	Y120 V241 W264 Y297 L308	Y120-V188 HydrophobicContact CD2-CG1 4.25Å; V188-V241 HydrophobicContact CG1-CG2 4.15Å; V188-V241 HydrophobicContact CG2-CG2 4.19Å; V188-W264 HydrophobicContact CG2-CG 4.45Å; V188-Y297 HydrophobicContact CB-CE2 4.44Å; V188-Y297 HydrophobicContact CG1-CD1 4.15Å; V188-Y297 HydrophobicContact CG1-CE1 3.78Å; V188-Y297 HydrophobicContact CG2-CD1 4.49Å; V188-Y297 HydrophobicContact CG2-CD2 4.07Å; V188-Y297 HydrophobicContact CG2-CE2 4.16Å; V188-Y297 HydrophobicContact CG2-CG 4.24Å; V188-L308 HydrophobicContact CG2-CD1 4.03Å
189	T	94.2	Very high	93.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	161.7	-171.3	62.5	0	0	0	0	111.1	C187 L240 F256	C187-T189 HydrophobicContact CB-CG2 4.07Å; T189-L240 PolarHBondContact N-O 2.84Å; T189-L240 PolarHBondContact O-N 3.39Å; T189-L240 PolarHBondContact OG1-O 2.79Å; T189-F256 CarbonylContact C-O 3.39Å; T189-F256 VanDerWaalsContact CA-O 3.26Å; T189-F256 WeakPolarHBondContact CA-O 3.4Å; T189-F256 WeakPolarHBondContact CB-O 3.49Å
190	S	94.7	Very high	93.9	Very high	12 Å²	12	39.4 Å²	39.4	8%	0.084	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	157.1	173.6	176.9	0	0	0	0	109.7	Q121 I238 F256	Q121-S190 PolarHBondContact NE2-OG 2.78Å; S190-I238 VanDerWaalsContact CA-O 3.32Å; S190-I238 WeakPolarHBondContact CA-O 3.21Å; S190-I238 WeakPolarHBondContact CB-O 3.18Å; S190-I238 PolarHBondContact OG-O 3.22Å; S190-F256 PolarHBondContact N-O 2.98Å; S190-F256 PolarHBondContact O-N 3.43Å
191	L	93.7	Very high	93.9	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.7	173.9	-175	73.6	0	0	0	108.6	P193 T195 L196 V199 I238 L240 L254 L255	L191-P193 WeakPolarHBondContact O-CD 3.4Å; L191-T195 WeakPolarHBondContact CD1-OG1 3.26Å; L191-T195 WeakPolarHBondContact CG-OG1 3.31Å; L191-L196 HydrophobicContact CD2-CB 4.26Å; L191-L196 HydrophobicContact CD2-CD1 3.81Å; L191-V199 HydrophobicContact CD1-CG2 4.26Å; L191-V199 HydrophobicContact CD2-CG2 3.51Å; L191-I238 HydrophobicContact CB-CB 4.11Å; L191-I238 HydrophobicContact CB-CD1 4.41Å; L191-I238 HydrophobicContact CB-CG2 3.86Å; L191-I238 HydrophobicContact CD2-CD1 4.17Å; L191-L240 HydrophobicContact CB-CD1 4.33Å; L191-L254 HydrophobicContact CD1-CB 4.05Å; L191-L254 WeakPolarHBondContact CD1-O 3.39Å; L191-L255 HydrophobicContact CD1-CD2 4.29Å
192	D	92.1	Very high	94	Very high	61 Å²	61	40.1 Å²	40.1	33%	0.326	24%	0.239	S	C	.	.			trans	-68.6	125.7	167.6	-168.9	-36.1	0	0	0	108.9	D194 T195 L196 F256	D192-D194 PolarHBondContact O-N 3.15Å; D192-D194 VanDerWaalsContact O-N 3.13Å; D192-D194 WeakPolarHBondContact OD1-CB 3.39Å; D192-D194 PolarHBondContact OD1-N 2.83Å; D192-T195 HydrophobicContact CB-CG2 3.82Å; D192-T195 WeakPolarHBondContact O-CA 3.34Å; D192-T195 WeakPolarHBondContact O-CB 3.47Å; D192-T195 PolarHBondContact O-N 2.96Å; D192-T195 PolarHBondContact O-OG1 2.79Å; D192-L196 PolarHBondContact O-N 2.85Å; D192-F256 HydrophobicContact CB-CE2 3.82Å; D192-F256 HydrophobicContact CB-CZ 4.28Å
193	P	89.4	Confident	94.1	Very high	55 Å²	55	39.7 Å²	39.7	36%	0.357	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-50.9	-34.1	175	-26.3	33.9	0	0	0	114.4	L191 T195 L196 G236 I238	L191-P193 WeakPolarHBondContact O-CD 3.4Å; P193-T195 PolarHBondContact O-N 2.86Å; P193-L196 WeakPolarHBondContact O-CB 3.32Å; P193-L196 PolarHBondContact O-N 2.93Å; P193-L196 VanDerWaalsContact O-N 3.16Å; P193-G236 WeakPolarHBondContact CG-O 3.32Å; P193-I238 HydrophobicContact CB-CD1 4.42Å; P193-I238 HydrophobicContact CG-CD1 4.42Å
194	D	90.5	Very high	94.1	Very high	144 Å²	144	39.7 Å²	39.7	77%	0.77	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-70.1	-20.4	179.2	-72.3	-17.4	0	0	0	112.2	D192 P197	D192-D194 PolarHBondContact O-N 3.15Å; D192-D194 VanDerWaalsContact O-N 3.13Å; D192-D194 WeakPolarHBondContact OD1-CB 3.39Å; D192-D194 PolarHBondContact OD1-N 2.83Å; D194-P197 WeakPolarHBondContact O-CD 3.06Å
195	T	92	Very high	94.1	Very high	33 Å²	33	42.1 Å²	42.1	20%	0.202	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-91.2	-10.2	175.8	69.5	0	0	0	0	113.2	L191 D192 P193 P197 A198 L254	L191-T195 WeakPolarHBondContact CD1-OG1 3.26Å; L191-T195 WeakPolarHBondContact CG-OG1 3.31Å; D192-T195 HydrophobicContact CB-CG2 3.82Å; D192-T195 WeakPolarHBondContact O-CA 3.34Å; D192-T195 WeakPolarHBondContact O-CB 3.47Å; D192-T195 PolarHBondContact O-N 2.96Å; D192-T195 PolarHBondContact O-OG1 2.79Å; P193-T195 PolarHBondContact O-N 2.86Å; T195-P197 VanDerWaalsContact C-CD 3.42Å; T195-P197 VanDerWaalsContact C-N 3.32Å; T195-A198 WeakPolarHBondContact O-CB 3.41Å; T195-A198 PolarHBondContact O-N 3.08Å; T195-L254 HydrophobicContact CG2-CD2 3.9Å
196	L	92.2	Very high	94	Very high	15 Å²	15	36.8 Å²	36.8	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-52.3	-42.2	178.9	-176.3	65	0	0	0	113.3	A31 F32 L191 D192 P193 A198 V199 A200 L203 I238	A31-L196 VanDerWaalsContact O-CD2 3.28Å; A31-L196 WeakPolarHBondContact O-CD2 3.36Å; F32-L196 HydrophobicContact CD1-CD1 4.05Å; F32-L196 HydrophobicContact CD1-CD2 4.04Å; F32-L196 HydrophobicContact CD1-CG 3.98Å; F32-L196 HydrophobicContact CE1-CD1 3.95Å; F32-L196 HydrophobicContact CE1-CG 4.39Å; L191-L196 HydrophobicContact CD2-CB 4.26Å; L191-L196 HydrophobicContact CD2-CD1 3.81Å; D192-L196 PolarHBondContact O-N 2.85Å; P193-L196 WeakPolarHBondContact O-CB 3.32Å; P193-L196 PolarHBondContact O-N 2.93Å; P193-L196 VanDerWaalsContact O-N 3.16Å; L196-A198 PolarHBondContact O-N 2.96Å; L196-V199 HydrophobicContact CD1-CG2 4.44Å; L196-V199 CarbonylContact O-C 3.54Å; L196-V199 PolarHBondContact O-N 2.79Å; L196-V199 VanDerWaalsContact O-N 3.15Å; L196-A200 WeakPolarHBondContact O-CB 3.49Å; L196-A200 PolarHBondContact O-N 2.84Å; L196-L203 HydrophobicContact CD1-CD2 3.68Å; L196-I238 HydrophobicContact CB-CD1 4.18Å; L196-I238 HydrophobicContact CD1-CD1 4.11Å; L196-I238 HydrophobicContact CD2-CD1 4.09Å; L196-I238 HydrophobicContact CG-CD1 4.35Å
197	P	92.8	Very high	94	Very high	105 Å²	105	36.9 Å²	36.9	68%	0.682	22%	0.224	S	C	*	.	H	α-helix	trans	-57.9	-31.9	175.6	-26.1	36.5	0	0	0	114.1	D194 T195 V199	D194-P197 WeakPolarHBondContact O-CD 3.06Å; T195-P197 VanDerWaalsContact C-CD 3.42Å; T195-P197 VanDerWaalsContact C-N 3.32Å; P197-V199 VanDerWaalsContact C-N 3.31Å; P197-V199 PolarHBondContact O-N 2.89Å
198	A	94.6	Very high	93.9	Very high	74 Å²	74	37.4 Å²	37.4	61%	0.612	23%	0.226	S	C	*	.	H	α-helix	trans	-72.8	-24.1	-178.8	0	0	0	0	0	113	T195 L196 L254	T195-A198 WeakPolarHBondContact O-CB 3.41Å; T195-A198 PolarHBondContact O-N 3.08Å; L196-A198 PolarHBondContact O-N 2.96Å; A198-L254 HydrophobicContact CB-CD1 4.24Å
199	V	95.1	Very high	93.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-113.4	3.5	179.7	-60.2	0	0	0	0	113.1	L191 L196 P197 T201 L202 L203 F250 P251 L254	L191-V199 HydrophobicContact CD1-CG2 4.26Å; L191-V199 HydrophobicContact CD2-CG2 3.51Å; L196-V199 HydrophobicContact CD1-CG2 4.44Å; L196-V199 CarbonylContact O-C 3.54Å; L196-V199 PolarHBondContact O-N 2.79Å; L196-V199 VanDerWaalsContact O-N 3.15Å; P197-V199 VanDerWaalsContact C-N 3.31Å; P197-V199 PolarHBondContact O-N 2.89Å; V199-T201 PolarHBondContact O-N 2.75Å; V199-L202 WeakPolarHBondContact O-CB 3.46Å; V199-L202 PolarHBondContact O-N 3.12Å; V199-L202 VanDerWaalsContact O-N 3.17Å; V199-L203 WeakPolarHBondContact O-CB 3.42Å; V199-L203 PolarHBondContact O-N 2.94Å; V199-F250 HydrophobicContact CB-CD1 4.31Å; V199-F250 HydrophobicContact CB-CE1 4.3Å; V199-F250 HydrophobicContact CG1-CD1 4.27Å; V199-P251 HydrophobicContact CG1-CG 4.46Å; V199-L254 HydrophobicContact CG1-CD1 3.59Å
200	A	95.4	Very high	92.8	Very high	16 Å²	16	45.3 Å²	45.3	13%	0.132	26%	0.26	C	S	.	.	H	α-helix	trans	-57.4	-44.4	-171.5	0	0	0	0	0	113.2	F32 L196 L203 M204	F32-A200 HydrophobicContact CD1-CB 3.88Å; F32-A200 HydrophobicContact CE1-CB 3.96Å; L196-A200 WeakPolarHBondContact O-CB 3.49Å; L196-A200 PolarHBondContact O-N 2.84Å; A200-L203 PolarHBondContact O-N 3.21Å; A200-M204 WeakPolarHBondContact O-CB 3.42Å; A200-M204 VanDerWaalsContact O-CG 3.24Å; A200-M204 WeakPolarHBondContact O-CG 3.41Å; A200-M204 PolarHBondContact O-N 2.83Å
201	T	95.4	Very high	91.4	Very high	116 Å²	116	49.8 Å²	49.8	71%	0.712	28%	0.283	S	S	*	.	H	α-helix	trans	-65.7	-41.4	179.2	51.8	0	0	0	0	112.3	V199 D205	V199-T201 PolarHBondContact O-N 2.75Å; T201-D205 PolarHBondContact O-N 2.85Å
202	L	95.5	Very high	89.4	Confident	28 Å²	28	52.9 Å²	52.9	15%	0.147	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-45.3	173.5	171.3	62.6	0	0	0	110.7	V199 M204 D205 V206 R249 F250	V199-L202 WeakPolarHBondContact O-CB 3.46Å; V199-L202 PolarHBondContact O-N 3.12Å; V199-L202 VanDerWaalsContact O-N 3.17Å; L202-M204 PolarHBondContact O-N 2.82Å; L202-D205 WeakPolarHBondContact O-CB 3.46Å; L202-D205 PolarHBondContact O-N 2.83Å; L202-V206 HydrophobicContact CD1-CG2 4.16Å; L202-V206 WeakPolarHBondContact O-CG2 3.24Å; L202-V206 PolarHBondContact O-N 3.39Å; L202-R249 HydrophobicContact CD1-CB 3.87Å; L202-R249 HydrophobicContact CD2-CB 4.32Å; L202-R249 VanDerWaalsContact CD2-O 3.25Å; L202-R249 WeakPolarHBondContact CD2-O 3.47Å; L202-F250 HydrophobicContact CD2-CB 4.21Å; L202-F250 HydrophobicContact CD2-CD1 3.64Å; L202-F250 HydrophobicContact CD2-CD2 3.82Å; L202-F250 HydrophobicContact CD2-CE1 3.84Å; L202-F250 HydrophobicContact CD2-CE2 4Å; L202-F250 HydrophobicContact CD2-CG 3.62Å; L202-F250 HydrophobicContact CD2-CZ 4.02Å; L202-F250 HydrophobicContact CG-CD1 4.5Å; L202-F250 HydrophobicContact CG-CE1 4.22Å; L202-F250 HydrophobicContact CG-CE2 4.26Å; L202-F250 HydrophobicContact CG-CZ 4.09Å
203	L	95.8	Very high	87.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.5	-40	-178.6	-166.4	65.2	0	0	0	111.4	F32 L196 V199 A200 D205 V206 M207 F229 F231 L240 F250	F32-L203 HydrophobicContact CE1-CB 4.05Å; F32-L203 HydrophobicContact CE1-CD2 3.62Å; F32-L203 HydrophobicContact CE1-CG 4.2Å; F32-L203 HydrophobicContact CZ-CB 4.01Å; F32-L203 HydrophobicContact CZ-CD2 3.82Å; F32-L203 HydrophobicContact CZ-CG 4.02Å; L196-L203 HydrophobicContact CD1-CD2 3.68Å; V199-L203 WeakPolarHBondContact O-CB 3.42Å; V199-L203 PolarHBondContact O-N 2.94Å; A200-L203 PolarHBondContact O-N 3.21Å; L203-D205 VanDerWaalsContact C-N 3.34Å; L203-D205 PolarHBondContact O-N 2.97Å; L203-V206 PolarHBondContact O-N 2.83Å; L203-M207 HydrophobicContact CD1-SD 4.44Å; L203-M207 HydrophobicContact CD2-SD 4.2Å; L203-M207 HydrophobicContact CG-CG 4.31Å; L203-M207 HydrophobicContact CG-SD 3.75Å; L203-M207 VanDerWaalsContact O-CB 3.28Å; L203-M207 WeakPolarHBondContact O-CB 3.44Å; L203-M207 WeakPolarHBondContact O-CG 3.26Å; L203-M207 PolarHBondContact O-N 2.78Å; L203-F229 HydrophobicContact CD1-CE1 4.34Å; L203-F229 HydrophobicContact CD1-CZ 3.63Å; L203-F231 HydrophobicContact CD1-CD2 4.31Å; L203-F231 HydrophobicContact CD2-CD2 3.72Å; L203-F231 HydrophobicContact CD2-CE2 3.52Å; L203-F231 HydrophobicContact CD2-CZ 4.44Å; L203-F231 HydrophobicContact CG-CD2 4.45Å; L203-L240 HydrophobicContact CD1-CD2 4.16Å; L203-F250 HydrophobicContact CD1-CE1 4.2Å; L203-F250 HydrophobicContact CD1-CZ 3.89Å
204	M	95.7	Very high	85.3	Confident	49 Å²	49	61.2 Å²	61.2	24%	0.241	35%	0.351	C	S	.	.	H	α-helix	trans	-61.2	-41.8	172.4	-72	172.8	-169.6	0	0	112.1	I28 F32 A200 L202 M207 F208	I28-M204 HydrophobicContact CG1-CE 4.34Å; I28-M204 HydrophobicContact CG2-CE 4.09Å; F32-M204 HydrophobicContact CB-CE 4.46Å; F32-M204 HydrophobicContact CD1-CE 4.29Å; F32-M204 HydrophobicContact CD2-CE 3.48Å; F32-M204 VanDerWaalsContact CD2-CE 3.48Å; F32-M204 HydrophobicContact CD2-CG 4.35Å; F32-M204 HydrophobicContact CE1-CE 4.43Å; F32-M204 HydrophobicContact CE2-CE 3.68Å; F32-M204 HydrophobicContact CE2-CG 3.56Å; F32-M204 HydrophobicContact CG-CE 3.83Å; F32-M204 HydrophobicContact CZ-CE 4.16Å; F32-M204 HydrophobicContact CZ-CG 3.69Å; A200-M204 WeakPolarHBondContact O-CB 3.42Å; A200-M204 VanDerWaalsContact O-CG 3.24Å; A200-M204 WeakPolarHBondContact O-CG 3.41Å; A200-M204 PolarHBondContact O-N 2.83Å; L202-M204 PolarHBondContact O-N 2.82Å; M204-M207 PolarHBondContact O-N 2.75Å; M204-F208 HydrophobicContact CB-CD2 4.21Å; M204-F208 HydrophobicContact CB-CE2 4.49Å; M204-F208 HydrophobicContact CG-CD2 4.5Å; M204-F208 HydrophobicContact CG-CE2 4.32Å; M204-F208 WeakPolarHBondContact O-CB 3.4Å; M204-F208 WeakPolarHBondContact O-CD2 3.38Å; M204-F208 PolarHBondContact O-N 2.79Å
