A0A096MUB7_PAPAN Loading...

BRCA1-associated protein

Negatively regulates MAP kinase activation by limiting the formation of Raf/MEK complexes probably by inactivation of the KSR1 scaffold protein. Also acts as a Ras responsive E3 ubiquitin ligase that, on activation of Ras, is modified by auto-polyubiquitination resulting in the release of inhibition of Raf/MEK complex formation. May also act as a cytoplasmic retention protein with a role in regulating nuclear transport.

AlphaFold DB , UniProt , Accession A0A096MUB7, Species PAPAN (Papio anubis, Olive baboon), Gene BRAP, Length 592 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	60.5	Low	78.5	Confident	176 Å²	176	26.5 Å²	26.5	87%	0.867	15%	0.147	S	C	*	.				0	142.7	0	-73.6	-176.5	-101.2	0	0	108.6	L153	M1-L153 HydrophobicContact CB-CD1 3.55Å; M1-L153 WeakPolarHBondContact O-CB 3.31Å; M1-L153 PolarHBondContact O-N 3.34Å
2	S	64.8	Low	78.9	Confident	67 Å²	67	24.3 Å²	24.3	47%	0.469	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.5	176.4	50.6	0	0	0	0	109.4	T151	S2-T151 CarbonylContact C-O 3.43Å; S2-T151 WeakPolarHBondContact CA-O 3.48Å
3	V	72.9	Confident	78.7	Confident	13 Å²	13	23.9 Å²	23.9	8%	0.079	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	143.6	-177.3	-68.2	0	0	0	0	110	T151 L153 Y218 Y238	V3-T151 PolarHBondContact N-O 2.84Å; V3-T151 WeakPolarHBondContact O-CB 3.49Å; V3-T151 PolarHBondContact O-N 3.31Å; V3-L153 HydrophobicContact CG1-CD1 3.64Å; V3-L153 HydrophobicContact CG1-CD2 4.17Å; V3-L153 HydrophobicContact CG1-CG 3.93Å; V3-L153 HydrophobicContact CG2-CD2 3.95Å; V3-L153 HydrophobicContact CG2-CG 4.08Å; V3-Y218 HydrophobicContact CG1-CE1 4.43Å; V3-Y238 HydrophobicContact CB-CD2 4.27Å; V3-Y238 HydrophobicContact CB-CE2 4.48Å; V3-Y238 HydrophobicContact CG1-CE2 4.42Å; V3-Y238 HydrophobicContact CG2-CD2 3.86Å; V3-Y238 HydrophobicContact CG2-CE2 3.98Å
4	S	75.2	Confident	78.1	Confident	11 Å²	11	30.1 Å²	30.1	8%	0.077	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	145.9	169.7	-51.8	0	0	0	0	109.5	K146 M150	S4-K146 WeakPolarHBondContact OG-CE 3.2Å; S4-M150 PolarHBondContact OG-SD 3.42Å; S4-M150 VanDerWaalsContact OG-SD 3.33Å
5	L	82.8	Confident	77.5	Confident	19 Å²	19	39.5 Å²	39.5	10%	0.099	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	152.9	170	-54.1	170.7	0	0	0	109	T147 Y238 E240	L5-T147 HydrophobicContact CB-CG2 4.15Å; L5-T147 PolarHBondContact N-OG1 3.12Å; L5-T147 VanDerWaalsContact N-OG1 3.17Å; L5-T147 PolarHBondContact O-N 3.45Å; L5-T147 PolarHBondContact O-OG1 3.41Å; L5-T147 VanDerWaalsContact O-OG1 3.08Å; L5-Y238 CarbonylContact C-O 3.53Å; L5-Y238 WeakPolarHBondContact CA-O 3.35Å; L5-Y238 HydrophobicContact CD2-CG 4.25Å; L5-E240 HydrophobicContact CB-CB 3.8Å; L5-E240 HydrophobicContact CD1-CB 4.05Å; L5-E240 HydrophobicContact CD1-CG 4.14Å
6	I	85.3	Confident	77.3	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	149.6	174.2	65.6	153.5	0	0	0	111.7	I8 L144 Y145 C164 V237 Y238 V239 E240	I6-I8 HydrophobicContact CD1-CD1 3.89Å; I6-I8 HydrophobicContact CD1-CG1 3.75Å; I6-I8 HydrophobicContact CG1-CG1 4.5Å; I6-L144 HydrophobicContact CD1-CD2 4.34Å; I6-Y145 CarbonylContact C-O 3.56Å; I6-Y145 WeakPolarHBondContact CA-O 3.37Å; I6-Y145 WeakPolarHBondContact CB-O 3.46Å; I6-C164 HydrophobicContact CD1-CB 4.15Å; I6-V237 HydrophobicContact CD1-CB 4.43Å; I6-V237 HydrophobicContact CD1-CG2 3.4Å; I6-V237 VanDerWaalsContact CD1-CG2 3.4Å; I6-V237 HydrophobicContact CG1-CB 4.33Å; I6-V237 HydrophobicContact CG1-CG2 3.78Å; I6-V237 HydrophobicContact CG2-CB 4.21Å; I6-V237 HydrophobicContact CG2-CG2 4.23Å; I6-Y238 WeakPolarHBondContact CG1-O 3Å; I6-Y238 PolarHBondContact N-O 2.6Å; I6-V239 HydrophobicContact CD1-CG2 4.2Å; I6-V239 HydrophobicContact CG1-CG2 4.09Å; I6-V239 CarbonylContact O-C 3.58Å; I6-V239 WeakPolarHBondContact O-CA 3.43Å; I6-E240 PolarHBondContact O-N 3.4Å
7	V	83.7	Confident	77.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.9	171.3	178	0	0	0	0	107.4	Y145 E240 R241 L258	V7-Y145 HydrophobicContact CB-CD2 4.49Å; V7-Y145 HydrophobicContact CG1-CD2 4.48Å; V7-Y145 PolarHBondContact N-O 3.35Å; V7-Y145 PolarHBondContact O-N 3Å; V7-E240 HydrophobicContact CG2-CB 4.32Å; V7-E240 WeakPolarHBondContact CG2-OE2 3.38Å; V7-R241 WeakPolarHBondContact CA-O 3.21Å; V7-R241 HydrophobicContact CB-CG 4.44Å; V7-R241 HydrophobicContact CG1-CG 3.76Å; V7-R241 HydrophobicContact CG2-CG 4.16Å; V7-R241 VanDerWaalsContact CG2-NH1 3.31Å; V7-L258 HydrophobicContact CB-CD1 4.28Å; V7-L258 HydrophobicContact CG2-CD1 4.06Å; V7-L258 HydrophobicContact CG2-CD2 4.16Å
8	I	85	Confident	77	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.2	176.9	-55.4	175.1	0	0	0	107.7	I6 F22 M142 L144 C164 L205 V239 R241 A242 E243	I6-I8 HydrophobicContact CD1-CD1 3.89Å; I6-I8 HydrophobicContact CD1-CG1 3.75Å; I6-I8 HydrophobicContact CG1-CG1 4.5Å; I8-F22 HydrophobicContact CG2-CE1 4.35Å; I8-F22 HydrophobicContact CG2-CZ 3.92Å; I8-M142 HydrophobicContact CG2-CG 4.49Å; I8-L144 HydrophobicContact CG1-CG 4.33Å; I8-L144 HydrophobicContact CG2-CD1 4.34Å; I8-C164 HydrophobicContact CD1-CB 4.35Å; I8-L205 HydrophobicContact CD1-CD1 4.33Å; I8-L205 HydrophobicContact CD1-CD2 3.41Å; I8-L205 VanDerWaalsContact CD1-CD2 3.41Å; I8-L205 HydrophobicContact CD1-CG 4.34Å; I8-V239 HydrophobicContact CD1-CG1 4.37Å; I8-V239 HydrophobicContact CD1-CG2 4.14Å; I8-R241 PolarHBondContact N-O 3.29Å; I8-A242 CarbonylContact O-C 3.59Å; I8-A242 VanDerWaalsContact O-CA 3.3Å; I8-A242 WeakPolarHBondContact O-CA 3.49Å; I8-E243 PolarHBondContact O-N 3.39Å
9	R	85.1	Confident	77	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.7	178.5	170.7	-174.4	-61.5	178.6	-2.6	109.7	L41 H143 Y145 E243 L245 A251	R9-L41 VanDerWaalsContact NH2-CD2 3.29Å; R9-H143 HydrophobicContact CB-CB 4.19Å; R9-H143 PolarHBondContact N-O 2.97Å; R9-H143 PolarHBondContact O-N 3.33Å; R9-Y145 HydrophobicContact CB-CE2 4.06Å; R9-Y145 PolarHBondContact NH1-OH 3.36Å; R9-E243 WeakPolarHBondContact CA-O 3.23Å; R9-E243 HydrophobicContact CB-CG 3.9Å; R9-E243 HydrophobicContact CG-CG 4.12Å; R9-E243 IonicContact CZ-OE1 3.15Å; R9-E243 IonicContact NE-OE1 3.79Å; R9-E243 PolarHBondContact NE-OE1 3.47Å; R9-E243 IonicContact NH2-OE1 3.13Å; R9-E243 PolarHBondContact NH2-OE1 2.83Å; R9-L245 HydrophobicContact CG-CD1 4.2Å; R9-A251 WeakPolarHBondContact CD-O 3.35Å; R9-A251 PolarHBondContact NH1-O 2.77Å
10	L	83.9	Confident	76.6	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.9	163.9	-85.1	92.3	0	0	0	109.6	L12 F22 V72 I74 V138 E243 V244 L245	L10-L12 HydrophobicContact CB-CD2 4.26Å; L10-F22 HydrophobicContact CD1-CD1 3.94Å; L10-F22 HydrophobicContact CD1-CD2 4.33Å; L10-F22 HydrophobicContact CD1-CE1 3.2Å; L10-F22 HydrophobicContact CD1-CE2 3.66Å; L10-F22 HydrophobicContact CD1-CG 4.47Å; L10-F22 HydrophobicContact CD1-CZ 3.04Å; L10-V72 HydrophobicContact CD2-CG1 4.34Å; L10-I74 HydrophobicContact CD2-CD1 3.94Å; L10-V138 HydrophobicContact CD2-CG1 4.35Å; L10-E243 PolarHBondContact N-O 3.47Å; L10-V244 HydrophobicContact CB-CG1 4.48Å; L10-L245 PolarHBondContact O-N 2.89Å; L10-L245 VanDerWaalsContact O-O 3.13Å
11	E	84.1	Confident	76.2	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.009	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.1	165.5	174.3	174.5	158	0	0	108.9	L64 G140 I141 H143 L245 S247 A251 S252	E11-L64 WeakPolarHBondContact OE1-CD1 3.37Å; E11-G140 CarbonylContact O-C 3.6Å; E11-G140 WeakPolarHBondContact O-CA 3.4Å; E11-I141 HydrophobicContact CB-CB 4.3Å; E11-I141 PolarHBondContact N-O 3.43Å; E11-I141 PolarHBondContact O-N 3.5Å; E11-H143 IonicContact OE2-NE2 3.83Å; E11-H143 PolarHBondContact OE2-NE2 3.46Å; E11-H143 VanDerWaalsContact OE2-NE2 3.15Å; E11-L245 CarbonylContact C-O 3.58Å; E11-L245 WeakPolarHBondContact CA-O 3.4Å; E11-S247 PolarHBondContact OE1-OG 3.4Å; E11-A251 HydrophobicContact CB-CB 3.83Å; E11-A251 HydrophobicContact CG-CB 3.74Å; E11-S252 WeakPolarHBondContact OE2-CB 3.35Å; E11-S252 PolarHBondContact OE2-N 3.5Å
12	L	83.3	Confident	77	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	145.9	-179.9	-57.7	-167	0	0	0	112.4	L10 V18 V138 V244 L245 S247	L10-L12 HydrophobicContact CB-CD2 4.26Å; L12-V18 HydrophobicContact CD1-CG2 4.06Å; L12-V138 HydrophobicContact CD1-CG1 4.41Å; L12-V138 HydrophobicContact CD2-CG1 3.12Å; L12-V138 HydrophobicContact CG-CG1 4.37Å; L12-V244 HydrophobicContact CD1-CG1 3.4Å; L12-V244 VanDerWaalsContact CD1-CG1 3.4Å; L12-V244 HydrophobicContact CD2-CG1 4.25Å; L12-V244 HydrophobicContact CG-CG1 3.62Å; L12-L245 PolarHBondContact N-O 3.3Å; L12-S247 PolarHBondContact O-N 2.85Å; L12-S247 VanDerWaalsContact O-N 3.1Å; L12-S247 PolarHBondContact O-OG 3.15Å
13	A	77.2	Confident	77.3	Confident	19 Å²	19	35.2 Å²	35.2	16%	0.157	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-61.3	149.6	160.6	0	0	0	0	0	110.4	H15 S16 M69 H139	A13-H15 PolarHBondContact O-N 2.8Å; A13-S16 WeakPolarHBondContact O-CB 3.39Å; A13-S16 PolarHBondContact O-N 3.35Å; A13-M69 HydrophobicContact CB-CE 4.44Å; A13-M69 HydrophobicContact CB-SD 3.66Å; A13-H139 PolarHBondContact N-O 3.39Å
14	E	69.9	Low	77.5	Confident	111 Å²	111	36 Å²	36	52%	0.519	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-35.2	-172.5	-70.3	-178.7	-179.2	0	0	114.4	K246	E14-K246 PolarHBondContact O-NZ 3.01Å
15	H	69.5	Low	77.5	Confident	171 Å²	171	36.1 Å²	36.1	79%	0.792	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	3.3	-174	-36.7	-41.7	0	0	0	113.4	A13	A13-H15 PolarHBondContact O-N 2.8Å
16	S	74.6	Confident	76.7	Confident	19 Å²	19	37.2 Å²	37.2	13%	0.133	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-79.1	138.2	-178.1	-150.4	0	0	0	0	111.3	A13 H139	A13-S16 WeakPolarHBondContact O-CB 3.39Å; A13-S16 PolarHBondContact O-N 3.35Å; S16-H139 PolarHBondContact OG-N 3.49Å; S16-H139 VanDerWaalsContact OG-N 3.08Å
17	P	73.8	Confident	75.4	Confident	89 Å²	89	39.6 Å²	39.6	58%	0.578	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-66.4	143.2	175.7	28.1	-34.2	0	0	0	111.3
18	V	74.7	Confident	73.9	Confident	96 Å²	96	43.6 Å²	43.6	58%	0.582	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-76.6	125.9	175	177	0	0	0	0	109.1	L12 V244	L12-V18 HydrophobicContact CD1-CG2 4.06Å; V18-V244 HydrophobicContact CG1-CB 4.27Å; V18-V244 HydrophobicContact CG1-CG1 4.09Å; V18-V244 HydrophobicContact CG1-CG2 4.44Å
19	P	77	Confident	72.2	Confident	7 Å²	7	47.3 Å²	47.3	5%	0.045	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-64.9	135.8	-179.8	22.9	-31	0	0	0	112.1	G21 F22 I74 E136 V138 V244	P19-G21 PolarHBondContact O-N 3.1Å; P19-F22 HydrophobicContact CB-CB 4.25Å; P19-F22 HydrophobicContact CG-CB 3.99Å; P19-F22 HydrophobicContact CG-CG 4.35Å; P19-I74 HydrophobicContact CB-CD1 3.77Å; P19-I74 HydrophobicContact CG-CD1 3.92Å; P19-E136 WeakPolarHBondContact CA-OE2 3.49Å; P19-E136 WeakPolarHBondContact CB-OE2 3.49Å; P19-V138 HydrophobicContact CB-CG2 4.08Å; P19-V138 HydrophobicContact CG-CG2 4.21Å; P19-V244 HydrophobicContact CG-CG2 4Å
20	A	69.9	Low	70.4	Confident	63 Å²	63	54.9 Å²	54.9	52%	0.521	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	129.8	-172.4	0	0	0	0	0	111.2	F22 E136 K192	A20-F22 PolarHBondContact O-N 3.25Å; A20-E136 WeakPolarHBondContact CB-OE1 3.34Å; A20-E136 PolarHBondContact N-OE1 3.43Å; A20-E136 PolarHBondContact N-OE2 3.36Å; A20-K192 PolarHBondContact O-NZ 2.83Å
21	G	67.1	Low	68.7	Low	54 Å²	54	59 Å²	59	56%	0.557	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	25.2	176.4	0	0	0	0	0	114.5	P19 K192	P19-G21 PolarHBondContact O-N 3.1Å; G21-K192 WeakPolarHBondContact O-CE 3.08Å
22	F	76.9	Confident	67.4	Low	5 Å²	5	61.6 Å²	61.6	2%	0.022	41%	0.407	C	S	.	.			trans	-77.3	-27.1	171.1	-168.9	-91	0	0	0	112.4	I8 L10 P19 A20 F24 I74 K192 I194 L205 A242 V244	I8-F22 HydrophobicContact CG2-CE1 4.35Å; I8-F22 HydrophobicContact CG2-CZ 3.92Å; L10-F22 HydrophobicContact CD1-CD1 3.94Å; L10-F22 HydrophobicContact CD1-CD2 4.33Å; L10-F22 HydrophobicContact CD1-CE1 3.2Å; L10-F22 HydrophobicContact CD1-CE2 3.66Å; L10-F22 HydrophobicContact CD1-CG 4.47Å; L10-F22 HydrophobicContact CD1-CZ 3.04Å; P19-F22 HydrophobicContact CB-CB 4.25Å; P19-F22 HydrophobicContact CG-CB 3.99Å; P19-F22 HydrophobicContact CG-CG 4.35Å; A20-F22 PolarHBondContact O-N 3.25Å; F22-F24 PolarHBondContact O-N 3.26Å; F22-I74 HydrophobicContact CD2-CD1 3.94Å; F22-I74 HydrophobicContact CE2-CD1 4.19Å; F22-K192 HydrophobicContact CD2-CD 4.37Å; F22-I194 HydrophobicContact CE2-CD1 3.79Å; F22-I194 HydrophobicContact CE2-CG1 4.49Å; F22-I194 HydrophobicContact CZ-CD1 4.23Å; F22-L205 HydrophobicContact CE2-CD1 3.85Å; F22-L205 HydrophobicContact CZ-CD1 4.06Å; F22-A242 HydrophobicContact CD1-CB 4.14Å; F22-A242 HydrophobicContact CE1-CB 3.73Å; F22-A242 HydrophobicContact CZ-CB 4.29Å; F22-A242 WeakPolarHBondContact O-CB 3.39Å; F22-V244 HydrophobicContact CB-CG2 4.17Å; F22-V244 HydrophobicContact CD1-CG2 3.7Å; F22-V244 HydrophobicContact CG-CG2 4.23Å
23	G	71.8	Confident	66.1	Low	56 Å²	56	66.2 Å²	66.2	58%	0.577	43%	0.432	S	S	*	.			trans	-60.6	125.9	179.2	0	0	0	0	0	112.2	A242	G23-A242 WeakPolarHBondContact CA-O 3.4Å
24	F	77.5	Confident	65.2	Low	29 Å²	29	72.7 Å²	72.7	13%	0.127	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	143.9	174	174.7	-92.8	0	0	0	110.2	F22 A26 S160 M162 K207 V239 R241 A242	F22-F24 PolarHBondContact O-N 3.26Å; F24-A26 HydrophobicContact CE1-CB 4.38Å; F24-S160 VanDerWaalsContact CE1-OG 3.25Å; F24-S160 WeakPolarHBondContact CE1-OG 3.4Å; F24-S160 WeakPolarHBondContact CZ-OG 3.44Å; F24-M162 HydrophobicContact CB-CE 3.66Å; F24-M162 HydrophobicContact CB-SD 3.72Å; F24-M162 HydrophobicContact CD1-CB 3.81Å; F24-M162 HydrophobicContact CD1-CE 4.11Å; F24-M162 HydrophobicContact CD1-CG 4.26Å; F24-M162 HydrophobicContact CD1-SD 3.51Å; F24-M162 VanDerWaalsContact CD1-SD 3.51Å; F24-M162 HydrophobicContact CD2-CB 4.24Å; F24-M162 HydrophobicContact CD2-CE 3.42Å; F24-M162 VanDerWaalsContact CD2-CE 3.42Å; F24-M162 HydrophobicContact CD2-SD 3.99Å; F24-M162 HydrophobicContact CE1-CB 3.39Å; F24-M162 HydrophobicContact CE1-CG 4.31Å; F24-M162 HydrophobicContact CE1-SD 4.15Å; F24-M162 HydrophobicContact CE2-CB 3.82Å; F24-M162 HydrophobicContact CE2-CE 4.08Å; F24-M162 HydrophobicContact CG-CB 4.23Å; F24-M162 HydrophobicContact CG-CE 3.43Å; F24-M162 VanDerWaalsContact CG-CE 3.43Å; F24-M162 HydrophobicContact CG-CG 4.49Å; F24-M162 HydrophobicContact CG-SD 3.43Å; F24-M162 WeakPolarHBondContact CG-SD 3.37Å; F24-M162 HydrophobicContact CZ-CB 3.39Å; F24-K207 HydrophobicContact CD2-CD 4.46Å; F24-K207 HydrophobicContact CE2-CG 4.33Å; F24-V239 HydrophobicContact CD1-CG1 4.38Å; F24-R241 CarbonylContact O-C 3.5Å; F24-R241 WeakPolarHBondContact O-CA 3.35Å; F24-R241 WeakPolarHBondContact O-CB 3.42Å; F24-A242 HydrophobicContact CB-CB 4.11Å; F24-A242 PolarHBondContact N-O 3.04Å; F24-A242 PolarHBondContact O-N 2.97Å
25	S	73.6	Confident	64.7	Low	14 Å²	14	72.1 Å²	72.1	10%	0.098	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	128.9	172.4	179.3	0	0	0	0	110.4	A27 A28 I36	S25-A27 PolarHBondContact O-N 3.48Å; S25-A27 PolarHBondContact OG-N 2.84Å; S25-A28 WeakPolarHBondContact O-CB 3.32Å; S25-A28 PolarHBondContact O-N 2.86Å; S25-I36 WeakPolarHBondContact OG-CD1 3.45Å
26	A	66.1	Low	64.3	Low	43 Å²	43	64.7 Å²	64.7	36%	0.355	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.1	175.4	0	0	0	0	0	112.9	F24 E240	F24-A26 HydrophobicContact CE1-CB 4.38Å; A26-E240 WeakPolarHBondContact CB-O 3.44Å; A26-E240 PolarHBondContact N-O 2.76Å
27	A	59.6	Low	63.7	Low	50 Å²	50	67.4 Å²	67.4	41%	0.413	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	10.5	179.8	0	0	0	0	0	114.1	S25 G29 E30 I36	S25-A27 PolarHBondContact O-N 3.48Å; S25-A27 PolarHBondContact OG-N 2.84Å; A27-G29 VanDerWaalsContact C-N 3.32Å; A27-G29 PolarHBondContact O-N 3.38Å; A27-E30 PolarHBondContact O-N 2.81Å; A27-I36 HydrophobicContact CB-CD1 3.97Å
28	A	51.1	Low	63.2	Low	84 Å²	84	71 Å²	71	69%	0.694	44%	0.438	S	S	*	.	B	Isolated β-bridge	trans	-60.9	88.3	-179.4	0	0	0	0	0	111.3	S25	S25-A28 WeakPolarHBondContact O-CB 3.32Å; S25-A28 PolarHBondContact O-N 2.86Å
29	G	48.9	Very low	62.7	Low	78 Å²	78	70.8 Å²	70.8	80%	0.804	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	163.1	-27.5	-176.5	0	0	0	0	0	114.3	A27	A27-G29 VanDerWaalsContact C-N 3.32Å; A27-G29 PolarHBondContact O-N 3.38Å
30	E	47.4	Very low	62	Low	159 Å²	159	72.4 Å²	72.4	74%	0.743	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-22.2	-178	-72.5	175.1	-161.2	0	0	114	A27 R158	A27-E30 PolarHBondContact O-N 2.81Å; E30-R158 IonicContact OE1-NH1 2.77Å; E30-R158 PolarHBondContact OE1-NH1 3.36Å
31	M	49.1	Very low	61.8	Low	90 Å²	90	69.8 Å²	69.8	44%	0.443	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-147.3	150.8	176.4	-68.8	-167.4	-65.4	0	0	111	E35 I36	M31-E35 HydrophobicContact CB-CB 4.15Å; M31-E35 HydrophobicContact SD-CB 4.5Å; M31-I36 HydrophobicContact CB-CD1 4.4Å; M31-I36 HydrophobicContact CB-CG1 3.94Å; M31-I36 HydrophobicContact CE-CG1 4.1Å
32	S	56.2	Low	61.8	Low	56 Å²	56	69.6 Å²	69.6	39%	0.392	42%	0.418	S	S	.	.			trans	-71.1	154.4	173.4	61.8	0	0	0	0	112	E34 E35 I36	S32-E34 PolarHBondContact O-N 2.68Å; S32-E34 VanDerWaalsContact O-N 3.15Å; S32-E35 WeakPolarHBondContact CB-OE2 3.34Å; S32-E35 PolarHBondContact N-OE2 3.38Å; S32-E35 WeakPolarHBondContact O-CB 3.27Å; S32-E35 PolarHBondContact O-N 3.35Å; S32-E35 VanDerWaalsContact OG-CG 3.26Å; S32-E35 WeakPolarHBondContact OG-CG 3.47Å; S32-E35 PolarHBondContact OG-N 2.86Å; S32-E35 PolarHBondContact OG-OE2 2.82Å; S32-I36 PolarHBondContact O-N 2.81Å
33	D	55.5	Low	61.3	Low	98 Å²	98	71.6 Å²	71.6	52%	0.524	43%	0.432	S	S	.	.	H	α-helix	trans	-55.5	-32.4	177.2	-73	-20	0	0	0	112.6	K37	D33-K37 WeakPolarHBondContact O-CB 3.49Å; D33-K37 VanDerWaalsContact O-CG 3.3Å; D33-K37 WeakPolarHBondContact O-CG 3.47Å; D33-K37 PolarHBondContact O-N 3.42Å
34	E	59	Low	61	Low	155 Å²	155	69 Å²	69	72%	0.724	41%	0.406	S	S	*	.	H	α-helix	trans	-63.7	-44.6	172.3	-84.2	-94.9	144.7	0	0	112.3	S32 K38	S32-E34 PolarHBondContact O-N 2.68Å; S32-E34 VanDerWaalsContact O-N 3.15Å; E34-K38 WeakPolarHBondContact O-CB 3.46Å; E34-K38 PolarHBondContact O-N 3.05Å