205	D	94.9	Very high	83.4	Confident	52 Å²	52	58.7 Å²	58.7	28%	0.278	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-46.7	175.5	-178.6	82.8	0	0	0	111.4	T201 L202 L203 Y209 R249	T201-D205 PolarHBondContact O-N 2.85Å; L202-D205 WeakPolarHBondContact O-CB 3.46Å; L202-D205 PolarHBondContact O-N 2.83Å; L203-D205 VanDerWaalsContact C-N 3.34Å; L203-D205 PolarHBondContact O-N 2.97Å; D205-Y209 CarbonylContact O-C 3.52Å; D205-Y209 WeakPolarHBondContact O-CA 3.44Å; D205-Y209 PolarHBondContact O-N 3.4Å; D205-R249 IonicContact OD2-CZ 2.88Å; D205-R249 VanDerWaalsContact OD2-CZ 3.29Å; D205-R249 IonicContact OD2-NH1 3.92Å; D205-R249 PolarHBondContact OD2-NH1 3.31Å; D205-R249 IonicContact OD2-NH2 3.41Å; D205-R249 PolarHBondContact OD2-NH2 2.75Å
206	V	95.3	Very high	81	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-63.3	-43.7	176.7	175.3	0	0	0	0	111.4	L202 L203 R227 F229 T246 F250	L202-V206 HydrophobicContact CD1-CG2 4.16Å; L202-V206 WeakPolarHBondContact O-CG2 3.24Å; L202-V206 PolarHBondContact O-N 3.39Å; L203-V206 PolarHBondContact O-N 2.83Å; V206-R227 PolarHBondContact O-NH2 2.85Å; V206-F229 HydrophobicContact CG1-CD1 4.09Å; V206-F229 HydrophobicContact CG1-CD2 3.44Å; V206-F229 VanDerWaalsContact CG1-CD2 3.44Å; V206-F229 HydrophobicContact CG1-CE1 4.08Å; V206-F229 HydrophobicContact CG1-CE2 3.44Å; V206-F229 VanDerWaalsContact CG1-CE2 3.44Å; V206-F229 HydrophobicContact CG1-CG 3.79Å; V206-F229 HydrophobicContact CG1-CZ 3.78Å; V206-T246 HydrophobicContact CG1-CG2 3.69Å; V206-T246 HydrophobicContact CG2-CG2 3.89Å; V206-F250 HydrophobicContact CG2-CE2 4.32Å
207	M	95.1	Very high	78.8	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-73.2	-32.1	-176	-73.5	171.9	79.8	0	0	113.6	A31 F32 L44 Y51 L203 M204 F229 F231	A31-M207 HydrophobicContact CB-CE 4.17Å; F32-M207 HydrophobicContact CE2-SD 4.35Å; F32-M207 HydrophobicContact CZ-SD 4.03Å; L44-M207 HydrophobicContact CB-CE 4.39Å; L44-M207 HydrophobicContact CD2-CB 4.46Å; L44-M207 HydrophobicContact CD2-CE 3.38Å; L44-M207 HydrophobicContact CD2-CG 4.49Å; Y51-M207 WeakPolarHBondContact CE1-O 3.27Å; Y51-M207 PolarHBondContact OH-O 2.77Å; L203-M207 HydrophobicContact CD1-SD 4.44Å; L203-M207 HydrophobicContact CD2-SD 4.2Å; L203-M207 HydrophobicContact CG-CG 4.31Å; L203-M207 HydrophobicContact CG-SD 3.75Å; L203-M207 VanDerWaalsContact O-CB 3.28Å; L203-M207 WeakPolarHBondContact O-CB 3.44Å; L203-M207 WeakPolarHBondContact O-CG 3.26Å; L203-M207 PolarHBondContact O-N 2.78Å; M204-M207 PolarHBondContact O-N 2.75Å; M207-F229 HydrophobicContact CG-CD1 4.27Å; M207-F229 HydrophobicContact CG-CE1 3.59Å; M207-F229 HydrophobicContact CG-CZ 4.44Å; M207-F231 HydrophobicContact CE-CB 4.37Å; M207-F231 HydrophobicContact CE-CD1 4.15Å; M207-F231 HydrophobicContact CE-CG 4.24Å; M207-F231 HydrophobicContact SD-CG 4.41Å
208	F	93.7	Very high	76.7	Confident	13 Å²	13	67.5 Å²	67.5	6%	0.057	39%	0.39	C	S	.	.	H	α-helix	trans	-128.4	-15.4	-165.4	-50.4	-53.1	0	0	0	115.1	I20 T24 L27 I28 L44 M204	I20-F208 HydrophobicContact CG1-CD1 3.95Å; T24-F208 HydrophobicContact CG2-CB 4.4Å; T24-F208 HydrophobicContact CG2-CD1 4.29Å; T24-F208 HydrophobicContact CG2-CG 4.17Å; L27-F208 HydrophobicContact CB-CE1 3.93Å; L27-F208 HydrophobicContact CB-CZ 3.77Å; L27-F208 HydrophobicContact CD1-CE1 3.75Å; L27-F208 HydrophobicContact CD1-CZ 4.46Å; L27-F208 HydrophobicContact CG-CE1 4.5Å; I28-F208 HydrophobicContact CG1-CE2 3.94Å; L44-F208 HydrophobicContact CD2-CE1 4.05Å; M204-F208 HydrophobicContact CB-CD2 4.21Å; M204-F208 HydrophobicContact CB-CE2 4.49Å; M204-F208 HydrophobicContact CG-CD2 4.5Å; M204-F208 HydrophobicContact CG-CE2 4.32Å; M204-F208 WeakPolarHBondContact O-CB 3.4Å; M204-F208 WeakPolarHBondContact O-CD2 3.38Å; M204-F208 PolarHBondContact O-N 2.79Å
209	Y	89.6	Confident	74.4	Confident	151 Å²	151	70.5 Å²	70.5	59%	0.592	40%	0.401	S	S	*	.			trans	-122.6	12.8	-171.9	-65.7	-85.7	0	0	0	114.3	D205 N211 G212	D205-Y209 CarbonylContact O-C 3.52Å; D205-Y209 WeakPolarHBondContact O-CA 3.44Å; D205-Y209 PolarHBondContact O-N 3.4Å; Y209-N211 PolarHBondContact O-N 2.79Å; Y209-N211 VanDerWaalsContact O-N 3.13Å; Y209-G212 PolarHBondContact O-N 3.24Å; Y209-G212 VanDerWaalsContact O-N 3.13Å
210	S	75.6	Confident	71.9	Confident	23 Å²	23	72.8 Å²	72.8	16%	0.161	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-55.2	-31.2	179.1	61.8	0	0	0	0	114.2	E46 G212 V213	E46-S210 PolarHBondContact OE1-OG 3.45Å; E46-S210 PolarHBondContact OE2-OG 3.18Å; S210-G212 PolarHBondContact O-N 3.06Å; S210-V213 PolarHBondContact O-N 2.82Å
211	N	65.5	Low	69.7	Low	105 Å²	105	79.7 Å²	79.7	56%	0.561	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-64.4	-18.9	-179.5	-67.9	-24.1	0	0	0	114	Y209	Y209-N211 PolarHBondContact O-N 2.79Å; Y209-N211 VanDerWaalsContact O-N 3.13Å
212	G	51.4	Low	67.7	Low	68 Å²	68	78.3 Å²	78.3	70%	0.701	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-81.9	-20.6	-175.6	0	0	0	0	0	114.6	Y209 S210 K214	Y209-G212 PolarHBondContact O-N 3.24Å; Y209-G212 VanDerWaalsContact O-N 3.13Å; S210-G212 PolarHBondContact O-N 3.06Å; G212-K214 PolarHBondContact O-N 3.5Å; G212-K214 VanDerWaalsContact O-N 3.15Å
213	V	49.9	Very low	66.1	Low	99 Å²	99	82.9 Å²	82.9	60%	0.6	48%	0.481	S	S	*	.			trans	-89.2	83.8	-178.9	-169.8	0	0	0	0	108.5	S210 D215	S210-V213 PolarHBondContact O-N 2.82Å; V213-D215 VanDerWaalsContact C-N 3.28Å; V213-D215 PolarHBondContact O-N 2.8Å
214	K	46.1	Very low	65.6	Low	192 Å²	192	84.4 Å²	84.4	84%	0.835	50%	0.496	S	S	*	.			trans	-63.5	102.4	151	-75	-174.8	178.4	-178.3	0	105.5	G212 P216	G212-K214 PolarHBondContact O-N 3.5Å; G212-K214 VanDerWaalsContact O-N 3.15Å; K214-P216 WeakPolarHBondContact O-CD 3.32Å
215	D	48.9	Very low	65.4	Low	91 Å²	91	85 Å²	85	49%	0.487	50%	0.499	S	S	.	.			trans	-54.1	116.9	173.3	-166.8	-18.4	0	0	0	107.8	V213 M217 A218	V213-D215 VanDerWaalsContact C-N 3.28Å; V213-D215 PolarHBondContact O-N 2.8Å; D215-M217 PolarHBondContact O-N 3.02Å; D215-M217 VanDerWaalsContact O-N 3.09Å; D215-M217 WeakPolarHBondContact OD1-CB 3.45Å; D215-M217 PolarHBondContact OD1-N 2.87Å; D215-A218 HydrophobicContact CB-CB 4.02Å; D215-A218 WeakPolarHBondContact O-CB 3.36Å; D215-A218 PolarHBondContact O-N 2.82Å
216	P	43.2	Very low	65.3	Low	110 Å²	110	84.4 Å²	84.4	71%	0.714	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-22.4	177.1	-21	32.3	0	0	0	111.9	K214 T219	K214-P216 WeakPolarHBondContact O-CD 3.32Å; P216-T219 PolarHBondContact O-OG1 2.99Å
217	M	46.1	Very low	65.2	Low	161 Å²	161	86.9 Å²	86.9	79%	0.793	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.6	176.4	-114.4	169.9	-169.9	0	0	114.3	D215 T219	D215-M217 PolarHBondContact O-N 3.02Å; D215-M217 VanDerWaalsContact O-N 3.09Å; D215-M217 WeakPolarHBondContact OD1-CB 3.45Å; D215-M217 PolarHBondContact OD1-N 2.87Å; M217-T219 PolarHBondContact O-N 3.24Å
218	A	48.3	Very low	65.3	Low	66 Å²	66	86.8 Å²	86.8	55%	0.545	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	18.9	172.6	0	0	0	0	0	113.7	D215	D215-A218 HydrophobicContact CB-CB 4.02Å; D215-A218 WeakPolarHBondContact O-CB 3.36Å; D215-A218 PolarHBondContact O-N 2.82Å
219	T	45.6	Very low	65.5	Low	138 Å²	138	86.3 Å²	86.3	85%	0.847	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	3.3	169.1	45.1	0	0	0	0	113	P216 M217	P216-T219 PolarHBondContact O-OG1 2.99Å; M217-T219 PolarHBondContact O-N 3.24Å
220	G	43.8	Very low	65.9	Low	49 Å²	49	79.2 Å²	79.2	51%	0.505	47%	0.474	S	S	.	.	S	Bend	trans	-143.4	111.6	171.7	0	0	0	0	0	112.3	D222	G220-D222 VanDerWaalsContact C-N 3.32Å; G220-D222 PolarHBondContact O-N 3.19Å
221	D	48	Very low	67	Low	162 Å²	162	78.1 Å²	78.1	87%	0.866	47%	0.466	S	S	*	.			trans	56.1	18.2	146.4	-132.9	12.7	0	0	0	120.7	C223	D221-C223 PolarHBondContact O-N 3.01Å
222	D	53.9	Low	68.6	Low	86 Å²	86	73.2 Å²	73.2	46%	0.46	44%	0.44	S	S	.	.			trans	-79.9	43.7	174.6	-148.3	15.3	0	0	0	113.1	G220 G224 H225	G220-D222 VanDerWaalsContact C-N 3.32Å; G220-D222 PolarHBondContact O-N 3.19Å; D222-G224 PolarHBondContact O-N 3.34Å; D222-H225 PolarHBondContact O-N 2.78Å; D222-H225 IonicContact OD1-CE1 3.69Å; D222-H225 PolarHBondContact OD1-CE1 3.5Å; D222-H225 IonicContact OD1-CG 3.9Å; D222-H225 IonicContact OD1-ND1 2.76Å; D222-H225 PolarHBondContact OD1-ND1 3.32Å; D222-H225 IonicContact OD2-CE1 2.72Å; D222-H225 PolarHBondContact OD2-CE1 3.4Å; D222-H225 IonicContact OD2-CG 3.51Å; D222-H225 IonicContact OD2-ND1 3.61Å; D222-H225 PolarHBondContact OD2-ND1 3.39Å
223	C	62.7	Low	70.7	Confident	125 Å²	125	71.2 Å²	71.2	85%	0.845	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-8.3	-164.2	-165.5	0	0	0	0	114.9	D221	D221-C223 PolarHBondContact O-N 3.01Å
224	G	84.7	Confident	73	Confident	32 Å²	32	66.9 Å²	66.9	33%	0.33	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-6.3	-175.3	0	0	0	0	0	116.2	P182 S183 D222	P182-G224 CarbonylContact C-O 3.55Å; P182-G224 WeakPolarHBondContact CA-O 2.84Å; P182-G224 VanDerWaalsContact CB-O 3.27Å; P182-G224 WeakPolarHBondContact CB-O 3.26Å; S183-G224 PolarHBondContact N-O 2.77Å; S183-G224 WeakPolarHBondContact OG-CA 3.47Å; S183-G224 PolarHBondContact OG-O 2.89Å; D222-G224 PolarHBondContact O-N 3.34Å
225	H	90.6	Very high	75.1	Confident	62 Å²	62	62.6 Å²	62.6	29%	0.287	37%	0.37	S	S	.	.			trans	-79.3	137	-177.2	-82.8	85.3	0	0	0	110.9	S183 N184 D222 Q245	S183-H225 PolarHBondContact OG-CE1 3.16Å; S183-H225 PolarHBondContact OG-N 2.89Å; S183-H225 PolarHBondContact OG-ND1 2.94Å; N184-H225 WeakPolarHBondContact OD1-CA 3.35Å; D222-H225 PolarHBondContact O-N 2.78Å; D222-H225 IonicContact OD1-CE1 3.69Å; D222-H225 PolarHBondContact OD1-CE1 3.5Å; D222-H225 IonicContact OD1-CG 3.9Å; D222-H225 IonicContact OD1-ND1 2.76Å; D222-H225 PolarHBondContact OD1-ND1 3.32Å; D222-H225 IonicContact OD2-CE1 2.72Å; D222-H225 PolarHBondContact OD2-CE1 3.4Å; D222-H225 IonicContact OD2-CG 3.51Å; D222-H225 IonicContact OD2-ND1 3.61Å; D222-H225 PolarHBondContact OD2-ND1 3.39Å; H225-Q245 PolarHBondContact NE2-NE2 3.02Å; H225-Q245 VanDerWaalsContact NE2-NE2 3.17Å
226	I	93.5	Very high	77.2	Confident	38 Å²	38	60.2 Å²	60.2	20%	0.195	37%	0.367	C	S	.	.			trans	-118.6	154.5	174.6	70.6	173.3	0	0	0	110.4	P48 P182 N184 F228 M266	P48-I226 HydrophobicContact CG-CB 4Å; P182-I226 HydrophobicContact CB-CB 4.29Å; P182-I226 HydrophobicContact CB-CD1 3.95Å; P182-I226 HydrophobicContact CB-CG1 3.65Å; P182-I226 HydrophobicContact CB-CG2 3.95Å; P182-I226 HydrophobicContact CG-CD1 3.72Å; P182-I226 HydrophobicContact CG-CG1 3.82Å; N184-I226 PolarHBondContact ND2-O 2.77Å; N184-I226 PolarHBondContact OD1-N 2.78Å; N184-I226 PolarHBondContact OD1-O 3.31Å; I226-F228 PolarHBondContact O-N 2.88Å; I226-M266 HydrophobicContact CD1-SD 3.85Å
227	R	93.6	Very high	79.7	Confident	52 Å²	52	61.8 Å²	61.8	20%	0.196	36%	0.359	C	S	.	.			trans	-77.9	120.7	169.3	-179.3	58.7	-176	166.3	4.6	109.6	E46 T47 P48 V206	E46-R227 HydrophobicContact CG-CG 4.23Å; E46-R227 WeakPolarHBondContact OE1-CG 3.41Å; E46-R227 IonicContact OE1-NE 2.64Å; E46-R227 IonicContact OE2-CZ 3.98Å; E46-R227 VanDerWaalsContact OE2-CZ 3.22Å; E46-R227 IonicContact OE2-NE 3.79Å; E46-R227 PolarHBondContact OE2-NE 2.88Å; E46-R227 IonicContact OE2-NH2 2.76Å; E46-R227 PolarHBondContact OE2-NH2 2.84Å; T47-R227 CarbonylContact C-O 3.57Å; P48-R227 WeakPolarHBondContact CD-O 3.46Å; V206-R227 PolarHBondContact O-NH2 2.85Å
228	F	97	Very high	82	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.322	C	S	.	.			trans	-147.4	126.8	170.5	-173.3	-83.8	0	0	0	110.2	T45 E46 T47 F186 I226 V241 M266 I299 H306	T45-F228 HydrophobicContact CG2-CE1 4.4Å; T45-F228 HydrophobicContact CG2-CE2 3.88Å; T45-F228 HydrophobicContact CG2-CZ 3.77Å; E46-F228 WeakPolarHBondContact O-CA 3.28Å; T47-F228 HydrophobicContact CG2-CD2 4.42Å; F186-F228 HydrophobicContact CE1-CB 3.83Å; F186-F228 HydrophobicContact CE1-CD1 4.15Å; F186-F228 HydrophobicContact CE1-CG 4.36Å; F186-F228 HydrophobicContact CZ-CB 4.03Å; I226-F228 PolarHBondContact O-N 2.88Å; F228-V241 HydrophobicContact CD1-CG1 4.31Å; F228-V241 HydrophobicContact CE1-CB 4.44Å; F228-V241 HydrophobicContact CE1-CG1 3.84Å; F228-M266 HydrophobicContact CB-CE 3.95Å; F228-M266 HydrophobicContact CD1-CE 3.59Å; F228-M266 HydrophobicContact CD2-CE 3.49Å; F228-M266 VanDerWaalsContact CD2-CE 3.49Å; F228-M266 HydrophobicContact CD2-SD 4.3Å; F228-M266 HydrophobicContact CE1-CE 3.86Å; F228-M266 HydrophobicContact CE2-CE 3.76Å; F228-M266 HydrophobicContact CG-CE 3.39Å; F228-M266 HydrophobicContact CZ-CE 3.93Å; F228-I299 HydrophobicContact CE1-CD1 4.25Å; F228-I299 HydrophobicContact CZ-CB 4.34Å; F228-I299 HydrophobicContact CZ-CD1 4.11Å; F228-I299 HydrophobicContact CZ-CG2 4.26Å; F228-H306 HydrophobicContact CE2-CB 4.07Å; F228-H306 AromaticContact CE2-CD2 3.66Å; F228-H306 AromaticContact CE2-CG 3.58Å; F228-H306 AromaticContact CE2-ND1 3.85Å; F228-H306 AromaticContact CE2-NE2 4Å; F228-H306 HydrophobicContact CZ-CB 4.31Å
229	F	97.8	Very high	84.3	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.009	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	123.9	177.1	179.1	-98.3	0	0	0	109.6	T45 E46 L203 V206 M207 F231 L240 V241 M242	T45-F229 CarbonylContact C-O 3.59Å; T45-F229 WeakPolarHBondContact CA-O 3.49Å; E46-F229 HydrophobicContact CB-CB 4.36Å; E46-F229 PolarHBondContact N-O 2.77Å; E46-F229 PolarHBondContact O-N 2.78Å; E46-F229 VanDerWaalsContact O-N 3.09Å; L203-F229 HydrophobicContact CD1-CE1 4.34Å; L203-F229 HydrophobicContact CD1-CZ 3.63Å; V206-F229 HydrophobicContact CG1-CD1 4.09Å; V206-F229 HydrophobicContact CG1-CD2 3.44Å; V206-F229 VanDerWaalsContact CG1-CD2 3.44Å; V206-F229 HydrophobicContact CG1-CE1 4.08Å; V206-F229 HydrophobicContact CG1-CE2 3.44Å; V206-F229 VanDerWaalsContact CG1-CE2 3.44Å; V206-F229 HydrophobicContact CG1-CG 3.79Å; V206-F229 HydrophobicContact CG1-CZ 3.78Å; M207-F229 HydrophobicContact CG-CD1 4.27Å; M207-F229 HydrophobicContact CG-CE1 3.59Å; M207-F229 HydrophobicContact CG-CZ 4.44Å; F229-F231 HydrophobicContact CE1-CB 3.8Å; F229-F231 HydrophobicContact CZ-CB 4.31Å; F229-L240 HydrophobicContact CZ-CD2 4.18Å; F229-V241 CarbonylContact C-O 3.51Å; F229-V241 WeakPolarHBondContact CA-O 3.39Å; F229-M242 HydrophobicContact CD2-CB 3.69Å; F229-M242 HydrophobicContact CE2-CB 4.01Å; F229-M242 HydrophobicContact CE2-CE 3.85Å; F229-M242 HydrophobicContact CE2-SD 4.34Å
230	S	98.4	Very high	86.8	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128	174.2	-158.7	0	0	0	0	110.3	L44 T45 L240 V241	L44-S230 WeakPolarHBondContact O-CA 3.42Å; T45-S230 PolarHBondContact OG1-OG 2.86Å; S230-L240 CarbonylContact O-C 3.49Å; S230-L240 WeakPolarHBondContact O-CA 3.29Å; S230-V241 PolarHBondContact N-O 2.83Å; S230-V241 PolarHBondContact O-N 2.97Å
231	F	98.2	Very high	89.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.1	169.7	171.9	-87.7	0	0	0	108.3	A31 F42 S43 L44 L203 M207 F229 L233 I238 L240	A31-F231 HydrophobicContact CB-CE1 3.95Å; A31-F231 HydrophobicContact CB-CZ 4.23Å; F42-F231 HydrophobicContact CD1-CD1 4.13Å; F42-F231 AromaticContact CD1-CE1 3.82Å; F42-F231 HydrophobicContact CD1-CE1 3.82Å; F42-F231 AromaticContact CE1-CD1 3.73Å; F42-F231 HydrophobicContact CE1-CD1 3.73Å; F42-F231 AromaticContact CE1-CE1 3.69Å; F42-F231 HydrophobicContact CE1-CE1 3.69Å; S43-F231 CarbonylContact C-O 3.54Å; S43-F231 VanDerWaalsContact CA-O 3.29Å; S43-F231 WeakPolarHBondContact CA-O 3.34Å; S43-F231 PolarHBondContact OG-O 2.85Å; L44-F231 PolarHBondContact N-O 2.91Å; L44-F231 PolarHBondContact O-N 2.84Å; L203-F231 HydrophobicContact CD1-CD2 4.31Å; L203-F231 HydrophobicContact CD2-CD2 3.72Å; L203-F231 HydrophobicContact CD2-CE2 3.52Å; L203-F231 HydrophobicContact CD2-CZ 4.44Å; L203-F231 HydrophobicContact CG-CD2 4.45Å; M207-F231 HydrophobicContact CE-CB 4.37Å; M207-F231 HydrophobicContact CE-CD1 4.15Å; M207-F231 HydrophobicContact CE-CG 4.24Å; M207-F231 HydrophobicContact SD-CG 4.41Å; F229-F231 HydrophobicContact CE1-CB 3.8Å; F229-F231 HydrophobicContact CZ-CB 4.31Å; F231-L233 HydrophobicContact CE1-CB 3.72Å; F231-L233 HydrophobicContact CZ-CB 3.86Å; F231-I238 HydrophobicContact CD2-CG2 4.38Å; F231-I238 HydrophobicContact CE2-CG2 3.79Å; F231-I238 HydrophobicContact CZ-CG2 4.45Å; F231-L240 HydrophobicContact CB-CD2 4.34Å; F231-L240 HydrophobicContact CD2-CD2 3.43Å; F231-L240 VanDerWaalsContact CD2-CD2 3.43Å; F231-L240 HydrophobicContact CE2-CD2 4.15Å; F231-L240 HydrophobicContact CG-CD2 4.32Å
232	S	98.1	Very high	91.6	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.8	171.1	-46.8	0	0	0	0	109.6	F42 S43 I238 S239	F42-S232 CarbonylContact O-C 3.51Å; F42-S232 WeakPolarHBondContact O-CA 3.47Å; S43-S232 PolarHBondContact OG-OG 3.3Å; S232-I238 CarbonylContact O-C 3.59Å; S232-I238 VanDerWaalsContact O-CA 3.26Å; S232-I238 WeakPolarHBondContact O-CA 3.27Å; S232-S239 PolarHBondContact N-O 3.13Å; S232-S239 PolarHBondContact O-N 2.98Å
233	L	97.2	Very high	93.6	Very high	26 Å²	26	31.1 Å²	31.1	14%	0.136	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	100.5	169.5	173.6	61.1	0	0	0	107.4	F42 F231 Y237 I238	F42-L233 HydrophobicContact CD1-CB 4.48Å; F42-L233 PolarHBondContact N-O 3.35Å; F42-L233 CarbonylContact O-C 3.57Å; F42-L233 PolarHBondContact O-N 3.16Å; F231-L233 HydrophobicContact CE1-CB 3.72Å; F231-L233 HydrophobicContact CZ-CB 3.86Å; L233-Y237 WeakPolarHBondContact CA-O 3.42Å; L233-I238 HydrophobicContact CD1-CD1 4.44Å; L233-I238 HydrophobicContact CD1-CG1 3.68Å
234	I	96.4	Very high	95.1	Very high	8 Å²	8	26 Å²	26	4%	0.041	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	119.6	-173.5	-60	165.7	0	0	0	108.5	K40 F41 L117 T119 F124 G236 Y237	K40-I234 CarbonylContact O-C 3.54Å; K40-I234 WeakPolarHBondContact O-CA 3.34Å; F41-I234 HydrophobicContact CD1-CD1 4.13Å; F41-I234 HydrophobicContact CD1-CG1 4.04Å; F41-I234 HydrophobicContact CD2-CB 4.44Å; F41-I234 HydrophobicContact CD2-CD1 4.26Å; F41-I234 HydrophobicContact CD2-CG1 4.13Å; F41-I234 HydrophobicContact CD2-CG2 3.47Å; F41-I234 VanDerWaalsContact CD2-CG2 3.47Å; F41-I234 HydrophobicContact CE1-CD1 3.66Å; F41-I234 HydrophobicContact CE1-CG1 4.1Å; F41-I234 HydrophobicContact CE2-CD1 3.81Å; F41-I234 HydrophobicContact CE2-CG1 4.2Å; F41-I234 HydrophobicContact CE2-CG2 3.75Å; F41-I234 HydrophobicContact CG-CD1 4.41Å; F41-I234 HydrophobicContact CG-CG1 4.05Å; F41-I234 HydrophobicContact CG-CG2 4.08Å; F41-I234 HydrophobicContact CZ-CD1 3.49Å; F41-I234 VanDerWaalsContact CZ-CD1 3.49Å; F41-I234 HydrophobicContact CZ-CG1 4.19Å; L117-I234 HydrophobicContact CD2-CD1 3.79Å; T119-I234 HydrophobicContact CG2-CD1 4.14Å; F124-I234 HydrophobicContact CD2-CD1 3.98Å; F124-I234 HydrophobicContact CE1-CG2 4.39Å; F124-I234 HydrophobicContact CE2-CD1 3.53Å; F124-I234 HydrophobicContact CE2-CG2 4.25Å; F124-I234 HydrophobicContact CZ-CB 4.45Å; F124-I234 HydrophobicContact CZ-CD1 4.16Å; F124-I234 HydrophobicContact CZ-CG2 3.76Å; I234-G236 PolarHBondContact O-N 3.43Å; I234-G236 VanDerWaalsContact O-N 3.08Å; I234-Y237 PolarHBondContact N-O 2.66Å; I234-Y237 WeakPolarHBondContact O-CB 3.39Å; I234-Y237 PolarHBondContact O-N 2.86Å
235	E	91.8	Very high	95.5	Very high	102 Å²	102	28.7 Å²	28.7	48%	0.477	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	32.2	-177.6	-62.3	-172.7	169.3	0	0	113.8	H8 K40 Y237	H8-E235 IonicContact CD2-OE1 3.06Å; H8-E235 IonicContact CE1-OE1 3.89Å; H8-E235 IonicContact NE2-OE1 2.82Å; H8-E235 PolarHBondContact NE2-OE1 3.12Å; K40-E235 PolarHBondContact O-N 2.88Å; E235-Y237 VanDerWaalsContact C-N 3.34Å
236	G	92.8	Very high	95.7	Very high	41 Å²	41	26.2 Å²	26.2	42%	0.423	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	3.8	-177.8	0	0	0	0	0	114.3	P193 I234	P193-G236 WeakPolarHBondContact CG-O 3.32Å; I234-G236 PolarHBondContact O-N 3.43Å; I234-G236 VanDerWaalsContact O-N 3.08Å
237	Y	94.3	Very high	95.7	Very high	142 Å²	142	26.6 Å²	26.6	56%	0.557	13%	0.132	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.9	171.2	-63.1	-79.6	0	0	0	110.6	Q121 L233 I234 E235	Q121-Y237 HydrophobicContact CG-CD1 4.06Å; Q121-Y237 HydrophobicContact CG-CG 4.17Å; L233-Y237 WeakPolarHBondContact CA-O 3.42Å; I234-Y237 PolarHBondContact N-O 2.66Å; I234-Y237 WeakPolarHBondContact O-CB 3.39Å; I234-Y237 PolarHBondContact O-N 2.86Å; E235-Y237 VanDerWaalsContact C-N 3.34Å
238	I	96.2	Very high	95.7	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.5	176	-61	172.7	0	0	0	109.5	Q121 S190 L191 P193 L196 F231 S232 L233 L240	Q121-I238 PolarHBondContact NE2-O 3.26Å; S190-I238 VanDerWaalsContact CA-O 3.32Å; S190-I238 WeakPolarHBondContact CA-O 3.21Å; S190-I238 WeakPolarHBondContact CB-O 3.18Å; S190-I238 PolarHBondContact OG-O 3.22Å; L191-I238 HydrophobicContact CB-CB 4.11Å; L191-I238 HydrophobicContact CB-CD1 4.41Å; L191-I238 HydrophobicContact CB-CG2 3.86Å; L191-I238 HydrophobicContact CD2-CD1 4.17Å; P193-I238 HydrophobicContact CB-CD1 4.42Å; P193-I238 HydrophobicContact CG-CD1 4.42Å; L196-I238 HydrophobicContact CB-CD1 4.18Å; L196-I238 HydrophobicContact CD1-CD1 4.11Å; L196-I238 HydrophobicContact CD2-CD1 4.09Å; L196-I238 HydrophobicContact CG-CD1 4.35Å; F231-I238 HydrophobicContact CD2-CG2 4.38Å; F231-I238 HydrophobicContact CE2-CG2 3.79Å; F231-I238 HydrophobicContact CZ-CG2 4.45Å; S232-I238 CarbonylContact O-C 3.59Å; S232-I238 VanDerWaalsContact O-CA 3.26Å; S232-I238 WeakPolarHBondContact O-CA 3.27Å; L233-I238 HydrophobicContact CD1-CD1 4.44Å; L233-I238 HydrophobicContact CD1-CG1 3.68Å; I238-L240 HydrophobicContact CG2-CD2 4.11Å; I238-L240 HydrophobicContact CG2-CG 4.12Å
239	S	96.3	Very high	95.6	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.1	170.7	177.5	0	0	0	0	109.7	T119 Y120 S232	T119-S239 WeakPolarHBondContact CA-OG 3.49Å; Y120-S239 PolarHBondContact N-OG 2.79Å; S232-S239 PolarHBondContact N-O 3.13Å; S232-S239 PolarHBondContact O-N 2.98Å
240	L	96.9	Very high	95.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.8	-179.3	-57.4	174.6	0	0	0	109.6	T189 L191 L203 F229 S230 F231 I238 M242 L255	T189-L240 PolarHBondContact N-O 2.84Å; T189-L240 PolarHBondContact O-N 3.39Å; T189-L240 PolarHBondContact OG1-O 2.79Å; L191-L240 HydrophobicContact CB-CD1 4.33Å; L203-L240 HydrophobicContact CD1-CD2 4.16Å; F229-L240 HydrophobicContact CZ-CD2 4.18Å; S230-L240 CarbonylContact O-C 3.49Å; S230-L240 WeakPolarHBondContact O-CA 3.29Å; F231-L240 HydrophobicContact CB-CD2 4.34Å; F231-L240 HydrophobicContact CD2-CD2 3.43Å; F231-L240 VanDerWaalsContact CD2-CD2 3.43Å; F231-L240 HydrophobicContact CE2-CD2 4.15Å; F231-L240 HydrophobicContact CG-CD2 4.32Å; I238-L240 HydrophobicContact CG2-CD2 4.11Å; I238-L240 HydrophobicContact CG2-CG 4.12Å; L240-M242 HydrophobicContact CB-CE 3.51Å; L240-M242 HydrophobicContact CD1-CE 3.74Å; L240-M242 HydrophobicContact CG-CE 4.13Å; L240-L255 HydrophobicContact CD1-CD2 3.93Å
241	V	97.1	Very high	95.1	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.5	170.9	179.5	0	0	0	0	108.3	C187 V188 F228 F229 S230 I299 L308	C187-V241 WeakPolarHBondContact O-CA 3.46Å; V188-V241 HydrophobicContact CG1-CG2 4.15Å; V188-V241 HydrophobicContact CG2-CG2 4.19Å; F228-V241 HydrophobicContact CD1-CG1 4.31Å; F228-V241 HydrophobicContact CE1-CB 4.44Å; F228-V241 HydrophobicContact CE1-CG1 3.84Å; F229-V241 CarbonylContact C-O 3.51Å; F229-V241 WeakPolarHBondContact CA-O 3.39Å; S230-V241 PolarHBondContact N-O 2.83Å; S230-V241 PolarHBondContact O-N 2.97Å; V241-I299 HydrophobicContact CB-CD1 4.32Å; V241-I299 HydrophobicContact CG1-CD1 4.44Å; V241-I299 HydrophobicContact CG2-CD1 3.95Å; V241-L308 HydrophobicContact CG1-CD1 3.42Å; V241-L308 VanDerWaalsContact CG1-CD1 3.42Å