35	E	58.8	Low	60.6	Low	98 Å²	98	70.4 Å²	70.4	46%	0.458	42%	0.416	S	S	.	.	H	α-helix	trans	-70.4	-36	179.4	-74.3	162.6	151.6	0	0	112.1	M31 S32 K38 T39	M31-E35 HydrophobicContact CB-CB 4.15Å; M31-E35 HydrophobicContact SD-CB 4.5Å; S32-E35 WeakPolarHBondContact CB-OE2 3.34Å; S32-E35 PolarHBondContact N-OE2 3.38Å; S32-E35 WeakPolarHBondContact O-CB 3.27Å; S32-E35 PolarHBondContact O-N 3.35Å; S32-E35 VanDerWaalsContact OG-CG 3.26Å; S32-E35 WeakPolarHBondContact OG-CG 3.47Å; S32-E35 PolarHBondContact OG-N 2.86Å; S32-E35 PolarHBondContact OG-OE2 2.82Å; E35-K38 PolarHBondContact O-N 3.3Å; E35-T39 VanDerWaalsContact O-CB 3.31Å; E35-T39 WeakPolarHBondContact O-CB 3.34Å; E35-T39 PolarHBondContact O-N 2.91Å; E35-T39 PolarHBondContact O-OG1 3.42Å
36	I	61.8	Low	60.4	Low	16 Å²	16	72.4 Å²	72.4	8%	0.082	43%	0.434	C	S	.	.	H	α-helix	trans	-67.6	-46	176	-64	168.9	0	0	0	110.4	S25 A27 M31 S32 T39 T40	S25-I36 WeakPolarHBondContact OG-CD1 3.45Å; A27-I36 HydrophobicContact CB-CD1 3.97Å; M31-I36 HydrophobicContact CB-CD1 4.4Å; M31-I36 HydrophobicContact CB-CG1 3.94Å; M31-I36 HydrophobicContact CE-CG1 4.1Å; S32-I36 PolarHBondContact O-N 2.81Å; I36-T39 PolarHBondContact O-N 3.36Å; I36-T40 PolarHBondContact O-N 2.81Å; I36-T40 PolarHBondContact O-OG1 2.91Å
37	K	62	Low	60.4	Low	75 Å²	75	73.3 Å²	73.3	33%	0.326	44%	0.437	S	S	.	.	H	α-helix	trans	-57.7	-49.1	172.4	-79.6	-178.5	178.8	-169.1	0	110.6	D33 T39 L41 V244 L245	D33-K37 WeakPolarHBondContact O-CB 3.49Å; D33-K37 VanDerWaalsContact O-CG 3.3Å; D33-K37 WeakPolarHBondContact O-CG 3.47Å; D33-K37 PolarHBondContact O-N 3.42Å; K37-T39 VanDerWaalsContact C-N 3.33Å; K37-T39 PolarHBondContact O-N 2.86Å; K37-L41 HydrophobicContact CB-CD1 4.26Å; K37-L41 WeakPolarHBondContact O-CB 3.38Å; K37-L41 WeakPolarHBondContact O-CG 3.33Å; K37-L41 PolarHBondContact O-N 3.46Å; K37-V244 PolarHBondContact NZ-O 3.38Å; K37-L245 HydrophobicContact CD-CD2 4.33Å
38	K	63.1	Low	60.9	Low	164 Å²	164	71.4 Å²	71.4	71%	0.713	42%	0.42	S	S	*	.	H	α-helix	trans	-62.1	-38.2	-179.4	-169.2	174.5	-176	176	0	112.8	E34 E35 A42	E34-K38 WeakPolarHBondContact O-CB 3.46Å; E34-K38 PolarHBondContact O-N 3.05Å; E35-K38 PolarHBondContact O-N 3.3Å; K38-A42 VanDerWaalsContact O-CA 3.3Å; K38-A42 WeakPolarHBondContact O-CA 3.46Å; K38-A42 WeakPolarHBondContact O-CB 3.28Å; K38-A42 PolarHBondContact O-N 2.89Å
39	T	63.4	Low	62	Low	93 Å²	93	73.9 Å²	73.9	57%	0.571	42%	0.417	S	S	*	.	H	α-helix	trans	-76.8	-40.4	-177.4	-51.9	0	0	0	0	112.2	E35 I36 K37	E35-T39 VanDerWaalsContact O-CB 3.31Å; E35-T39 WeakPolarHBondContact O-CB 3.34Å; E35-T39 PolarHBondContact O-N 2.91Å; E35-T39 PolarHBondContact O-OG1 3.42Å; I36-T39 PolarHBondContact O-N 3.36Å; K37-T39 VanDerWaalsContact C-N 3.33Å; K37-T39 PolarHBondContact O-N 2.86Å
40	T	62.6	Low	63.1	Low	40 Å²	40	74.5 Å²	74.5	25%	0.245	42%	0.423	C	S	.	.	H	α-helix	trans	-81.3	-30.4	179.8	49.1	0	0	0	0	112.9	I36 V255	I36-T40 PolarHBondContact O-N 2.81Å; I36-T40 PolarHBondContact O-OG1 2.91Å; T40-V255 VanDerWaalsContact O-CG1 3.31Å; T40-V255 WeakPolarHBondContact O-CG1 3.41Å
41	L	67.1	Low	64.6	Low	9 Å²	9	70.9 Å²	70.9	5%	0.047	41%	0.405	C	S	.	.	H	α-helix	trans	-91	-2.5	174.6	-61.5	165.6	0	0	0	113.1	R9 K37 S43 A44 V45 L245 V255	R9-L41 VanDerWaalsContact NH2-CD2 3.29Å; K37-L41 HydrophobicContact CB-CD1 4.26Å; K37-L41 WeakPolarHBondContact O-CB 3.38Å; K37-L41 WeakPolarHBondContact O-CG 3.33Å; K37-L41 PolarHBondContact O-N 3.46Å; L41-S43 PolarHBondContact O-N 3.43Å; L41-S43 VanDerWaalsContact O-N 3.11Å; L41-A44 HydrophobicContact CD2-CB 4.48Å; L41-A44 CarbonylContact O-C 3.57Å; L41-A44 WeakPolarHBondContact O-CA 3.4Å; L41-A44 PolarHBondContact O-N 3.25Å; L41-V45 HydrophobicContact CB-CG2 3.96Å; L41-V45 WeakPolarHBondContact O-CB 3.47Å; L41-V45 WeakPolarHBondContact O-CG2 3.43Å; L41-V45 PolarHBondContact O-N 3.48Å; L41-L245 HydrophobicContact CD1-CD1 3.77Å; L41-L245 HydrophobicContact CD1-CD2 3.93Å; L41-L245 HydrophobicContact CD2-CD1 4.08Å; L41-V255 HydrophobicContact CD2-CG2 4.31Å
42	A	66.9	Low	66.1	Low	50 Å²	50	69.1 Å²	69.1	41%	0.413	40%	0.402	S	S	.	.	H	α-helix	trans	-49.3	-44.1	-176.5	0	0	0	0	0	112.5	K38 A46	K38-A42 VanDerWaalsContact O-CA 3.3Å; K38-A42 WeakPolarHBondContact O-CA 3.46Å; K38-A42 WeakPolarHBondContact O-CB 3.28Å; K38-A42 PolarHBondContact O-N 2.89Å; A42-A46 WeakPolarHBondContact O-CB 3.45Å; A42-A46 PolarHBondContact O-N 2.87Å
43	S	64.9	Low	67	Low	46 Å²	46	71.6 Å²	71.6	32%	0.322	42%	0.416	S	S	.	.	H	α-helix	trans	-69.6	-39.3	178.2	-175.1	0	0	0	0	112.9	L41 C47	L41-S43 PolarHBondContact O-N 3.43Å; L41-S43 VanDerWaalsContact O-N 3.11Å; S43-C47 PolarHBondContact O-N 3.42Å; S43-C47 VanDerWaalsContact O-N 3.08Å; S43-C47 PolarHBondContact O-SG 3.24Å; S43-C47 VanDerWaalsContact O-SG 3.35Å
44	A	66.4	Low	67.8	Low	3 Å²	3	69.5 Å²	69.5	3%	0.025	42%	0.418	C	S	.	.	H	α-helix	trans	-69.2	-43.5	178.4	0	0	0	0	0	111.3	L41 C47 L48 L253	L41-A44 HydrophobicContact CD2-CB 4.48Å; L41-A44 CarbonylContact O-C 3.57Å; L41-A44 WeakPolarHBondContact O-CA 3.4Å; L41-A44 PolarHBondContact O-N 3.25Å; A44-C47 WeakPolarHBondContact O-CB 3.41Å; A44-C47 PolarHBondContact O-N 2.87Å; A44-L48 PolarHBondContact O-N 3.44Å; A44-L253 HydrophobicContact CB-CB 3.73Å; A44-L253 HydrophobicContact CB-CD1 3.94Å; A44-L253 HydrophobicContact CB-CG 4.5Å; A44-L253 WeakPolarHBondContact O-CD1 3.49Å
45	V	68.4	Low	68.7	Low	57 Å²	57	66.9 Å²	66.9	35%	0.345	41%	0.406	S	S	.	.	H	α-helix	trans	-66.3	-44.3	175.9	175.4	0	0	0	0	110.3	L41 C47 L48 E49	L41-V45 HydrophobicContact CB-CG2 3.96Å; L41-V45 WeakPolarHBondContact O-CB 3.47Å; L41-V45 WeakPolarHBondContact O-CG2 3.43Å; L41-V45 PolarHBondContact O-N 3.48Å; V45-C47 PolarHBondContact O-N 2.9Å; V45-L48 CarbonylContact O-C 3.56Å; V45-L48 WeakPolarHBondContact O-CA 3.25Å; V45-L48 PolarHBondContact O-N 2.87Å; V45-E49 HydrophobicContact CG1-CG 4.19Å; V45-E49 WeakPolarHBondContact O-CG 3.49Å; V45-E49 PolarHBondContact O-N 3.45Å
46	A	70.1	Confident	69.4	Low	57 Å²	57	65.9 Å²	65.9	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-59.4	-33	174.1	0	0	0	0	0	112.6	A42 L48	A42-A46 WeakPolarHBondContact O-CB 3.45Å; A42-A46 PolarHBondContact O-N 2.87Å; A46-L48 PolarHBondContact O-N 2.83Å
47	C	66.1	Low	69.8	Low	62 Å²	62	69.8 Å²	69.8	42%	0.419	42%	0.424	S	S	.	.	H	α-helix	trans	-66.4	-21.6	172.7	-79.2	0	0	0	0	113.7	S43 A44 V45 K51	S43-C47 PolarHBondContact O-N 3.42Å; S43-C47 VanDerWaalsContact O-N 3.08Å; S43-C47 PolarHBondContact O-SG 3.24Å; S43-C47 VanDerWaalsContact O-SG 3.35Å; A44-C47 WeakPolarHBondContact O-CB 3.41Å; A44-C47 PolarHBondContact O-N 2.87Å; V45-C47 PolarHBondContact O-N 2.9Å; C47-K51 WeakPolarHBondContact O-CD 3.45Å; C47-K51 WeakPolarHBondContact O-CE 3.29Å; C47-K51 PolarHBondContact O-NZ 2.79Å
48	L	69.3	Low	70.4	Confident	10 Å²	10	69 Å²	69	5%	0.052	43%	0.432	C	S	.	.	H	α-helix	trans	-104.3	-15.7	179	-62	175.1	0	0	0	113.1	A44 V45 A46 K51 K56 I59 L253	A44-L48 PolarHBondContact O-N 3.44Å; V45-L48 CarbonylContact O-C 3.56Å; V45-L48 WeakPolarHBondContact O-CA 3.25Å; V45-L48 PolarHBondContact O-N 2.87Å; A46-L48 PolarHBondContact O-N 2.83Å; L48-K51 PolarHBondContact O-N 3Å; L48-K56 HydrophobicContact CB-CG 4.48Å; L48-K56 HydrophobicContact CD2-CB 4.19Å; L48-K56 HydrophobicContact CD2-CG 4.09Å; L48-K56 WeakPolarHBondContact O-CE 3.24Å; L48-I59 HydrophobicContact CD2-CG2 4.35Å; L48-L253 HydrophobicContact CD1-CD1 3.57Å; L48-L253 HydrophobicContact CD2-CD1 4.09Å; L48-L253 HydrophobicContact CG-CD1 3.62Å
49	E	75.6	Confident	70.9	Confident	135 Å²	135	62.7 Å²	62.7	63%	0.631	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	133.8	178.1	-83.5	179.6	176.3	0	0	111.7	V45 K51	V45-E49 HydrophobicContact CG1-CG 4.19Å; V45-E49 WeakPolarHBondContact O-CG 3.49Å; V45-E49 PolarHBondContact O-N 3.45Å; E49-K51 VanDerWaalsContact C-N 3.26Å; E49-K51 PolarHBondContact O-N 3.22Å
50	G	70.4	Confident	71.3	Confident	91 Å²	91	59.4 Å²	59.4	94%	0.938	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	-1.7	178.4	0	0	0	0	0	116.3
51	K	79.5	Confident	71.6	Confident	83 Å²	83	63.4 Å²	63.4	36%	0.361	40%	0.4	S	S	.	.			trans	-90.8	148.1	179.4	-63.3	-174.7	179.9	166.8	0	112.9	C47 L48 E49 E55 K56 I59	C47-K51 WeakPolarHBondContact O-CD 3.45Å; C47-K51 WeakPolarHBondContact O-CE 3.29Å; C47-K51 PolarHBondContact O-NZ 2.79Å; L48-K51 PolarHBondContact O-N 3Å; E49-K51 VanDerWaalsContact C-N 3.26Å; E49-K51 PolarHBondContact O-N 3.22Å; K51-E55 HydrophobicContact CB-CB 4.19Å; K51-K56 HydrophobicContact CB-CG 4.13Å; K51-K56 VanDerWaalsContact O-CE 3.29Å; K51-K56 WeakPolarHBondContact O-CE 3.4Å; K51-I59 HydrophobicContact CD-CD1 3.3Å
52	S	80.9	Confident	71.9	Confident	54 Å²	54	70 Å²	70	38%	0.378	43%	0.43	S	S	.	.			trans	-67.4	156.9	176.2	66.9	0	0	0	0	111.8	G54 E55 K56	S52-G54 PolarHBondContact O-N 3.49Å; S52-E55 WeakPolarHBondContact CB-OE2 3.46Å; S52-E55 PolarHBondContact N-OE2 2.88Å; S52-E55 PolarHBondContact O-N 3.36Å; S52-E55 VanDerWaalsContact O-N 3.1Å; S52-E55 VanDerWaalsContact OG-CG 3.24Å; S52-E55 WeakPolarHBondContact OG-CG 3.33Å; S52-E55 PolarHBondContact OG-N 2.81Å; S52-E55 PolarHBondContact OG-OE2 3.36Å; S52-K56 WeakPolarHBondContact O-CG 3.16Å; S52-K56 PolarHBondContact O-N 2.8Å
53	P	74.6	Confident	71.8	Confident	107 Å²	107	71.8 Å²	71.8	70%	0.695	43%	0.43	S	S	*	.	H	α-helix	trans	-54.6	-38.6	179.6	-26.4	34.5	0	0	0	113.6	K56 V57	P53-K56 PolarHBondContact O-N 2.93Å; P53-V57 WeakPolarHBondContact O-CG2 3.18Å; P53-V57 PolarHBondContact O-N 3.31Å; P53-V57 VanDerWaalsContact O-N 3.16Å
54	G	73.1	Confident	71.9	Confident	54 Å²	54	70.9 Å²	70.9	56%	0.557	42%	0.421	S	S	*	.	H	α-helix	trans	-67.6	-38.1	177.4	0	0	0	0	0	113.5	S52 A58	S52-G54 PolarHBondContact O-N 3.49Å; G54-A58 PolarHBondContact O-N 3.03Å
55	E	76.9	Confident	71.5	Confident	100 Å²	100	72.4 Å²	72.4	47%	0.467	44%	0.438	S	S	.	.	H	α-helix	trans	-69.5	-38	176.1	-70.9	164.4	149.2	0	0	111.8	K51 S52 A58 I59	K51-E55 HydrophobicContact CB-CB 4.19Å; S52-E55 WeakPolarHBondContact CB-OE2 3.46Å; S52-E55 PolarHBondContact N-OE2 2.88Å; S52-E55 PolarHBondContact O-N 3.36Å; S52-E55 VanDerWaalsContact O-N 3.1Å; S52-E55 VanDerWaalsContact OG-CG 3.24Å; S52-E55 WeakPolarHBondContact OG-CG 3.33Å; S52-E55 PolarHBondContact OG-N 2.81Å; S52-E55 PolarHBondContact OG-OE2 3.36Å; E55-A58 PolarHBondContact O-N 3.45Å; E55-I59 WeakPolarHBondContact O-CB 3.47Å; E55-I59 WeakPolarHBondContact O-CD1 3.47Å; E55-I59 VanDerWaalsContact O-CG1 3.23Å; E55-I59 WeakPolarHBondContact O-CG1 3.23Å; E55-I59 PolarHBondContact O-N 2.83Å
56	K	73.9	Confident	71	Confident	78 Å²	78	81.8 Å²	81.8	34%	0.339	47%	0.467	S	S	.	.	H	α-helix	trans	-59.4	-47.4	174.7	-68.6	-177.3	179.8	-170.2	0	111.2	L48 K51 S52 P53 A58 I59 I60	L48-K56 HydrophobicContact CB-CG 4.48Å; L48-K56 HydrophobicContact CD2-CB 4.19Å; L48-K56 HydrophobicContact CD2-CG 4.09Å; L48-K56 WeakPolarHBondContact O-CE 3.24Å; K51-K56 HydrophobicContact CB-CG 4.13Å; K51-K56 VanDerWaalsContact O-CE 3.29Å; K51-K56 WeakPolarHBondContact O-CE 3.4Å; S52-K56 WeakPolarHBondContact O-CG 3.16Å; S52-K56 PolarHBondContact O-N 2.8Å; P53-K56 PolarHBondContact O-N 2.93Å; K56-A58 PolarHBondContact O-N 2.85Å; K56-I59 PolarHBondContact O-N 2.96Å; K56-I60 WeakPolarHBondContact O-CB 3.45Å; K56-I60 WeakPolarHBondContact O-CD1 3.45Å; K56-I60 VanDerWaalsContact O-CG1 3.28Å; K56-I60 WeakPolarHBondContact O-CG1 3.36Å; K56-I60 PolarHBondContact O-N 3.41Å
57	V	70.9	Confident	70.9	Confident	98 Å²	98	84.4 Å²	84.4	59%	0.594	46%	0.464	S	S	*	.	H	α-helix	trans	-61.9	-42.9	177.5	172.9	0	0	0	0	111.2	P53 I59 I60 H61	P53-V57 WeakPolarHBondContact O-CG2 3.18Å; P53-V57 PolarHBondContact O-N 3.31Å; P53-V57 VanDerWaalsContact O-N 3.16Å; V57-I59 PolarHBondContact O-N 2.99Å; V57-I60 PolarHBondContact O-N 2.81Å; V57-H61 VanDerWaalsContact O-CB 3.26Å; V57-H61 WeakPolarHBondContact O-CB 3.34Å; V57-H61 PolarHBondContact O-N 2.62Å
58	A	74.6	Confident	71.2	Confident	59 Å²	59	89.6 Å²	89.6	49%	0.488	48%	0.483	S	S	.	.	H	α-helix	trans	-62.9	-42.3	177.7	0	0	0	0	0	112.6	G54 E55 K56 H61 Q62	G54-A58 PolarHBondContact O-N 3.03Å; E55-A58 PolarHBondContact O-N 3.45Å; K56-A58 PolarHBondContact O-N 2.85Å; A58-H61 PolarHBondContact O-N 2.95Å; A58-Q62 WeakPolarHBondContact O-CB 3.49Å; A58-Q62 PolarHBondContact O-N 2.83Å
59	I	72.9	Confident	71.7	Confident	30 Å²	30	92.1 Å²	92.1	15%	0.154	50%	0.495	C	S	.	.	H	α-helix	trans	-66.5	-45.7	177.3	-68.2	161.5	0	0	0	110.6	L48 K51 E55 K56 V57 H61 Q62 H63 L253	L48-I59 HydrophobicContact CD2-CG2 4.35Å; K51-I59 HydrophobicContact CD-CD1 3.3Å; E55-I59 WeakPolarHBondContact O-CB 3.47Å; E55-I59 WeakPolarHBondContact O-CD1 3.47Å; E55-I59 VanDerWaalsContact O-CG1 3.23Å; E55-I59 WeakPolarHBondContact O-CG1 3.23Å; E55-I59 PolarHBondContact O-N 2.83Å; K56-I59 PolarHBondContact O-N 2.96Å; V57-I59 PolarHBondContact O-N 2.99Å; I59-H61 PolarHBondContact O-N 3.47Å; I59-Q62 WeakPolarHBondContact O-CB 3.39Å; I59-Q62 PolarHBondContact O-N 2.94Å; I59-H63 PolarHBondContact O-N 2.93Å; I59-H63 PolarHBondContact O-ND1 3.4Å; I59-L253 HydrophobicContact CG2-CD2 4.03Å
60	I	71.7	Confident	71.8	Confident	24 Å²	24	87.9 Å²	87.9	12%	0.123	48%	0.479	C	S	.	.	H	α-helix	trans	-59.1	-49.1	176.4	-73	163.3	0	0	0	109.8	K56 V57 Q62 H63 L64 S252	K56-I60 WeakPolarHBondContact O-CB 3.45Å; K56-I60 WeakPolarHBondContact O-CD1 3.45Å; K56-I60 VanDerWaalsContact O-CG1 3.28Å; K56-I60 WeakPolarHBondContact O-CG1 3.36Å; K56-I60 PolarHBondContact O-N 3.41Å; V57-I60 PolarHBondContact O-N 2.81Å; I60-Q62 VanDerWaalsContact C-N 3.28Å; I60-Q62 PolarHBondContact O-N 2.67Å; I60-H63 PolarHBondContact O-N 3.34Å; I60-H63 VanDerWaalsContact O-N 3.07Å; I60-L64 WeakPolarHBondContact O-CB 3.41Å; I60-L64 PolarHBondContact O-N 3.46Å; I60-S252 VanDerWaalsContact CG2-OG 3.25Å; I60-S252 WeakPolarHBondContact CG2-OG 3.49Å
61	H	69.8	Low	72.4	Confident	124 Å²	124	88.1 Å²	88.1	57%	0.574	46%	0.458	S	S	*	.	H	α-helix	trans	-63.5	-32.4	179.6	-167.6	-72.5	0	0	0	113	V57 A58 I59 H63 G65	V57-H61 VanDerWaalsContact O-CB 3.26Å; V57-H61 WeakPolarHBondContact O-CB 3.34Å; V57-H61 PolarHBondContact O-N 2.62Å; A58-H61 PolarHBondContact O-N 2.95Å; I59-H61 PolarHBondContact O-N 3.47Å; H61-H63 VanDerWaalsContact C-N 3.34Å; H61-G65 PolarHBondContact O-N 2.89Å
62	Q	72.1	Confident	72.4	Confident	147 Å²	147	84.2 Å²	84.2	69%	0.687	44%	0.441	S	S	*	.	H	α-helix	trans	-64	-38.9	173.7	-175.8	-179.5	0.8	0	0	112.1	A58 I59 I60	A58-Q62 WeakPolarHBondContact O-CB 3.49Å; A58-Q62 PolarHBondContact O-N 2.83Å; I59-Q62 WeakPolarHBondContact O-CB 3.39Å; I59-Q62 PolarHBondContact O-N 2.94Å; I60-Q62 VanDerWaalsContact C-N 3.28Å; I60-Q62 PolarHBondContact O-N 2.67Å
63	H	66.5	Low	72.4	Confident	88 Å²	88	84.1 Å²	84.1	41%	0.407	44%	0.436	S	S	.	.	H	α-helix	trans	-87	-31.5	-177.7	-66.7	79.4	0	0	0	112.9	I59 I60 H61 G65 L253	I59-H63 PolarHBondContact O-N 2.93Å; I59-H63 PolarHBondContact O-ND1 3.4Å; I60-H63 PolarHBondContact O-N 3.34Å; I60-H63 VanDerWaalsContact O-N 3.07Å; H61-H63 VanDerWaalsContact C-N 3.34Å; H63-G65 PolarHBondContact O-N 3.35Å; H63-L253 HydrophobicContact CB-CD2 4.35Å
64	L	65.9	Low	72.7	Confident	27 Å²	27	79 Å²	79	14%	0.141	40%	0.403	C	S	.	.	H	α-helix	trans	-64.5	-31.3	174.7	-153	85	0	0	0	111.5	E11 I60 R67 I141	E11-L64 WeakPolarHBondContact OE1-CD1 3.37Å; I60-L64 WeakPolarHBondContact O-CB 3.41Å; I60-L64 PolarHBondContact O-N 3.46Å; L64-R67 HydrophobicContact CG-CB 4.35Å; L64-R67 VanDerWaalsContact O-CD 3.25Å; L64-R67 WeakPolarHBondContact O-CD 3.43Å; L64-R67 WeakPolarHBondContact O-CG 3.38Å; L64-I141 HydrophobicContact CD1-CD1 4.15Å; L64-I141 HydrophobicContact CG-CD1 4.49Å
65	G	58.8	Low	73.1	Confident	36 Å²	36	78.4 Å²	78.4	37%	0.371	39%	0.385	S	S	.	.			trans	62.9	-155.8	-169.4	0	0	0	0	0	111.4	H61 H63 R67	H61-G65 PolarHBondContact O-N 2.89Å; H63-G65 PolarHBondContact O-N 3.35Å; G65-R67 PolarHBondContact O-N 3.22Å; G65-R67 VanDerWaalsContact O-N 3.14Å
66	R	56.5	Low	73.2	Confident	253 Å²	253	74.7 Å²	74.7	96%	0.955	37%	0.37	S	S	*	.	S	Bend	trans	-83.2	39.5	174.8	-66.7	-168.5	-178.3	-158.5	1.8	112.9
67	R	69.1	Low	73.2	Confident	112 Å²	112	72.9 Å²	72.9	42%	0.423	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-81.4	126	176.9	-65.9	175.7	-169.8	-162.1	5.4	109.1	L64 G65 I141 E260	L64-R67 HydrophobicContact CG-CB 4.35Å; L64-R67 VanDerWaalsContact O-CD 3.25Å; L64-R67 WeakPolarHBondContact O-CD 3.43Å; L64-R67 WeakPolarHBondContact O-CG 3.38Å; G65-R67 PolarHBondContact O-N 3.22Å; G65-R67 VanDerWaalsContact O-N 3.14Å; R67-I141 HydrophobicContact CB-CD1 4.13Å; R67-E260 IonicContact CZ-OE1 3.96Å; R67-E260 IonicContact CZ-OE2 2.77Å; R67-E260 VanDerWaalsContact NH1-CD 3.35Å; R67-E260 IonicContact NH1-OE1 3.75Å; R67-E260 PolarHBondContact NH1-OE1 3.48Å; R67-E260 IonicContact NH1-OE2 3.06Å; R67-E260 PolarHBondContact NH1-OE2 2.73Å; R67-E260 VanDerWaalsContact NH1-OE2 3.09Å; R67-E260 IonicContact NH2-OE1 3.38Å; R67-E260 IonicContact NH2-OE2 3.8Å; R67-E260 PolarHBondContact NH2-OE2 2.67Å
68	E	71.9	Confident	72.9	Confident	171 Å²	171	76.4 Å²	76.4	80%	0.799	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-92.5	143.1	174.3	-66.4	-177.9	171.9	0	0	110.1
69	M	79.6	Confident	71.8	Confident	63 Å²	63	76.8 Å²	76.8	31%	0.31	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-68.5	139.4	173.7	-69	-178.1	174.4	0	0	110	A13 H139 I141 S247	A13-M69 HydrophobicContact CB-CE 4.44Å; A13-M69 HydrophobicContact CB-SD 3.66Å; M69-H139 WeakPolarHBondContact CB-NE2 3.33Å; M69-I141 HydrophobicContact CG-CD1 4.31Å; M69-I141 HydrophobicContact CG-CG1 4.19Å; M69-S247 WeakPolarHBondContact CE-OG 3.33Å
70	T	78.8	Confident	70.3	Confident	47 Å²	47	80.1 Å²	80.1	29%	0.288	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	158.6	-176.9	54.1	0	0	0	0	111.2	V72 G140	T70-V72 PolarHBondContact O-N 3.12Å; T70-G140 PolarHBondContact N-O 3.21Å; T70-G140 PolarHBondContact O-N 2.85Å; T70-G140 PolarHBondContact OG1-O 3Å
71	D	81.8	Confident	68.8	Low	95 Å²	95	84.6 Å²	84.6	51%	0.508	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	128.4	173.3	-66.1	-18.1	0	0	0	110.3	I137 H139	D71-I137 HydrophobicContact CB-CG2 4.38Å; D71-H139 IonicContact OD1-CE1 3.34Å; D71-H139 IonicContact OD1-CG 3.53Å; D71-H139 IonicContact OD1-ND1 2.87Å; D71-H139 PolarHBondContact OD1-ND1 3.45Å
72	V	80.8	Confident	67.1	Low	2 Å²	2	84.5 Å²	84.5	1%	0.012	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.1	172.1	-177.8	0	0	0	0	107.6	L10 T70 I74 V138 I194 R195	L10-V72 HydrophobicContact CD2-CG1 4.34Å; T70-V72 PolarHBondContact O-N 3.12Å; V72-I74 HydrophobicContact CG1-CG1 4.32Å; V72-V138 PolarHBondContact N-O 2.99Å; V72-V138 PolarHBondContact O-N 2.91Å; V72-I194 HydrophobicContact CG1-CG2 3.7Å; V72-R195 CarbonylContact C-O 3.56Å; V72-R195 WeakPolarHBondContact CA-O 3.21Å
73	I	79.9	Confident	65.5	Low	51 Å²	51	83.9 Å²	83.9	26%	0.262	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	117.4	-178.2	-52	173.2	0	0	0	108.4	V135 I137 R195	I73-V135 HydrophobicContact CG2-CG1 3.46Å; I73-V135 VanDerWaalsContact CG2-CG1 3.46Å; I73-I137 HydrophobicContact CG1-CG1 4.38Å; I73-I137 HydrophobicContact CG2-CG1 4.46Å; I73-R195 HydrophobicContact CB-CB 4.21Å; I73-R195 PolarHBondContact N-O 2.96Å; I73-R195 PolarHBondContact O-N 2.96Å
74	I	81.3	Confident	64	Low	0 Å²	0	87.1 Å²	87.1	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.8	178.9	-58.4	172.3	0	0	0	108.7	L10 P19 F22 V72 V135 E136 V138 K192 I193	L10-I74 HydrophobicContact CD2-CD1 3.94Å; P19-I74 HydrophobicContact CB-CD1 3.77Å; P19-I74 HydrophobicContact CG-CD1 3.92Å; F22-I74 HydrophobicContact CD2-CD1 3.94Å; F22-I74 HydrophobicContact CE2-CD1 4.19Å; V72-I74 HydrophobicContact CG1-CG1 4.32Å; I74-V135 WeakPolarHBondContact O-CA 3.41Å; I74-E136 HydrophobicContact CB-CB 4.42Å; I74-E136 PolarHBondContact N-O 2.93Å; I74-E136 PolarHBondContact O-N 2.9Å; I74-V138 HydrophobicContact CD1-CG2 4.38Å; I74-K192 HydrophobicContact CG2-CD 4.32Å; I74-I193 CarbonylContact C-O 3.56Å; I74-I193 WeakPolarHBondContact CA-O 3.3Å
75	E	80.7	Confident	62.4	Low	41 Å²	41	94.2 Å²	94.2	19%	0.192	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	119.5	178.1	-177.4	168.2	176.6	0	0	109.7	S134 V135 K192 I193 R195	E75-S134 WeakPolarHBondContact CA-O 3.48Å; E75-V135 HydrophobicContact CB-CG2 4.25Å; E75-V135 HydrophobicContact CG-CG2 3.91Å; E75-K192 CarbonylContact O-C 3.53Å; E75-K192 WeakPolarHBondContact O-CA 3.44Å; E75-I193 HydrophobicContact CB-CB 4.25Å; E75-I193 PolarHBondContact N-O 2.94Å; E75-I193 PolarHBondContact O-N 3.44Å; E75-R195 IonicContact OE2-CZ 3.86Å; E75-R195 IonicContact OE2-NH2 3.8Å; E75-R195 PolarHBondContact OE2-NH2 3.34Å
76	T	80.1	Confident	61.1	Low	22 Å²	22	97.5 Å²	97.5	14%	0.135	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117.7	-177	-55.5	0	0	0	0	110.6	S134 Q190 K192	T76-S134 PolarHBondContact N-O 3.34Å; T76-Q190 HydrophobicContact CG2-CG 4.38Å; T76-K192 HydrophobicContact CG2-CG 4.12Å; T76-K192 PolarHBondContact OG1-NZ 3.47Å
77	M	74	Confident	59.8	Low	40 Å²	40	91 Å²	91	20%	0.197	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.4	171.8	-55.6	-151.2	-59.2	0	0	109.7	M178 M191 I193	M77-M178 HydrophobicContact CE-CG 3.96Å; M77-M178 HydrophobicContact CE-SD 3.63Å; M77-M191 HydrophobicContact CB-CB 4.37Å; M77-M191 HydrophobicContact CE-CG 4.32Å; M77-M191 HydrophobicContact CE-SD 3.42Å; M77-M191 WeakPolarHBondContact CE-SD 3.49Å; M77-M191 PolarHBondContact N-O 2.87Å; M77-M191 PolarHBondContact O-N 3.25Å; M77-M191 VanDerWaalsContact O-O 3.04Å; M77-I193 HydrophobicContact CE-CD1 4.2Å; M77-I193 HydrophobicContact SD-CD1 4.21Å
78	K	64.9	Low	58.1	Low	172 Å²	172	91.5 Å²	91.5	75%	0.748	49%	0.485	S	S	*	.			trans	-105.1	133.4	172.7	-66.8	-176.6	179.8	179	0	108.7	N80	K78-N80 PolarHBondContact O-N 3.2Å; K78-N80 VanDerWaalsContact O-N 3.13Å
79	S	51.6	Low	56.1	Low	67 Å²	67	92 Å²	92	47%	0.469	49%	0.488	S	S	.	.			trans	-66.3	108.1	166	41.5	0	0	0	0	107.7	P81 I188	S79-P81 VanDerWaalsContact O-CD 3.29Å; S79-P81 WeakPolarHBondContact O-CD 3.29Å; S79-I188 PolarHBondContact OG-O 3.39Å; S79-I188 VanDerWaalsContact OG-O 3.08Å
80	N	40.2	Very low	53.7	Low	100 Å²	100	98 Å²	98	54%	0.535	52%	0.515	S	S	.	.			trans	-97	106.2	178	-148.2	13	0	0	0	108.1	K78 D82	K78-N80 PolarHBondContact O-N 3.2Å; K78-N80 VanDerWaalsContact O-N 3.13Å; N80-D82 PolarHBondContact O-N 2.83Å; N80-D82 VanDerWaalsContact O-N 3.11Å
81	P	40.7	Very low	51.4	Low	119 Å²	119	106.9 Å²	106.9	77%	0.773	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-7.1	-176.9	23.9	-31.2	0	0	0	114.3	S79	S79-P81 VanDerWaalsContact O-CD 3.29Å; S79-P81 WeakPolarHBondContact O-CD 3.29Å
82	D	34.3	Very low	48.7	Very low	122 Å²	122	111.6 Å²	111.6	65%	0.652	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-9.2	-175.2	-97.6	-23.7	0	0	0	115.8	N80	N80-D82 PolarHBondContact O-N 2.83Å; N80-D82 VanDerWaalsContact O-N 3.11Å
83	E	38.3	Very low	46.2	Very low	134 Å²	134	117 Å²	117	63%	0.626	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-83.7	-9.2	-179.6	-81	-173.3	162.5	0	0	114.4	K85	E83-K85 PolarHBondContact O-N 3.47Å
84	L	35.3	Very low	43.7	Very low	155 Å²	155	120.2 Å²	120.2	81%	0.812	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-77.9	-2.7	178.9	-114.4	91.3	0	0	0	114.5
85	K	32.8	Very low	40.9	Very low	176 Å²	176	129.3 Å²	129.3	77%	0.765	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-101.8	-14.2	-178.3	-76.7	-179	-179.7	169.3	0	115.1	E83	E83-K85 PolarHBondContact O-N 3.47Å
86	T	29.8	Very low	38.3	Very low	105 Å²	105	132.4 Å²	132.4	64%	0.644	70%	0.698	S	S	*	*	S	Bend	trans	-100	-7.4	-172	44.9	0	0	0	0	114.6
87	T	29.9	Very low	35.5	Very low	116 Å²	116	136.8 Å²	136.8	71%	0.712	73%	0.73	S	S	*	*	S	Bend	trans	-93.1	5.1	-174.1	45.7	0	0	0	0	115.4
88	V	32.9	Very low	34.2	Very low	123 Å²	123	140 Å²	140	75%	0.745	75%	0.754	S	S	*	*	S	Bend	trans	-100.7	-17.7	-179.3	-177.3	0	0	0	0	113.7
89	E	29.8	Very low	32.2	Very low	183 Å²	183	138.5 Å²	138.5	86%	0.855	76%	0.76	S	S	*	*	S	Bend	trans	-103.3	-14.4	-172.3	-71.4	-165	149.9	0	0	116.8
90	E	29.7	Very low	30.9	Very low	189 Å²	189	139.4 Å²	139.4	88%	0.883	77%	0.771	S	S	*	*			trans	-107.1	56.7	178.4	-72.2	-173.2	160.8	0	0	112.8
91	R	30.6	Very low	30.3	Very low	232 Å²	232	143.6 Å²	143.6	88%	0.875	79%	0.787	S	S	*	*			trans	-116.4	82.2	155.1	-86.2	-174.4	176.7	177.2	0.7	108.8
92	K	25.4	Very low	29.5	Very low	195 Å²	195	148.9 Å²	148.9	85%	0.848	79%	0.792	S	S	*	*			trans	-167.4	130.1	155.4	-107	160.9	-172.2	-177.6	0	110.9
93	S	27.4	Very low	28.9	Very low	116 Å²	116	147.8 Å²	147.8	81%	0.811	79%	0.793	S	S	*	*			trans	63.2	134.3	169.2	48.2	0	0	0	0	116.3
94	S	27.1	Very low	28.3	Very low	117 Å²	117	150.2 Å²	150.2	82%	0.818	80%	0.802	S	S	*	*			cis	-171.2	156.8	13.2	25.1	0	0	0	0	109.1
95	E	23.8	Very low	27.8	Very low	192 Å²	192	149 Å²	149	90%	0.897	80%	0.801	S	S	*	*			trans	-67.6	167.4	-177.3	-61.8	170.2	131.8	0	0	115.4
96	A	25.4	Very low	27.4	Very low	105 Å²	105	149 Å²	149	87%	0.868	80%	0.803	S	S	*	*			trans	98.1	140	148.7	0	0	0	0	0	118.9
97	S	21.9	Very low	27.1	Very low	114 Å²	114	149 Å²	149	80%	0.797	81%	0.807	S	S	*	*			trans	-110.1	-150	-157.5	42.5	0	0	0	0	111.3
98	P	45.5	Very low	26.9	Very low	108 Å²	108	152.9 Å²	152.9	70%	0.701	82%	0.815	S	S	*	*				-122.1	164.5	-98.5	36.5	-19.9	0	0	0	113.5
99	T	23.4	Very low	26.5	Very low	141 Å²	141	155.7 Å²	155.7	87%	0.865	82%	0.819	S	S	*	*			trans	-179.9	117.3	151.6	12.3	0	0	0	0	109.7
100	A	24.7	Very low	26.3	Very low	85 Å²	85	153.4 Å²	153.4	70%	0.702	82%	0.822	S	S	*	*				76.2	118.4	87.9	0	0	0	0	0	115.4
101	Q	27.4	Very low	26.1	Very low	189 Å²	189	151.2 Å²	151.2	88%	0.883	82%	0.815	S	S	*	*			trans	155.7	108	132.8	-84.7	172.5	4.2	0	0	108.9
102	R	23.5	Very low	25.9	Very low	230 Å²	230	146.8 Å²	146.8	87%	0.868	81%	0.809	S	S	*	*				74.5	122.5	71	-147.7	-176.2	-160.5	-176.1	5	113.6
103	S	23.2	Very low	25.9	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	81%	0.81	S	S	*	*			trans	73.4	146.2	150.2	39.1	0	0	0	0	117.7
104	K	24.3	Very low	26.1	Very low	185 Å²	185	143.3 Å²	143.3	80%	0.804	81%	0.809	S	S	*	*			cis	-173.4	144.9	16.2	-121.1	168.8	174.7	179.7	0	109
105	V	24.3	Very low	26.4	Very low	131 Å²	131	143.2 Å²	143.2	79%	0.794	81%	0.806	S	S	*	*				73.1	123.4	129.8	173.5	0	0	0	0	121.8
106	H	24.8	Very low	26.5	Very low	174 Å²	174	141.5 Å²	141.5	81%	0.806	80%	0.803	S	S	*	*			trans	-43	148.3	156.8	-75.2	-34.9	0	0	0	115.9
107	S	23.5	Very low	26.6	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	80%	0.796	S	S	*	*				161.8	151.5	94.5	57.3	0	0	0	0	113.8
108	K	25.8	Very low	27.1	Very low	199 Å²	199	142.3 Å²	142.3	87%	0.865	80%	0.799	S	S	*	*			trans	98	121.5	150.6	-75.7	176.9	178.6	-179.2	0	120.5
109	E	25.4	Very low	26.5	Very low	181 Å²	181	142 Å²	142	85%	0.846	80%	0.799	S	S	*	*			trans	-57.8	151.7	170.7	-61.3	161	137.1	0	0	113.8
110	C	24.4	Very low	27.3	Very low	136 Å²	136	144.2 Å²	144.2	92%	0.919	80%	0.797	S	S	*	*			trans	-159.2	137.2	131.7	-113.2	0	0	0	0	110.7
111	I	27.2	Very low	28	Very low	142 Å²	142	149.3 Å²	149.3	73%	0.728	81%	0.806	S	S	*	*			trans	-90.4	128.7	-175.5	-69.4	161.2	0	0	0	109.5
112	N	25.6	Very low	28.4	Very low	140 Å²	140	147.1 Å²	147.1	75%	0.749	80%	0.799	S	S	*	*				163.3	144.4	123.4	-92.7	-38.7	0	0	0	115
113	T	26.1	Very low	29	Very low	143 Å²	143	141.1 Å²	141.1	88%	0.877	79%	0.79	S	S	*	*			trans	84.1	109.5	161	56.3	0	0	0	0	119.9
114	A	29.8	Very low	29.7	Very low	95 Å²	95	144.8 Å²	144.8	79%	0.785	80%	0.802	S	S	*	*			trans	-80	172.9	176.6	0	0	0	0	0	112.2
115	P	34.3	Very low	30.3	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	80%	0.8	S	S	*	*				-148.4	167.4	68.9	33.8	-11.1	0	0	0	117.8
116	D	25.8	Very low	30.8	Very low	155 Å²	155	144.1 Å²	144.1	83%	0.829	80%	0.796	S	S	*	*			trans	76	89.8	153.8	-66.5	-17.3	0	0	0	121.6
117	S	28.2	Very low	31.2	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	78%	0.783	S	S	*	*			trans	-75.4	136.6	160.7	-57.1	0	0	0	0	112.7
118	P	31.7	Very low	31.5	Very low	132 Å²	132	142.7 Å²	142.7	86%	0.857	79%	0.785	S	S	*	*			trans	-98	71.5	151.7	35.1	-25.3	0	0	0	109	K120	P118-K120 PolarHBondContact O-N 2.96Å; P118-K120 VanDerWaalsContact O-N 3.14Å
119	S	33.5	Very low	31.7	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	78%	0.777	S	S	*	*			trans	-79.2	83.3	166.1	45.6	0	0	0	0	109.7
120	K	39.1	Very low	31.8	Very low	189 Å²	189	137.4 Å²	137.4	82%	0.822	77%	0.773	S	S	*	*			trans	-149.8	86.4	159	-78.2	-166.2	178.7	175.7	0	109.9	P118	P118-K120 PolarHBondContact O-N 2.96Å; P118-K120 VanDerWaalsContact O-N 3.14Å
121	Q	39.9	Very low	32.4	Very low	192 Å²	192	133.7 Å²	133.7	90%	0.897	76%	0.758	S	S	*	*			trans	159.2	75	146.2	-88.7	165.5	-1.9	0	0	109.4
122	L	35	Very low	33.6	Very low	142 Å²	142	130.9 Å²	130.9	74%	0.743	74%	0.744	S	S	*	*			trans	-132.6	134.4	153.4	-74.1	172.2	0	0	0	106.7
123	P	36.8	Very low	34.9	Very low	104 Å²	104	129.2 Å²	129.2	68%	0.675	74%	0.741	S	S	*	*			trans	-57.9	137.8	173.5	-18.8	30	0	0	0	110.4	Q125	P123-Q125 PolarHBondContact O-N 3.4Å
124	D	38.5	Very low	36.6	Very low	175 Å²	175	124.9 Å²	124.9	94%	0.936	72%	0.717	S	S	*	*	S	Bend	trans	-66.2	5.5	-174.7	-81.4	-33	0	0	0	115.3
125	Q	36	Very low	38.4	Very low	160 Å²	160	122.3 Å²	122.3	75%	0.748	69%	0.691	S	S	*	*			trans	-146.8	109.2	169.5	-97.8	176.4	-4.8	0	0	109.3	P123 S127	P123-Q125 PolarHBondContact O-N 3.4Å; Q125-S127 PolarHBondContact O-N 3.21Å
126	I	36.1	Very low	40.5	Very low	142 Å²	142	119.1 Å²	119.1	73%	0.728	67%	0.666	S	S	*	*			trans	-87.4	96.6	153.5	-59.2	174.8	0	0	0	105.2	F128	I126-F128 PolarHBondContact O-N 3.42Å
127	S	32.5	Very low	42.9	Very low	76 Å²	76	116.7 Å²	116.7	53%	0.531	65%	0.652	S	S	.	*			trans	-66.7	98.5	170.2	-42.4	0	0	0	0	107.8	Q125 F129	Q125-S127 PolarHBondContact O-N 3.21Å; S127-F129 PolarHBondContact O-N 2.93Å
128	F	29.4	Very low	45.3	Very low	174 Å²	174	111.8 Å²	111.8	76%	0.763	62%	0.618	S	S	*	*			trans	-76.3	110.7	169.7	-176	-99.1	0	0	0	108.3	I126	I126-F128 PolarHBondContact O-N 3.42Å
129	F	30.2	Very low	47.5	Very low	158 Å²	158	109.1 Å²	109.1	69%	0.693	59%	0.594	S	S	*	*			trans	-87	114.7	166.7	-71.4	-88.2	0	0	0	108.2	S127 G131	S127-F129 PolarHBondContact O-N 2.93Å; F129-G131 PolarHBondContact O-N 2.83Å
130	S	28	Very low	49.9	Very low	111 Å²	111	104.4 Å²	104.4	78%	0.776	56%	0.561	S	S	*	*			trans	-88.6	96.9	165.8	-177	0	0	0	0	108.2
131	G	35.8	Very low	51.9	Low	58 Å²	58	96.1 Å²	96.1	60%	0.598	53%	0.526	S	S	*	.	S	Bend	trans	142.7	171.4	177.3	0	0	0	0	0	113.1	F129 P133	F129-G131 PolarHBondContact O-N 2.83Å; G131-P133 WeakPolarHBondContact O-CD 3.39Å
132	N	52.7	Low	53.9	Low	82 Å²	82	87.6 Å²	87.6	44%	0.439	49%	0.486	S	S	.	.			trans	-67.3	116.3	171.2	179.8	-6.4	0	0	0	108.4	S134 V135	N132-S134 PolarHBondContact O-N 3.44Å; N132-S134 VanDerWaalsContact OD1-CB 3.3Å; N132-S134 WeakPolarHBondContact OD1-CB 3.28Å; N132-S134 PolarHBondContact OD1-N 3.3Å; N132-S134 PolarHBondContact OD1-OG 2.96Å; N132-S134 VanDerWaalsContact OD1-OG 3.12Å; N132-V135 HydrophobicContact CB-CB 4.31Å; N132-V135 HydrophobicContact CB-CG2 3.83Å; N132-V135 PolarHBondContact O-N 3.4Å
133	P	53.1	Low	56.2	Low	105 Å²	105	81 Å²	81	68%	0.682	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.7	-177.8	25.6	-33.7	0	0	0	113.7	G131 V135	G131-P133 WeakPolarHBondContact O-CD 3.39Å; P133-V135 VanDerWaalsContact C-N 3.32Å
134	S	62.2	Low	58.4	Low	52 Å²	52	76.1 Å²	76.1	36%	0.364	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-9.4	175	-42.6	0	0	0	0	113.1	E75 T76 N132	E75-S134 WeakPolarHBondContact CA-O 3.48Å; T76-S134 PolarHBondContact N-O 3.34Å; N132-S134 PolarHBondContact O-N 3.44Å; N132-S134 VanDerWaalsContact OD1-CB 3.3Å; N132-S134 WeakPolarHBondContact OD1-CB 3.28Å; N132-S134 PolarHBondContact OD1-N 3.3Å; N132-S134 PolarHBondContact OD1-OG 2.96Å; N132-S134 VanDerWaalsContact OD1-OG 3.12Å
135	V	68.5	Low	60.5	Low	42 Å²	42	68.2 Å²	68.2	26%	0.255	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	109.2	-177.9	-179.4	0	0	0	0	109.1	I73 I74 E75 N132 P133 I137	I73-V135 HydrophobicContact CG2-CG1 3.46Å; I73-V135 VanDerWaalsContact CG2-CG1 3.46Å; I74-V135 WeakPolarHBondContact O-CA 3.41Å; E75-V135 HydrophobicContact CB-CG2 4.25Å; E75-V135 HydrophobicContact CG-CG2 3.91Å; N132-V135 HydrophobicContact CB-CB 4.31Å; N132-V135 HydrophobicContact CB-CG2 3.83Å; N132-V135 PolarHBondContact O-N 3.4Å; P133-V135 VanDerWaalsContact C-N 3.32Å; V135-I137 HydrophobicContact CG1-CG1 4.46Å
136	E	76.8	Confident	62.6	Low	47 Å²	47	61.6 Å²	61.6	22%	0.22	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.6	175.4	-62.8	174.1	-179.9	0	0	108.3	P19 A20 I74	P19-E136 WeakPolarHBondContact CA-OE2 3.49Å; P19-E136 WeakPolarHBondContact CB-OE2 3.49Å; A20-E136 WeakPolarHBondContact CB-OE1 3.34Å; A20-E136 PolarHBondContact N-OE1 3.43Å; A20-E136 PolarHBondContact N-OE2 3.36Å; I74-E136 HydrophobicContact CB-CB 4.42Å; I74-E136 PolarHBondContact N-O 2.93Å; I74-E136 PolarHBondContact O-N 2.9Å
137	I	77.6	Confident	64.6	Low	104 Å²	104	55.4 Å²	55.4	53%	0.533	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.4	173.6	-56	177.1	0	0	0	107.5	D71 I73 V135	D71-I137 HydrophobicContact CB-CG2 4.38Å; I73-I137 HydrophobicContact CG1-CG1 4.38Å; I73-I137 HydrophobicContact CG2-CG1 4.46Å; V135-I137 HydrophobicContact CG1-CG1 4.46Å
138	V	77.9	Confident	66.3	Low	2 Å²	2	56.6 Å²	56.6	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.3	-174.3	-178.6	0	0	0	0	108.7	L10 L12 P19 V72 I74	L10-V138 HydrophobicContact CD2-CG1 4.35Å; L12-V138 HydrophobicContact CD1-CG1 4.41Å; L12-V138 HydrophobicContact CD2-CG1 3.12Å; L12-V138 HydrophobicContact CG-CG1 4.37Å; P19-V138 HydrophobicContact CB-CG2 4.08Å; P19-V138 HydrophobicContact CG-CG2 4.21Å; V72-V138 PolarHBondContact N-O 2.99Å; V72-V138 PolarHBondContact O-N 2.91Å; I74-V138 HydrophobicContact CD1-CG2 4.38Å
139	H	78.4	Confident	68.1	Low	75 Å²	75	55.5 Å²	55.5	35%	0.347	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	113.5	-178.9	-169.1	73.3	0	0	0	109.8	A13 S16 M69 D71	A13-H139 PolarHBondContact N-O 3.39Å; S16-H139 PolarHBondContact OG-N 3.49Å; S16-H139 VanDerWaalsContact OG-N 3.08Å; M69-H139 WeakPolarHBondContact CB-NE2 3.33Å; D71-H139 IonicContact OD1-CE1 3.34Å; D71-H139 IonicContact OD1-CG 3.53Å; D71-H139 IonicContact OD1-ND1 2.87Å; D71-H139 PolarHBondContact OD1-ND1 3.45Å
140	G	82.4	Confident	69.9	Low	2 Å²	2	53.4 Å²	53.4	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.5	-169.7	-170.1	0	0	0	0	0	116.2	E11 T70	E11-G140 CarbonylContact O-C 3.6Å; E11-G140 WeakPolarHBondContact O-CA 3.4Å; T70-G140 PolarHBondContact N-O 3.21Å; T70-G140 PolarHBondContact O-N 2.85Å; T70-G140 PolarHBondContact OG1-O 3Å
141	I	80.9	Confident	71.9	Confident	16 Å²	16	49.3 Å²	49.3	8%	0.082	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.5	176.4	-58	172.8	0	0	0	108.7	E11 L64 R67 M69	E11-I141 HydrophobicContact CB-CB 4.3Å; E11-I141 PolarHBondContact N-O 3.43Å; E11-I141 PolarHBondContact O-N 3.5Å; L64-I141 HydrophobicContact CD1-CD1 4.15Å; L64-I141 HydrophobicContact CG-CD1 4.49Å; R67-I141 HydrophobicContact CB-CD1 4.13Å; M69-I141 HydrophobicContact CG-CD1 4.31Å; M69-I141 HydrophobicContact CG-CG1 4.19Å
142	M	83.4	Confident	73.4	Confident	13 Å²	13	48.6 Å²	48.6	6%	0.064	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.5	178.7	-175.7	177.6	68	0	0	111.1	I8 L144 I194 D196 M203 R270	I8-M142 HydrophobicContact CG2-CG 4.49Å; M142-L144 HydrophobicContact CE-CD1 4.11Å; M142-L144 HydrophobicContact CG-CD1 3.82Å; M142-L144 HydrophobicContact SD-CD1 4.19Å; M142-I194 HydrophobicContact SD-CG2 3.76Å; M142-D196 HydrophobicContact CE-CB 3.75Å; M142-D196 WeakPolarHBondContact CE-OD2 3.3Å; M142-M203 HydrophobicContact CE-CE 3.19Å; M142-M203 HydrophobicContact CE-SD 3.95Å; M142-M203 HydrophobicContact SD-CE 3.23Å; M142-M203 WeakPolarHBondContact SD-CE 3.44Å; M142-R270 PolarHBondContact O-NH2 2.94Å
143	H	82.2	Confident	74.1	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.019	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.5	176.1	-57	-82.9	0	0	0	110.2	R9 E11 Y145 E260	R9-H143 HydrophobicContact CB-CB 4.19Å; R9-H143 PolarHBondContact N-O 2.97Å; R9-H143 PolarHBondContact O-N 3.33Å; E11-H143 IonicContact OE2-NE2 3.83Å; E11-H143 PolarHBondContact OE2-NE2 3.46Å; E11-H143 VanDerWaalsContact OE2-NE2 3.15Å; H143-Y145 HydrophobicContact CB-CD2 4.25Å; H143-Y145 HydrophobicContact CB-CE2 3.53Å; H143-E260 IonicContact CE1-OE1 3.69Å; H143-E260 IonicContact CG-OE1 3.94Å; H143-E260 IonicContact ND1-OE1 3.31Å; H143-E260 PolarHBondContact ND1-OE1 3.33Å
144	L	83.3	Confident	74.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	112.8	169.3	-89.5	71.9	0	0	0	107.5	I6 I8 M142 L166 M203 L261	I6-L144 HydrophobicContact CD1-CD2 4.34Å; I8-L144 HydrophobicContact CG1-CG 4.33Å; I8-L144 HydrophobicContact CG2-CD1 4.34Å; M142-L144 HydrophobicContact CE-CD1 4.11Å; M142-L144 HydrophobicContact CG-CD1 3.82Å; M142-L144 HydrophobicContact SD-CD1 4.19Å; L144-L166 HydrophobicContact CD2-CD2 3.75Å; L144-M203 HydrophobicContact CD1-CE 4.28Å; L144-M203 HydrophobicContact CD1-SD 4.47Å; L144-M203 HydrophobicContact CD2-SD 4.17Å; L144-L261 HydrophobicContact CB-CD1 4.31Å; L144-L261 PolarHBondContact O-N 3.34Å