242	M	96.2	Very high	94.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	162	-175.2	69.1	-174.2	85.2	0	0	111.6	F186 C187 F229 L240 T246 Q247 F250	F186-M242 CarbonylContact C-O 3.52Å; F186-M242 WeakPolarHBondContact CA-O 3.34Å; C187-M242 PolarHBondContact N-O 3.43Å; C187-M242 PolarHBondContact O-N 3.27Å; C187-M242 VanDerWaalsContact SG-CG 3.55Å; C187-M242 PolarHBondContact SG-O 3.01Å; F229-M242 HydrophobicContact CD2-CB 3.69Å; F229-M242 HydrophobicContact CE2-CB 4.01Å; F229-M242 HydrophobicContact CE2-CE 3.85Å; F229-M242 HydrophobicContact CE2-SD 4.34Å; L240-M242 HydrophobicContact CB-CE 3.51Å; L240-M242 HydrophobicContact CD1-CE 3.74Å; L240-M242 HydrophobicContact CG-CE 4.13Å; M242-T246 HydrophobicContact CB-CG2 4.13Å; M242-T246 HydrophobicContact CG-CG2 4.38Å; M242-T246 HydrophobicContact SD-CG2 3.78Å; M242-Q247 HydrophobicContact CG-CB 4.09Å; M242-Q247 VanDerWaalsContact SD-CA 3.54Å; M242-Q247 HydrophobicContact SD-CB 4.05Å; M242-F250 HydrophobicContact CE-CD2 4.35Å; M242-F250 HydrophobicContact CE-CE2 3.89Å; M242-F250 HydrophobicContact CE-CZ 4.17Å; M242-F250 HydrophobicContact SD-CD2 3.88Å; M242-F250 HydrophobicContact SD-CE2 3.61Å; M242-F250 HydrophobicContact SD-CZ 4.44Å
243	D	95.6	Very high	93.8	Very high	13 Å²	13	50.8 Å²	50.8	7%	0.07	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	160.7	172.2	59.3	52.5	0	0	0	112.5	N184 R185 F186 Q245 T246 Q247	N184-D243 HydrophobicContact CB-CB 4.42Å; R185-D243 CarbonylContact O-C 3.55Å; R185-D243 VanDerWaalsContact O-CA 3.27Å; R185-D243 WeakPolarHBondContact O-CA 3.44Å; F186-D243 HydrophobicContact CD1-CB 4.26Å; F186-D243 HydrophobicContact CE1-CB 4.18Å; D243-Q245 VanDerWaalsContact C-N 3.25Å; D243-Q245 PolarHBondContact O-N 3.09Å; D243-Q245 PolarHBondContact OD1-N 3.19Å; D243-T246 PolarHBondContact O-N 2.9Å; D243-T246 VanDerWaalsContact OD1-CB 3.22Å; D243-T246 WeakPolarHBondContact OD1-CB 3.49Å; D243-T246 PolarHBondContact OD1-N 3Å; D243-T246 PolarHBondContact OD1-OG1 2.73Å; D243-Q247 PolarHBondContact O-N 3.07Å
244	V	94.5	Very high	93.5	Very high	18 Å²	18	51 Å²	51	11%	0.109	26%	0.264	C	S	.	.	H	α-helix	trans	-57.8	-38.3	-179.5	171.7	0	0	0	0	111.8	R185 T246 Q247 Q248 L263	R185-V244 HydrophobicContact CB-CG2 4Å; R185-V244 WeakPolarHBondContact O-CG2 3.34Å; R185-V244 PolarHBondContact O-N 2.73Å; V244-T246 VanDerWaalsContact C-N 3.33Å; V244-T246 PolarHBondContact O-N 3.31Å; V244-Q247 PolarHBondContact O-N 2.87Å; V244-Q248 HydrophobicContact CG1-CG 4.41Å; V244-Q248 VanDerWaalsContact O-CG 3.27Å; V244-Q248 WeakPolarHBondContact O-CG 3.27Å; V244-Q248 PolarHBondContact O-N 2.64Å; V244-L263 HydrophobicContact CG2-CD1 4.37Å; V244-L263 HydrophobicContact CG2-CD2 3.62Å
245	Q	93.3	Very high	93.3	Very high	88 Å²	88	51.3 Å²	51.3	41%	0.411	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-42.1	179.2	-63.7	90.7	-41.6	0	0	111.3	H225 D243	H225-Q245 PolarHBondContact NE2-NE2 3.02Å; H225-Q245 VanDerWaalsContact NE2-NE2 3.17Å; D243-Q245 VanDerWaalsContact C-N 3.25Å; D243-Q245 PolarHBondContact O-N 3.09Å; D243-Q245 PolarHBondContact OD1-N 3.19Å
246	T	94.3	Very high	93.1	Very high	10 Å²	10	51.6 Å²	51.6	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-69.9	-43.6	175.9	-56.5	0	0	0	0	110.7	V206 M242 D243 V244 Q248 R249 F250	V206-T246 HydrophobicContact CG1-CG2 3.69Å; V206-T246 HydrophobicContact CG2-CG2 3.89Å; M242-T246 HydrophobicContact CB-CG2 4.13Å; M242-T246 HydrophobicContact CG-CG2 4.38Å; M242-T246 HydrophobicContact SD-CG2 3.78Å; D243-T246 PolarHBondContact O-N 2.9Å; D243-T246 VanDerWaalsContact OD1-CB 3.22Å; D243-T246 WeakPolarHBondContact OD1-CB 3.49Å; D243-T246 PolarHBondContact OD1-N 3Å; D243-T246 PolarHBondContact OD1-OG1 2.73Å; V244-T246 VanDerWaalsContact C-N 3.33Å; V244-T246 PolarHBondContact O-N 3.31Å; T246-Q248 VanDerWaalsContact C-N 3.29Å; T246-Q248 PolarHBondContact O-N 3.14Å; T246-R249 VanDerWaalsContact O-CB 3.28Å; T246-R249 WeakPolarHBondContact O-CB 3.21Å; T246-R249 WeakPolarHBondContact O-CG 3.41Å; T246-R249 PolarHBondContact O-N 3.23Å; T246-R249 VanDerWaalsContact O-N 3.09Å; T246-F250 HydrophobicContact CG2-CE2 4.35Å; T246-F250 WeakPolarHBondContact O-CD2 3.12Å
247	Q	93.8	Very high	92.6	Very high	45 Å²	45	52.2 Å²	52.2	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-40.4	178.2	-169.4	-162.5	-8.9	0	0	112.2	C187 M242 D243 V244 R249 F250 L255	C187-Q247 PolarHBondContact SG-OE1 2.8Å; M242-Q247 HydrophobicContact CG-CB 4.09Å; M242-Q247 VanDerWaalsContact SD-CA 3.54Å; M242-Q247 HydrophobicContact SD-CB 4.05Å; D243-Q247 PolarHBondContact O-N 3.07Å; V244-Q247 PolarHBondContact O-N 2.87Å; Q247-R249 PolarHBondContact O-N 2.68Å; Q247-R249 VanDerWaalsContact O-N 3.09Å; Q247-F250 WeakPolarHBondContact O-CB 3.44Å; Q247-F250 PolarHBondContact O-N 2.85Å; Q247-L255 HydrophobicContact CG-CD1 3.74Å
248	Q	93.3	Very high	91.6	Very high	150 Å²	150	47.7 Å²	47.7	70%	0.701	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.7	179.1	-76.4	173.3	-1.3	0	0	114	V244 T246 F250	V244-Q248 HydrophobicContact CG1-CG 4.41Å; V244-Q248 VanDerWaalsContact O-CG 3.27Å; V244-Q248 WeakPolarHBondContact O-CG 3.27Å; V244-Q248 PolarHBondContact O-N 2.64Å; T246-Q248 VanDerWaalsContact C-N 3.29Å; T246-Q248 PolarHBondContact O-N 3.14Å; Q248-F250 VanDerWaalsContact C-N 3.31Å
249	R	94.5	Very high	90.1	Very high	112 Å²	112	53.1 Å²	53.1	42%	0.423	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-21.7	175.2	-55.2	174.4	58.4	-171.1	-4.6	112.4	L202 D205 T246 Q247	L202-R249 HydrophobicContact CD1-CB 3.87Å; L202-R249 HydrophobicContact CD2-CB 4.32Å; L202-R249 VanDerWaalsContact CD2-O 3.25Å; L202-R249 WeakPolarHBondContact CD2-O 3.47Å; D205-R249 IonicContact OD2-CZ 2.88Å; D205-R249 VanDerWaalsContact OD2-CZ 3.29Å; D205-R249 IonicContact OD2-NH1 3.92Å; D205-R249 PolarHBondContact OD2-NH1 3.31Å; D205-R249 IonicContact OD2-NH2 3.41Å; D205-R249 PolarHBondContact OD2-NH2 2.75Å; T246-R249 VanDerWaalsContact O-CB 3.28Å; T246-R249 WeakPolarHBondContact O-CB 3.21Å; T246-R249 WeakPolarHBondContact O-CG 3.41Å; T246-R249 PolarHBondContact O-N 3.23Å; T246-R249 VanDerWaalsContact O-N 3.09Å; Q247-R249 PolarHBondContact O-N 2.68Å; Q247-R249 VanDerWaalsContact O-N 3.09Å
250	F	94.1	Very high	88.8	Confident	11 Å²	11	57 Å²	57	5%	0.048	32%	0.323	C	S	.	.	S	Bend	trans	-84.3	145.9	-179.5	-72.7	-101	0	0	0	111.2	V199 L202 L203 V206 M242 T246 Q247 Q248 S252 L255	V199-F250 HydrophobicContact CB-CD1 4.31Å; V199-F250 HydrophobicContact CB-CE1 4.3Å; V199-F250 HydrophobicContact CG1-CD1 4.27Å; L202-F250 HydrophobicContact CD2-CB 4.21Å; L202-F250 HydrophobicContact CD2-CD1 3.64Å; L202-F250 HydrophobicContact CD2-CD2 3.82Å; L202-F250 HydrophobicContact CD2-CE1 3.84Å; L202-F250 HydrophobicContact CD2-CE2 4Å; L202-F250 HydrophobicContact CD2-CG 3.62Å; L202-F250 HydrophobicContact CD2-CZ 4.02Å; L202-F250 HydrophobicContact CG-CD1 4.5Å; L202-F250 HydrophobicContact CG-CE1 4.22Å; L202-F250 HydrophobicContact CG-CE2 4.26Å; L202-F250 HydrophobicContact CG-CZ 4.09Å; L203-F250 HydrophobicContact CD1-CE1 4.2Å; L203-F250 HydrophobicContact CD1-CZ 3.89Å; V206-F250 HydrophobicContact CG2-CE2 4.32Å; M242-F250 HydrophobicContact CE-CD2 4.35Å; M242-F250 HydrophobicContact CE-CE2 3.89Å; M242-F250 HydrophobicContact CE-CZ 4.17Å; M242-F250 HydrophobicContact SD-CD2 3.88Å; M242-F250 HydrophobicContact SD-CE2 3.61Å; M242-F250 HydrophobicContact SD-CZ 4.44Å; T246-F250 HydrophobicContact CG2-CE2 4.35Å; T246-F250 WeakPolarHBondContact O-CD2 3.12Å; Q247-F250 WeakPolarHBondContact O-CB 3.44Å; Q247-F250 PolarHBondContact O-N 2.85Å; Q248-F250 VanDerWaalsContact C-N 3.31Å; F250-S252 PolarHBondContact O-N 2.81Å; F250-S252 VanDerWaalsContact O-N 3.16Å; F250-L255 HydrophobicContact CB-CD1 3.59Å; F250-L255 HydrophobicContact CB-CD2 4.37Å; F250-L255 HydrophobicContact CB-CG 3.98Å; F250-L255 HydrophobicContact CD1-CD2 4.15Å; F250-L255 HydrophobicContact CG-CD1 4.09Å; F250-L255 HydrophobicContact CG-CD2 4.36Å; F250-L255 HydrophobicContact CG-CG 4.48Å
251	P	91.9	Very high	87.9	Confident	56 Å²	56	59.1 Å²	59.1	36%	0.364	34%	0.344	S	S	.	.			trans	-60.5	118.2	168.8	-19.6	32.1	0	0	0	110.2	V199 N253 L254	V199-P251 HydrophobicContact CG1-CG 4.46Å; P251-N253 WeakPolarHBondContact CB-OD1 3.33Å; P251-N253 PolarHBondContact O-N 2.92Å; P251-N253 VanDerWaalsContact O-N 3.09Å; P251-L254 HydrophobicContact CB-CD1 4.01Å; P251-L254 HydrophobicContact CB-CG 4.1Å; P251-L254 HydrophobicContact CG-CD1 3.98Å; P251-L254 PolarHBondContact O-N 3.07Å
252	S	82.5	Confident	87.4	Confident	110 Å²	110	61 Å²	61	77%	0.769	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.7	-173.4	55.1	0	0	0	0	113.9	F250 L254	F250-S252 PolarHBondContact O-N 2.81Å; F250-S252 VanDerWaalsContact O-N 3.16Å; S252-L254 VanDerWaalsContact C-N 3.27Å; S252-L254 PolarHBondContact O-N 2.86Å
253	N	87.2	Confident	87.3	Confident	129 Å²	129	62.8 Å²	62.8	69%	0.69	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.7	177.8	67.6	-71.8	0	0	0	114.2	P251	P251-N253 WeakPolarHBondContact CB-OD1 3.33Å; P251-N253 PolarHBondContact O-N 2.92Å; P251-N253 VanDerWaalsContact O-N 3.09Å
254	L	91.1	Very high	87.3	Confident	29 Å²	29	62.5 Å²	62.5	15%	0.152	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-22.6	179.3	-59.8	-177.9	0	0	0	112.8	L191 T195 A198 V199 P251 S252	L191-L254 HydrophobicContact CD1-CB 4.05Å; L191-L254 WeakPolarHBondContact CD1-O 3.39Å; T195-L254 HydrophobicContact CG2-CD2 3.9Å; A198-L254 HydrophobicContact CB-CD1 4.24Å; V199-L254 HydrophobicContact CG1-CD1 3.59Å; P251-L254 HydrophobicContact CB-CD1 4.01Å; P251-L254 HydrophobicContact CB-CG 4.1Å; P251-L254 HydrophobicContact CG-CD1 3.98Å; P251-L254 PolarHBondContact O-N 3.07Å; S252-L254 VanDerWaalsContact C-N 3.27Å; S252-L254 PolarHBondContact O-N 2.86Å
255	L	91.1	Very high	87.5	Confident	16 Å²	16	62.8 Å²	62.8	8%	0.084	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.5	179.9	-63.9	-177	0	0	0	110.8	L191 L240 Q247 F250 T257	L191-L255 HydrophobicContact CD1-CD2 4.29Å; L240-L255 HydrophobicContact CD1-CD2 3.93Å; Q247-L255 HydrophobicContact CG-CD1 3.74Å; F250-L255 HydrophobicContact CB-CD1 3.59Å; F250-L255 HydrophobicContact CB-CD2 4.37Å; F250-L255 HydrophobicContact CB-CG 3.98Å; F250-L255 HydrophobicContact CD1-CD2 4.15Å; F250-L255 HydrophobicContact CG-CD1 4.09Å; F250-L255 HydrophobicContact CG-CD2 4.36Å; F250-L255 HydrophobicContact CG-CG 4.48Å; L255-T257 PolarHBondContact O-N 3.13Å
256	F	88.5	Confident	87.6	Confident	108 Å²	108	58.6 Å²	58.6	47%	0.474	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	112.2	164.7	-56.2	-61	0	0	0	108.6	T189 S190 D192	T189-F256 CarbonylContact C-O 3.39Å; T189-F256 VanDerWaalsContact CA-O 3.26Å; T189-F256 WeakPolarHBondContact CA-O 3.4Å; T189-F256 WeakPolarHBondContact CB-O 3.49Å; S190-F256 PolarHBondContact N-O 2.98Å; S190-F256 PolarHBondContact O-N 3.43Å; D192-F256 HydrophobicContact CB-CE2 3.82Å; D192-F256 HydrophobicContact CB-CZ 4.28Å
257	T	82.6	Confident	87.7	Confident	54 Å²	54	58.6 Å²	58.6	33%	0.331	34%	0.34	S	S	.	.			trans	-116.5	165.2	172.6	-174	0	0	0	0	109.6	L255 A259	L255-T257 PolarHBondContact O-N 3.13Å; T257-A259 PolarHBondContact O-N 3.02Å
258	S	73.6	Confident	87.9	Confident	47 Å²	47	57.8 Å²	57.8	33%	0.329	34%	0.335	S	S	.	.			trans	-54.8	138.6	168.4	-179.7	0	0	0	0	110.1	S260 G261	S258-S260 PolarHBondContact O-N 3.15Å; S258-S260 PolarHBondContact OG-OG 3.09Å; S258-G261 PolarHBondContact O-N 2.73Å
259	A	63.5	Low	88	Confident	114 Å²	114	50.7 Å²	50.7	94%	0.942	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.6	179.7	0	0	0	0	0	113.1	T257 G261	T257-A259 PolarHBondContact O-N 3.02Å; A259-G261 VanDerWaalsContact C-N 3.31Å
260	S	69.9	Low	88	Confident	85 Å²	85	45.7 Å²	45.7	59%	0.594	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-16	176	54.6	0	0	0	0	113.8	S258 E262	S258-S260 PolarHBondContact O-N 3.15Å; S258-S260 PolarHBondContact OG-OG 3.09Å; S260-E262 PolarHBondContact O-N 2.93Å; S260-E262 WeakPolarHBondContact OG-CB 3.24Å; S260-E262 PolarHBondContact OG-N 2.79Å