145	Y	82.6	Confident	74.7	Confident	10 Å²	10	54.5 Å²	54.5	4%	0.039	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	146.1	174.5	-55.7	-80.8	0	0	0	110.7	I6 V7 R9 H143 L258 T259 E260	I6-Y145 CarbonylContact C-O 3.56Å; I6-Y145 WeakPolarHBondContact CA-O 3.37Å; I6-Y145 WeakPolarHBondContact CB-O 3.46Å; V7-Y145 HydrophobicContact CB-CD2 4.49Å; V7-Y145 HydrophobicContact CG1-CD2 4.48Å; V7-Y145 PolarHBondContact N-O 3.35Å; V7-Y145 PolarHBondContact O-N 3Å; R9-Y145 HydrophobicContact CB-CE2 4.06Å; R9-Y145 PolarHBondContact NH1-OH 3.36Å; H143-Y145 HydrophobicContact CB-CD2 4.25Å; H143-Y145 HydrophobicContact CB-CE2 3.53Å; Y145-L258 HydrophobicContact CD1-CB 4.27Å; Y145-L258 HydrophobicContact CD2-CD1 4.42Å; Y145-L258 HydrophobicContact CG-CB 4.27Å; Y145-L258 HydrophobicContact CG-CD1 4.18Å; Y145-T259 CarbonylContact C-O 3.59Å; Y145-T259 WeakPolarHBondContact CA-O 2.99Å; Y145-E260 HydrophobicContact CD1-CB 3.91Å; Y145-E260 HydrophobicContact CD1-CG 4.46Å; Y145-E260 HydrophobicContact CE1-CB 3.94Å; Y145-E260 HydrophobicContact CE1-CG 4.34Å
146	K	80.7	Confident	74.2	Confident	21 Å²	21	60.1 Å²	60.1	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.1	171.1	-175.9	175.4	178.1	177.3	0	109	S4 L258 T259 L261 D272	S4-K146 WeakPolarHBondContact OG-CE 3.2Å; K146-L258 WeakPolarHBondContact O-CA 3.5Å; K146-T259 PolarHBondContact N-O 2.9Å; K146-T259 PolarHBondContact O-N 3.28Å; K146-L261 HydrophobicContact CB-CD2 4.02Å; K146-L261 HydrophobicContact CB-CG 4.33Å; K146-L261 HydrophobicContact CD-CD2 4.09Å; K146-D272 IonicContact NZ-OD1 2.84Å; K146-D272 PolarHBondContact NZ-OD1 2.89Å
147	T	78.6	Confident	73.8	Confident	12 Å²	12	60.2 Å²	60.2	7%	0.074	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	132.2	172.4	60.3	0	0	0	0	110	L5 K149 E240 L258	L5-T147 HydrophobicContact CB-CG2 4.15Å; L5-T147 PolarHBondContact N-OG1 3.12Å; L5-T147 VanDerWaalsContact N-OG1 3.17Å; L5-T147 PolarHBondContact O-N 3.45Å; L5-T147 PolarHBondContact O-OG1 3.41Å; L5-T147 VanDerWaalsContact O-OG1 3.08Å; T147-K149 PolarHBondContact O-N 2.99Å; T147-K149 VanDerWaalsContact O-N 3.1Å; T147-K149 PolarHBondContact OG1-O 3.24Å; T147-E240 WeakPolarHBondContact CG2-OE2 3.38Å; T147-L258 HydrophobicContact CG2-CD2 3.76Å
148	N	67.2	Low	73.3	Confident	101 Å²	101	64.8 Å²	64.8	54%	0.54	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-4	175.5	-66.7	-14.1	0	0	0	113.2	D257 T259	N148-D257 PolarHBondContact N-O 2.97Å; N148-D257 VanDerWaalsContact N-O 3.08Å; N148-T259 PolarHBondContact OD1-OG1 2.87Å
149	K	67.9	Low	73.3	Confident	151 Å²	151	65.3 Å²	65.3	66%	0.657	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.9	175.9	-64.9	178.4	-175.9	170.7	0	110.6	T147	T147-K149 PolarHBondContact O-N 2.99Å; T147-K149 VanDerWaalsContact O-N 3.1Å; T147-K149 PolarHBondContact OG1-O 3.24Å
150	M	68.6	Low	73.6	Confident	114 Å²	114	61.9 Å²	61.9	56%	0.562	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.3	174.7	-76.4	-65.4	-151.8	0	0	110.4	S4	S4-M150 PolarHBondContact OG-SD 3.42Å; S4-M150 VanDerWaalsContact OG-SD 3.33Å
151	T	68.8	Low	73.9	Confident	24 Å²	24	62.9 Å²	62.9	15%	0.147	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.5	-178.4	-47.1	0	0	0	0	110.3	S2 V3 V157 R159	S2-T151 CarbonylContact C-O 3.43Å; S2-T151 WeakPolarHBondContact CA-O 3.48Å; V3-T151 PolarHBondContact N-O 2.84Å; V3-T151 WeakPolarHBondContact O-CB 3.49Å; V3-T151 PolarHBondContact O-N 3.31Å; T151-V157 HydrophobicContact CG2-CG1 3.59Å; T151-R159 HydrophobicContact CG2-CG 3.8Å
152	S	68.4	Low	74.2	Confident	44 Å²	44	62.7 Å²	62.7	31%	0.308	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	141.2	-178.9	-161.9	0	0	0	0	112.1	K154 R159	S152-K154 PolarHBondContact O-N 2.91Å; S152-K154 VanDerWaalsContact O-N 3.16Å; S152-R159 PolarHBondContact O-NE 3.27Å
153	L	67.6	Low	74.5	Confident	39 Å²	39	62.1 Å²	62.1	20%	0.204	30%	0.301	C	S	.	.			trans	-79.9	26.8	172.2	-74.2	167.4	0	0	0	113.5	M1 V3 Y218 Y238	M1-L153 HydrophobicContact CB-CD1 3.55Å; M1-L153 WeakPolarHBondContact O-CB 3.31Å; M1-L153 PolarHBondContact O-N 3.34Å; V3-L153 HydrophobicContact CG1-CD1 3.64Å; V3-L153 HydrophobicContact CG1-CD2 4.17Å; V3-L153 HydrophobicContact CG1-CG 3.93Å; V3-L153 HydrophobicContact CG2-CD2 3.95Å; V3-L153 HydrophobicContact CG2-CG 4.08Å; L153-Y218 HydrophobicContact CD1-CE1 4.29Å; L153-Y238 HydrophobicContact CD2-CE2 4.08Å
154	K	68.9	Low	74.9	Confident	142 Å²	142	61.9 Å²	61.9	62%	0.617	30%	0.301	S	S	*	.	S	Bend	trans	-79.9	147.3	171.9	-69	-179.3	179.4	-174.6	0	109.7	S152 D156 V157 R159	S152-K154 PolarHBondContact O-N 2.91Å; S152-K154 VanDerWaalsContact O-N 3.16Å; K154-D156 PolarHBondContact O-N 3.47Å; K154-V157 HydrophobicContact CB-CG2 4.34Å; K154-V157 PolarHBondContact O-N 2.94Å; K154-R159 PolarHBondContact O-NH2 2.95Å
155	E	57.6	Low	75.2	Confident	182 Å²	182	61.9 Å²	61.9	85%	0.85	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.3	-177.4	-70.8	178.4	164.5	0	0	112.9	V157	E155-V157 PolarHBondContact O-N 3.33Å
156	D	58.6	Low	75.4	Confident	159 Å²	159	62 Å²	62	85%	0.85	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	0.2	-176.4	-57.9	-43.9	0	0	0	115	K154	K154-D156 PolarHBondContact O-N 3.47Å
157	V	68.4	Low	75.6	Confident	49 Å²	49	61.9 Å²	61.9	30%	0.297	30%	0.303	S	S	.	.	S	Bend	trans	-104.4	120.1	-176	-175.8	0	0	0	0	110.2	T151 K154 E155 R159 Q211	T151-V157 HydrophobicContact CG2-CG1 3.59Å; K154-V157 HydrophobicContact CB-CG2 4.34Å; K154-V157 PolarHBondContact O-N 2.94Å; E155-V157 PolarHBondContact O-N 3.33Å; V157-R159 PolarHBondContact O-N 2.89Å; V157-Q211 PolarHBondContact O-NE2 3.19Å
158	R	67.1	Low	76	Confident	201 Å²	201	61.3 Å²	61.3	76%	0.758	30%	0.299	S	S	*	.			trans	-62.6	127	171	-77.2	-171.6	178.3	167.5	-0.1	110.3	E30	E30-R158 IonicContact OE1-NH1 2.77Å; E30-R158 PolarHBondContact OE1-NH1 3.36Å
159	R	78.6	Confident	77	Confident	13 Å²	13	57.2 Å²	57.2	5%	0.049	28%	0.278	C	S	.	.			trans	-124.2	-134.5	176.3	-67.7	-177.4	-114.2	90.8	3.3	107.5	T151 S152 K154 V157 Q211 D215 Y238	T151-R159 HydrophobicContact CG2-CG 3.8Å; S152-R159 PolarHBondContact O-NE 3.27Å; K154-R159 PolarHBondContact O-NH2 2.95Å; V157-R159 PolarHBondContact O-N 2.89Å; R159-Q211 HydrophobicContact CB-CG 4.28Å; R159-D215 IonicContact CZ-OD1 3.06Å; R159-D215 IonicContact CZ-OD2 2.92Å; R159-D215 IonicContact NH1-OD1 3.8Å; R159-D215 PolarHBondContact NH1-OD1 2.91Å; R159-D215 IonicContact NH1-OD2 2.8Å; R159-D215 PolarHBondContact NH1-OD2 3.28Å; R159-D215 IonicContact NH2-OD2 2.66Å; R159-D215 PolarHBondContact NH2-OD2 3.35Å; R159-Y238 HydrophobicContact CB-CD1 4.41Å
160	S	84.8	Confident	77.8	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.014	27%	0.269	C	S	.	.			trans	-129.8	143.4	-178.3	-178.3	0	0	0	0	111	F24 M162 V239	F24-S160 VanDerWaalsContact CE1-OG 3.25Å; F24-S160 WeakPolarHBondContact CE1-OG 3.4Å; F24-S160 WeakPolarHBondContact CZ-OG 3.44Å; S160-M162 PolarHBondContact O-N 3.31Å; S160-M162 PolarHBondContact OG-N 3.43Å; S160-M162 PolarHBondContact OG-O 3.46Å; S160-V239 WeakPolarHBondContact CB-O 3.45Å; S160-V239 PolarHBondContact OG-O 3.19Å
161	A	87	Confident	78.6	Confident	23 Å²	23	50.6 Å²	50.6	19%	0.19	27%	0.27	C	S	.	.	S	Bend	trans	-81.2	3.2	168.3	0	0	0	0	0	112.6	F208	A161-F208 WeakPolarHBondContact O-CB 3.28Å; A161-F208 PolarHBondContact O-N 2.9Å
162	M	88.3	Confident	79.5	Confident	13 Å²	13	50.2 Å²	50.2	6%	0.064	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.1	177.2	-174.9	173.8	-80.1	0	0	111.5	F24 S160 L205 I206 K207 V239	F24-M162 HydrophobicContact CB-CE 3.66Å; F24-M162 HydrophobicContact CB-SD 3.72Å; F24-M162 HydrophobicContact CD1-CB 3.81Å; F24-M162 HydrophobicContact CD1-CE 4.11Å; F24-M162 HydrophobicContact CD1-CG 4.26Å; F24-M162 HydrophobicContact CD1-SD 3.51Å; F24-M162 VanDerWaalsContact CD1-SD 3.51Å; F24-M162 HydrophobicContact CD2-CB 4.24Å; F24-M162 HydrophobicContact CD2-CE 3.42Å; F24-M162 VanDerWaalsContact CD2-CE 3.42Å; F24-M162 HydrophobicContact CD2-SD 3.99Å; F24-M162 HydrophobicContact CE1-CB 3.39Å; F24-M162 HydrophobicContact CE1-CG 4.31Å; F24-M162 HydrophobicContact CE1-SD 4.15Å; F24-M162 HydrophobicContact CE2-CB 3.82Å; F24-M162 HydrophobicContact CE2-CE 4.08Å; F24-M162 HydrophobicContact CG-CB 4.23Å; F24-M162 HydrophobicContact CG-CE 3.43Å; F24-M162 VanDerWaalsContact CG-CE 3.43Å; F24-M162 HydrophobicContact CG-CG 4.49Å; F24-M162 HydrophobicContact CG-SD 3.43Å; F24-M162 WeakPolarHBondContact CG-SD 3.37Å; F24-M162 HydrophobicContact CZ-CB 3.39Å; S160-M162 PolarHBondContact O-N 3.31Å; S160-M162 PolarHBondContact OG-N 3.43Å; S160-M162 PolarHBondContact OG-O 3.46Å; M162-L205 HydrophobicContact SD-CD2 4.49Å; M162-I206 WeakPolarHBondContact CA-O 3.38Å; M162-K207 HydrophobicContact CE-CB 3.76Å; M162-K207 HydrophobicContact CE-CD 4.32Å; M162-K207 HydrophobicContact CE-CG 4Å; M162-V239 HydrophobicContact CB-CB 4.21Å; M162-V239 HydrophobicContact CG-CB 3.98Å; M162-V239 HydrophobicContact CG-CG1 4.47Å; M162-V239 HydrophobicContact CG-CG2 4.16Å; M162-V239 PolarHBondContact O-N 2.9Å; M162-V239 HydrophobicContact SD-CB 4.32Å; M162-V239 HydrophobicContact SD-CG1 4.16Å
163	L	90.2	Very high	80.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	152.8	175.3	-65.4	178.4	0	0	0	110.5	I206 F208 A214 F217 Y218 V237 Y238	L163-I206 PolarHBondContact N-O 2.92Å; L163-I206 PolarHBondContact O-N 2.97Å; L163-F208 HydrophobicContact CB-CE2 4.32Å; L163-F208 HydrophobicContact CD1-CE2 3.93Å; L163-F208 HydrophobicContact CG-CE2 4.23Å; L163-A214 HydrophobicContact CD1-CB 4.17Å; L163-A214 WeakPolarHBondContact CD1-O 3.3Å; L163-A214 HydrophobicContact CG-CB 4.18Å; L163-F217 HydrophobicContact CD1-CB 4.41Å; L163-F217 HydrophobicContact CD1-CD1 3.62Å; L163-F217 HydrophobicContact CD1-CE1 4.43Å; L163-F217 HydrophobicContact CD1-CG 4.47Å; L163-Y218 HydrophobicContact CD2-CD2 4.48Å; L163-V237 WeakPolarHBondContact CA-O 3.07Å; L163-Y238 HydrophobicContact CD2-CD1 3.36Å; L163-Y238 HydrophobicContact CD2-CD2 4.11Å; L163-Y238 HydrophobicContact CD2-CE1 3.62Å; L163-Y238 HydrophobicContact CD2-CE2 4.3Å; L163-Y238 HydrophobicContact CD2-CG 3.63Å
164	C	90.1	Very high	81.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.7	171.3	-170.8	0	0	0	0	109.8	I6 I8 V204 L205 L236 V237 V239	I6-C164 HydrophobicContact CD1-CB 4.15Å; I8-C164 HydrophobicContact CD1-CB 4.35Å; C164-V204 CarbonylContact C-O 3.44Å; C164-V204 WeakPolarHBondContact CA-O 3.39Å; C164-L205 HydrophobicContact CB-CD2 3.62Å; C164-L236 WeakPolarHBondContact O-CA 3.28Å; C164-V237 HydrophobicContact CB-CG2 3.85Å; C164-V237 PolarHBondContact N-O 3.23Å; C164-V237 PolarHBondContact O-N 3.04Å; C164-V239 HydrophobicContact CB-CG2 3.7Å
165	I	90.2	Very high	82	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.7	162.3	-52.1	172.9	0	0	0	107.1	V168 L177 M203 V204 I206 F226 Q235 L236	I165-V168 HydrophobicContact CB-CG2 3.97Å; I165-V168 HydrophobicContact CD1-CG2 4.4Å; I165-V168 HydrophobicContact CG2-CG2 3.42Å; I165-V168 VanDerWaalsContact CG2-CG2 3.42Å; I165-L177 HydrophobicContact CD1-CD1 4.16Å; I165-M203 WeakPolarHBondContact O-CA 3.38Å; I165-V204 HydrophobicContact CB-CB 4.15Å; I165-V204 HydrophobicContact CD1-CB 4.07Å; I165-V204 HydrophobicContact CD1-CG2 4.48Å; I165-V204 HydrophobicContact CG1-CB 4.28Å; I165-V204 PolarHBondContact N-O 3.16Å; I165-V204 PolarHBondContact O-N 2.91Å; I165-V204 VanDerWaalsContact O-N 3.09Å; I165-I206 HydrophobicContact CD1-CD1 4.06Å; I165-I206 HydrophobicContact CG1-CD1 4.46Å; I165-F226 HydrophobicContact CG2-CZ 4.01Å; I165-Q235 WeakPolarHBondContact CA-O 3.38Å; I165-L236 HydrophobicContact CB-CD2 4.39Å; I165-L236 HydrophobicContact CG1-CD2 3.51Å
166	L	85.2	Confident	83.5	Confident	11 Å²	11	45.4 Å²	45.4	6%	0.058	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-34.7	-173.3	-71.6	179.7	0	0	0	113.7	L144 M203 Q235 V237	L144-L166 HydrophobicContact CD2-CD2 3.75Å; L166-M203 WeakPolarHBondContact O-CG 3.49Å; L166-Q235 PolarHBondContact N-O 3.49Å; L166-Q235 VanDerWaalsContact N-O 3.09Å; L166-V237 HydrophobicContact CD1-CG1 3.72Å; L166-V237 HydrophobicContact CD1-CG2 4.27Å; L166-V237 HydrophobicContact CD2-CG2 3.72Å; L166-V237 HydrophobicContact CG-CG1 4.15Å; L166-V237 HydrophobicContact CG-CG2 3.83Å
167	T	85.3	Confident	84.9	Confident	19 Å²	19	37.9 Å²	37.9	12%	0.117	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	107.4	-174.2	48.2	0	0	0	0	109.1	F226 E269	T167-F226 WeakPolarHBondContact O-CE2 3.42Å; T167-E269 HydrophobicContact CG2-CG 4.5Å
168	V	88	Confident	85.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	124	168	-172.9	0	0	0	0	108.2	I165 M172 Q201 Y202 V204 F226	I165-V168 HydrophobicContact CB-CG2 3.97Å; I165-V168 HydrophobicContact CD1-CG2 4.4Å; I165-V168 HydrophobicContact CG2-CG2 3.42Å; I165-V168 VanDerWaalsContact CG2-CG2 3.42Å; V168-M172 HydrophobicContact CG1-CB 4.03Å; V168-M172 HydrophobicContact CG1-CG 4.34Å; V168-M172 HydrophobicContact CG1-SD 3.77Å; V168-Q201 CarbonylContact O-C 3.53Å; V168-Q201 WeakPolarHBondContact O-CA 3.37Å; V168-Q201 WeakPolarHBondContact O-CB 3.48Å; V168-Y202 HydrophobicContact CB-CD1 4.28Å; V168-Y202 HydrophobicContact CB-CD2 3.91Å; V168-Y202 HydrophobicContact CB-CE1 4.02Å; V168-Y202 HydrophobicContact CB-CE2 3.65Å; V168-Y202 HydrophobicContact CB-CG 4.25Å; V168-Y202 WeakPolarHBondContact CB-O 3.48Å; V168-Y202 HydrophobicContact CG1-CD1 4.47Å; V168-Y202 HydrophobicContact CG1-CD2 4.41Å; V168-Y202 HydrophobicContact CG1-CE1 3.73Å; V168-Y202 HydrophobicContact CG1-CE2 3.68Å; V168-Y202 VanDerWaalsContact CG1-OH 3.32Å; V168-Y202 WeakPolarHBondContact CG1-OH 3.2Å; V168-Y202 HydrophobicContact CG2-CD2 4.4Å; V168-Y202 HydrophobicContact CG2-CE2 4.12Å; V168-Y202 PolarHBondContact N-O 3.01Å; V168-Y202 PolarHBondContact O-N 3.47Å; V168-V204 HydrophobicContact CG2-CG2 3.76Å; V168-F226 HydrophobicContact CG1-CZ 4.4Å; V168-F226 HydrophobicContact CG2-CE1 4.48Å; V168-F226 HydrophobicContact CG2-CZ 4.04Å
169	P	87.7	Confident	86.9	Confident	16 Å²	16	35.8 Å²	35.8	10%	0.104	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	138.3	178.7	-24.2	33.9	0	0	0	111.6	A171 M172 Y202 F226 D232	P169-A171 PolarHBondContact O-N 3.31Å; P169-A171 VanDerWaalsContact O-N 3.15Å; P169-M172 VanDerWaalsContact O-CB 3.3Å; P169-M172 WeakPolarHBondContact O-CB 3.5Å; P169-M172 PolarHBondContact O-N 3.34Å; P169-Y202 WeakPolarHBondContact O-CE1 3.37Å; P169-F226 HydrophobicContact CG-CD2 4.4Å; P169-D232 HydrophobicContact CG-CB 3.64Å; P169-D232 WeakPolarHBondContact CG-OD2 3.43Å
170	A	85.1	Confident	87.4	Confident	56 Å²	56	36 Å²	36	46%	0.463	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.2	177.9	0	0	0	0	0	113.3	M172 N200	A170-M172 PolarHBondContact O-N 2.88Å; A170-N200 VanDerWaalsContact CB-C 3.41Å; A170-N200 WeakPolarHBondContact CB-O 3.45Å; A170-N200 PolarHBondContact N-O 2.98Å
171	A	85.6	Confident	87.7	Confident	69 Å²	69	36 Å²	36	57%	0.57	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-27.3	170	0	0	0	0	0	112.2	P169 T173	P169-A171 PolarHBondContact O-N 3.31Å; P169-A171 VanDerWaalsContact O-N 3.15Å; A171-T173 PolarHBondContact O-N 3.45Å
172	M	87.1	Confident	87.7	Confident	16 Å²	16	37.1 Å²	37.1	8%	0.079	22%	0.216	C	C	.	.	S	Bend	trans	-78.7	108.8	176.2	-167.6	178.2	-136.4	0	0	110.2	V168 P169 A170 D176 L177 F180 Y202 F226	V168-M172 HydrophobicContact CG1-CB 4.03Å; V168-M172 HydrophobicContact CG1-CG 4.34Å; V168-M172 HydrophobicContact CG1-SD 3.77Å; P169-M172 VanDerWaalsContact O-CB 3.3Å; P169-M172 WeakPolarHBondContact O-CB 3.5Å; P169-M172 PolarHBondContact O-N 3.34Å; A170-M172 PolarHBondContact O-N 2.88Å; M172-D176 HydrophobicContact CE-CB 4.27Å; M172-D176 HydrophobicContact CG-CB 3.75Å; M172-L177 HydrophobicContact SD-CB 4.4Å; M172-L177 HydrophobicContact SD-CD1 4.41Å; M172-F180 HydrophobicContact CE-CB 3.88Å; M172-F180 HydrophobicContact CE-CG 4.34Å; M172-Y202 WeakPolarHBondContact O-CE1 3.32Å; M172-Y202 PolarHBondContact O-OH 3.36Å; M172-F226 HydrophobicContact CE-CB 3.89Å; M172-F226 HydrophobicContact CE-CD1 3.71Å; M172-F226 HydrophobicContact CE-CG 4.16Å; M172-F226 HydrophobicContact SD-CB 4.26Å; M172-F226 HydrophobicContact SD-CD1 3.59Å; M172-F226 VanDerWaalsContact SD-CD1 3.59Å; M172-F226 HydrophobicContact SD-CE1 4.11Å; M172-F226 HydrophobicContact SD-CG 4.04Å
173	T	87	Confident	87.8	Confident	69 Å²	69	41.3 Å²	41.3	42%	0.423	24%	0.244	S	C	.	.			trans	-69.8	162.9	177.2	71.3	0	0	0	0	111.5	A171 H175 D176 L177	A171-T173 PolarHBondContact O-N 3.45Å; T173-H175 PolarHBondContact O-N 3.45Å; T173-D176 PolarHBondContact N-OD2 2.86Å; T173-D176 PolarHBondContact O-N 3.31Å; T173-D176 VanDerWaalsContact OG1-CG 3.28Å; T173-D176 PolarHBondContact OG1-N 2.96Å; T173-D176 PolarHBondContact OG1-OD2 3.14Å; T173-L177 PolarHBondContact O-N 2.91Å
174	S	84	Confident	87.8	Confident	46 Å²	46	43 Å²	43	32%	0.322	25%	0.252	S	S	.	.	H	α-helix	trans	-55.5	-34.6	173.8	53.9	0	0	0	0	112.3	M178	S174-M178 VanDerWaalsContact O-CG 3.28Å; S174-M178 WeakPolarHBondContact O-CG 3.3Å; S174-M178 PolarHBondContact O-N 3.3Å
175	H	85.9	Confident	87.6	Confident	136 Å²	136	45.7 Å²	45.7	63%	0.63	27%	0.266	S	S	*	.	H	α-helix	trans	-66.5	-39.3	174.7	-69.2	-69.6	0	0	0	112.8	T173 M178 K179	T173-H175 PolarHBondContact O-N 3.45Å; H175-M178 PolarHBondContact O-N 3.02Å; H175-K179 WeakPolarHBondContact O-CG 3.18Å; H175-K179 PolarHBondContact O-N 3.33Å
176	D	89.1	Confident	87.5	Confident	56 Å²	56	55.3 Å²	55.3	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-71.6	-37.5	179.1	-58.7	-44.4	0	0	0	111	M172 T173 K179 F180	M172-D176 HydrophobicContact CE-CB 4.27Å; M172-D176 HydrophobicContact CG-CB 3.75Å; T173-D176 PolarHBondContact N-OD2 2.86Å; T173-D176 PolarHBondContact O-N 3.31Å; T173-D176 VanDerWaalsContact OG1-CG 3.28Å; T173-D176 PolarHBondContact OG1-N 2.96Å; T173-D176 PolarHBondContact OG1-OD2 3.14Å; D176-K179 WeakPolarHBondContact O-CB 3.37Å; D176-K179 PolarHBondContact O-N 3.11Å; D176-K179 IonicContact OD1-NZ 2.69Å; D176-K179 PolarHBondContact OD1-NZ 3.39Å; D176-F180 PolarHBondContact O-N 2.92Å
177	L	89.1	Confident	87.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.1	-46.5	169.8	-179.4	67.9	0	0	0	111.3	I165 M172 T173 K179 F180 V181 M191 I193 Y202 V204	I165-L177 HydrophobicContact CD1-CD1 4.16Å; M172-L177 HydrophobicContact SD-CB 4.4Å; M172-L177 HydrophobicContact SD-CD1 4.41Å; T173-L177 PolarHBondContact O-N 2.91Å; L177-K179 VanDerWaalsContact C-N 3.28Å; L177-K179 PolarHBondContact O-N 3.16Å; L177-F180 WeakPolarHBondContact O-CB 3.34Å; L177-F180 PolarHBondContact O-N 2.92Å; L177-V181 WeakPolarHBondContact O-CG2 3.27Å; L177-V181 PolarHBondContact O-N 2.77Å; L177-M191 HydrophobicContact CD2-CE 4.41Å; L177-M191 HydrophobicContact CD2-SD 3.94Å; L177-I193 HydrophobicContact CD2-CD1 4.49Å; L177-Y202 HydrophobicContact CD2-CE2 4.2Å; L177-V204 HydrophobicContact CD1-CG2 4.46Å; L177-V204 HydrophobicContact CD2-CG1 4.1Å; L177-V204 HydrophobicContact CD2-CG2 3.7Å
178	M	88	Confident	87.9	Confident	65 Å²	65	56.3 Å²	56.3	32%	0.32	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-31.2	177.4	-72.7	-55.6	-61.2	0	0	113.2	M77 S174 H175 V181 A182 N185 M191	M77-M178 HydrophobicContact CE-CG 3.96Å; M77-M178 HydrophobicContact CE-SD 3.63Å; S174-M178 VanDerWaalsContact O-CG 3.28Å; S174-M178 WeakPolarHBondContact O-CG 3.3Å; S174-M178 PolarHBondContact O-N 3.3Å; H175-M178 PolarHBondContact O-N 3.02Å; M178-V181 HydrophobicContact CE-CG2 4.46Å; M178-V181 HydrophobicContact SD-CG2 4.12Å; M178-A182 WeakPolarHBondContact O-CA 3.23Å; M178-A182 WeakPolarHBondContact O-CB 3.29Å; M178-A182 PolarHBondContact O-N 3.08Å; M178-A182 VanDerWaalsContact O-N 3.1Å; M178-N185 WeakPolarHBondContact CE-OD1 3.24Å; M178-M191 HydrophobicContact SD-SD 4.11Å
179	K	88.3	Confident	87.8	Confident	142 Å²	142	60.8 Å²	60.8	62%	0.617	34%	0.338	S	S	*	.	H	α-helix	trans	-69.2	-39.7	170.6	-69.2	170.5	-162.2	154.5	0	111.6	H175 D176 L177 A182	H175-K179 WeakPolarHBondContact O-CG 3.18Å; H175-K179 PolarHBondContact O-N 3.33Å; D176-K179 WeakPolarHBondContact O-CB 3.37Å; D176-K179 PolarHBondContact O-N 3.11Å; D176-K179 IonicContact OD1-NZ 2.69Å; D176-K179 PolarHBondContact OD1-NZ 3.39Å; L177-K179 VanDerWaalsContact C-N 3.28Å; L177-K179 PolarHBondContact O-N 3.16Å; K179-A182 WeakPolarHBondContact O-CB 3.44Å; K179-A182 PolarHBondContact O-N 3.47Å
180	F	89.6	Confident	87.7	Confident	18 Å²	18	62.4 Å²	62.4	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-44	178.6	179.4	-95	0	0	0	111.7	M172 D176 L177 A182 C221 F226 C234	M172-F180 HydrophobicContact CE-CB 3.88Å; M172-F180 HydrophobicContact CE-CG 4.34Å; D176-F180 PolarHBondContact O-N 2.92Å; L177-F180 WeakPolarHBondContact O-CB 3.34Å; L177-F180 PolarHBondContact O-N 2.92Å; F180-A182 VanDerWaalsContact C-N 3.3Å; F180-A182 PolarHBondContact O-N 3.15Å; F180-C221 HydrophobicContact CE1-CB 4.22Å; F180-C221 HydrophobicContact CZ-CB 4.24Å; F180-F226 HydrophobicContact CD1-CD1 4.35Å; F180-F226 HydrophobicContact CD1-CE1 4.37Å; F180-F226 HydrophobicContact CD2-CD1 4.13Å; F180-F226 HydrophobicContact CE1-CD1 4.3Å; F180-F226 HydrophobicContact CE1-CE1 4.16Å; F180-F226 HydrophobicContact CE2-CD1 4.07Å; F180-F226 HydrophobicContact CG-CD1 4.27Å; F180-F226 HydrophobicContact CZ-CD1 4.17Å; F180-F226 HydrophobicContact CZ-CE1 4.31Å; F180-C234 HydrophobicContact CE1-CB 4.15Å; F180-C234 HydrophobicContact CZ-CB 3.75Å
181	V	90.3	Very high	87.8	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.323	C	S	.	.	S	Bend	trans	-83.8	-1.4	178	-57.8	0	0	0	0	114.2	L177 M178 P183 F184 N185 I188 M191 I206 F217	L177-V181 WeakPolarHBondContact O-CG2 3.27Å; L177-V181 PolarHBondContact O-N 2.77Å; M178-V181 HydrophobicContact CE-CG2 4.46Å; M178-V181 HydrophobicContact SD-CG2 4.12Å; V181-P183 VanDerWaalsContact C-N 3.32Å; V181-P183 WeakPolarHBondContact O-CD 3.43Å; V181-P183 VanDerWaalsContact O-N 3.08Å; V181-F184 PolarHBondContact O-N 3.25Å; V181-N185 PolarHBondContact O-OD1 3.28Å; V181-I188 HydrophobicContact CB-CD1 4.23Å; V181-I188 HydrophobicContact CG2-CD1 4.27Å; V181-M191 HydrophobicContact CB-CE 4.43Å; V181-M191 HydrophobicContact CG1-CE 4.01Å; V181-M191 HydrophobicContact CG2-CE 3.87Å; V181-I206 HydrophobicContact CG1-CD1 4.27Å; V181-F217 HydrophobicContact CB-CE2 4.29Å; V181-F217 HydrophobicContact CG1-CE2 3.95Å; V181-F217 HydrophobicContact CG1-CZ 3.9Å
182	A	88	Confident	87.9	Confident	47 Å²	47	57.1 Å²	57.1	39%	0.388	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-47.7	-40.8	-172.5	0	0	0	0	0	116	M178 K179 F180 F184 N185	M178-A182 WeakPolarHBondContact O-CA 3.23Å; M178-A182 WeakPolarHBondContact O-CB 3.29Å; M178-A182 PolarHBondContact O-N 3.08Å; M178-A182 VanDerWaalsContact O-N 3.1Å; K179-A182 WeakPolarHBondContact O-CB 3.44Å; K179-A182 PolarHBondContact O-N 3.47Å; F180-A182 VanDerWaalsContact C-N 3.3Å; F180-A182 PolarHBondContact O-N 3.15Å; A182-F184 PolarHBondContact O-N 3.32Å; A182-N185 PolarHBondContact O-N 3.13Å
183	P	89.5	Confident	87.9	Confident	101 Å²	101	56.8 Å²	56.8	66%	0.656	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-61	-17.4	179.5	-23	34.6	0	0	0	114.7	V181	V181-P183 VanDerWaalsContact C-N 3.32Å; V181-P183 WeakPolarHBondContact O-CD 3.43Å; V181-P183 VanDerWaalsContact O-N 3.08Å
184	F	90	Very high	87.9	Confident	37 Å²	37	53.6 Å²	53.6	16%	0.162	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-117.2	8.7	-175.7	-61.8	-90.3	0	0	0	112.9	V181 A182 E186 V187 I188 F208 F217 A220	V181-F184 PolarHBondContact O-N 3.25Å; A182-F184 PolarHBondContact O-N 3.32Å; F184-E186 PolarHBondContact O-N 3.08Å; F184-E186 VanDerWaalsContact O-N 3.15Å; F184-V187 HydrophobicContact CB-CG2 3.89Å; F184-V187 HydrophobicContact CD1-CG2 4.15Å; F184-V187 WeakPolarHBondContact O-CG2 3.42Å; F184-V187 PolarHBondContact O-N 3.03Å; F184-V187 VanDerWaalsContact O-N 3.08Å; F184-I188 HydrophobicContact CB-CD1 4.4Å; F184-I188 VanDerWaalsContact O-CG1 3.3Å; F184-I188 WeakPolarHBondContact O-CG1 3.34Å; F184-I188 PolarHBondContact O-N 3.08Å; F184-F208 HydrophobicContact CB-CE1 4.28Å; F184-F217 HydrophobicContact CB-CD2 4.06Å; F184-F217 HydrophobicContact CD1-CB 4.25Å; F184-F217 HydrophobicContact CD1-CD2 4.3Å; F184-F217 AromaticContact CD2-CD2 3.48Å; F184-F217 HydrophobicContact CD2-CD2 3.48Å; F184-F217 VanDerWaalsContact CD2-CD2 3.48Å; F184-F217 HydrophobicContact CD2-CE2 4.1Å; F184-F217 HydrophobicContact CE1-CB 4.23Å; F184-F217 AromaticContact CE2-CD2 3.9Å; F184-F217 HydrophobicContact CE2-CD2 3.9Å; F184-F217 HydrophobicContact CG-CB 4.48Å; F184-F217 AromaticContact CG-CD2 3.69Å; F184-F217 HydrophobicContact CG-CD2 3.69Å; F184-F217 HydrophobicContact CZ-CB 4.44Å; F184-F217 HydrophobicContact CZ-CD2 4.47Å; F184-A220 HydrophobicContact CE2-CB 4.17Å; F184-A220 HydrophobicContact CZ-CB 3.94Å
185	N	86.8	Confident	87.9	Confident	56 Å²	56	55.8 Å²	55.8	30%	0.299	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-57.6	-32.1	-176.8	-80.6	-10.2	0	0	0	113.9	M178 V181 A182 V187	M178-N185 WeakPolarHBondContact CE-OD1 3.24Å; V181-N185 PolarHBondContact O-OD1 3.28Å; A182-N185 PolarHBondContact O-N 3.13Å; N185-V187 VanDerWaalsContact C-N 3.3Å; N185-V187 PolarHBondContact O-N 2.67Å
186	E	87.6	Confident	87.6	Confident	201 Å²	201	50.6 Å²	50.6	94%	0.939	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-70.7	-25.5	-179.6	-63.5	-172	171.4	0	0	113.3	F184	F184-E186 PolarHBondContact O-N 3.08Å; F184-E186 VanDerWaalsContact O-N 3.15Å
187	V	90.1	Very high	86.9	Confident	38 Å²	38	51.3 Å²	51.3	23%	0.23	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-100.5	-1.9	-177.9	-64.3	0	0	0	0	113	F184 N185 F208 S209 D213	F184-V187 HydrophobicContact CB-CG2 3.89Å; F184-V187 HydrophobicContact CD1-CG2 4.15Å; F184-V187 WeakPolarHBondContact O-CG2 3.42Å; F184-V187 PolarHBondContact O-N 3.03Å; F184-V187 VanDerWaalsContact O-N 3.08Å; N185-V187 VanDerWaalsContact C-N 3.3Å; N185-V187 PolarHBondContact O-N 2.67Å; V187-F208 HydrophobicContact CG2-CD1 3.97Å; V187-F208 HydrophobicContact CG2-CE1 4.32Å; V187-F208 WeakPolarHBondContact O-CA 3.47Å; V187-S209 PolarHBondContact O-N 2.69Å; V187-S209 PolarHBondContact O-OG 3.48Å; V187-D213 HydrophobicContact CB-CB 4.04Å; V187-D213 HydrophobicContact CG1-CB 4.48Å; V187-D213 HydrophobicContact CG2-CB 4.08Å
188	I	88.8	Confident	86.1	Confident	14 Å²	14	52.2 Å²	52.2	7%	0.072	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	115.4	177.2	-67.3	166.9	0	0	0	109.6	S79 V181 F184 I206 F208	S79-I188 PolarHBondContact OG-O 3.39Å; S79-I188 VanDerWaalsContact OG-O 3.08Å; V181-I188 HydrophobicContact CB-CD1 4.23Å; V181-I188 HydrophobicContact CG2-CD1 4.27Å; F184-I188 HydrophobicContact CB-CD1 4.4Å; F184-I188 VanDerWaalsContact O-CG1 3.3Å; F184-I188 WeakPolarHBondContact O-CG1 3.34Å; F184-I188 PolarHBondContact O-N 3.08Å; I188-I206 HydrophobicContact CB-CG2 4.43Å; I188-I206 HydrophobicContact CD1-CG2 4Å; I188-I206 HydrophobicContact CG1-CG2 3.76Å; I188-I206 HydrophobicContact CG2-CG2 3.85Å; I188-F208 HydrophobicContact CD1-CE1 4.32Å; I188-F208 HydrophobicContact CG1-CD1 4.02Å; I188-F208 HydrophobicContact CG1-CE1 3.64Å; I188-F208 HydrophobicContact CG1-CZ 4.27Å
189	E	86.9	Confident	85.3	Confident	94 Å²	94	53.3 Å²	53.3	44%	0.439	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-41.3	175.7	-65.4	-171.9	164.1	0	0	112	K207	E189-K207 PolarHBondContact N-O 2.88Å; E189-K207 WeakPolarHBondContact OE2-CD 3.39Å; E189-K207 WeakPolarHBondContact OE2-CE 3.37Å; E189-K207 IonicContact OE2-NZ 3.41Å; E189-K207 PolarHBondContact OE2-NZ 2.88Å
190	Q	85.4	Confident	85	Confident	50 Å²	50	53.2 Å²	53.2	23%	0.234	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	138.4	-173.4	-171.3	175.9	19.6	0	0	110.8	T76 K192 K207	T76-Q190 HydrophobicContact CG2-CG 4.38Å; Q190-K192 VanDerWaalsContact NE2-CE 3.35Å; Q190-K207 HydrophobicContact CB-CB 4.19Å; Q190-K207 PolarHBondContact N-O 3.41Å; Q190-K207 PolarHBondContact O-N 3.05Å
191	M	87.8	Confident	84.8	Confident	5 Å²	5	54 Å²	54	3%	0.025	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.1	171.2	-178.2	179.5	-90.4	0	0	109.8	M77 L177 M178 V181 V204 L205 I206	M77-M191 HydrophobicContact CB-CB 4.37Å; M77-M191 HydrophobicContact CE-CG 4.32Å; M77-M191 HydrophobicContact CE-SD 3.42Å; M77-M191 WeakPolarHBondContact CE-SD 3.49Å; M77-M191 PolarHBondContact N-O 2.87Å; M77-M191 PolarHBondContact O-N 3.25Å; M77-M191 VanDerWaalsContact O-O 3.04Å; L177-M191 HydrophobicContact CD2-CE 4.41Å; L177-M191 HydrophobicContact CD2-SD 3.94Å; M178-M191 HydrophobicContact SD-SD 4.11Å; V181-M191 HydrophobicContact CB-CE 4.43Å; V181-M191 HydrophobicContact CG1-CE 4.01Å; V181-M191 HydrophobicContact CG2-CE 3.87Å; M191-V204 HydrophobicContact CE-CG1 3.94Å; M191-V204 HydrophobicContact CG-CG1 3.56Å; M191-V204 HydrophobicContact SD-CG1 3.9Å; M191-L205 CarbonylContact C-O 3.58Å; M191-L205 VanDerWaalsContact CA-O 3.28Å; M191-L205 WeakPolarHBondContact CA-O 3.5Å; M191-I206 HydrophobicContact CE-CD1 3.52Å; M191-I206 HydrophobicContact CE-CG1 3.72Å; M191-I206 HydrophobicContact CG-CG1 4.37Å
192	K	86.5	Confident	84.8	Confident	9 Å²	9	54.9 Å²	54.9	4%	0.039	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.7	175.8	-75.1	-179.4	175.3	-79.6	0	110.1	A20 G21 F22 I74 E75 T76 Q190 V204 L205	A20-K192 PolarHBondContact O-NZ 2.83Å; G21-K192 WeakPolarHBondContact O-CE 3.08Å; F22-K192 HydrophobicContact CD2-CD 4.37Å; I74-K192 HydrophobicContact CG2-CD 4.32Å; E75-K192 CarbonylContact O-C 3.53Å; E75-K192 WeakPolarHBondContact O-CA 3.44Å; T76-K192 HydrophobicContact CG2-CG 4.12Å; T76-K192 PolarHBondContact OG1-NZ 3.47Å; Q190-K192 VanDerWaalsContact NE2-CE 3.35Å; K192-V204 CarbonylContact O-C 3.49Å; K192-V204 WeakPolarHBondContact O-CA 3.45Å; K192-L205 HydrophobicContact CB-CB 4.28Å; K192-L205 PolarHBondContact N-O 3.5Å; K192-L205 PolarHBondContact O-N 3.19Å
193	I	88	Confident	84.8	Confident	9 Å²	9	53 Å²	53	5%	0.046	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	129.5	172.4	-64.9	171.4	0	0	0	108.1	I74 E75 M77 L177 R195 Y202 M203 V204	I74-I193 CarbonylContact C-O 3.56Å; I74-I193 WeakPolarHBondContact CA-O 3.3Å; E75-I193 HydrophobicContact CB-CB 4.25Å; E75-I193 PolarHBondContact N-O 2.94Å; E75-I193 PolarHBondContact O-N 3.44Å; M77-I193 HydrophobicContact CE-CD1 4.2Å; M77-I193 HydrophobicContact SD-CD1 4.21Å; L177-I193 HydrophobicContact CD2-CD1 4.49Å; I193-R195 HydrophobicContact CG2-CG 4.41Å; I193-Y202 HydrophobicContact CG1-CE2 4.42Å; I193-Y202 HydrophobicContact CG2-CD2 3.6Å; I193-Y202 HydrophobicContact CG2-CE2 4.15Å; I193-Y202 HydrophobicContact CG2-CG 4.14Å; I193-M203 CarbonylContact C-O 3.54Å; I193-M203 WeakPolarHBondContact CA-O 3.41Å; I193-V204 HydrophobicContact CG1-CG2 4.39Å
194	I	86	Confident	84.8	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.5	178.7	-53.9	169.3	0	0	0	108.3	F22 V72 M142 M203 L205	F22-I194 HydrophobicContact CE2-CD1 3.79Å; F22-I194 HydrophobicContact CE2-CG1 4.49Å; F22-I194 HydrophobicContact CZ-CD1 4.23Å; V72-I194 HydrophobicContact CG1-CG2 3.7Å; M142-I194 HydrophobicContact SD-CG2 3.76Å; I194-M203 HydrophobicContact CB-CB 4.31Å; I194-M203 HydrophobicContact CB-CE 4.19Å; I194-M203 HydrophobicContact CD1-CE 4.1Å; I194-M203 HydrophobicContact CG2-CE 4.1Å; I194-M203 PolarHBondContact N-O 3.46Å; I194-M203 PolarHBondContact O-N 3.29Å; I194-L205 HydrophobicContact CD1-CD1 3.59Å; I194-L205 HydrophobicContact CD1-CG 3.87Å
195	R	84.2	Confident	84.8	Confident	93 Å²	93	46.7 Å²	46.7	35%	0.351	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.6	172.2	-65.3	178	-77.8	-143.8	-14.5	108.8	V72 I73 E75 I193	V72-R195 CarbonylContact C-O 3.56Å; V72-R195 WeakPolarHBondContact CA-O 3.21Å; I73-R195 HydrophobicContact CB-CB 4.21Å; I73-R195 PolarHBondContact N-O 2.96Å; I73-R195 PolarHBondContact O-N 2.96Å; E75-R195 IonicContact OE2-CZ 3.86Å; E75-R195 IonicContact OE2-NH2 3.8Å; E75-R195 PolarHBondContact OE2-NH2 3.34Å; I193-R195 HydrophobicContact CG2-CG 4.41Å
196	D	80.1	Confident	85	Confident	27 Å²	27	44 Å²	44	14%	0.144	23%	0.226	C	C	.	.			trans	-104.7	-163.9	173.5	76.2	-10.7	0	0	0	110.7	M142 T198 K263	M142-D196 HydrophobicContact CE-CB 3.75Å; M142-D196 WeakPolarHBondContact CE-OD2 3.3Å; D196-T198 PolarHBondContact O-N 2.92Å; D196-T198 VanDerWaalsContact OD1-CB 3.28Å; D196-T198 WeakPolarHBondContact OD1-CB 3.46Å; D196-T198 WeakPolarHBondContact OD1-CG2 3.44Å; D196-T198 PolarHBondContact OD1-N 3.47Å; D196-T198 PolarHBondContact OD1-OG1 2.83Å; D196-K263 IonicContact OD2-NZ 3.84Å
197	S	73.8	Confident	85.1	Confident	71 Å²	71	37.4 Å²	37.4	50%	0.497	20%	0.195	S	C	.	.	S	Bend	trans	-71	-2.4	177.2	52.9	0	0	0	0	114.6	P199	S197-P199 VanDerWaalsContact O-CD 3.32Å; S197-P199 WeakPolarHBondContact O-CD 3.41Å
198	T	73.3	Confident	85.1	Confident	18 Å²	18	35.7 Å²	35.7	11%	0.11	18%	0.184	C	C	.	.			trans	-77.1	116.3	176.8	62	0	0	0	0	110.5	D196 Q201	D196-T198 PolarHBondContact O-N 2.92Å; D196-T198 VanDerWaalsContact OD1-CB 3.28Å; D196-T198 WeakPolarHBondContact OD1-CB 3.46Å; D196-T198 WeakPolarHBondContact OD1-CG2 3.44Å; D196-T198 PolarHBondContact OD1-N 3.47Å; D196-T198 PolarHBondContact OD1-OG1 2.83Å; T198-Q201 VanDerWaalsContact CB-NE2 3.3Å; T198-Q201 VanDerWaalsContact OG1-CG 3.26Å; T198-Q201 WeakPolarHBondContact OG1-CG 3.5Å; T198-Q201 PolarHBondContact OG1-NE2 3.21Å
199	P	71.3	Confident	85.1	Confident	89 Å²	89	38 Å²	38	58%	0.578	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	151.5	179.6	30.1	-34	0	0	0	110.1	S197 Q201	S197-P199 VanDerWaalsContact O-CD 3.32Å; S197-P199 WeakPolarHBondContact O-CD 3.41Å; P199-Q201 VanDerWaalsContact C-N 3.26Å; P199-Q201 PolarHBondContact O-N 3.33Å
200	N	81.1	Confident	85.2	Confident	139 Å²	139	35.5 Å²	35.5	74%	0.743	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	11.8	173.3	-52.1	-35	0	0	0	117	A170	A170-N200 VanDerWaalsContact CB-C 3.41Å; A170-N200 WeakPolarHBondContact CB-O 3.45Å; A170-N200 PolarHBondContact N-O 2.98Å
201	Q	86.4	Confident	85.3	Confident	35 Å²	35	35.2 Å²	35.2	16%	0.164	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	162.7	172.4	65.9	-173.5	-2.1	0	0	112.3	V168 T198 P199	V168-Q201 CarbonylContact O-C 3.53Å; V168-Q201 WeakPolarHBondContact O-CA 3.37Å; V168-Q201 WeakPolarHBondContact O-CB 3.48Å; T198-Q201 VanDerWaalsContact CB-NE2 3.3Å; T198-Q201 VanDerWaalsContact OG1-CG 3.26Å; T198-Q201 WeakPolarHBondContact OG1-CG 3.5Å; T198-Q201 PolarHBondContact OG1-NE2 3.21Å; P199-Q201 VanDerWaalsContact C-N 3.26Å; P199-Q201 PolarHBondContact O-N 3.33Å
202	Y	88.7	Confident	85.3	Confident	19 Å²	19	37.9 Å²	37.9	8%	0.075	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	160.5	172.7	62.4	-90.3	0	0	0	110.8	V168 P169 M172 L177 I193 V204	V168-Y202 HydrophobicContact CB-CD1 4.28Å; V168-Y202 HydrophobicContact CB-CD2 3.91Å; V168-Y202 HydrophobicContact CB-CE1 4.02Å; V168-Y202 HydrophobicContact CB-CE2 3.65Å; V168-Y202 HydrophobicContact CB-CG 4.25Å; V168-Y202 WeakPolarHBondContact CB-O 3.48Å; V168-Y202 HydrophobicContact CG1-CD1 4.47Å; V168-Y202 HydrophobicContact CG1-CD2 4.41Å; V168-Y202 HydrophobicContact CG1-CE1 3.73Å; V168-Y202 HydrophobicContact CG1-CE2 3.68Å; V168-Y202 VanDerWaalsContact CG1-OH 3.32Å; V168-Y202 WeakPolarHBondContact CG1-OH 3.2Å; V168-Y202 HydrophobicContact CG2-CD2 4.4Å; V168-Y202 HydrophobicContact CG2-CE2 4.12Å; V168-Y202 PolarHBondContact N-O 3.01Å; V168-Y202 PolarHBondContact O-N 3.47Å; P169-Y202 WeakPolarHBondContact O-CE1 3.37Å; M172-Y202 WeakPolarHBondContact O-CE1 3.32Å; M172-Y202 PolarHBondContact O-OH 3.36Å; L177-Y202 HydrophobicContact CD2-CE2 4.2Å; I193-Y202 HydrophobicContact CG1-CE2 4.42Å; I193-Y202 HydrophobicContact CG2-CD2 3.6Å; I193-Y202 HydrophobicContact CG2-CE2 4.15Å; I193-Y202 HydrophobicContact CG2-CG 4.14Å; Y202-V204 HydrophobicContact CD2-CG2 3.73Å; Y202-V204 HydrophobicContact CE2-CG2 3.52Å
203	M	88.6	Confident	85.5	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.039	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	156.6	175.4	-56.3	-169.4	-47.7	0	0	110.7	M142 L144 I165 L166 I193 I194	M142-M203 HydrophobicContact CE-CE 3.19Å; M142-M203 HydrophobicContact CE-SD 3.95Å; M142-M203 HydrophobicContact SD-CE 3.23Å; M142-M203 WeakPolarHBondContact SD-CE 3.44Å; L144-M203 HydrophobicContact CD1-CE 4.28Å; L144-M203 HydrophobicContact CD1-SD 4.47Å; L144-M203 HydrophobicContact CD2-SD 4.17Å; I165-M203 WeakPolarHBondContact O-CA 3.38Å; L166-M203 WeakPolarHBondContact O-CG 3.49Å; I193-M203 CarbonylContact C-O 3.54Å; I193-M203 WeakPolarHBondContact CA-O 3.41Å; I194-M203 HydrophobicContact CB-CB 4.31Å; I194-M203 HydrophobicContact CB-CE 4.19Å; I194-M203 HydrophobicContact CD1-CE 4.1Å; I194-M203 HydrophobicContact CG2-CE 4.1Å; I194-M203 PolarHBondContact N-O 3.46Å; I194-M203 PolarHBondContact O-N 3.29Å