261	G	76.7	Confident	87.9	Confident	44 Å²	44	47.3 Å²	47.3	45%	0.454	31%	0.306	S	S	.	.			trans	62.1	25.9	-169.3	0	0	0	0	0	112.9	S258 A259 L263	S258-G261 PolarHBondContact O-N 2.73Å; A259-G261 VanDerWaalsContact C-N 3.31Å; G261-L263 PolarHBondContact O-N 3.02Å
262	E	87.7	Confident	88	Confident	42 Å²	42	51.8 Å²	51.8	20%	0.196	32%	0.322	C	S	.	.			trans	-53.9	128.8	-178	-178	176.7	-140.8	0	0	111.6	S260 W264 P310	S260-E262 PolarHBondContact O-N 2.93Å; S260-E262 WeakPolarHBondContact OG-CB 3.24Å; S260-E262 PolarHBondContact OG-N 2.79Å; E262-W264 HydrophobicContact CG-CZ2 4.14Å; E262-W264 PolarHBondContact O-NE1 3.5Å; E262-W264 WeakPolarHBondContact OE2-CZ2 3.43Å; E262-P310 HydrophobicContact CG-CB 4.5Å
263	L	94.6	Very high	88.6	Confident	37 Å²	37	50.1 Å²	50.1	19%	0.194	31%	0.308	C	S	.	.			trans	-101.7	149.5	177.3	-64.3	-178.7	0	0	0	109.8	R185 V244 G261 E311	R185-L263 HydrophobicContact CB-CD1 4.31Å; V244-L263 HydrophobicContact CG2-CD1 4.37Å; V244-L263 HydrophobicContact CG2-CD2 3.62Å; G261-L263 PolarHBondContact O-N 3.02Å; L263-E311 HydrophobicContact CB-CB 4.36Å; L263-E311 WeakPolarHBondContact O-CB 3.17Å; L263-E311 PolarHBondContact O-N 2.74Å
264	W	95.8	Very high	89	Confident	7 Å²	7	45 Å²	45	3%	0.027	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.1	-172.6	-59.9	74.9	0	0	0	110.3	F186 V188 E262 Y297 L308 V309 P310	F186-W264 HydrophobicContact CB-CB 4.18Å; F186-W264 PolarHBondContact N-O 2.9Å; F186-W264 PolarHBondContact O-N 3.13Å; V188-W264 HydrophobicContact CG2-CG 4.45Å; E262-W264 HydrophobicContact CG-CZ2 4.14Å; E262-W264 PolarHBondContact O-NE1 3.5Å; E262-W264 WeakPolarHBondContact OE2-CZ2 3.43Å; W264-Y297 HydrophobicContact CD2-CD2 4.36Å; W264-Y297 AromaticContact CE3-CD2 3.97Å; W264-Y297 HydrophobicContact CE3-CD2 3.97Å; W264-Y297 HydrophobicContact CE3-CE2 4.42Å; W264-Y297 AromaticContact CH2-CD2 3.67Å; W264-Y297 HydrophobicContact CH2-CD2 3.67Å; W264-Y297 AromaticContact CH2-CE2 3.44Å; W264-Y297 HydrophobicContact CH2-CE2 3.44Å; W264-Y297 VanDerWaalsContact CH2-CE2 3.44Å; W264-Y297 HydrophobicContact CZ2-CD2 4.04Å; W264-Y297 AromaticContact CZ2-CE2 3.52Å; W264-Y297 HydrophobicContact CZ2-CE2 3.52Å; W264-Y297 AromaticContact CZ3-CD2 3.61Å; W264-Y297 HydrophobicContact CZ3-CD2 3.61Å; W264-Y297 AromaticContact CZ3-CE2 3.9Å; W264-Y297 HydrophobicContact CZ3-CE2 3.9Å; W264-L308 HydrophobicContact CB-CB 4.15Å; W264-L308 HydrophobicContact CB-CD2 4.24Å; W264-L308 HydrophobicContact CE3-CB 4.08Å; W264-V309 CarbonylContact C-O 3.44Å; W264-V309 VanDerWaalsContact CA-O 3.28Å; W264-V309 WeakPolarHBondContact CA-O 3.34Å; W264-P310 HydrophobicContact CE3-CG 4.39Å; W264-P310 HydrophobicContact CH2-CG 4Å; W264-P310 HydrophobicContact CZ3-CG 3.85Å
265	K	96.8	Very high	89.2	Confident	25 Å²	25	45.6 Å²	45.6	11%	0.109	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	145.1	167.9	-68.1	-62.6	-60.6	170.7	0	108.9	P182 S183 N184 R185 L308 V309 E311 I314	P182-K265 PolarHBondContact O-NZ 3.42Å; S183-K265 PolarHBondContact O-NZ 3.09Å; N184-K265 PolarHBondContact O-NZ 2.76Å; R185-K265 HydrophobicContact CG-CD 4.41Å; K265-L308 WeakPolarHBondContact O-CA 3.39Å; K265-V309 HydrophobicContact CB-CG2 4.33Å; K265-V309 PolarHBondContact N-O 3.42Å; K265-V309 WeakPolarHBondContact O-CG2 3.24Å; K265-V309 PolarHBondContact O-N 2.95Å; K265-E311 HydrophobicContact CD-CG 4.31Å; K265-E311 HydrophobicContact CG-CB 4.01Å; K265-E311 HydrophobicContact CG-CG 3.96Å; K265-I314 HydrophobicContact CB-CD1 4.03Å
266	M	96.6	Very high	89.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.8	177.8	-177.3	-178.3	-73.4	0	0	110.6	S181 P182 F186 I226 F228 H306 A307 L308	S181-M266 VanDerWaalsContact CA-O 3.31Å; S181-M266 WeakPolarHBondContact CA-O 2.82Å; S181-M266 WeakPolarHBondContact CB-O 3.34Å; S181-M266 PolarHBondContact OG-O 3.49Å; S181-M266 VanDerWaalsContact OG-O 3.12Å; P182-M266 WeakPolarHBondContact CD-O 3.26Å; P182-M266 HydrophobicContact CG-CB 3.94Å; P182-M266 HydrophobicContact CG-CG 4.44Å; P182-M266 HydrophobicContact CG-SD 4.17Å; F186-M266 HydrophobicContact CD2-CB 4.01Å; F186-M266 HydrophobicContact CD2-CE 4.34Å; F186-M266 HydrophobicContact CE1-CE 4.13Å; F186-M266 HydrophobicContact CE2-CB 3.61Å; F186-M266 HydrophobicContact CE2-CE 3.72Å; F186-M266 HydrophobicContact CE2-SD 4.29Å; F186-M266 HydrophobicContact CZ-CE 3.61Å; F186-M266 HydrophobicContact CZ-SD 4.37Å; I226-M266 HydrophobicContact CD1-SD 3.85Å; F228-M266 HydrophobicContact CB-CE 3.95Å; F228-M266 HydrophobicContact CD1-CE 3.59Å; F228-M266 HydrophobicContact CD2-CE 3.49Å; F228-M266 VanDerWaalsContact CD2-CE 3.49Å; F228-M266 HydrophobicContact CD2-SD 4.3Å; F228-M266 HydrophobicContact CE1-CE 3.86Å; F228-M266 HydrophobicContact CE2-CE 3.76Å; F228-M266 HydrophobicContact CG-CE 3.39Å; F228-M266 HydrophobicContact CZ-CE 3.93Å; M266-H306 HydrophobicContact CE-CB 4.32Å; M266-H306 HydrophobicContact CG-CB 4.32Å; M266-H306 HydrophobicContact SD-CB 4.25Å; M266-A307 CarbonylContact C-O 3.57Å; M266-A307 WeakPolarHBondContact CA-O 3.44Å; M266-L308 HydrophobicContact CB-CD2 3.83Å; M266-L308 HydrophobicContact CE-CD2 4.14Å; M266-L308 HydrophobicContact CG-CD2 4.34Å
267	V	96.6	Very high	89.8	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.055	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	110.2	160.2	-177.2	0	0	0	0	106.5	L179 I269 A307 V309 V317 L321	L179-V267 HydrophobicContact CB-CG1 4.25Å; L179-V267 HydrophobicContact CD1-CG1 4.33Å; L179-V267 HydrophobicContact CD2-CG1 4.15Å; L179-V267 HydrophobicContact CG-CG1 4.49Å; V267-I269 VanDerWaalsContact O-CD1 3.27Å; V267-I269 WeakPolarHBondContact O-CD1 3.16Å; V267-A307 HydrophobicContact CB-CB 4.42Å; V267-A307 PolarHBondContact N-O 3.32Å; V267-A307 PolarHBondContact O-N 3.49Å; V267-V309 HydrophobicContact CG2-CG2 4.38Å; V267-V317 HydrophobicContact CG2-CG1 3.9Å; V267-L321 HydrophobicContact CG1-CD1 4.16Å
268	R	96.5	Very high	90.3	Very high	28 Å²	28	47.4 Å²	47.4	11%	0.106	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.8	174.5	-179.4	176.8	172.8	-172	-4.1	109.4	E49 L179 S180	E49-R268 IonicContact OE1-CZ 2.74Å; E49-R268 VanDerWaalsContact OE1-CZ 3.28Å; E49-R268 IonicContact OE1-NH1 3.29Å; E49-R268 PolarHBondContact OE1-NH1 3.23Å; E49-R268 IonicContact OE1-NH2 2.75Å; E49-R268 PolarHBondContact OE1-NH2 2.79Å; E49-R268 IonicContact OE2-CZ 2.76Å; E49-R268 IonicContact OE2-NH1 3.22Å; E49-R268 IonicContact OE2-NH2 2.79Å; E49-R268 PolarHBondContact OE2-NH2 2.67Å; L179-R268 WeakPolarHBondContact CA-O 3.48Å; S180-R268 PolarHBondContact N-O 3.4Å; S180-R268 PolarHBondContact O-N 2.87Å
269	I	96.9	Very high	91.3	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.4	-174.3	-55.4	100.9	0	0	0	109.6	H177 L179 V267 I281 I285 Y298 D305 A307	H177-I269 HydrophobicContact CB-CG2 3.83Å; L179-I269 HydrophobicContact CD2-CB 4.2Å; L179-I269 HydrophobicContact CD2-CG1 3.65Å; L179-I269 HydrophobicContact CD2-CG2 4.14Å; V267-I269 VanDerWaalsContact O-CD1 3.27Å; V267-I269 WeakPolarHBondContact O-CD1 3.16Å; I269-I281 HydrophobicContact CG2-CG2 4.06Å; I269-I285 HydrophobicContact CD1-CG1 4.23Å; I269-I285 HydrophobicContact CG1-CD1 3.92Å; I269-I285 HydrophobicContact CG1-CG1 3.95Å; I269-Y298 HydrophobicContact CD1-CE2 4.33Å; I269-D305 HydrophobicContact CB-CB 4.05Å; I269-D305 HydrophobicContact CD1-CB 4.01Å; I269-D305 WeakPolarHBondContact CD1-O 3.28Å; I269-D305 PolarHBondContact N-O 2.86Å; I269-D305 PolarHBondContact O-N 3.03Å; I269-A307 HydrophobicContact CD1-CB 4.25Å
270	G	94.3	Very high	92.8	Very high	7 Å²	7	41.8 Å²	41.8	7%	0.072	26%	0.258	C	S	.	.			trans	106.9	139.9	179.1	0	0	0	0	0	112.9	P178	P178-G270 PolarHBondContact O-N 3.24Å
271	G	90.7	Very high	94	Very high	46 Å²	46	38.3 Å²	38.3	47%	0.474	23%	0.233	S	C	.	.	S	Bend	trans	-109.5	-9	174.2	0	0	0	0	0	112.9	P178	P178-G271 VanDerWaalsContact CG-N 3.25Å
272	Q	94.1	Very high	95	Very high	150 Å²	150	36.4 Å²	36.4	70%	0.701	21%	0.212	S	C	*	.	S	Bend	trans	-140.8	162.7	170.9	-66.3	-62.1	-32.9	0	0	106.9	L274 F304	Q272-L274 PolarHBondContact O-N 2.9Å; Q272-F304 VanDerWaalsContact C-CE1 3.46Å; Q272-F304 VanDerWaalsContact O-CE1 3.27Å; Q272-F304 WeakPolarHBondContact O-CE1 3.28Å
273	P	96.1	Very high	95.4	Very high	74 Å²	74	34.4 Å²	34.4	48%	0.481	20%	0.203	S	C	.	.			trans	-51.5	126.6	175.7	-28.1	36.3	0	0	0	112.2	G275 K303	P273-G275 VanDerWaalsContact C-N 3.33Å; P273-K303 CarbonylContact C-O 3.41Å; P273-K303 VanDerWaalsContact CA-O 3.24Å; P273-K303 WeakPolarHBondContact CA-O 3.2Å; P273-K303 HydrophobicContact CB-CB 4.19Å; P273-K303 HydrophobicContact CB-CG 4.26Å; P273-K303 HydrophobicContact CG-CB 4.33Å; P273-K303 HydrophobicContact CG-CG 4.2Å
274	L	96.2	Very high	95.4	Very high	21 Å²	21	33.2 Å²	33.2	11%	0.11	20%	0.196	C	C	.	.			trans	-72.5	-27.4	-176.2	-62.8	172.2	0	0	0	112.6	Q272 I281 K303 D305	Q272-L274 PolarHBondContact O-N 2.9Å; L274-I281 HydrophobicContact CB-CD1 4.02Å; L274-I281 HydrophobicContact CD1-CD1 4.15Å; L274-I281 HydrophobicContact CD1-CG2 4.31Å; L274-I281 HydrophobicContact CD2-CD1 4.13Å; L274-I281 HydrophobicContact CG-CD1 4.32Å; L274-K303 PolarHBondContact N-O 2.91Å; L274-D305 HydrophobicContact CD1-CB 3.96Å
275	G	95.2	Very high	95.4	Very high	42 Å²	42	33 Å²	33	43%	0.433	20%	0.195	S	C	.	.			trans	72.5	-165.2	-172.3	0	0	0	0	0	112.4	P273	P273-G275 VanDerWaalsContact C-N 3.33Å
276	F	96.6	Very high	95.3	Very high	35 Å²	35	31.8 Å²	31.8	15%	0.154	19%	0.19	C	C	.	.	S	Bend	trans	-118.9	-6.7	-172.3	-61.2	-82.2	0	0	0	114.2	V12 A72 W76 S113 F115 F302	V12-F276 HydrophobicContact CG1-CE1 4.04Å; V12-F276 HydrophobicContact CG1-CZ 4.32Å; A72-F276 HydrophobicContact CB-CD1 4.27Å; A72-F276 HydrophobicContact CB-CD2 4.05Å; A72-F276 HydrophobicContact CB-CE1 3.98Å; A72-F276 HydrophobicContact CB-CE2 3.75Å; A72-F276 HydrophobicContact CB-CG 4.31Å; A72-F276 HydrophobicContact CB-CZ 3.71Å; W76-F276 HydrophobicContact CH2-CB 4.35Å; W76-F276 HydrophobicContact CH2-CD1 4.13Å; W76-F276 HydrophobicContact CZ2-CB 4.18Å; W76-F276 AromaticContact CZ2-CD1 3.68Å; W76-F276 HydrophobicContact CZ2-CD1 3.68Å; W76-F276 HydrophobicContact CZ2-CE1 4.47Å; W76-F276 HydrophobicContact CZ2-CG 4.22Å; S113-F276 WeakPolarHBondContact CB-O 3.3Å; S113-F276 PolarHBondContact OG-O 3.14Å; F115-F276 HydrophobicContact CD2-CD1 4.06Å; F115-F276 AromaticContact CD2-CE1 3.91Å; F115-F276 HydrophobicContact CD2-CE1 3.91Å; F115-F276 HydrophobicContact CE2-CD1 4.25Å; F115-F276 AromaticContact CE2-CE1 3.67Å; F115-F276 HydrophobicContact CE2-CE1 3.67Å; F276-F302 HydrophobicContact CE2-CD1 4.43Å; F276-F302 HydrophobicContact CE2-CD2 4.2Å; F276-F302 HydrophobicContact CE2-CE1 4.16Å; F276-F302 AromaticContact CE2-CE2 3.92Å; F276-F302 HydrophobicContact CE2-CE2 3.92Å; F276-F302 HydrophobicContact CE2-CG 4.42Å; F276-F302 AromaticContact CE2-CZ 3.89Å; F276-F302 HydrophobicContact CE2-CZ 3.89Å; F276-F302 HydrophobicContact CZ-CD1 4.33Å; F276-F302 AromaticContact CZ-CD2 3.59Å; F276-F302 HydrophobicContact CZ-CD2 3.59Å; F276-F302 HydrophobicContact CZ-CE1 4.43Å; F276-F302 AromaticContact CZ-CE2 3.71Å; F276-F302 HydrophobicContact CZ-CE2 3.71Å; F276-F302 AromaticContact CZ-CG 3.9Å; F276-F302 HydrophobicContact CZ-CG 3.9Å; F276-F302 HydrophobicContact CZ-CZ 4.14Å
277	D	95.1	Very high	95.2	Very high	116 Å²	116	34.3 Å²	34.3	62%	0.62	20%	0.202	S	C	*	.	S	Bend	trans	-98.5	-21.4	-173.5	-69.3	-47.2	0	0	0	113.6	R128 C279	R128-D277 IonicContact CZ-OD1 3.02Å; R128-D277 IonicContact NH1-OD1 2.73Å; R128-D277 PolarHBondContact NH1-OD1 2.93Å; D277-C279 PolarHBondContact O-N 2.91Å; D277-C279 PolarHBondContact O-SG 3.18Å; D277-C279 VanDerWaalsContact O-SG 3.36Å