204	V	89.9	Confident	85.6	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	118.2	178.7	-173.5	0	0	0	0	110	C164 I165 V168 L177 M191 K192 I193 Y202 I206	C164-V204 CarbonylContact C-O 3.44Å; C164-V204 WeakPolarHBondContact CA-O 3.39Å; I165-V204 HydrophobicContact CB-CB 4.15Å; I165-V204 HydrophobicContact CD1-CB 4.07Å; I165-V204 HydrophobicContact CD1-CG2 4.48Å; I165-V204 HydrophobicContact CG1-CB 4.28Å; I165-V204 PolarHBondContact N-O 3.16Å; I165-V204 PolarHBondContact O-N 2.91Å; I165-V204 VanDerWaalsContact O-N 3.09Å; V168-V204 HydrophobicContact CG2-CG2 3.76Å; L177-V204 HydrophobicContact CD1-CG2 4.46Å; L177-V204 HydrophobicContact CD2-CG1 4.1Å; L177-V204 HydrophobicContact CD2-CG2 3.7Å; M191-V204 HydrophobicContact CE-CG1 3.94Å; M191-V204 HydrophobicContact CG-CG1 3.56Å; M191-V204 HydrophobicContact SD-CG1 3.9Å; K192-V204 CarbonylContact O-C 3.49Å; K192-V204 WeakPolarHBondContact O-CA 3.45Å; I193-V204 HydrophobicContact CG1-CG2 4.39Å; Y202-V204 HydrophobicContact CD2-CG2 3.73Å; Y202-V204 HydrophobicContact CE2-CG2 3.52Å; V204-I206 HydrophobicContact CG1-CD1 4.26Å; V204-I206 HydrophobicContact CG1-CG1 3.82Å
205	L	89.9	Confident	85.7	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.6	167.7	-67.6	174.9	0	0	0	110.2	I8 F22 M162 C164 M191 K192 I194 V239	I8-L205 HydrophobicContact CD1-CD1 4.33Å; I8-L205 HydrophobicContact CD1-CD2 3.41Å; I8-L205 VanDerWaalsContact CD1-CD2 3.41Å; I8-L205 HydrophobicContact CD1-CG 4.34Å; F22-L205 HydrophobicContact CE2-CD1 3.85Å; F22-L205 HydrophobicContact CZ-CD1 4.06Å; M162-L205 HydrophobicContact SD-CD2 4.49Å; C164-L205 HydrophobicContact CB-CD2 3.62Å; M191-L205 CarbonylContact C-O 3.58Å; M191-L205 VanDerWaalsContact CA-O 3.28Å; M191-L205 WeakPolarHBondContact CA-O 3.5Å; K192-L205 HydrophobicContact CB-CB 4.28Å; K192-L205 PolarHBondContact N-O 3.5Å; K192-L205 PolarHBondContact O-N 3.19Å; I194-L205 HydrophobicContact CD1-CD1 3.59Å; I194-L205 HydrophobicContact CD1-CG 3.87Å; L205-V239 HydrophobicContact CD2-CG2 3.9Å
206	I	91.1	Very high	86	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	121.3	179.8	-48.9	178.7	0	0	0	108.1	M162 L163 I165 V181 I188 M191 V204 F208 F217	M162-I206 WeakPolarHBondContact CA-O 3.38Å; L163-I206 PolarHBondContact N-O 2.92Å; L163-I206 PolarHBondContact O-N 2.97Å; I165-I206 HydrophobicContact CD1-CD1 4.06Å; I165-I206 HydrophobicContact CG1-CD1 4.46Å; V181-I206 HydrophobicContact CG1-CD1 4.27Å; I188-I206 HydrophobicContact CB-CG2 4.43Å; I188-I206 HydrophobicContact CD1-CG2 4Å; I188-I206 HydrophobicContact CG1-CG2 3.76Å; I188-I206 HydrophobicContact CG2-CG2 3.85Å; M191-I206 HydrophobicContact CE-CD1 3.52Å; M191-I206 HydrophobicContact CE-CG1 3.72Å; M191-I206 HydrophobicContact CG-CG1 4.37Å; V204-I206 HydrophobicContact CG1-CD1 4.26Å; V204-I206 HydrophobicContact CG1-CG1 3.82Å; I206-F208 HydrophobicContact CB-CE2 3.92Å; I206-F208 HydrophobicContact CB-CZ 4.28Å; I206-F208 HydrophobicContact CG2-CD2 4.18Å; I206-F208 HydrophobicContact CG2-CE1 4.21Å; I206-F208 HydrophobicContact CG2-CE2 3.55Å; I206-F208 HydrophobicContact CG2-CZ 3.57Å; I206-F217 HydrophobicContact CD1-CE1 4.14Å; I206-F217 HydrophobicContact CD1-CZ 3.98Å
207	K	89.8	Confident	86.5	Confident	62 Å²	62	37.6 Å²	37.6	27%	0.27	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	124.7	172.8	-167	-171.2	177.9	-145.9	0	109.3	F24 M162 E189 Q190	F24-K207 HydrophobicContact CD2-CD 4.46Å; F24-K207 HydrophobicContact CE2-CG 4.33Å; M162-K207 HydrophobicContact CE-CB 3.76Å; M162-K207 HydrophobicContact CE-CD 4.32Å; M162-K207 HydrophobicContact CE-CG 4Å; E189-K207 PolarHBondContact N-O 2.88Å; E189-K207 WeakPolarHBondContact OE2-CD 3.39Å; E189-K207 WeakPolarHBondContact OE2-CE 3.37Å; E189-K207 IonicContact OE2-NZ 3.41Å; E189-K207 PolarHBondContact OE2-NZ 2.88Å; Q190-K207 HydrophobicContact CB-CB 4.19Å; Q190-K207 PolarHBondContact N-O 3.41Å; Q190-K207 PolarHBondContact O-N 3.05Å
208	F	90.3	Very high	87.3	Confident	1 Å²	1	35.6 Å²	35.6	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	158.4	176.9	-64.6	-90	0	0	0	111.5	A161 L163 F184 V187 I188 I206 A210 D213 A214 F217	A161-F208 WeakPolarHBondContact O-CB 3.28Å; A161-F208 PolarHBondContact O-N 2.9Å; L163-F208 HydrophobicContact CB-CE2 4.32Å; L163-F208 HydrophobicContact CD1-CE2 3.93Å; L163-F208 HydrophobicContact CG-CE2 4.23Å; F184-F208 HydrophobicContact CB-CE1 4.28Å; V187-F208 HydrophobicContact CG2-CD1 3.97Å; V187-F208 HydrophobicContact CG2-CE1 4.32Å; V187-F208 WeakPolarHBondContact O-CA 3.47Å; I188-F208 HydrophobicContact CD1-CE1 4.32Å; I188-F208 HydrophobicContact CG1-CD1 4.02Å; I188-F208 HydrophobicContact CG1-CE1 3.64Å; I188-F208 HydrophobicContact CG1-CZ 4.27Å; I206-F208 HydrophobicContact CB-CE2 3.92Å; I206-F208 HydrophobicContact CB-CZ 4.28Å; I206-F208 HydrophobicContact CG2-CD2 4.18Å; I206-F208 HydrophobicContact CG2-CE1 4.21Å; I206-F208 HydrophobicContact CG2-CE2 3.55Å; I206-F208 HydrophobicContact CG2-CZ 3.57Å; F208-A210 VanDerWaalsContact C-N 3.33Å; F208-A210 PolarHBondContact O-N 3.1Å; F208-D213 HydrophobicContact CB-CB 4.09Å; F208-D213 HydrophobicContact CD1-CB 4.12Å; F208-D213 HydrophobicContact CG-CB 4.4Å; F208-A214 HydrophobicContact CB-CB 4.29Å; F208-A214 HydrophobicContact CD2-CB 3.71Å; F208-A214 HydrophobicContact CE2-CB 4.35Å; F208-A214 HydrophobicContact CG-CB 4.12Å; F208-F217 HydrophobicContact CE1-CB 3.98Å; F208-F217 HydrophobicContact CE1-CD2 4.21Å; F208-F217 HydrophobicContact CE1-CG 4.06Å; F208-F217 HydrophobicContact CE2-CB 4.38Å; F208-F217 HydrophobicContact CE2-CD1 4.2Å; F208-F217 HydrophobicContact CE2-CG 4.3Å; F208-F217 HydrophobicContact CZ-CB 3.67Å; F208-F217 AromaticContact CZ-CD1 3.7Å; F208-F217 HydrophobicContact CZ-CD1 3.7Å; F208-F217 AromaticContact CZ-CD2 3.85Å; F208-F217 HydrophobicContact CZ-CD2 3.85Å; F208-F217 HydrophobicContact CZ-CE1 4.24Å; F208-F217 HydrophobicContact CZ-CE2 4.42Å; F208-F217 AromaticContact CZ-CG 3.46Å; F208-F217 HydrophobicContact CZ-CG 3.46Å; F208-F217 VanDerWaalsContact CZ-CG 3.46Å
209	S	88.7	Confident	88	Confident	63 Å²	63	40.9 Å²	40.9	44%	0.441	24%	0.236	S	C	.	.	S	Bend	trans	-61.6	-38.4	175.2	38.1	0	0	0	0	113.3	V187 D213	V187-S209 PolarHBondContact O-N 2.69Å; V187-S209 PolarHBondContact O-OG 3.48Å; S209-D213 PolarHBondContact OG-OD2 3.35Å
210	A	87.6	Confident	88.9	Confident	41 Å²	41	39.2 Å²	39.2	34%	0.339	23%	0.23	S	C	.	.	S	Bend	trans	-138.2	157.3	178.9	0	0	0	0	0	112	F208 A212 D213 A214	F208-A210 VanDerWaalsContact C-N 3.33Å; F208-A210 PolarHBondContact O-N 3.1Å; A210-A212 VanDerWaalsContact C-N 3.26Å; A210-A212 PolarHBondContact O-N 3.05Å; A210-D213 WeakPolarHBondContact CB-OD2 3.42Å; A210-D213 PolarHBondContact N-OD2 2.8Å; A210-D213 WeakPolarHBondContact O-CB 3.41Å; A210-D213 PolarHBondContact O-N 3.24Å; A210-A214 PolarHBondContact O-N 2.99Å
211	Q	88.4	Confident	89.2	Confident	45 Å²	45	32.8 Å²	32.8	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-37.3	173.7	-175.2	-172.7	-52.4	0	0	111.9	V157 R159 D213 A214 D215	V157-Q211 PolarHBondContact O-NE2 3.19Å; R159-Q211 HydrophobicContact CB-CG 4.28Å; Q211-D213 VanDerWaalsContact C-N 3.26Å; Q211-D213 PolarHBondContact O-N 3.01Å; Q211-A214 WeakPolarHBondContact O-CB 3.39Å; Q211-A214 PolarHBondContact O-N 3.47Å; Q211-D215 PolarHBondContact O-N 2.93Å
212	A	88.3	Confident	89.3	Confident	61 Å²	61	33.6 Å²	33.6	50%	0.504	20%	0.201	S	C	.	.	H	α-helix	trans	-62.2	-33.2	178.6	0	0	0	0	0	112.9	A210 D215 S216	A210-A212 VanDerWaalsContact C-N 3.26Å; A210-A212 PolarHBondContact O-N 3.05Å; A212-D215 PolarHBondContact O-N 2.94Å; A212-S216 WeakPolarHBondContact O-CB 3.41Å; A212-S216 PolarHBondContact O-N 3.35Å; A212-S216 PolarHBondContact O-OG 3.14Å
213	D	90.2	Very high	89.1	Confident	42 Å²	42	35.1 Å²	35.1	23%	0.225	22%	0.223	C	C	.	.	H	α-helix	trans	-70	-43.1	176.1	-57.6	-40.3	0	0	0	110.6	V187 F208 S209 A210 Q211 D215 S216 F217	V187-D213 HydrophobicContact CB-CB 4.04Å; V187-D213 HydrophobicContact CG1-CB 4.48Å; V187-D213 HydrophobicContact CG2-CB 4.08Å; F208-D213 HydrophobicContact CB-CB 4.09Å; F208-D213 HydrophobicContact CD1-CB 4.12Å; F208-D213 HydrophobicContact CG-CB 4.4Å; S209-D213 PolarHBondContact OG-OD2 3.35Å; A210-D213 WeakPolarHBondContact CB-OD2 3.42Å; A210-D213 PolarHBondContact N-OD2 2.8Å; A210-D213 WeakPolarHBondContact O-CB 3.41Å; A210-D213 PolarHBondContact O-N 3.24Å; Q211-D213 VanDerWaalsContact C-N 3.26Å; Q211-D213 PolarHBondContact O-N 3.01Å; D213-D215 VanDerWaalsContact C-N 3.32Å; D213-D215 PolarHBondContact O-N 2.95Å; D213-S216 PolarHBondContact O-N 3.08Å; D213-F217 WeakPolarHBondContact O-CB 3.38Å; D213-F217 PolarHBondContact O-N 3.36Å
214	A	89.3	Confident	89	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.3	-42.2	173.6	0	0	0	0	0	111.4	L163 F208 A210 Q211 S216 F217 Y218	L163-A214 HydrophobicContact CD1-CB 4.17Å; L163-A214 WeakPolarHBondContact CD1-O 3.3Å; L163-A214 HydrophobicContact CG-CB 4.18Å; F208-A214 HydrophobicContact CB-CB 4.29Å; F208-A214 HydrophobicContact CD2-CB 3.71Å; F208-A214 HydrophobicContact CE2-CB 4.35Å; F208-A214 HydrophobicContact CG-CB 4.12Å; A210-A214 PolarHBondContact O-N 2.99Å; Q211-A214 WeakPolarHBondContact O-CB 3.39Å; Q211-A214 PolarHBondContact O-N 3.47Å; A214-S216 PolarHBondContact O-N 3.46Å; A214-F217 PolarHBondContact O-N 3.13Å; A214-Y218 WeakPolarHBondContact O-CB 3.38Å; A214-Y218 PolarHBondContact O-N 3.32Å
215	D	89.1	Confident	89	Confident	27 Å²	27	46 Å²	46	14%	0.144	27%	0.267	C	S	.	.	H	α-helix	trans	-63.3	-43.9	177.8	-62.8	-13.8	0	0	0	111.9	R159 Q211 A212 D213 F217 Y218 M219 Y238	R159-D215 IonicContact CZ-OD1 3.06Å; R159-D215 IonicContact CZ-OD2 2.92Å; R159-D215 IonicContact NH1-OD1 3.8Å; R159-D215 PolarHBondContact NH1-OD1 2.91Å; R159-D215 IonicContact NH1-OD2 2.8Å; R159-D215 PolarHBondContact NH1-OD2 3.28Å; R159-D215 IonicContact NH2-OD2 2.66Å; R159-D215 PolarHBondContact NH2-OD2 3.35Å; Q211-D215 PolarHBondContact O-N 2.93Å; A212-D215 PolarHBondContact O-N 2.94Å; D213-D215 VanDerWaalsContact C-N 3.32Å; D213-D215 PolarHBondContact O-N 2.95Å; D215-F217 VanDerWaalsContact C-N 3.32Å; D215-F217 PolarHBondContact O-N 3.36Å; D215-Y218 PolarHBondContact O-N 3.39Å; D215-M219 WeakPolarHBondContact O-CB 3.23Å; D215-M219 VanDerWaalsContact O-CG 3.23Å; D215-M219 WeakPolarHBondContact O-CG 3.5Å; D215-M219 PolarHBondContact O-N 3.38Å; D215-Y238 PolarHBondContact OD1-OH 3.47Å
216	S	90.1	Very high	88.8	Confident	64 Å²	64	46.6 Å²	46.6	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-42.5	177.1	-60	0	0	0	0	110.9	A212 D213 A214 M219 A220	A212-S216 WeakPolarHBondContact O-CB 3.41Å; A212-S216 PolarHBondContact O-N 3.35Å; A212-S216 PolarHBondContact O-OG 3.14Å; D213-S216 PolarHBondContact O-N 3.08Å; A214-S216 PolarHBondContact O-N 3.46Å; S216-M219 PolarHBondContact O-N 3.19Å; S216-A220 VanDerWaalsContact O-CB 3.29Å; S216-A220 WeakPolarHBondContact O-CB 3.44Å; S216-A220 PolarHBondContact O-N 3.03Å
217	F	91.1	Very high	88.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-44.6	174.4	-176.5	-96.1	0	0	0	112	L163 V181 F184 I206 F208 D213 A214 D215 M219 A220 C221 L236	L163-F217 HydrophobicContact CD1-CB 4.41Å; L163-F217 HydrophobicContact CD1-CD1 3.62Å; L163-F217 HydrophobicContact CD1-CE1 4.43Å; L163-F217 HydrophobicContact CD1-CG 4.47Å; V181-F217 HydrophobicContact CB-CE2 4.29Å; V181-F217 HydrophobicContact CG1-CE2 3.95Å; V181-F217 HydrophobicContact CG1-CZ 3.9Å; F184-F217 HydrophobicContact CB-CD2 4.06Å; F184-F217 HydrophobicContact CD1-CB 4.25Å; F184-F217 HydrophobicContact CD1-CD2 4.3Å; F184-F217 AromaticContact CD2-CD2 3.48Å; F184-F217 HydrophobicContact CD2-CD2 3.48Å; F184-F217 VanDerWaalsContact CD2-CD2 3.48Å; F184-F217 HydrophobicContact CD2-CE2 4.1Å; F184-F217 HydrophobicContact CE1-CB 4.23Å; F184-F217 AromaticContact CE2-CD2 3.9Å; F184-F217 HydrophobicContact CE2-CD2 3.9Å; F184-F217 HydrophobicContact CG-CB 4.48Å; F184-F217 AromaticContact CG-CD2 3.69Å; F184-F217 HydrophobicContact CG-CD2 3.69Å; F184-F217 HydrophobicContact CZ-CB 4.44Å; F184-F217 HydrophobicContact CZ-CD2 4.47Å; I206-F217 HydrophobicContact CD1-CE1 4.14Å; I206-F217 HydrophobicContact CD1-CZ 3.98Å; F208-F217 HydrophobicContact CE1-CB 3.98Å; F208-F217 HydrophobicContact CE1-CD2 4.21Å; F208-F217 HydrophobicContact CE1-CG 4.06Å; F208-F217 HydrophobicContact CE2-CB 4.38Å; F208-F217 HydrophobicContact CE2-CD1 4.2Å; F208-F217 HydrophobicContact CE2-CG 4.3Å; F208-F217 HydrophobicContact CZ-CB 3.67Å; F208-F217 AromaticContact CZ-CD1 3.7Å; F208-F217 HydrophobicContact CZ-CD1 3.7Å; F208-F217 AromaticContact CZ-CD2 3.85Å; F208-F217 HydrophobicContact CZ-CD2 3.85Å; F208-F217 HydrophobicContact CZ-CE1 4.24Å; F208-F217 HydrophobicContact CZ-CE2 4.42Å; F208-F217 AromaticContact CZ-CG 3.46Å; F208-F217 HydrophobicContact CZ-CG 3.46Å; F208-F217 VanDerWaalsContact CZ-CG 3.46Å; D213-F217 WeakPolarHBondContact O-CB 3.38Å; D213-F217 PolarHBondContact O-N 3.36Å; A214-F217 PolarHBondContact O-N 3.13Å; D215-F217 VanDerWaalsContact C-N 3.32Å; D215-F217 PolarHBondContact O-N 3.36Å; F217-M219 PolarHBondContact O-N 3.12Å; F217-A220 PolarHBondContact O-N 3.03Å; F217-C221 HydrophobicContact CE1-CB 4.27Å; F217-C221 HydrophobicContact CE2-CB 4.29Å; F217-C221 HydrophobicContact CZ-CB 4.14Å; F217-C221 VanDerWaalsContact O-CB 3.3Å; F217-C221 WeakPolarHBondContact O-CB 3.47Å; F217-C221 PolarHBondContact O-N 2.92Å; F217-L236 HydrophobicContact CD1-CD1 3.7Å; F217-L236 HydrophobicContact CD1-CD2 4.35Å; F217-L236 HydrophobicContact CE1-CD1 3.6Å; F217-L236 HydrophobicContact CE1-CD2 3.7Å; F217-L236 HydrophobicContact CE1-CG 4.34Å
218	Y	89.8	Confident	88.1	Confident	28 Å²	28	52 Å²	52	11%	0.11	31%	0.311	C	S	.	.	H	α-helix	trans	-58.2	-48.5	176.5	-176.5	-89.6	0	0	0	111.4	V3 L153 L163 A214 D215 A220 N222 L236 Y238	V3-Y218 HydrophobicContact CG1-CE1 4.43Å; L153-Y218 HydrophobicContact CD1-CE1 4.29Å; L163-Y218 HydrophobicContact CD2-CD2 4.48Å; A214-Y218 WeakPolarHBondContact O-CB 3.38Å; A214-Y218 PolarHBondContact O-N 3.32Å; D215-Y218 PolarHBondContact O-N 3.39Å; Y218-A220 VanDerWaalsContact C-N 3.3Å; Y218-A220 PolarHBondContact O-N 3.36Å; Y218-N222 HydrophobicContact CD1-CB 4.49Å; Y218-N222 HydrophobicContact CD2-CB 4.31Å; Y218-N222 HydrophobicContact CE1-CB 4.42Å; Y218-N222 HydrophobicContact CE2-CB 4.24Å; Y218-N222 HydrophobicContact CG-CB 4.42Å; Y218-N222 WeakPolarHBondContact O-CB 3.29Å; Y218-N222 PolarHBondContact O-N 2.99Å; Y218-N222 PolarHBondContact OH-ND2 2.86Å; Y218-L236 HydrophobicContact CD2-CB 3.68Å; Y218-L236 HydrophobicContact CD2-CD1 4.47Å; Y218-L236 HydrophobicContact CE2-CB 3.92Å; Y218-L236 WeakPolarHBondContact CE2-O 3.34Å; Y218-Y238 WeakPolarHBondContact CB-OH 3.08Å; Y218-Y238 HydrophobicContact CD1-CE2 4.13Å; Y218-Y238 HydrophobicContact CD2-CD2 4.19Å; Y218-Y238 AromaticContact CD2-CE2 3.51Å; Y218-Y238 HydrophobicContact CD2-CE2 3.51Å; Y218-Y238 HydrophobicContact CE1-CE2 4.33Å; Y218-Y238 HydrophobicContact CE2-CD2 4.2Å; Y218-Y238 AromaticContact CE2-CE2 3.73Å; Y218-Y238 HydrophobicContact CE2-CE2 3.73Å; Y218-Y238 AromaticContact CG-CE2 3.73Å; Y218-Y238 HydrophobicContact CG-CE2 3.73Å; Y218-Y238 AromaticContact CG-CZ 3.87Å
219	M	88.4	Confident	87.6	Confident	130 Å²	130	59.7 Å²	59.7	64%	0.64	35%	0.35	S	S	*	.	H	α-helix	trans	-67.4	-30	-179	-65.9	-67.7	-78.8	0	0	112.9	D215 S216 F217	D215-M219 WeakPolarHBondContact O-CB 3.23Å; D215-M219 VanDerWaalsContact O-CG 3.23Å; D215-M219 WeakPolarHBondContact O-CG 3.5Å; D215-M219 PolarHBondContact O-N 3.38Å; S216-M219 PolarHBondContact O-N 3.19Å; F217-M219 PolarHBondContact O-N 3.12Å
220	A	89.4	Confident	87	Confident	54 Å²	54	60 Å²	60	45%	0.446	35%	0.345	S	S	.	.	H	α-helix	trans	-86.2	-34.8	-178.6	0	0	0	0	0	114	F184 S216 F217 Y218	F184-A220 HydrophobicContact CE2-CB 4.17Å; F184-A220 HydrophobicContact CZ-CB 3.94Å; S216-A220 VanDerWaalsContact O-CB 3.29Å; S216-A220 WeakPolarHBondContact O-CB 3.44Å; S216-A220 PolarHBondContact O-N 3.03Å; F217-A220 PolarHBondContact O-N 3.03Å; Y218-A220 VanDerWaalsContact C-N 3.3Å; Y218-A220 PolarHBondContact O-N 3.36Å
221	C	88.2	Confident	86.6	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.02	36%	0.363	C	S	.	.	H	α-helix	trans	-110	-24.1	-168.6	-64.2	0	0	0	0	113.8	F180 F217 G223 R224 C234 L236	F180-C221 HydrophobicContact CE1-CB 4.22Å; F180-C221 HydrophobicContact CZ-CB 4.24Å; F217-C221 HydrophobicContact CE1-CB 4.27Å; F217-C221 HydrophobicContact CE2-CB 4.29Å; F217-C221 HydrophobicContact CZ-CB 4.14Å; F217-C221 VanDerWaalsContact O-CB 3.3Å; F217-C221 WeakPolarHBondContact O-CB 3.47Å; F217-C221 PolarHBondContact O-N 2.92Å; C221-G223 PolarHBondContact O-N 2.87Å; C221-R224 VanDerWaalsContact O-CB 3.28Å; C221-R224 WeakPolarHBondContact O-CB 3.3Å; C221-R224 PolarHBondContact O-N 3.49Å; C221-R224 VanDerWaalsContact O-N 3.15Å; C221-C234 WeakPolarHBondContact O-CB 3.45Å; C221-L236 HydrophobicContact CB-CD1 3.9Å
222	N	88.5	Confident	86.3	Confident	53 Å²	53	65.4 Å²	65.4	28%	0.283	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	128.8	-178.2	-170.8	49.5	0	0	0	111.2	Y218 R224 L236	Y218-N222 HydrophobicContact CD1-CB 4.49Å; Y218-N222 HydrophobicContact CD2-CB 4.31Å; Y218-N222 HydrophobicContact CE1-CB 4.42Å; Y218-N222 HydrophobicContact CE2-CB 4.24Å; Y218-N222 HydrophobicContact CG-CB 4.42Å; Y218-N222 WeakPolarHBondContact O-CB 3.29Å; Y218-N222 PolarHBondContact O-N 2.99Å; Y218-N222 PolarHBondContact OH-ND2 2.86Å; N222-R224 PolarHBondContact O-N 3.03Å; N222-L236 HydrophobicContact CB-CB 4.17Å; N222-L236 HydrophobicContact CB-CD1 4.05Å; N222-L236 HydrophobicContact CB-CG 4.39Å; N222-L236 PolarHBondContact OD1-N 2.66Å
223	G	83.9	Confident	86.3	Confident	51 Å²	51	64.8 Å²	64.8	53%	0.526	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	2.7	-176.8	0	0	0	0	0	114.8	C221 C234	C221-G223 PolarHBondContact O-N 2.87Å; G223-C234 PolarHBondContact N-O 3.31Å