278	E	93.7	Very high	95	Very high	65 Å²	65	35 Å²	35	30%	0.304	21%	0.207	S	C	.	.			trans	-69.5	127.1	179.5	-170	-178.1	147.8	0	0	110.8	H177 I281	H177-E278 IonicContact CD2-OE1 3.66Å; H177-E278 IonicContact CE1-OE1 3.56Å; H177-E278 IonicContact CE1-OE2 3.51Å; H177-E278 PolarHBondContact CE1-OE2 3.21Å; H177-E278 IonicContact NE2-OE1 2.75Å; H177-E278 PolarHBondContact NE2-OE1 3.15Å; H177-E278 IonicContact NE2-OE2 2.68Å; H177-E278 PolarHBondContact NE2-OE2 2.72Å; E278-I281 HydrophobicContact CB-CD1 3.86Å; E278-I281 HydrophobicContact CB-CG1 4.33Å; E278-I281 HydrophobicContact CG-CD1 3.95Å; E278-I281 HydrophobicContact CG-CG1 3.94Å; E278-I281 WeakPolarHBondContact OE1-CG1 3.39Å
279	C	93.9	Very high	95	Very high	33 Å²	33	33.7 Å²	33.7	22%	0.223	20%	0.202	C	C	.	.			trans	-100	143.4	-176	-59.7	0	0	0	0	111.1	N111 S113 D277	N111-C279 HydrophobicContact CB-CB 4.41Å; N111-C279 PolarHBondContact O-SG 3.41Å; S113-C279 PolarHBondContact N-SG 3.13Å; S113-C279 VanDerWaalsContact N-SG 3.42Å; D277-C279 PolarHBondContact O-N 2.91Å; D277-C279 PolarHBondContact O-SG 3.18Å; D277-C279 VanDerWaalsContact O-SG 3.36Å
280	G	94.5	Very high	94.8	Very high	10 Å²	10	34.5 Å²	34.5	10%	0.103	21%	0.208	C	C	.	.	S	Bend	trans	84.5	5.9	172.4	0	0	0	0	0	116.1	V282 A283 Q284	G280-V282 VanDerWaalsContact C-N 3.33Å; G280-V282 PolarHBondContact O-N 3.31Å; G280-A283 WeakPolarHBondContact O-CB 3.32Å; G280-A283 PolarHBondContact O-N 3.34Å; G280-A283 VanDerWaalsContact O-N 3.1Å; G280-Q284 WeakPolarHBondContact O-CG 3.35Å; G280-Q284 PolarHBondContact O-N 2.73Å
281	I	96.1	Very high	94.7	Very high	13 Å²	13	38 Å²	38	7%	0.067	24%	0.237	C	C	.	.	H	α-helix	trans	-55.2	-49.7	173.2	-61.5	175.9	0	0	0	110.6	I269 L274 E278 A283 Q284 D305	I269-I281 HydrophobicContact CG2-CG2 4.06Å; L274-I281 HydrophobicContact CB-CD1 4.02Å; L274-I281 HydrophobicContact CD1-CD1 4.15Å; L274-I281 HydrophobicContact CD1-CG2 4.31Å; L274-I281 HydrophobicContact CD2-CD1 4.13Å; L274-I281 HydrophobicContact CG-CD1 4.32Å; E278-I281 HydrophobicContact CB-CD1 3.86Å; E278-I281 HydrophobicContact CB-CG1 4.33Å; E278-I281 HydrophobicContact CG-CD1 3.95Å; E278-I281 HydrophobicContact CG-CG1 3.94Å; E278-I281 WeakPolarHBondContact OE1-CG1 3.39Å; I281-A283 VanDerWaalsContact C-N 3.27Å; I281-A283 PolarHBondContact O-N 3.18Å; I281-Q284 WeakPolarHBondContact O-CB 3.47Å; I281-Q284 PolarHBondContact O-N 2.68Å; I281-D305 WeakPolarHBondContact CG2-OD2 3.48Å
282	V	96.7	Very high	94.8	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-36.9	177.4	-173.2	0	0	0	0	111.3	I104 V114 M116 G280 I285 S286 Y298	I104-V282 HydrophobicContact CD1-CG1 4.44Å; I104-V282 HydrophobicContact CG2-CB 3.95Å; I104-V282 HydrophobicContact CG2-CG1 3.85Å; V114-V282 HydrophobicContact CG2-CB 4.2Å; V114-V282 HydrophobicContact CG2-CG2 3.87Å; M116-V282 HydrophobicContact CG-CB 4.39Å; M116-V282 HydrophobicContact CG-CG1 3.77Å; M116-V282 HydrophobicContact CG-CG2 3.77Å; G280-V282 VanDerWaalsContact C-N 3.33Å; G280-V282 PolarHBondContact O-N 3.31Å; V282-I285 PolarHBondContact O-N 3.17Å; V282-S286 VanDerWaalsContact O-CB 3.29Å; V282-S286 WeakPolarHBondContact O-CB 3.39Å; V282-S286 PolarHBondContact O-N 3.46Å; V282-S286 PolarHBondContact O-OG 3.06Å; V282-Y298 HydrophobicContact CG1-CD2 4.31Å; V282-Y298 HydrophobicContact CG1-CE1 4.38Å; V282-Y298 HydrophobicContact CG1-CE2 4.2Å; V282-Y298 HydrophobicContact CG1-CG 4.45Å; V282-Y298 HydrophobicContact CG2-CD1 4.5Å; V282-Y298 HydrophobicContact CG2-CE1 3.86Å
283	A	95.4	Very high	94.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-44.2	177.8	0	0	0	0	0	111.7	I104 A108 G280 I281 I285 S286 E287	I104-A283 HydrophobicContact CG2-CB 3.95Å; A108-A283 HydrophobicContact CB-CB 3.83Å; G280-A283 WeakPolarHBondContact O-CB 3.32Å; G280-A283 PolarHBondContact O-N 3.34Å; G280-A283 VanDerWaalsContact O-N 3.1Å; I281-A283 VanDerWaalsContact C-N 3.27Å; I281-A283 PolarHBondContact O-N 3.18Å; A283-I285 PolarHBondContact O-N 2.87Å; A283-S286 PolarHBondContact O-N 3.41Å; A283-E287 HydrophobicContact CB-CG 4.45Å; A283-E287 WeakPolarHBondContact O-CB 3.2Å; A283-E287 WeakPolarHBondContact O-CG 3.28Å; A283-E287 PolarHBondContact O-N 2.97Å
284	Q	94.8	Very high	94.5	Very high	13 Å²	13	34.7 Å²	34.7	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-54.8	-27.9	177.3	-70.1	169.3	33.7	0	0	112.9	R173 P174 V175 G280 I281 P288	R173-Q284 HydrophobicContact CB-CG 3.95Å; P174-Q284 PolarHBondContact O-OE1 2.87Å; V175-Q284 HydrophobicContact CG2-CB 4.24Å; V175-Q284 VanDerWaalsContact CG2-O 3.28Å; V175-Q284 WeakPolarHBondContact CG2-O 3.5Å; G280-Q284 WeakPolarHBondContact O-CG 3.35Å; G280-Q284 PolarHBondContact O-N 2.73Å; I281-Q284 WeakPolarHBondContact O-CB 3.47Å; I281-Q284 PolarHBondContact O-N 2.68Å; Q284-P288 WeakPolarHBondContact O-CD 3.28Å; Q284-P288 WeakPolarHBondContact O-CG 3.46Å
285	I	95.7	Very high	94.3	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-97	-48.8	178.7	-53.5	-59.6	0	0	0	111.7	V175 L179 I269 V282 A283 P288 L289 Y298 A307 L321	V175-I285 HydrophobicContact CG1-CD1 4.3Å; V175-I285 HydrophobicContact CG2-CD1 3.98Å; L179-I285 HydrophobicContact CD2-CD1 3.92Å; I269-I285 HydrophobicContact CD1-CG1 4.23Å; I269-I285 HydrophobicContact CG1-CD1 3.92Å; I269-I285 HydrophobicContact CG1-CG1 3.95Å; V282-I285 PolarHBondContact O-N 3.17Å; A283-I285 PolarHBondContact O-N 2.87Å; I285-P288 WeakPolarHBondContact O-CD 3.35Å; I285-L289 HydrophobicContact CG2-CD1 3.98Å; I285-L289 WeakPolarHBondContact O-CG 3.33Å; I285-L289 PolarHBondContact O-N 2.98Å; I285-Y298 HydrophobicContact CB-CE2 4Å; I285-Y298 HydrophobicContact CG1-CE2 4.35Å; I285-Y298 HydrophobicContact CG2-CE2 4.04Å; I285-A307 HydrophobicContact CG2-CB 4.07Å; I285-L321 HydrophobicContact CD1-CD2 4.17Å; I285-L321 HydrophobicContact CG2-CD2 4.43Å
286	S	95.1	Very high	94.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-73.3	-30.7	-172.2	60.3	0	0	0	0	113.5	V282 A283 A290	V282-S286 VanDerWaalsContact O-CB 3.29Å; V282-S286 WeakPolarHBondContact O-CB 3.39Å; V282-S286 PolarHBondContact O-N 3.46Å; V282-S286 PolarHBondContact O-OG 3.06Å; A283-S286 PolarHBondContact O-N 3.41Å; S286-A290 WeakPolarHBondContact O-CB 3.48Å; S286-A290 PolarHBondContact O-N 3.32Å
287	E	94	Very high	94.2	Very high	52 Å²	52	32.8 Å²	32.8	24%	0.243	20%	0.199	C	C	.	.	H	α-helix	trans	-68.5	-49.3	179.5	-68.3	179.3	109.8	0	0	112.9	A105 R173 A283 L289 A290 A291	A105-E287 HydrophobicContact CB-CG 4.17Å; A105-E287 WeakPolarHBondContact CB-OE1 3.16Å; R173-E287 IonicContact CZ-OE2 2.86Å; R173-E287 IonicContact NH1-OE1 3.7Å; R173-E287 PolarHBondContact NH1-OE1 3.21Å; R173-E287 IonicContact NH1-OE2 3.67Å; R173-E287 PolarHBondContact NH1-OE2 3.02Å; A283-E287 HydrophobicContact CB-CG 4.45Å; A283-E287 WeakPolarHBondContact O-CB 3.2Å; A283-E287 WeakPolarHBondContact O-CG 3.28Å; A283-E287 PolarHBondContact O-N 2.97Å; E287-L289 VanDerWaalsContact C-N 3.28Å; E287-L289 PolarHBondContact O-N 2.92Å; E287-A290 PolarHBondContact O-N 3.47Å; E287-A291 WeakPolarHBondContact O-CB 3.4Å; E287-A291 PolarHBondContact O-N 2.93Å
288	P	94.2	Very high	94.3	Very high	24 Å²	24	27.3 Å²	27.3	16%	0.156	17%	0.17	C	C	.	.	H	α-helix	trans	-60.4	-37.7	174.5	-24.4	34.3	0	0	0	112.9	Q284 I285 A291 A292 A320 L321	Q284-P288 WeakPolarHBondContact O-CD 3.28Å; Q284-P288 WeakPolarHBondContact O-CG 3.46Å; I285-P288 WeakPolarHBondContact O-CD 3.35Å; P288-A291 PolarHBondContact O-N 3.09Å; P288-A292 WeakPolarHBondContact O-CB 3.17Å; P288-A292 PolarHBondContact O-N 3.33Å; P288-A292 VanDerWaalsContact O-N 3.09Å; P288-A320 HydrophobicContact CB-CB 4.19Å; P288-L321 HydrophobicContact CB-CD2 4.29Å; P288-L321 HydrophobicContact CG-CD2 4.4Å
289	L	94.7	Very high	94.5	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-66.3	-40.3	176.1	-65.8	-178.8	0	0	0	111.6	I285 E287 A292 D293 I294 A296 V309 V317	I285-L289 HydrophobicContact CG2-CD1 3.98Å; I285-L289 WeakPolarHBondContact O-CG 3.33Å; I285-L289 PolarHBondContact O-N 2.98Å; E287-L289 VanDerWaalsContact C-N 3.28Å; E287-L289 PolarHBondContact O-N 2.92Å; L289-A292 CarbonylContact O-C 3.53Å; L289-A292 PolarHBondContact O-N 2.98Å; L289-A292 VanDerWaalsContact O-N 3.17Å; L289-D293 PolarHBondContact O-N 3.46Å; L289-I294 HydrophobicContact CB-CB 4.43Å; L289-I294 HydrophobicContact CD2-CB 4.2Å; L289-I294 HydrophobicContact CD2-CD1 4.27Å; L289-I294 HydrophobicContact CD2-CG2 4.24Å; L289-I294 PolarHBondContact O-N 3.09Å; L289-A296 HydrophobicContact CD1-CB 3.98Å; L289-V309 HydrophobicContact CD1-CG1 3.96Å; L289-V317 HydrophobicContact CD2-CB 4.21Å; L289-V317 HydrophobicContact CD2-CG1 4.06Å; L289-V317 HydrophobicContact CD2-CG2 3.78Å
290	A	93	Very high	94.8	Very high	17 Å²	17	22.8 Å²	22.8	14%	0.14	15%	0.145	C	C	.	.	H	α-helix	trans	-68.9	-33.2	175.5	0	0	0	0	0	113.3	T97 A100 S286 E287 A292 D293	T97-A290 HydrophobicContact CG2-CB 3.55Å; T97-A290 WeakPolarHBondContact O-CB 3.45Å; A100-A290 HydrophobicContact CB-CB 3.87Å; S286-A290 WeakPolarHBondContact O-CB 3.48Å; S286-A290 PolarHBondContact O-N 3.32Å; E287-A290 PolarHBondContact O-N 3.47Å; A290-A292 VanDerWaalsContact C-N 3.25Å; A290-A292 PolarHBondContact O-N 3.31Å; A290-D293 PolarHBondContact O-N 3.16Å
291	A	92.5	Very high	95	Very high	82 Å²	82	22.5 Å²	22.5	68%	0.678	14%	0.142	S	C	*	.	H	α-helix	trans	-66.3	-31.1	171.5	0	0	0	0	0	112.1	E287 P288	E287-A291 WeakPolarHBondContact O-CB 3.4Å; E287-A291 PolarHBondContact O-N 2.93Å; P288-A291 PolarHBondContact O-N 3.09Å
292	A	92.8	Very high	95	Very high	48 Å²	48	23.6 Å²	23.6	40%	0.397	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	2.2	177.4	0	0	0	0	0	114.3	P288 L289 A290 I294 A320	P288-A292 WeakPolarHBondContact O-CB 3.17Å; P288-A292 PolarHBondContact O-N 3.33Å; P288-A292 VanDerWaalsContact O-N 3.09Å; L289-A292 CarbonylContact O-C 3.53Å; L289-A292 PolarHBondContact O-N 2.98Å; L289-A292 VanDerWaalsContact O-N 3.17Å; A290-A292 VanDerWaalsContact C-N 3.25Å; A290-A292 PolarHBondContact O-N 3.31Å; A292-I294 VanDerWaalsContact C-N 3.26Å; A292-I294 HydrophobicContact CB-CD1 3.77Å; A292-I294 HydrophobicContact CB-CG1 3.94Å; A292-I294 PolarHBondContact O-N 3.25Å; A292-A320 HydrophobicContact CB-CB 4.42Å
293	D	91.8	Very high	95.1	Very high	145 Å²	145	26.1 Å²	26.1	78%	0.775	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	37.8	-175.1	-160.2	34.8	0	0	0	113.7	L289 A290	L289-D293 PolarHBondContact O-N 3.46Å; A290-D293 PolarHBondContact O-N 3.16Å
294	I	93.5	Very high	95.2	Very high	6 Å²	6	26.8 Å²	26.8	3%	0.031	16%	0.16	C	C	.	.			trans	-101.4	117	179.1	-60.3	172.2	0	0	0	108.9	T97 L289 A292 V309 N313 V317	T97-I294 WeakPolarHBondContact CB-O 3.22Å; T97-I294 WeakPolarHBondContact CG2-O 3.18Å; T97-I294 PolarHBondContact OG1-O 3.22Å; L289-I294 HydrophobicContact CB-CB 4.43Å; L289-I294 HydrophobicContact CD2-CB 4.2Å; L289-I294 HydrophobicContact CD2-CD1 4.27Å; L289-I294 HydrophobicContact CD2-CG2 4.24Å; L289-I294 PolarHBondContact O-N 3.09Å; A292-I294 VanDerWaalsContact C-N 3.26Å; A292-I294 HydrophobicContact CB-CD1 3.77Å; A292-I294 HydrophobicContact CB-CG1 3.94Å; A292-I294 PolarHBondContact O-N 3.25Å; I294-V309 HydrophobicContact CG2-CG1 4.46Å; I294-N313 HydrophobicContact CD1-CB 4.41Å; I294-N313 HydrophobicContact CG1-CB 4.4Å; I294-N313 HydrophobicContact CG2-CB 3.94Å; I294-V317 HydrophobicContact CD1-CG2 3.93Å; I294-V317 HydrophobicContact CG2-CG2 3.87Å
295	P	92	Very high	95.4	Very high	44 Å²	44	26.8 Å²	26.8	29%	0.286	16%	0.16	S	C	.	.			trans	-68.5	150.8	176.8	30.4	-34.3	0	0	0	110.5	P310	P295-P310 HydrophobicContact CG-CG 3.67Å; P295-P310 VanDerWaalsContact O-CD 3.26Å; P295-P310 WeakPolarHBondContact O-CD 3.21Å
296	A	94.1	Very high	95.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.008	16%	0.16	C	C	.	.			trans	-146.4	141.6	175.4	0	0	0	0	0	111.5	G95 V96 T97 L289 L308 V309	G95-A296 CarbonylContact C-O 3.53Å; G95-A296 WeakPolarHBondContact CA-O 3.24Å; V96-A296 HydrophobicContact CG2-CB 4.05Å; V96-A296 PolarHBondContact N-O 3Å; T97-A296 PolarHBondContact OG1-N 3.16Å; L289-A296 HydrophobicContact CD1-CB 3.98Å; A296-L308 CarbonylContact C-O 3.55Å; A296-L308 WeakPolarHBondContact CA-O 3.29Å; A296-V309 HydrophobicContact CB-CG1 4.13Å
297	Y	95.1	Very high	95.6	Very high	13 Å²	13	26.7 Å²	26.7	5%	0.051	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	144.6	159	-67	-102.1	0	0	0	108.2	P93 T119 V188 W264 A307 L308	P93-Y297 HydrophobicContact CB-CE2 4.17Å; P93-Y297 WeakPolarHBondContact CB-OH 3.24Å; T119-Y297 VanDerWaalsContact O-CE1 3.31Å; T119-Y297 WeakPolarHBondContact O-CE1 3.48Å; V188-Y297 HydrophobicContact CB-CE2 4.44Å; V188-Y297 HydrophobicContact CG1-CD1 4.15Å; V188-Y297 HydrophobicContact CG1-CE1 3.78Å; V188-Y297 HydrophobicContact CG2-CD1 4.49Å; V188-Y297 HydrophobicContact CG2-CD2 4.07Å; V188-Y297 HydrophobicContact CG2-CE2 4.16Å; V188-Y297 HydrophobicContact CG2-CG 4.24Å; W264-Y297 HydrophobicContact CD2-CD2 4.36Å; W264-Y297 AromaticContact CE3-CD2 3.97Å; W264-Y297 HydrophobicContact CE3-CD2 3.97Å; W264-Y297 HydrophobicContact CE3-CE2 4.42Å; W264-Y297 AromaticContact CH2-CD2 3.67Å; W264-Y297 HydrophobicContact CH2-CD2 3.67Å; W264-Y297 AromaticContact CH2-CE2 3.44Å; W264-Y297 HydrophobicContact CH2-CE2 3.44Å; W264-Y297 VanDerWaalsContact CH2-CE2 3.44Å; W264-Y297 HydrophobicContact CZ2-CD2 4.04Å; W264-Y297 AromaticContact CZ2-CE2 3.52Å; W264-Y297 HydrophobicContact CZ2-CE2 3.52Å; W264-Y297 AromaticContact CZ3-CD2 3.61Å; W264-Y297 HydrophobicContact CZ3-CD2 3.61Å; W264-Y297 AromaticContact CZ3-CE2 3.9Å; W264-Y297 HydrophobicContact CZ3-CE2 3.9Å; Y297-A307 CarbonylContact O-C 3.56Å; Y297-A307 WeakPolarHBondContact O-CA 3.21Å; Y297-L308 PolarHBondContact N-O 2.79Å; Y297-L308 PolarHBondContact O-N 3.39Å
298	Y	97.5	Very high	95.7	Very high	1 Å²	1	24.3 Å²	24.3	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	122.9	-177.3	-151.3	-75	0	0	0	110.7	V96 M116 S118 I269 V282 I285 D305 H306 A307	V96-Y298 VanDerWaalsContact CG1-CB 3.48Å; V96-Y298 HydrophobicContact CG2-CD2 4.21Å; V96-Y298 HydrophobicContact CG2-CG 4.49Å; M116-Y298 HydrophobicContact CB-CD1 3.71Å; M116-Y298 HydrophobicContact CB-CG 4.3Å; M116-Y298 HydrophobicContact CG-CD1 4.15Å; S118-Y298 VanDerWaalsContact CB-N 3.35Å; S118-Y298 WeakPolarHBondContact CB-O 3.44Å; S118-Y298 PolarHBondContact N-O 3.12Å; S118-Y298 PolarHBondContact OG-N 2.96Å; S118-Y298 PolarHBondContact OG-O 3.4Å; S118-Y298 VanDerWaalsContact OG-O 3.12Å; I269-Y298 HydrophobicContact CD1-CE2 4.33Å; V282-Y298 HydrophobicContact CG1-CD2 4.31Å; V282-Y298 HydrophobicContact CG1-CE1 4.38Å; V282-Y298 HydrophobicContact CG1-CE2 4.2Å; V282-Y298 HydrophobicContact CG1-CG 4.45Å; V282-Y298 HydrophobicContact CG2-CD1 4.5Å; V282-Y298 HydrophobicContact CG2-CE1 3.86Å; I285-Y298 HydrophobicContact CB-CE2 4Å; I285-Y298 HydrophobicContact CG1-CE2 4.35Å; I285-Y298 HydrophobicContact CG2-CE2 4.04Å; Y298-D305 HydrophobicContact CE1-CB 3.52Å; Y298-D305 VanDerWaalsContact CE1-CG 3.48Å; Y298-D305 WeakPolarHBondContact CE1-OD2 3.45Å; Y298-D305 VanDerWaalsContact OH-CB 3.3Å; Y298-D305 WeakPolarHBondContact OH-CB 3.48Å; Y298-D305 PolarHBondContact OH-OD2 2.94Å; Y298-D305 VanDerWaalsContact OH-OD2 3.08Å; Y298-H306 WeakPolarHBondContact CA-O 3.33Å; Y298-A307 HydrophobicContact CD2-CB 3.87Å; Y298-A307 HydrophobicContact CE2-CB 4.03Å
299	I	98.3	Very high	95.8	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	107.8	178	-60.6	174.7	0	0	0	107.8	T45 L117 F228 V241 T301 H306	T45-I299 HydrophobicContact CG2-CG2 4.12Å; L117-I299 HydrophobicContact CD1-CG2 4.48Å; F228-I299 HydrophobicContact CE1-CD1 4.25Å; F228-I299 HydrophobicContact CZ-CB 4.34Å; F228-I299 HydrophobicContact CZ-CD1 4.11Å; F228-I299 HydrophobicContact CZ-CG2 4.26Å; V241-I299 HydrophobicContact CB-CD1 4.32Å; V241-I299 HydrophobicContact CG1-CD1 4.44Å; V241-I299 HydrophobicContact CG2-CD1 3.95Å; I299-T301 HydrophobicContact CG2-CG2 4.36Å; I299-H306 PolarHBondContact N-O 3.49Å; I299-H306 PolarHBondContact O-N 3.5Å; I299-H306 PolarHBondContact O-ND1 3.14Å; I299-H306 VanDerWaalsContact O-ND1 3.15Å
300	S	98.5	Very high	95.8	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.007	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	137.2	166	-65.7	0	0	0	0	109.5	F115 M116 D305	F115-S300 VanDerWaalsContact CE1-CB 3.49Å; F115-S300 WeakPolarHBondContact CE1-O 3.49Å; F115-S300 VanDerWaalsContact CZ-CB 3.46Å; F115-S300 WeakPolarHBondContact CZ-O 3.21Å; M116-S300 PolarHBondContact N-OG 3.17Å; M116-S300 VanDerWaalsContact N-OG 3.14Å; M116-S300 WeakPolarHBondContact O-CB 3.27Å; M116-S300 PolarHBondContact O-N 3.2Å; S300-D305 VanDerWaalsContact CA-OD1 3.24Å; S300-D305 WeakPolarHBondContact CA-OD1 3.28Å; S300-D305 WeakPolarHBondContact CB-OD1 3.43Å; S300-D305 PolarHBondContact OG-OD1 2.93Å
301	T	98.5	Very high	95.9	Very high	4 Å²	4	25.6 Å²	25.6	3%	0.025	15%	0.149	C	C	.	.			trans	-118.3	170.8	171.2	77.6	0	0	0	0	109.2	T45 T47 T52 F115 I299 K303 F304 H306	T45-T301 HydrophobicContact CG2-CG2 3.83Å; T47-T301 HydrophobicContact CG2-CG2 3.77Å; T52-T301 WeakPolarHBondContact OG1-CB 3.35Å; F115-T301 WeakPolarHBondContact CE2-O 3.38Å; I299-T301 HydrophobicContact CG2-CG2 4.36Å; T301-K303 PolarHBondContact O-N 3.11Å; T301-F304 WeakPolarHBondContact CA-O 3.39Å; T301-F304 PolarHBondContact N-O 3.25Å; T301-F304 PolarHBondContact OG1-N 3.26Å; T301-F304 VanDerWaalsContact OG1-N 3.16Å; T301-F304 PolarHBondContact OG1-O 3.47Å; T301-H306 VanDerWaalsContact CG2-CE1 3.45Å; T301-H306 WeakPolarHBondContact CG2-CE1 3.33Å; T301-H306 PolarHBondContact OG1-CE1 3.27Å
302	F	98.1	Very high	96	Very high	37 Å²	37	27.8 Å²	27.8	16%	0.162	15%	0.146	C	C	.	.	S	Bend	trans	-56.1	-25.7	-177.6	-162.9	-85.5	0	0	0	113.2	V12 T52 A72 F276	V12-F302 HydrophobicContact CG1-CD2 4.29Å; T52-F302 HydrophobicContact CG2-CB 4.24Å; T52-F302 WeakPolarHBondContact OG1-CB 3.49Å; T52-F302 PolarHBondContact OG1-N 3.35Å; A72-F302 HydrophobicContact CB-CE2 4.39Å; F276-F302 HydrophobicContact CE2-CD1 4.43Å; F276-F302 HydrophobicContact CE2-CD2 4.2Å; F276-F302 HydrophobicContact CE2-CE1 4.16Å; F276-F302 AromaticContact CE2-CE2 3.92Å; F276-F302 HydrophobicContact CE2-CE2 3.92Å; F276-F302 HydrophobicContact CE2-CG 4.42Å; F276-F302 AromaticContact CE2-CZ 3.89Å; F276-F302 HydrophobicContact CE2-CZ 3.89Å; F276-F302 HydrophobicContact CZ-CD1 4.33Å; F276-F302 AromaticContact CZ-CD2 3.59Å; F276-F302 HydrophobicContact CZ-CD2 3.59Å; F276-F302 HydrophobicContact CZ-CE1 4.43Å; F276-F302 AromaticContact CZ-CE2 3.71Å; F276-F302 HydrophobicContact CZ-CE2 3.71Å; F276-F302 AromaticContact CZ-CG 3.9Å; F276-F302 HydrophobicContact CZ-CG 3.9Å; F276-F302 HydrophobicContact CZ-CZ 4.14Å
303	K	97.6	Very high	96	Very high	56 Å²	56	28.1 Å²	28.1	24%	0.243	14%	0.141	C	C	.	.	S	Bend	trans	-112.9	-37.3	-178.4	-64.1	175.4	-177.9	169.5	0	113.3	E49 D50 P273 L274 T301	E49-K303 HydrophobicContact CB-CD 3.8Å; E49-K303 PolarHBondContact O-NZ 2.8Å; E49-K303 VanDerWaalsContact O-NZ 3.14Å; D50-K303 WeakPolarHBondContact OD2-CD 3.46Å; D50-K303 WeakPolarHBondContact OD2-CE 3.46Å; D50-K303 IonicContact OD2-NZ 2.85Å; P273-K303 CarbonylContact C-O 3.41Å; P273-K303 VanDerWaalsContact CA-O 3.24Å; P273-K303 WeakPolarHBondContact CA-O 3.2Å; P273-K303 HydrophobicContact CB-CB 4.19Å; P273-K303 HydrophobicContact CB-CG 4.26Å; P273-K303 HydrophobicContact CG-CB 4.33Å; P273-K303 HydrophobicContact CG-CG 4.2Å; L274-K303 PolarHBondContact N-O 2.91Å; T301-K303 PolarHBondContact O-N 3.11Å
304	F	98	Very high	96.1	Very high	13 Å²	13	22.9 Å²	22.9	6%	0.057	11%	0.113	C	C	.	.			trans	-141.7	159.8	-167.1	-59.4	-76.1	0	0	0	112.1	E49 Q272 T301 H306	E49-F304 HydrophobicContact CG-CE2 3.95Å; Q272-F304 VanDerWaalsContact C-CE1 3.46Å; Q272-F304 VanDerWaalsContact O-CE1 3.27Å; Q272-F304 WeakPolarHBondContact O-CE1 3.28Å; T301-F304 WeakPolarHBondContact CA-O 3.39Å; T301-F304 PolarHBondContact N-O 3.25Å; T301-F304 PolarHBondContact OG1-N 3.26Å; T301-F304 VanDerWaalsContact OG1-N 3.16Å; T301-F304 PolarHBondContact OG1-O 3.47Å; F304-H306 PolarHBondContact O-CE1 2.76Å; F304-H306 PolarHBondContact O-ND1 2.81Å
305	D	98.2	Very high	96	Very high	13 Å²	13	28.3 Å²	28.3	7%	0.07	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	148	173.5	-78.6	-8	0	0	0	110.7	I269 L274 I281 Y298 S300	I269-D305 HydrophobicContact CB-CB 4.05Å; I269-D305 HydrophobicContact CD1-CB 4.01Å; I269-D305 WeakPolarHBondContact CD1-O 3.28Å; I269-D305 PolarHBondContact N-O 2.86Å; I269-D305 PolarHBondContact O-N 3.03Å; L274-D305 HydrophobicContact CD1-CB 3.96Å; I281-D305 WeakPolarHBondContact CG2-OD2 3.48Å; Y298-D305 HydrophobicContact CE1-CB 3.52Å; Y298-D305 VanDerWaalsContact CE1-CG 3.48Å; Y298-D305 WeakPolarHBondContact CE1-OD2 3.45Å; Y298-D305 VanDerWaalsContact OH-CB 3.3Å; Y298-D305 WeakPolarHBondContact OH-CB 3.48Å; Y298-D305 PolarHBondContact OH-OD2 2.94Å; Y298-D305 VanDerWaalsContact OH-OD2 3.08Å; S300-D305 VanDerWaalsContact CA-OD1 3.24Å; S300-D305 WeakPolarHBondContact CA-OD1 3.28Å; S300-D305 WeakPolarHBondContact CB-OD1 3.43Å; S300-D305 PolarHBondContact OG-OD1 2.93Å
306	H	98	Very high	96.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	112.5	-175.9	-48.5	78.3	0	0	0	109.3	F228 M266 Y298 I299 T301 F304	F228-H306 HydrophobicContact CE2-CB 4.07Å; F228-H306 AromaticContact CE2-CD2 3.66Å; F228-H306 AromaticContact CE2-CG 3.58Å; F228-H306 AromaticContact CE2-ND1 3.85Å; F228-H306 AromaticContact CE2-NE2 4Å; F228-H306 HydrophobicContact CZ-CB 4.31Å; M266-H306 HydrophobicContact CE-CB 4.32Å; M266-H306 HydrophobicContact CG-CB 4.32Å; M266-H306 HydrophobicContact SD-CB 4.25Å; Y298-H306 WeakPolarHBondContact CA-O 3.33Å; I299-H306 PolarHBondContact N-O 3.49Å; I299-H306 PolarHBondContact O-N 3.5Å; I299-H306 PolarHBondContact O-ND1 3.14Å; I299-H306 VanDerWaalsContact O-ND1 3.15Å; T301-H306 VanDerWaalsContact CG2-CE1 3.45Å; T301-H306 WeakPolarHBondContact CG2-CE1 3.33Å; T301-H306 PolarHBondContact OG1-CE1 3.27Å; F304-H306 PolarHBondContact O-CE1 2.76Å; F304-H306 PolarHBondContact O-ND1 2.81Å
307	A	97.4	Very high	96.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.2	171.8	0	0	0	0	0	109.5	M266 V267 I269 I285 Y297 Y298	M266-A307 CarbonylContact C-O 3.57Å; M266-A307 WeakPolarHBondContact CA-O 3.44Å; V267-A307 HydrophobicContact CB-CB 4.42Å; V267-A307 PolarHBondContact N-O 3.32Å; V267-A307 PolarHBondContact O-N 3.49Å; I269-A307 HydrophobicContact CD1-CB 4.25Å; I285-A307 HydrophobicContact CG2-CB 4.07Å; Y297-A307 CarbonylContact O-C 3.56Å; Y297-A307 WeakPolarHBondContact O-CA 3.21Å; Y298-A307 HydrophobicContact CD2-CB 3.87Å; Y298-A307 HydrophobicContact CE2-CB 4.03Å
308	L	97	Very high	95.9	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.3	168.6	-68.3	172.6	0	0	0	109	F186 V188 V241 W264 K265 M266 A296 Y297	F186-L308 HydrophobicContact CB-CD2 3.91Å; F186-L308 HydrophobicContact CD2-CD2 3.73Å; F186-L308 HydrophobicContact CE2-CD2 4.47Å; F186-L308 HydrophobicContact CG-CD2 3.91Å; V188-L308 HydrophobicContact CG2-CD1 4.03Å; V241-L308 HydrophobicContact CG1-CD1 3.42Å; V241-L308 VanDerWaalsContact CG1-CD1 3.42Å; W264-L308 HydrophobicContact CB-CB 4.15Å; W264-L308 HydrophobicContact CB-CD2 4.24Å; W264-L308 HydrophobicContact CE3-CB 4.08Å; K265-L308 WeakPolarHBondContact O-CA 3.39Å; M266-L308 HydrophobicContact CB-CD2 3.83Å; M266-L308 HydrophobicContact CE-CD2 4.14Å; M266-L308 HydrophobicContact CG-CD2 4.34Å; A296-L308 CarbonylContact C-O 3.55Å; A296-L308 WeakPolarHBondContact CA-O 3.29Å; Y297-L308 PolarHBondContact N-O 2.79Å; Y297-L308 PolarHBondContact O-N 3.39Å
309	V	95.8	Very high	95.6	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151.7	179.7	-67.4	0	0	0	0	109.6	W264 K265 V267 L289 I294 A296 E311 I314 V317	W264-V309 CarbonylContact C-O 3.44Å; W264-V309 VanDerWaalsContact CA-O 3.28Å; W264-V309 WeakPolarHBondContact CA-O 3.34Å; K265-V309 HydrophobicContact CB-CG2 4.33Å; K265-V309 PolarHBondContact N-O 3.42Å; K265-V309 WeakPolarHBondContact O-CG2 3.24Å; K265-V309 PolarHBondContact O-N 2.95Å; V267-V309 HydrophobicContact CG2-CG2 4.38Å; L289-V309 HydrophobicContact CD1-CG1 3.96Å; I294-V309 HydrophobicContact CG2-CG1 4.46Å; A296-V309 HydrophobicContact CB-CG1 4.13Å; V309-E311 PolarHBondContact O-N 2.74Å; V309-I314 HydrophobicContact CG2-CD1 4.36Å; V309-V317 HydrophobicContact CB-CG2 3.85Å; V309-V317 HydrophobicContact CG1-CG1 4.49Å; V309-V317 HydrophobicContact CG1-CG2 3.87Å; V309-V317 HydrophobicContact CG2-CG1 4.39Å; V309-V317 HydrophobicContact CG2-CG2 3.84Å