224	R	87.8	Confident	86.2	Confident	142 Å²	142	62.8 Å²	62.8	54%	0.536	35%	0.349	S	S	.	.			trans	-82.8	137.3	177	-172.5	-178.6	174.4	-173.3	-1.9	110.5	C221 N222 V233 C234	C221-R224 VanDerWaalsContact O-CB 3.28Å; C221-R224 WeakPolarHBondContact O-CB 3.3Å; C221-R224 PolarHBondContact O-N 3.49Å; C221-R224 VanDerWaalsContact O-N 3.15Å; N222-R224 PolarHBondContact O-N 3.03Å; R224-V233 WeakPolarHBondContact O-CA 3.35Å; R224-C234 WeakPolarHBondContact O-CB 3.42Å; R224-C234 PolarHBondContact O-N 3.24Å
225	Q	89	Confident	86	Confident	93 Å²	93	63.8 Å²	63.8	44%	0.435	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-64.1	140.7	172.8	-70.4	177.9	-29.1	0	0	111.7	D232 V233	Q225-D232 WeakPolarHBondContact CA-O 3.35Å; Q225-V233 HydrophobicContact CG-CG1 3.82Å
226	F	86.2	Confident	85.9	Confident	19 Å²	19	62.5 Å²	62.5	8%	0.083	35%	0.347	C	S	.	.	S	Bend	trans	-68.7	-39	178	-73.9	-68.1	0	0	0	112.4	I165 T167 V168 P169 M172 F180 D232 C234	I165-F226 HydrophobicContact CG2-CZ 4.01Å; T167-F226 WeakPolarHBondContact O-CE2 3.42Å; V168-F226 HydrophobicContact CG1-CZ 4.4Å; V168-F226 HydrophobicContact CG2-CE1 4.48Å; V168-F226 HydrophobicContact CG2-CZ 4.04Å; P169-F226 HydrophobicContact CG-CD2 4.4Å; M172-F226 HydrophobicContact CE-CB 3.89Å; M172-F226 HydrophobicContact CE-CD1 3.71Å; M172-F226 HydrophobicContact CE-CG 4.16Å; M172-F226 HydrophobicContact SD-CB 4.26Å; M172-F226 HydrophobicContact SD-CD1 3.59Å; M172-F226 VanDerWaalsContact SD-CD1 3.59Å; M172-F226 HydrophobicContact SD-CE1 4.11Å; M172-F226 HydrophobicContact SD-CG 4.04Å; F180-F226 HydrophobicContact CD1-CD1 4.35Å; F180-F226 HydrophobicContact CD1-CE1 4.37Å; F180-F226 HydrophobicContact CD2-CD1 4.13Å; F180-F226 HydrophobicContact CE1-CD1 4.3Å; F180-F226 HydrophobicContact CE1-CE1 4.16Å; F180-F226 HydrophobicContact CE2-CD1 4.07Å; F180-F226 HydrophobicContact CG-CD1 4.27Å; F180-F226 HydrophobicContact CZ-CD1 4.17Å; F180-F226 HydrophobicContact CZ-CE1 4.31Å; F226-D232 HydrophobicContact CD2-CB 4.14Å; F226-D232 PolarHBondContact N-O 3.06Å; F226-C234 HydrophobicContact CD1-CB 4.39Å; F226-C234 HydrophobicContact CE1-CB 3.78Å; F226-C234 HydrophobicContact CE2-CB 4.25Å; F226-C234 HydrophobicContact CZ-CB 3.7Å
227	N	83.1	Confident	85.8	Confident	53 Å²	53	59.9 Å²	59.9	28%	0.283	33%	0.328	S	S	.	.			trans	-144.9	174.8	178.3	66.8	55.4	0	0	0	109.7	I229 E230	N227-I229 PolarHBondContact OD1-N 3.24Å; N227-E230 PolarHBondContact ND2-OE2 3.33Å; N227-E230 PolarHBondContact OD1-N 2.97Å
228	S	82.6	Confident	85.7	Confident	123 Å²	123	60 Å²	60	86%	0.86	33%	0.328	S	S	*	.	S	Bend	trans	-93.6	4.8	-179.1	-53.4	0	0	0	0	113.8
229	I	79.3	Confident	85.6	Confident	161 Å²	161	58.6 Å²	58.6	83%	0.826	32%	0.323	S	S	*	.	S	Bend	trans	-104.6	-39.7	-173.3	-61	174.2	0	0	0	110.2	N227	N227-I229 PolarHBondContact OD1-N 3.24Å
230	E	77.4	Confident	85.4	Confident	70 Å²	70	55.4 Å²	55.4	33%	0.327	31%	0.306	S	S	.	.	S	Bend	trans	-107.9	146.1	179.9	-64.5	168	158.7	0	0	109.6	N227 D232	N227-E230 PolarHBondContact ND2-OE2 3.33Å; N227-E230 PolarHBondContact OD1-N 2.97Å; E230-D232 PolarHBondContact O-N 3.49Å
231	D	79.1	Confident	85.1	Confident	133 Å²	133	53.4 Å²	53.4	71%	0.711	29%	0.287	S	S	*	.			trans	-80.6	6.8	-179	-68.9	-43.2	0	0	0	113.3	V233	D231-V233 PolarHBondContact O-N 2.92Å
232	D	82.1	Confident	85	Confident	67 Å²	67	53.5 Å²	53.5	36%	0.358	29%	0.288	S	S	.	.			trans	-69.8	127.5	-176.4	-66.5	-41.3	0	0	0	111.8	P169 Q225 F226 E230	P169-D232 HydrophobicContact CG-CB 3.64Å; P169-D232 WeakPolarHBondContact CG-OD2 3.43Å; Q225-D232 WeakPolarHBondContact CA-O 3.35Å; F226-D232 HydrophobicContact CD2-CB 4.14Å; F226-D232 PolarHBondContact N-O 3.06Å; E230-D232 PolarHBondContact O-N 3.49Å
233	V	87.1	Confident	84.7	Confident	47 Å²	47	51.3 Å²	51.3	29%	0.285	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-108.1	143.6	-177.7	-66.7	0	0	0	0	111.9	R224 Q225 D231 Q235	R224-V233 WeakPolarHBondContact O-CA 3.35Å; Q225-V233 HydrophobicContact CG-CG1 3.82Å; D231-V233 PolarHBondContact O-N 2.92Å; V233-Q235 HydrophobicContact CG2-CG 4.25Å; V233-Q235 PolarHBondContact O-N 3.29Å
234	C	87.8	Confident	84.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.			trans	-71.5	110.1	174.7	-175.9	0	0	0	0	110.1	F180 C221 G223 R224 F226	F180-C234 HydrophobicContact CE1-CB 4.15Å; F180-C234 HydrophobicContact CZ-CB 3.75Å; C221-C234 WeakPolarHBondContact O-CB 3.45Å; G223-C234 PolarHBondContact N-O 3.31Å; R224-C234 WeakPolarHBondContact O-CB 3.42Å; R224-C234 PolarHBondContact O-N 3.24Å; F226-C234 HydrophobicContact CD1-CB 4.39Å; F226-C234 HydrophobicContact CE1-CB 3.78Å; F226-C234 HydrophobicContact CE2-CB 4.25Å; F226-C234 HydrophobicContact CZ-CB 3.7Å
235	Q	85.8	Confident	84.3	Confident	21 Å²	21	43.6 Å²	43.6	10%	0.098	23%	0.234	C	C	.	.			trans	-101	112.8	176.8	-67	176.6	1.1	0	0	110	I165 L166 V233 V275 N276	I165-Q235 WeakPolarHBondContact CA-O 3.38Å; L166-Q235 PolarHBondContact N-O 3.49Å; L166-Q235 VanDerWaalsContact N-O 3.09Å; V233-Q235 HydrophobicContact CG2-CG 4.25Å; V233-Q235 PolarHBondContact O-N 3.29Å; Q235-V275 HydrophobicContact CG-CG1 4Å; Q235-N276 PolarHBondContact NE2-OD1 2.82Å
236	L	87.9	Confident	83.9	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139.7	-178.1	-67.3	172.5	0	0	0	111.4	C164 I165 F217 Y218 C221 N222	C164-L236 WeakPolarHBondContact O-CA 3.28Å; I165-L236 HydrophobicContact CB-CD2 4.39Å; I165-L236 HydrophobicContact CG1-CD2 3.51Å; F217-L236 HydrophobicContact CD1-CD1 3.7Å; F217-L236 HydrophobicContact CD1-CD2 4.35Å; F217-L236 HydrophobicContact CE1-CD1 3.6Å; F217-L236 HydrophobicContact CE1-CD2 3.7Å; F217-L236 HydrophobicContact CE1-CG 4.34Å; Y218-L236 HydrophobicContact CD2-CB 3.68Å; Y218-L236 HydrophobicContact CD2-CD1 4.47Å; Y218-L236 HydrophobicContact CE2-CB 3.92Å; Y218-L236 WeakPolarHBondContact CE2-O 3.34Å; C221-L236 HydrophobicContact CB-CD1 3.9Å; N222-L236 HydrophobicContact CB-CB 4.17Å; N222-L236 HydrophobicContact CB-CD1 4.05Å; N222-L236 HydrophobicContact CB-CG 4.39Å; N222-L236 PolarHBondContact OD1-N 2.66Å
237	V	87.1	Confident	83.3	Confident	8 Å²	8	42.3 Å²	42.3	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.8	171.6	-65.6	0	0	0	0	110.6	I6 L163 C164 L166	I6-V237 HydrophobicContact CD1-CB 4.43Å; I6-V237 HydrophobicContact CD1-CG2 3.4Å; I6-V237 VanDerWaalsContact CD1-CG2 3.4Å; I6-V237 HydrophobicContact CG1-CB 4.33Å; I6-V237 HydrophobicContact CG1-CG2 3.78Å; I6-V237 HydrophobicContact CG2-CB 4.21Å; I6-V237 HydrophobicContact CG2-CG2 4.23Å; L163-V237 WeakPolarHBondContact CA-O 3.07Å; C164-V237 HydrophobicContact CB-CG2 3.85Å; C164-V237 PolarHBondContact N-O 3.23Å; C164-V237 PolarHBondContact O-N 3.04Å; L166-V237 HydrophobicContact CD1-CG1 3.72Å; L166-V237 HydrophobicContact CD1-CG2 4.27Å; L166-V237 HydrophobicContact CD2-CG2 3.72Å; L166-V237 HydrophobicContact CG-CG1 4.15Å; L166-V237 HydrophobicContact CG-CG2 3.83Å
238	Y	89	Confident	82.7	Confident	2 Å²	2	45 Å²	45	1%	0.008	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.1	177.1	-72.6	-92.5	0	0	0	110.7	V3 L5 I6 L153 R159 L163 D215 Y218	V3-Y238 HydrophobicContact CB-CD2 4.27Å; V3-Y238 HydrophobicContact CB-CE2 4.48Å; V3-Y238 HydrophobicContact CG1-CE2 4.42Å; V3-Y238 HydrophobicContact CG2-CD2 3.86Å; V3-Y238 HydrophobicContact CG2-CE2 3.98Å; L5-Y238 CarbonylContact C-O 3.53Å; L5-Y238 WeakPolarHBondContact CA-O 3.35Å; L5-Y238 HydrophobicContact CD2-CG 4.25Å; I6-Y238 WeakPolarHBondContact CG1-O 3Å; I6-Y238 PolarHBondContact N-O 2.6Å; L153-Y238 HydrophobicContact CD2-CE2 4.08Å; R159-Y238 HydrophobicContact CB-CD1 4.41Å; L163-Y238 HydrophobicContact CD2-CD1 3.36Å; L163-Y238 HydrophobicContact CD2-CD2 4.11Å; L163-Y238 HydrophobicContact CD2-CE1 3.62Å; L163-Y238 HydrophobicContact CD2-CE2 4.3Å; L163-Y238 HydrophobicContact CD2-CG 3.63Å; D215-Y238 PolarHBondContact OD1-OH 3.47Å; Y218-Y238 WeakPolarHBondContact CB-OH 3.08Å; Y218-Y238 HydrophobicContact CD1-CE2 4.13Å; Y218-Y238 HydrophobicContact CD2-CD2 4.19Å; Y218-Y238 AromaticContact CD2-CE2 3.51Å; Y218-Y238 HydrophobicContact CD2-CE2 3.51Å; Y218-Y238 HydrophobicContact CE1-CE2 4.33Å; Y218-Y238 HydrophobicContact CE2-CD2 4.2Å; Y218-Y238 AromaticContact CE2-CE2 3.73Å; Y218-Y238 HydrophobicContact CE2-CE2 3.73Å; Y218-Y238 AromaticContact CG-CE2 3.73Å; Y218-Y238 HydrophobicContact CG-CE2 3.73Å; Y218-Y238 AromaticContact CG-CZ 3.87Å
239	V	87.8	Confident	82	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.7	-179.8	-177.4	0	0	0	0	109.2	I6 I8 F24 S160 M162 C164 L205	I6-V239 HydrophobicContact CD1-CG2 4.2Å; I6-V239 HydrophobicContact CG1-CG2 4.09Å; I6-V239 CarbonylContact O-C 3.58Å; I6-V239 WeakPolarHBondContact O-CA 3.43Å; I8-V239 HydrophobicContact CD1-CG1 4.37Å; I8-V239 HydrophobicContact CD1-CG2 4.14Å; F24-V239 HydrophobicContact CD1-CG1 4.38Å; S160-V239 WeakPolarHBondContact CB-O 3.45Å; S160-V239 PolarHBondContact OG-O 3.19Å; M162-V239 HydrophobicContact CB-CB 4.21Å; M162-V239 HydrophobicContact CG-CB 3.98Å; M162-V239 HydrophobicContact CG-CG1 4.47Å; M162-V239 HydrophobicContact CG-CG2 4.16Å; M162-V239 PolarHBondContact O-N 2.9Å; M162-V239 HydrophobicContact SD-CB 4.32Å; M162-V239 HydrophobicContact SD-CG1 4.16Å; C164-V239 HydrophobicContact CB-CG2 3.7Å; L205-V239 HydrophobicContact CD2-CG2 3.9Å
240	E	83.8	Confident	81.6	Confident	63 Å²	63	35.2 Å²	35.2	29%	0.294	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	-48.3	172.8	-174.2	-179.7	-162.3	0	0	110.4	L5 I6 V7 A26 T147	L5-E240 HydrophobicContact CB-CB 3.8Å; L5-E240 HydrophobicContact CD1-CB 4.05Å; L5-E240 HydrophobicContact CD1-CG 4.14Å; I6-E240 PolarHBondContact O-N 3.4Å; V7-E240 HydrophobicContact CG2-CB 4.32Å; V7-E240 WeakPolarHBondContact CG2-OE2 3.38Å; A26-E240 WeakPolarHBondContact CB-O 3.44Å; A26-E240 PolarHBondContact N-O 2.76Å; T147-E240 WeakPolarHBondContact CG2-OE2 3.38Å
241	R	84	Confident	81.3	Confident	12 Å²	12	31.9 Å²	31.9	5%	0.045	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	153.6	176.2	67.4	-172.9	174.5	-75.4	-3.2	111.7	V7 I8 F24 E243	V7-R241 WeakPolarHBondContact CA-O 3.21Å; V7-R241 HydrophobicContact CB-CG 4.44Å; V7-R241 HydrophobicContact CG1-CG 3.76Å; V7-R241 HydrophobicContact CG2-CG 4.16Å; V7-R241 VanDerWaalsContact CG2-NH1 3.31Å; I8-R241 PolarHBondContact N-O 3.29Å; F24-R241 CarbonylContact O-C 3.5Å; F24-R241 WeakPolarHBondContact O-CA 3.35Å; F24-R241 WeakPolarHBondContact O-CB 3.42Å; R241-E243 IonicContact NE-OE2 3.72Å
242	A	84.9	Confident	80.9	Confident	4 Å²	4	26.1 Å²	26.1	3%	0.033	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.3	171.5	0	0	0	0	0	108.1	I8 F22 G23 F24	I8-A242 CarbonylContact O-C 3.59Å; I8-A242 VanDerWaalsContact O-CA 3.3Å; I8-A242 WeakPolarHBondContact O-CA 3.49Å; F22-A242 HydrophobicContact CD1-CB 4.14Å; F22-A242 HydrophobicContact CE1-CB 3.73Å; F22-A242 HydrophobicContact CZ-CB 4.29Å; F22-A242 WeakPolarHBondContact O-CB 3.39Å; G23-A242 WeakPolarHBondContact CA-O 3.4Å; F24-A242 HydrophobicContact CB-CB 4.11Å; F24-A242 PolarHBondContact N-O 3.04Å; F24-A242 PolarHBondContact O-N 2.97Å
243	E	83.6	Confident	80.4	Confident	8 Å²	8	23.1 Å²	23.1	4%	0.037	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	150.9	-173.3	66	-174.8	-179.2	0	0	112.4	I8 R9 L10 R241	I8-E243 PolarHBondContact O-N 3.39Å; R9-E243 WeakPolarHBondContact CA-O 3.23Å; R9-E243 HydrophobicContact CB-CG 3.9Å; R9-E243 HydrophobicContact CG-CG 4.12Å; R9-E243 IonicContact CZ-OE1 3.15Å; R9-E243 IonicContact NE-OE1 3.79Å; R9-E243 PolarHBondContact NE-OE1 3.47Å; R9-E243 IonicContact NH2-OE1 3.13Å; R9-E243 PolarHBondContact NH2-OE1 2.83Å; L10-E243 PolarHBondContact N-O 3.47Å; R241-E243 IonicContact NE-OE2 3.72Å
244	V	82.6	Confident	79.4	Confident	21 Å²	21	24.8 Å²	24.8	13%	0.127	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.8	173.5	-172.5	0	0	0	0	107.8	L10 L12 V18 P19 F22 K37	L10-V244 HydrophobicContact CB-CG1 4.48Å; L12-V244 HydrophobicContact CD1-CG1 3.4Å; L12-V244 VanDerWaalsContact CD1-CG1 3.4Å; L12-V244 HydrophobicContact CD2-CG1 4.25Å; L12-V244 HydrophobicContact CG-CG1 3.62Å; V18-V244 HydrophobicContact CG1-CB 4.27Å; V18-V244 HydrophobicContact CG1-CG1 4.09Å; V18-V244 HydrophobicContact CG1-CG2 4.44Å; P19-V244 HydrophobicContact CG-CG2 4Å; F22-V244 HydrophobicContact CB-CG2 4.17Å; F22-V244 HydrophobicContact CD1-CG2 3.7Å; F22-V244 HydrophobicContact CG-CG2 4.23Å; K37-V244 PolarHBondContact NZ-O 3.38Å
245	L	79.4	Confident	78.7	Confident	9 Å²	9	25.2 Å²	25.2	5%	0.047	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	145.8	-179.2	-65.1	173.1	0	0	0	109.6	R9 L10 E11 L12 K37 L41 A251	R9-L245 HydrophobicContact CG-CD1 4.2Å; L10-L245 PolarHBondContact O-N 2.89Å; L10-L245 VanDerWaalsContact O-O 3.13Å; E11-L245 CarbonylContact C-O 3.58Å; E11-L245 WeakPolarHBondContact CA-O 3.4Å; L12-L245 PolarHBondContact N-O 3.3Å; K37-L245 HydrophobicContact CD-CD2 4.33Å; L41-L245 HydrophobicContact CD1-CD1 3.77Å; L41-L245 HydrophobicContact CD1-CD2 3.93Å; L41-L245 HydrophobicContact CD2-CD1 4.08Å; L245-A251 HydrophobicContact CB-CB 3.71Å; L245-A251 HydrophobicContact CD1-CB 4.4Å
246	K	80.8	Confident	77.8	Confident	68 Å²	68	30.3 Å²	30.3	30%	0.296	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	157	170.6	-65.5	-171.9	175.3	-163.2	0	110.3	E14 E248 D249	E14-K246 PolarHBondContact O-NZ 3.01Å; K246-E248 HydrophobicContact CB-CG 3.96Å; K246-E248 WeakPolarHBondContact CD-OE1 3.36Å; K246-E248 PolarHBondContact O-N 3.49Å; K246-D249 PolarHBondContact N-OD2 2.87Å; K246-D249 WeakPolarHBondContact O-CB 3.33Å; K246-D249 PolarHBondContact O-N 2.86Å
247	S	73.9	Confident	76.9	Confident	17 Å²	17	35.3 Å²	35.3	12%	0.119	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-56.2	-35.7	177.9	-55.8	0	0	0	0	112.7	E11 L12 M69 D249 G250	E11-S247 PolarHBondContact OE1-OG 3.4Å; L12-S247 PolarHBondContact O-N 2.85Å; L12-S247 VanDerWaalsContact O-N 3.1Å; L12-S247 PolarHBondContact O-OG 3.15Å; M69-S247 WeakPolarHBondContact CE-OG 3.33Å; S247-D249 VanDerWaalsContact C-N 3.27Å; S247-D249 PolarHBondContact O-N 2.94Å; S247-G250 PolarHBondContact O-N 2.82Å
248	E	70	Confident	76.5	Confident	109 Å²	109	36.1 Å²	36.1	51%	0.509	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-67.2	-23.3	178.2	63.4	-174.5	157	0	0	114.2	K246 G250	K246-E248 HydrophobicContact CB-CG 3.96Å; K246-E248 WeakPolarHBondContact CD-OE1 3.36Å; K246-E248 PolarHBondContact O-N 3.49Å; E248-G250 PolarHBondContact O-N 3.24Å
249	D	69.4	Low	75.9	Confident	80 Å²	80	39.6 Å²	39.6	43%	0.428	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-84	6.5	-178.8	-59.5	-38.9	0	0	0	112.5	K246 S247	K246-D249 PolarHBondContact N-OD2 2.87Å; K246-D249 WeakPolarHBondContact O-CB 3.33Å; K246-D249 PolarHBondContact O-N 2.86Å; S247-D249 VanDerWaalsContact C-N 3.27Å; S247-D249 PolarHBondContact O-N 2.94Å
250	G	69.1	Low	75.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	29.1	-179.2	0	0	0	0	0	113.8	S247 E248 S252 L253	S247-G250 PolarHBondContact O-N 2.82Å; E248-G250 PolarHBondContact O-N 3.24Å; G250-S252 PolarHBondContact O-N 2.86Å; G250-S252 VanDerWaalsContact O-N 3.16Å; G250-L253 WeakPolarHBondContact O-CB 3.26Å; G250-L253 PolarHBondContact O-N 2.96Å
251	A	72	Confident	75.1	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-33.5	178.3	0	0	0	0	0	113.6	R9 E11 L245	R9-A251 WeakPolarHBondContact CD-O 3.35Å; R9-A251 PolarHBondContact NH1-O 2.77Å; E11-A251 HydrophobicContact CB-CB 3.83Å; E11-A251 HydrophobicContact CG-CB 3.74Å; L245-A251 HydrophobicContact CB-CB 3.71Å; L245-A251 HydrophobicContact CD1-CB 4.4Å
252	S	70.2	Confident	74.6	Confident	11 Å²	11	42.7 Å²	42.7	8%	0.077	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-8	-178.4	55	0	0	0	0	114.9	E11 I60 G250	E11-S252 WeakPolarHBondContact OE2-CB 3.35Å; E11-S252 PolarHBondContact OE2-N 3.5Å; I60-S252 VanDerWaalsContact CG2-OG 3.25Å; I60-S252 WeakPolarHBondContact CG2-OG 3.49Å; G250-S252 PolarHBondContact O-N 2.86Å; G250-S252 VanDerWaalsContact O-N 3.16Å
253	L	71.9	Confident	74.1	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	25%	0.247	C	C	.	.	S	Bend	trans	-80.2	143.9	-178.8	-66.5	177.4	0	0	0	111.4	A44 L48 I59 H63 G250 V255	A44-L253 HydrophobicContact CB-CB 3.73Å; A44-L253 HydrophobicContact CB-CD1 3.94Å; A44-L253 HydrophobicContact CB-CG 4.5Å; A44-L253 WeakPolarHBondContact O-CD1 3.49Å; L48-L253 HydrophobicContact CD1-CD1 3.57Å; L48-L253 HydrophobicContact CD2-CD1 4.09Å; L48-L253 HydrophobicContact CG-CD1 3.62Å; I59-L253 HydrophobicContact CG2-CD2 4.03Å; H63-L253 HydrophobicContact CB-CD2 4.35Å; G250-L253 WeakPolarHBondContact O-CB 3.26Å; G250-L253 PolarHBondContact O-N 2.96Å; L253-V255 PolarHBondContact O-N 2.8Å
254	P	67.3	Low	73.9	Confident	82 Å²	82	46 Å²	46	53%	0.532	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-62.4	136.9	175	26.6	-33.2	0	0	0	110.1
255	V	71.5	Confident	73.7	Confident	8 Å²	8	49 Å²	49	5%	0.048	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-99.7	134.5	177.7	179.7	0	0	0	0	108.2	T40 L41 L253 L258	T40-V255 VanDerWaalsContact O-CG1 3.31Å; T40-V255 WeakPolarHBondContact O-CG1 3.41Å; L41-V255 HydrophobicContact CD2-CG2 4.31Å; L253-V255 PolarHBondContact O-N 2.8Å; V255-L258 HydrophobicContact CB-CB 4.11Å; V255-L258 HydrophobicContact CB-CD1 3.89Å; V255-L258 HydrophobicContact CB-CG 4.25Å; V255-L258 HydrophobicContact CG1-CB 4.33Å; V255-L258 HydrophobicContact CG1-CD1 3.64Å; V255-L258 HydrophobicContact CG1-CG 3.96Å; V255-L258 HydrophobicContact CG2-CD1 4.46Å; V255-L258 PolarHBondContact O-N 2.92Å
256	M	67.6	Low	73.7	Confident	128 Å²	128	51.5 Å²	51.5	63%	0.631	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	143.8	176.3	-65.9	-173.4	69.1	0	0	110.7	L258	M256-L258 PolarHBondContact O-N 3.04Å; M256-L258 VanDerWaalsContact O-N 3.15Å
257	D	69.7	Low	73.4	Confident	107 Å²	107	50.2 Å²	50.2	57%	0.572	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	6.5	-179.1	-55.7	-29	0	0	0	116.8	N148	N148-D257 PolarHBondContact N-O 2.97Å; N148-D257 VanDerWaalsContact N-O 3.08Å