310	P	94.9	Very high	95.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	138.6	177.1	-22.9	32.5	0	0	0	111.1	E262 W264 P295 E312 N313	E262-P310 HydrophobicContact CG-CB 4.5Å; W264-P310 HydrophobicContact CE3-CG 4.39Å; W264-P310 HydrophobicContact CH2-CG 4Å; W264-P310 HydrophobicContact CZ3-CG 3.85Å; P295-P310 HydrophobicContact CG-CG 3.67Å; P295-P310 VanDerWaalsContact O-CD 3.26Å; P295-P310 WeakPolarHBondContact O-CD 3.21Å; P310-E312 VanDerWaalsContact C-N 3.27Å; P310-E312 HydrophobicContact CB-CG 4.25Å; P310-E312 WeakPolarHBondContact CB-OE2 3.47Å; P310-E312 PolarHBondContact O-N 2.94Å; P310-N313 HydrophobicContact CB-CB 4.38Å; P310-N313 WeakPolarHBondContact CB-OD1 3.48Å; P310-N313 PolarHBondContact O-N 2.79Å
311	E	94.8	Very high	94.9	Very high	68 Å²	68	35 Å²	35	32%	0.318	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-58.8	-39.8	-176.3	177.7	169.3	-134.2	0	0	112	R185 L263 K265 V309 N313 I314	R185-E311 WeakPolarHBondContact CD-OE1 3.42Å; R185-E311 WeakPolarHBondContact CG-OE1 3.28Å; L263-E311 HydrophobicContact CB-CB 4.36Å; L263-E311 WeakPolarHBondContact O-CB 3.17Å; L263-E311 PolarHBondContact O-N 2.74Å; K265-E311 HydrophobicContact CD-CG 4.31Å; K265-E311 HydrophobicContact CG-CB 4.01Å; K265-E311 HydrophobicContact CG-CG 3.96Å; V309-E311 PolarHBondContact O-N 2.74Å; E311-N313 PolarHBondContact O-N 3.45Å; E311-I314 VanDerWaalsContact O-CG2 3.3Å; E311-I314 WeakPolarHBondContact O-CG2 3.34Å; E311-I314 PolarHBondContact O-N 3.29Å
312	E	93.8	Very high	94.3	Very high	129 Å²	129	41.2 Å²	41.2	60%	0.603	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-62.3	-25.5	176.9	64.4	-93.1	-135.7	0	0	113.3	P310	P310-E312 VanDerWaalsContact C-N 3.27Å; P310-E312 HydrophobicContact CB-CG 4.25Å; P310-E312 WeakPolarHBondContact CB-OE2 3.47Å; P310-E312 PolarHBondContact O-N 2.94Å
313	N	94.1	Very high	93.4	Very high	55 Å²	55	43.7 Å²	43.7	29%	0.294	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-92	-0.7	-177.2	-68.7	117	0	0	0	113.5	I294 P310 E311 N315 G316 V317	I294-N313 HydrophobicContact CD1-CB 4.41Å; I294-N313 HydrophobicContact CG1-CB 4.4Å; I294-N313 HydrophobicContact CG2-CB 3.94Å; P310-N313 HydrophobicContact CB-CB 4.38Å; P310-N313 WeakPolarHBondContact CB-OD1 3.48Å; P310-N313 PolarHBondContact O-N 2.79Å; E311-N313 PolarHBondContact O-N 3.45Å; N313-N315 VanDerWaalsContact C-N 3.25Å; N313-N315 PolarHBondContact O-N 3.07Å; N313-N315 VanDerWaalsContact O-N 3.11Å; N313-G316 CarbonylContact O-C 3.5Å; N313-G316 WeakPolarHBondContact O-CA 3.45Å; N313-G316 PolarHBondContact O-N 3.21Å; N313-V317 WeakPolarHBondContact O-CG2 3.25Å; N313-V317 PolarHBondContact O-N 2.83Å
314	I	92.5	Very high	92.4	Very high	35 Å²	35	41.5 Å²	41.5	18%	0.179	23%	0.227	C	C	.	.	H	α-helix	trans	-55.1	-37.5	-172.3	-168.4	57.9	0	0	0	113.8	K265 V309 E311 V317 I318	K265-I314 HydrophobicContact CB-CD1 4.03Å; V309-I314 HydrophobicContact CG2-CD1 4.36Å; E311-I314 VanDerWaalsContact O-CG2 3.3Å; E311-I314 WeakPolarHBondContact O-CG2 3.34Å; E311-I314 PolarHBondContact O-N 3.29Å; I314-V317 PolarHBondContact O-N 3.17Å; I314-I318 HydrophobicContact CG1-CD1 4.22Å; I314-I318 VanDerWaalsContact O-CG1 3.29Å; I314-I318 WeakPolarHBondContact O-CG1 3.3Å; I314-I318 PolarHBondContact O-N 3.02Å
315	N	92.2	Very high	91.5	Very high	120 Å²	120	44.5 Å²	44.5	64%	0.642	24%	0.242	S	C	*	.	H	α-helix	trans	-67.6	-37.8	176.6	-69.3	-40.9	0	0	0	111.9	N313 S319	N313-N315 VanDerWaalsContact C-N 3.25Å; N313-N315 PolarHBondContact O-N 3.07Å; N313-N315 VanDerWaalsContact O-N 3.11Å; N315-S319 WeakPolarHBondContact O-CB 3.5Å; N315-S319 PolarHBondContact O-N 2.93Å; N315-S319 VanDerWaalsContact O-N 3.07Å; N315-S319 PolarHBondContact O-OG 2.86Å
316	G	94	Very high	90.1	Very high	33 Å²	33	47.1 Å²	47.1	34%	0.34	27%	0.265	S	S	.	.	H	α-helix	trans	-65.4	-42.5	174.1	0	0	0	0	0	111.6	N313 S319 A320	N313-G316 CarbonylContact O-C 3.5Å; N313-G316 WeakPolarHBondContact O-CA 3.45Å; N313-G316 PolarHBondContact O-N 3.21Å; G316-S319 PolarHBondContact O-N 3.29Å; G316-A320 WeakPolarHBondContact O-CB 3.46Å; G316-A320 PolarHBondContact O-N 2.93Å
317	V	94.1	Very high	88.3	Confident	1 Å²	1	51 Å²	51	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-50.3	175.1	172.7	0	0	0	0	111.2	V267 L289 I294 V309 N313 I314 S319 A320 L321	V267-V317 HydrophobicContact CG2-CG1 3.9Å; L289-V317 HydrophobicContact CD2-CB 4.21Å; L289-V317 HydrophobicContact CD2-CG1 4.06Å; L289-V317 HydrophobicContact CD2-CG2 3.78Å; I294-V317 HydrophobicContact CD1-CG2 3.93Å; I294-V317 HydrophobicContact CG2-CG2 3.87Å; V309-V317 HydrophobicContact CB-CG2 3.85Å; V309-V317 HydrophobicContact CG1-CG1 4.49Å; V309-V317 HydrophobicContact CG1-CG2 3.87Å; V309-V317 HydrophobicContact CG2-CG1 4.39Å; V309-V317 HydrophobicContact CG2-CG2 3.84Å; N313-V317 WeakPolarHBondContact O-CG2 3.25Å; N313-V317 PolarHBondContact O-N 2.83Å; I314-V317 PolarHBondContact O-N 3.17Å; V317-S319 PolarHBondContact O-N 2.64Å; V317-A320 PolarHBondContact O-N 3.18Å; V317-L321 HydrophobicContact CG1-CD1 3.73Å; V317-L321 HydrophobicContact CG1-CG 4.31Å; V317-L321 WeakPolarHBondContact O-CB 3.36Å; V317-L321 WeakPolarHBondContact O-CG 3.49Å; V317-L321 PolarHBondContact O-N 3.18Å
318	I	91.1	Very high	86.3	Confident	72 Å²	72	56.2 Å²	56.2	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-57.9	-41.4	177.6	-69.7	166.4	0	0	0	110.5	I314 K322	I314-I318 HydrophobicContact CG1-CD1 4.22Å; I314-I318 VanDerWaalsContact O-CG1 3.29Å; I314-I318 WeakPolarHBondContact O-CG1 3.3Å; I314-I318 PolarHBondContact O-N 3.02Å; I318-K322 HydrophobicContact CG2-CD 3.83Å; I318-K322 HydrophobicContact CG2-CG 4.35Å; I318-K322 VanDerWaalsContact O-CB 3.23Å; I318-K322 WeakPolarHBondContact O-CB 3.33Å; I318-K322 WeakPolarHBondContact O-CG 3.45Å; I318-K322 PolarHBondContact O-N 3.24Å
319	S	91.6	Very high	83.7	Confident	72 Å²	72	67.4 Å²	67.4	50%	0.503	36%	0.357	S	S	.	.	H	α-helix	trans	-66.9	-48	179.9	-57	0	0	0	0	111.3	N315 G316 V317 L321 K322 V323	N315-S319 WeakPolarHBondContact O-CB 3.5Å; N315-S319 PolarHBondContact O-N 2.93Å; N315-S319 VanDerWaalsContact O-N 3.07Å; N315-S319 PolarHBondContact O-OG 2.86Å; G316-S319 PolarHBondContact O-N 3.29Å; V317-S319 PolarHBondContact O-N 2.64Å; S319-L321 PolarHBondContact O-N 3.44Å; S319-K322 PolarHBondContact O-N 3.31Å; S319-V323 VanDerWaalsContact O-CG2 3.28Å; S319-V323 WeakPolarHBondContact O-CG2 3.4Å; S319-V323 PolarHBondContact O-N 2.96Å
320	A	90.8	Very high	83.1	Confident	19 Å²	19	70.8 Å²	70.8	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-61.2	-45.6	179	0	0	0	0	0	112.4	P288 A292 G316 V317 S324	P288-A320 HydrophobicContact CB-CB 4.19Å; A292-A320 HydrophobicContact CB-CB 4.42Å; G316-A320 WeakPolarHBondContact O-CB 3.46Å; G316-A320 PolarHBondContact O-N 2.93Å; V317-A320 PolarHBondContact O-N 3.18Å; A320-S324 PolarHBondContact O-N 3.47Å
321	L	90.6	Very high	82.4	Confident	5 Å²	5	74.5 Å²	74.5	3%	0.026	40%	0.395	C	S	.	.	H	α-helix	trans	-74.1	-33.2	-178.8	-61	179.1	0	0	0	112.5	V175 L179 V267 I285 P288 V317 S319 S324 Q325	V175-L321 HydrophobicContact CG2-CD2 4.2Å; L179-L321 HydrophobicContact CD1-CB 3.98Å; L179-L321 HydrophobicContact CD1-CD1 3.71Å; L179-L321 HydrophobicContact CD1-CG 4.4Å; V267-L321 HydrophobicContact CG1-CD1 4.16Å; I285-L321 HydrophobicContact CD1-CD2 4.17Å; I285-L321 HydrophobicContact CG2-CD2 4.43Å; P288-L321 HydrophobicContact CB-CD2 4.29Å; P288-L321 HydrophobicContact CG-CD2 4.4Å; V317-L321 HydrophobicContact CG1-CD1 3.73Å; V317-L321 HydrophobicContact CG1-CG 4.31Å; V317-L321 WeakPolarHBondContact O-CB 3.36Å; V317-L321 WeakPolarHBondContact O-CG 3.49Å; V317-L321 PolarHBondContact O-N 3.18Å; S319-L321 PolarHBondContact O-N 3.44Å; L321-S324 PolarHBondContact O-N 3.12Å; L321-Q325 WeakPolarHBondContact O-CG 3.45Å; L321-Q325 PolarHBondContact O-N 3.4Å
322	K	85.3	Confident	81.7	Confident	135 Å²	135	74.8 Å²	74.8	59%	0.587	40%	0.399	S	S	*	.	H	α-helix	trans	-66.5	-41	173.2	-80.9	179.6	177.5	176.4	0	112.5	I318 S319 S324 Q325 A326	I318-K322 HydrophobicContact CG2-CD 3.83Å; I318-K322 HydrophobicContact CG2-CG 4.35Å; I318-K322 VanDerWaalsContact O-CB 3.23Å; I318-K322 WeakPolarHBondContact O-CB 3.33Å; I318-K322 WeakPolarHBondContact O-CG 3.45Å; I318-K322 PolarHBondContact O-N 3.24Å; S319-K322 PolarHBondContact O-N 3.31Å; K322-S324 VanDerWaalsContact C-N 3.3Å; K322-S324 PolarHBondContact O-N 2.96Å; K322-Q325 PolarHBondContact O-N 3.18Å; K322-A326 PolarHBondContact O-N 3.13Å
323	V	79.6	Confident	81	Confident	89 Å²	89	71.6 Å²	71.6	54%	0.539	39%	0.387	S	S	.	.	H	α-helix	trans	-59.7	-45.6	175	170.7	0	0	0	0	109.7	S319 Q325 A326 E327	S319-V323 VanDerWaalsContact O-CG2 3.28Å; S319-V323 WeakPolarHBondContact O-CG2 3.4Å; S319-V323 PolarHBondContact O-N 2.96Å; V323-Q325 VanDerWaalsContact C-N 3.35Å; V323-Q325 PolarHBondContact O-N 3.13Å; V323-A326 PolarHBondContact O-N 3.47Å; V323-A326 VanDerWaalsContact O-N 3.11Å; V323-E327 PolarHBondContact O-N 2.95Å
324	S	76.8	Confident	80.2	Confident	9 Å²	9	72.7 Å²	72.7	6%	0.063	39%	0.393	C	S	.	.	H	α-helix	trans	-60.5	-38.6	174.5	176.6	0	0	0	0	113.1	R173 P174 V175 A320 L321 K322 A326 E327	R173-S324 PolarHBondContact O-OG 2.79Å; P174-S324 VanDerWaalsContact CA-O 3.24Å; P174-S324 WeakPolarHBondContact CA-O 3.27Å; P174-S324 WeakPolarHBondContact CB-O 3.39Å; V175-S324 PolarHBondContact N-OG 3.44Å; A320-S324 PolarHBondContact O-N 3.47Å; L321-S324 PolarHBondContact O-N 3.12Å; K322-S324 VanDerWaalsContact C-N 3.3Å; K322-S324 PolarHBondContact O-N 2.96Å; S324-A326 VanDerWaalsContact C-N 3.33Å; S324-A326 PolarHBondContact O-N 3.02Å; S324-E327 PolarHBondContact O-N 3.09Å
325	Q	78.5	Confident	79.4	Confident	77 Å²	77	75.2 Å²	75.2	36%	0.36	41%	0.407	S	S	.	.	H	α-helix	trans	-65.7	-33.1	174.3	-73.8	-174.7	3.1	0	0	113.4	V175 L321 K322 V323 E327 K328	V175-Q325 HydrophobicContact CB-CG 3.75Å; V175-Q325 HydrophobicContact CG1-CG 4.19Å; L321-Q325 WeakPolarHBondContact O-CG 3.45Å; L321-Q325 PolarHBondContact O-N 3.4Å; K322-Q325 PolarHBondContact O-N 3.18Å; V323-Q325 VanDerWaalsContact C-N 3.35Å; V323-Q325 PolarHBondContact O-N 3.13Å; Q325-E327 VanDerWaalsContact C-N 3.32Å; Q325-K328 WeakPolarHBondContact O-CB 3.17Å; Q325-K328 PolarHBondContact O-N 3.15Å
326	A	69	Low	78.5	Confident	67 Å²	67	72 Å²	72	55%	0.554	39%	0.39	S	S	*	.	H	α-helix	trans	-73.4	-22.6	-178.4	0	0	0	0	0	113.1	K322 V323 S324 K328	K322-A326 PolarHBondContact O-N 3.13Å; V323-A326 PolarHBondContact O-N 3.47Å; V323-A326 VanDerWaalsContact O-N 3.11Å; S324-A326 VanDerWaalsContact C-N 3.33Å; S324-A326 PolarHBondContact O-N 3.02Å; A326-K328 PolarHBondContact O-N 3.21Å
327	E	61	Low	77.3	Confident	83 Å²	83	75 Å²	75	39%	0.388	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	6.4	173.6	-65	-175.2	-178.3	0	0	113.7	Q172 V323 S324 Q325 H329	Q172-E327 PolarHBondContact NE2-OE2 2.96Å; V323-E327 PolarHBondContact O-N 2.95Å; S324-E327 PolarHBondContact O-N 3.09Å; Q325-E327 VanDerWaalsContact C-N 3.32Å; E327-H329 PolarHBondContact O-N 3.03Å
328	K	55.6	Low	75.9	Confident	110 Å²	110	81.2 Å²	81.2	48%	0.478	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-9.4	171.1	-86.7	-174.7	173.5	176.1	0	114.5	P174 Q325 A326	P174-K328 HydrophobicContact CB-CG 3.85Å; P174-K328 HydrophobicContact CG-CG 4Å; Q325-K328 WeakPolarHBondContact O-CB 3.17Å; Q325-K328 PolarHBondContact O-N 3.15Å; A326-K328 PolarHBondContact O-N 3.21Å
329	H	40.8	Very low	74.5	Confident	236 Å²	236	82 Å²	82	100%	1.093	43%	0.432	S	S	*	.			trans	-121.8	0	-172.9	-66.4	-55.7	0	0	0	112.3	E327	E327-H329 PolarHBondContact O-N 3.03Å

Retrieved 329 of 329 residues in 90.4 ms (Link to these results)

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