258	L	77.4	Confident	73.4	Confident	25 Å²	25	54.1 Å²	54.1	13%	0.131	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	136	176.9	-68.1	-168.6	0	0	0	111.2	V7 Y145 K146 T147 V255 M256	V7-L258 HydrophobicContact CB-CD1 4.28Å; V7-L258 HydrophobicContact CG2-CD1 4.06Å; V7-L258 HydrophobicContact CG2-CD2 4.16Å; Y145-L258 HydrophobicContact CD1-CB 4.27Å; Y145-L258 HydrophobicContact CD2-CD1 4.42Å; Y145-L258 HydrophobicContact CG-CB 4.27Å; Y145-L258 HydrophobicContact CG-CD1 4.18Å; K146-L258 WeakPolarHBondContact O-CA 3.5Å; T147-L258 HydrophobicContact CG2-CD2 3.76Å; V255-L258 HydrophobicContact CB-CB 4.11Å; V255-L258 HydrophobicContact CB-CD1 3.89Å; V255-L258 HydrophobicContact CB-CG 4.25Å; V255-L258 HydrophobicContact CG1-CB 4.33Å; V255-L258 HydrophobicContact CG1-CD1 3.64Å; V255-L258 HydrophobicContact CG1-CG 3.96Å; V255-L258 HydrophobicContact CG2-CD1 4.46Å; V255-L258 PolarHBondContact O-N 2.92Å; M256-L258 PolarHBondContact O-N 3.04Å; M256-L258 VanDerWaalsContact O-N 3.15Å
259	T	77.4	Confident	73.6	Confident	74 Å²	74	51.8 Å²	51.8	45%	0.454	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.1	176.4	-54.1	0	0	0	0	109.9	Y145 K146 N148	Y145-T259 CarbonylContact C-O 3.59Å; Y145-T259 WeakPolarHBondContact CA-O 2.99Å; K146-T259 PolarHBondContact N-O 2.9Å; K146-T259 PolarHBondContact O-N 3.28Å; N148-T259 PolarHBondContact OD1-OG1 2.87Å
260	E	79	Confident	73.8	Confident	59 Å²	59	49.4 Å²	49.4	28%	0.276	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.7	176.3	-169.8	177.7	-151.7	0	0	110.5	R67 H143 Y145 P262	R67-E260 IonicContact CZ-OE1 3.96Å; R67-E260 IonicContact CZ-OE2 2.77Å; R67-E260 VanDerWaalsContact NH1-CD 3.35Å; R67-E260 IonicContact NH1-OE1 3.75Å; R67-E260 PolarHBondContact NH1-OE1 3.48Å; R67-E260 IonicContact NH1-OE2 3.06Å; R67-E260 PolarHBondContact NH1-OE2 2.73Å; R67-E260 VanDerWaalsContact NH1-OE2 3.09Å; R67-E260 IonicContact NH2-OE1 3.38Å; R67-E260 IonicContact NH2-OE2 3.8Å; R67-E260 PolarHBondContact NH2-OE2 2.67Å; H143-E260 IonicContact CE1-OE1 3.69Å; H143-E260 IonicContact CG-OE1 3.94Å; H143-E260 IonicContact ND1-OE1 3.31Å; H143-E260 PolarHBondContact ND1-OE1 3.33Å; Y145-E260 HydrophobicContact CD1-CB 3.91Å; Y145-E260 HydrophobicContact CD1-CG 4.46Å; Y145-E260 HydrophobicContact CE1-CB 3.94Å; Y145-E260 HydrophobicContact CE1-CG 4.34Å; E260-P262 VanDerWaalsContact O-CD 3.27Å; E260-P262 WeakPolarHBondContact O-CD 3.36Å
261	L	76.1	Confident	73.8	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.063	27%	0.272	C	S	.	.			trans	-76.3	114.3	179.7	-67.6	173.8	0	0	0	110.7	L144 K146 M271 D272	L144-L261 HydrophobicContact CB-CD1 4.31Å; L144-L261 PolarHBondContact O-N 3.34Å; K146-L261 HydrophobicContact CB-CD2 4.02Å; K146-L261 HydrophobicContact CB-CG 4.33Å; K146-L261 HydrophobicContact CD-CD2 4.09Å; L261-M271 WeakPolarHBondContact CD2-O 3.16Å; L261-D272 HydrophobicContact CD2-CB 4.45Å
262	P	72.1	Confident	73.6	Confident	69 Å²	69	50 Å²	50	45%	0.448	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-71.4	155.6	179.4	28.9	-32.6	0	0	0	111.7	E260 M271	E260-P262 VanDerWaalsContact O-CD 3.27Å; E260-P262 WeakPolarHBondContact O-CD 3.36Å; P262-M271 HydrophobicContact CB-CE 3.71Å; P262-M271 HydrophobicContact CG-CB 4.33Å; P262-M271 HydrophobicContact CG-CE 3.6Å; P262-M271 WeakPolarHBondContact O-CB 3.08Å; P262-M271 PolarHBondContact O-N 3.3Å
263	K	75.9	Confident	73.2	Confident	82 Å²	82	56.6 Å²	56.6	36%	0.357	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-87.4	139.8	170.8	-63.5	-174.4	179	-170.6	0	109.7	D196 E269 R270 M271	D196-K263 IonicContact OD2-NZ 3.84Å; K263-E269 CarbonylContact C-O 3.44Å; K263-E269 WeakPolarHBondContact CA-O 3.49Å; K263-R270 HydrophobicContact CG-CG 4.45Å; K263-M271 WeakPolarHBondContact O-CE 3.38Å
264	C	77.8	Confident	72.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-71.1	131.9	172.7	-176.1	0	0	0	0	109.3	V266 C267 L268 E269 M271 H288	C264-V266 PolarHBondContact O-N 3.42Å; C264-C267 VanDerWaalsContact CB-SG 3.58Å; C264-L268 WeakPolarHBondContact O-CA 3.04Å; C264-L268 PolarHBondContact O-N 3.32Å; C264-E269 PolarHBondContact N-O 2.8Å; C264-M271 HydrophobicContact CB-CG 3.67Å; C264-M271 HydrophobicContact CB-SD 3.73Å; C264-H288 WeakPolarHBondContact CB-ND1 3.46Å
265	T	78.7	Confident	72	Confident	84 Å²	84	57.9 Å²	57.9	52%	0.515	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-9.2	-179.8	64.2	0	0	0	0	113.5	F287 V302	T265-F287 VanDerWaalsContact OG1-CE1 3.26Å; T265-F287 WeakPolarHBondContact OG1-CE1 3.5Å; T265-V302 HydrophobicContact CG2-CG2 4.26Å
266	V	80.2	Confident	71.6	Confident	62 Å²	62	59.3 Å²	59.3	38%	0.376	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-55.5	-179.6	178.4	0	0	0	0	110.5	C264 F287 C291 P301	C264-V266 PolarHBondContact O-N 3.42Å; V266-F287 HydrophobicContact CG2-CD1 3.77Å; V266-F287 HydrophobicContact CG2-CE1 4.21Å; V266-C291 HydrophobicContact CB-CB 3.84Å; V266-C291 HydrophobicContact CG1-CB 3.82Å; V266-C291 HydrophobicContact CG2-CB 4.38Å; V266-P301 HydrophobicContact CG2-CB 4.2Å; V266-P301 HydrophobicContact CG2-CG 4.22Å
267	C	74.9	Confident	71.5	Confident	40 Å²	40	55.2 Å²	55.2	27%	0.27	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-8.2	179.7	62.8	0	0	0	0	114.5	C264 E269 H288 C291	C264-C267 VanDerWaalsContact CB-SG 3.58Å; C267-E269 HydrophobicContact CB-CG 4.25Å; C267-E269 PolarHBondContact O-N 2.87Å; C267-E269 VanDerWaalsContact O-N 3.08Å; C267-E269 VanDerWaalsContact SG-CB 3.6Å; C267-H288 VanDerWaalsContact SG-CE1 3.54Å; C267-H288 PolarHBondContact SG-ND1 3.02Å; C267-C291 PolarHBondContact SG-SG 2.79Å
268	L	73.4	Confident	71.9	Confident	99 Å²	99	52.5 Å²	52.5	52%	0.518	30%	0.296	S	S	.	.			trans	63.1	5.1	-175.4	-51.5	178	0	0	0	115.1	C264	C264-L268 WeakPolarHBondContact O-CA 3.04Å; C264-L268 PolarHBondContact O-N 3.32Å
269	E	73.9	Confident	71.8	Confident	60 Å²	60	55.3 Å²	55.3	28%	0.28	31%	0.311	S	S	.	.			trans	-79.6	161	173.1	-61.2	169.1	-162.4	0	0	111.8	T167 K263 C264 C267	T167-E269 HydrophobicContact CG2-CG 4.5Å; K263-E269 CarbonylContact C-O 3.44Å; K263-E269 WeakPolarHBondContact CA-O 3.49Å; C264-E269 PolarHBondContact N-O 2.8Å; C267-E269 HydrophobicContact CB-CG 4.25Å; C267-E269 PolarHBondContact O-N 2.87Å; C267-E269 VanDerWaalsContact O-N 3.08Å; C267-E269 VanDerWaalsContact SG-CB 3.6Å
270	R	74.1	Confident	71.8	Confident	31 Å²	31	55.1 Å²	55.1	12%	0.117	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-74.2	138.1	179.9	-67	-175.8	178.6	-95.9	4.9	111.1	M142 K263 H288	M142-R270 PolarHBondContact O-NH2 2.94Å; K263-R270 HydrophobicContact CG-CG 4.45Å; R270-H288 PolarHBondContact O-NE2 2.97Å
271	M	68.1	Low	71.7	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.03	30%	0.299	C	S	.	.			trans	-94.9	104.3	179.7	-63	-172.1	-68.8	0	0	110	L261 P262 K263 C264 I278 S286 H288	L261-M271 WeakPolarHBondContact CD2-O 3.16Å; P262-M271 HydrophobicContact CB-CE 3.71Å; P262-M271 HydrophobicContact CG-CB 4.33Å; P262-M271 HydrophobicContact CG-CE 3.6Å; P262-M271 WeakPolarHBondContact O-CB 3.08Å; P262-M271 PolarHBondContact O-N 3.3Å; K263-M271 WeakPolarHBondContact O-CE 3.38Å; C264-M271 HydrophobicContact CB-CG 3.67Å; C264-M271 HydrophobicContact CB-SD 3.73Å; M271-I278 HydrophobicContact CB-CD1 3.76Å; M271-I278 HydrophobicContact CB-CG1 4.15Å; M271-S286 WeakPolarHBondContact CE-O 3.38Å; M271-H288 WeakPolarHBondContact CA-NE2 3.25Å
272	D	68.2	Low	71.7	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.027	33%	0.328	C	S	.	.			trans	-105.5	115.1	168.1	-173.9	-6.9	0	0	0	110.3	K146 L261 S274 V275 N276	K146-D272 IonicContact NZ-OD1 2.84Å; K146-D272 PolarHBondContact NZ-OD1 2.89Å; L261-D272 HydrophobicContact CD2-CB 4.45Å; D272-S274 PolarHBondContact O-N 3.07Å; D272-S274 VanDerWaalsContact O-N 3.11Å; D272-S274 WeakPolarHBondContact OD1-CB 3.3Å; D272-S274 PolarHBondContact OD1-N 3.33Å; D272-S274 PolarHBondContact OD1-OG 2.89Å; D272-S274 PolarHBondContact OD2-OG 3.27Å; D272-V275 HydrophobicContact CB-CG2 4.47Å; D272-V275 PolarHBondContact O-N 2.82Å; D272-V275 VanDerWaalsContact O-N 3.15Å; D272-N276 PolarHBondContact O-N 3.25Å
273	E	62	Low	72.1	Confident	150 Å²	150	56.8 Å²	56.8	70%	0.701	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.2	176.8	-167.4	-177.1	-177	0	0	113.4	I278	E273-I278 HydrophobicContact CB-CD1 3.85Å; E273-I278 HydrophobicContact CB-CG1 4.44Å
274	S	57.5	Low	72.2	Confident	61 Å²	61	59.3 Å²	59.3	43%	0.427	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-16.5	-176.6	67.4	0	0	0	0	114.4	D272	D272-S274 PolarHBondContact O-N 3.07Å; D272-S274 VanDerWaalsContact O-N 3.11Å; D272-S274 WeakPolarHBondContact OD1-CB 3.3Å; D272-S274 PolarHBondContact OD1-N 3.33Å; D272-S274 PolarHBondContact OD1-OG 2.89Å; D272-S274 PolarHBondContact OD2-OG 3.27Å
275	V	56.4	Low	72.3	Confident	54 Å²	54	62.3 Å²	62.3	33%	0.327	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-47	-174.6	-176.4	0	0	0	0	110.8	Q235 D272	Q235-V275 HydrophobicContact CG-CG1 4Å; D272-V275 HydrophobicContact CB-CG2 4.47Å; D272-V275 PolarHBondContact O-N 2.82Å; D272-V275 VanDerWaalsContact O-N 3.15Å
276	N	62.4	Low	72.4	Confident	37 Å²	37	60.1 Å²	60.1	20%	0.198	34%	0.338	C	S	.	.	S	Bend	trans	-115	120.4	179.9	-63.6	-21.3	0	0	0	107.8	Q235 D272 I278 H288	Q235-N276 PolarHBondContact NE2-OD1 2.82Å; D272-N276 PolarHBondContact O-N 3.25Å; N276-I278 PolarHBondContact O-N 3.22Å; N276-H288 VanDerWaalsContact CB-CD2 3.47Å; N276-H288 WeakPolarHBondContact CB-CD2 3.28Å
277	G	67.3	Low	72.5	Confident	43 Å²	43	57.2 Å²	57.2	44%	0.443	32%	0.32	S	S	.	.			trans	-54.2	115	176.7	0	0	0	0	0	109.8	S289	G277-S289 VanDerWaalsContact O-CB 3.23Å; G277-S289 WeakPolarHBondContact O-CB 3.4Å; G277-S289 PolarHBondContact O-N 3.37Å; G277-S289 PolarHBondContact O-OG 2.83Å
278	I	77.8	Confident	72.9	Confident	50 Å²	50	55.6 Å²	55.6	26%	0.256	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	127	176.7	-62.2	176.8	0	0	0	107.3	M271 E273 N276 F287	M271-I278 HydrophobicContact CB-CD1 3.76Å; M271-I278 HydrophobicContact CB-CG1 4.15Å; E273-I278 HydrophobicContact CB-CD1 3.85Å; E273-I278 HydrophobicContact CB-CG1 4.44Å; N276-I278 PolarHBondContact O-N 3.22Å; I278-F287 WeakPolarHBondContact CA-O 3.33Å
279	L	74.7	Confident	73.1	Confident	84 Å²	84	53.7 Å²	53.7	44%	0.44	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.7	170.3	-161.6	82.4	0	0	0	109.2	S286 F287 L292	L279-S286 WeakPolarHBondContact O-CA 3.46Å; L279-F287 PolarHBondContact N-O 3.01Å; L279-F287 PolarHBondContact O-N 3.46Å; L279-L292 HydrophobicContact CD2-CD2 3.34Å
280	T	78.1	Confident	73.5	Confident	70 Å²	70	55.3 Å²	55.3	43%	0.429	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.4	169.1	-53.2	0	0	0	0	108.9	N284 H285 S286	T280-N284 WeakPolarHBondContact CG2-OD1 3.41Å; T280-H285 WeakPolarHBondContact CA-O 3.48Å; T280-S286 WeakPolarHBondContact CG2-OG 3.3Å; T280-S286 PolarHBondContact OG1-OG 3.15Å
281	T	75.4	Confident	73.9	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.055	31%	0.31	C	S	.	.			trans	-74.7	164.2	178.7	56.8	0	0	0	0	111.5	C283 N284 H285 F287 L292 Q307	T281-C283 PolarHBondContact O-N 3.34Å; T281-C283 VanDerWaalsContact O-N 3.16Å; T281-C283 PolarHBondContact OG1-SG 2.93Å; T281-N284 WeakPolarHBondContact O-CA 3.32Å; T281-N284 PolarHBondContact O-N 3.16Å; T281-H285 PolarHBondContact N-O 3.07Å; T281-H285 PolarHBondContact OG1-N 3.37Å; T281-H285 PolarHBondContact OG1-O 2.94Å; T281-F287 HydrophobicContact CG2-CD2 3.89Å; T281-F287 HydrophobicContact CG2-CE2 3.63Å; T281-L292 HydrophobicContact CG2-CD2 4.29Å; T281-Q307 VanDerWaalsContact CG2-CD 3.46Å; T281-Q307 HydrophobicContact CG2-CG 4.32Å
282	L	77.3	Confident	74.6	Confident	130 Å²	130	55.3 Å²	55.3	68%	0.681	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.3	179.7	-63.5	179.2	0	0	0	113.8	N284 Y305 Q307	L282-N284 PolarHBondContact O-N 2.84Å; L282-Y305 HydrophobicContact CB-CE1 4.48Å; L282-Q307 VanDerWaalsContact CD1-O 3.3Å; L282-Q307 WeakPolarHBondContact CD1-O 3.5Å
283	C	81.3	Confident	75.3	Confident	36 Å²	36	62 Å²	62	24%	0.243	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	12.9	172.5	58.2	0	0	0	0	113.3	T281 H285 C300 C303 Y305	T281-C283 PolarHBondContact O-N 3.34Å; T281-C283 VanDerWaalsContact O-N 3.16Å; T281-C283 PolarHBondContact OG1-SG 2.93Å; C283-H285 VanDerWaalsContact C-N 3.26Å; C283-H285 PolarHBondContact O-N 3.38Å; C283-H285 PolarHBondContact SG-ND1 3.28Å; C283-C300 PolarHBondContact SG-SG 2.87Å; C283-C303 PolarHBondContact SG-SG 2.76Å; C283-Y305 HydrophobicContact CB-CD1 4.22Å; C283-Y305 HydrophobicContact CB-CG 4.39Å
284	N	76.6	Confident	76.3	Confident	135 Å²	135	64 Å²	64	72%	0.722	35%	0.347	S	S	*	.	S	Bend	trans	64.1	19.5	176.2	-142	33.5	0	0	0	115.6	T280 T281 L282	T280-N284 WeakPolarHBondContact CG2-OD1 3.41Å; T281-N284 WeakPolarHBondContact O-CA 3.32Å; T281-N284 PolarHBondContact O-N 3.16Å; L282-N284 PolarHBondContact O-N 2.84Å
285	H	80.1	Confident	77.6	Confident	62 Å²	62	66 Å²	66	29%	0.287	35%	0.345	S	S	.	.			trans	-87.5	136.7	167.7	-62.7	111.7	0	0	0	110.2	T280 T281 C283 F287 C300 V302	T280-H285 WeakPolarHBondContact CA-O 3.48Å; T281-H285 PolarHBondContact N-O 3.07Å; T281-H285 PolarHBondContact OG1-N 3.37Å; T281-H285 PolarHBondContact OG1-O 2.94Å; C283-H285 VanDerWaalsContact C-N 3.26Å; C283-H285 PolarHBondContact O-N 3.38Å; C283-H285 PolarHBondContact SG-ND1 3.28Å; H285-F287 HydrophobicContact CB-CE2 3.64Å; H285-F287 HydrophobicContact CB-CZ 3.59Å; H285-C300 PolarHBondContact ND1-SG 3.01Å; H285-V302 HydrophobicContact CB-CG2 4.46Å; H285-V302 WeakPolarHBondContact NE2-CG1 3.36Å
286	S	80.1	Confident	78.3	Confident	39 Å²	39	71.5 Å²	71.5	27%	0.273	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.7	-175.9	-59.2	0	0	0	0	111.7	M271 L279 T280	M271-S286 WeakPolarHBondContact CE-O 3.38Å; L279-S286 WeakPolarHBondContact O-CA 3.46Å; T280-S286 WeakPolarHBondContact CG2-OG 3.3Å; T280-S286 PolarHBondContact OG1-OG 3.15Å
287	F	83.2	Confident	79	Confident	1 Å²	1	73.7 Å²	73.7	0%	0.004	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	161.4	-178.4	-48.4	-85.3	0	0	0	110.3	T265 V266 I278 L279 T281 H285 L292 P301 V302	T265-F287 VanDerWaalsContact OG1-CE1 3.26Å; T265-F287 WeakPolarHBondContact OG1-CE1 3.5Å; V266-F287 HydrophobicContact CG2-CD1 3.77Å; V266-F287 HydrophobicContact CG2-CE1 4.21Å; I278-F287 WeakPolarHBondContact CA-O 3.33Å; L279-F287 PolarHBondContact N-O 3.01Å; L279-F287 PolarHBondContact O-N 3.46Å; T281-F287 HydrophobicContact CG2-CD2 3.89Å; T281-F287 HydrophobicContact CG2-CE2 3.63Å; H285-F287 HydrophobicContact CB-CE2 3.64Å; H285-F287 HydrophobicContact CB-CZ 3.59Å; F287-L292 HydrophobicContact CB-CB 4.42Å; F287-L292 HydrophobicContact CD2-CD1 4.44Å; F287-P301 HydrophobicContact CE1-CB 4.09Å; F287-P301 HydrophobicContact CE1-CG 4.06Å; F287-P301 HydrophobicContact CZ-CB 4.31Å; F287-P301 HydrophobicContact CZ-CG 4.13Å; F287-V302 HydrophobicContact CE1-CG2 3.75Å; F287-V302 HydrophobicContact CZ-CB 4.47Å; F287-V302 HydrophobicContact CZ-CG2 3.72Å
288	H	82.3	Confident	79.5	Confident	6 Å²	6	75.3 Å²	75.3	3%	0.028	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	136.8	161	-55.4	118.5	0	0	0	109.2	C264 C267 R270 M271 N276 Q290 C291 L292	C264-H288 WeakPolarHBondContact CB-ND1 3.46Å; C267-H288 VanDerWaalsContact SG-CE1 3.54Å; C267-H288 PolarHBondContact SG-ND1 3.02Å; R270-H288 PolarHBondContact O-NE2 2.97Å; M271-H288 WeakPolarHBondContact CA-NE2 3.25Å; N276-H288 VanDerWaalsContact CB-CD2 3.47Å; N276-H288 WeakPolarHBondContact CB-CD2 3.28Å; H288-Q290 PolarHBondContact O-N 2.6Å; H288-C291 HydrophobicContact CB-CB 4.1Å; H288-C291 WeakPolarHBondContact O-CA 3.42Å; H288-C291 WeakPolarHBondContact O-CB 3.43Å; H288-C291 PolarHBondContact O-N 3.04Å; H288-L292 PolarHBondContact O-N 3.37Å
289	S	79.4	Confident	79.8	Confident	58 Å²	58	73.6 Å²	73.6	41%	0.406	38%	0.377	S	S	.	.	H	α-helix	trans	-49.6	-44.6	175.3	46.1	0	0	0	0	112.5	G277 C291 L292 Q293	G277-S289 VanDerWaalsContact O-CB 3.23Å; G277-S289 WeakPolarHBondContact O-CB 3.4Å; G277-S289 PolarHBondContact O-N 3.37Å; G277-S289 PolarHBondContact O-OG 2.83Å; S289-C291 VanDerWaalsContact C-N 3.35Å; S289-C291 PolarHBondContact O-N 3.41Å; S289-L292 PolarHBondContact O-N 3Å; S289-Q293 WeakPolarHBondContact O-CB 3.37Å; S289-Q293 PolarHBondContact O-N 3.36Å
290	Q	80.9	Confident	80.2	Confident	94 Å²	94	69.6 Å²	69.6	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-64.8	-35.8	177.2	-168.5	61.5	62.4	0	0	113.3	H288 Q293 R294	H288-Q290 PolarHBondContact O-N 2.6Å; Q290-Q293 PolarHBondContact O-N 3.04Å; Q290-R294 WeakPolarHBondContact O-CG 3.32Å; Q290-R294 PolarHBondContact O-N 2.81Å; Q290-R294 VanDerWaalsContact O-N 3.17Å
291	C	83.8	Confident	80.5	Confident	15 Å²	15	67.8 Å²	67.8	10%	0.101	35%	0.346	C	S	.	.	H	α-helix	trans	-68.9	-40.6	177.5	-75.9	0	0	0	0	111.5	V266 C267 H288 S289 W295	V266-C291 HydrophobicContact CB-CB 3.84Å; V266-C291 HydrophobicContact CG1-CB 3.82Å; V266-C291 HydrophobicContact CG2-CB 4.38Å; C267-C291 PolarHBondContact SG-SG 2.79Å; H288-C291 HydrophobicContact CB-CB 4.1Å; H288-C291 WeakPolarHBondContact O-CA 3.42Å; H288-C291 WeakPolarHBondContact O-CB 3.43Å; H288-C291 PolarHBondContact O-N 3.04Å; S289-C291 VanDerWaalsContact C-N 3.35Å; S289-C291 PolarHBondContact O-N 3.41Å; C291-W295 PolarHBondContact O-N 3.15Å
292	L	82.8	Confident	81	Confident	22 Å²	22	70.7 Å²	70.7	12%	0.115	36%	0.364	C	S	.	.	H	α-helix	trans	-72.3	-33	174.9	-171.1	68.6	0	0	0	111.9	L279 T281 F287 H288 S289 R294 W295 P301	L279-L292 HydrophobicContact CD2-CD2 3.34Å; T281-L292 HydrophobicContact CG2-CD2 4.29Å; F287-L292 HydrophobicContact CB-CB 4.42Å; F287-L292 HydrophobicContact CD2-CD1 4.44Å; H288-L292 PolarHBondContact O-N 3.37Å; S289-L292 PolarHBondContact O-N 3Å; L292-R294 VanDerWaalsContact C-N 3.28Å; L292-R294 PolarHBondContact O-N 2.88Å; L292-W295 HydrophobicContact CD1-CB 4.37Å; L292-W295 WeakPolarHBondContact O-CB 3.44Å; L292-W295 PolarHBondContact O-N 3.01Å; L292-P301 HydrophobicContact CD1-CG 3.97Å
293	Q	82.1	Confident	81.3	Confident	145 Å²	145	67.4 Å²	67.4	68%	0.678	35%	0.351	S	S	*	.	H	α-helix	trans	-64.4	-33	175.7	-172.7	-175.6	12.2	0	0	112.7	S289 Q290 W295	S289-Q293 WeakPolarHBondContact O-CB 3.37Å; S289-Q293 PolarHBondContact O-N 3.36Å; Q290-Q293 PolarHBondContact O-N 3.04Å; Q293-W295 PolarHBondContact O-N 2.79Å
294	R	83.6	Confident	81.3	Confident	193 Å²	193	74.8 Å²	74.8	73%	0.728	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.7	174.3	-70.4	178.1	-176.8	177.7	1.9	112.8	Q290 L292 D296	Q290-R294 WeakPolarHBondContact O-CG 3.32Å; Q290-R294 PolarHBondContact O-N 2.81Å; Q290-R294 VanDerWaalsContact O-N 3.17Å; L292-R294 VanDerWaalsContact C-N 3.28Å; L292-R294 PolarHBondContact O-N 2.88Å; R294-D296 PolarHBondContact O-N 2.81Å
295	W	83.7	Confident	81.5	Confident	102 Å²	102	75 Å²	75	39%	0.386	37%	0.365	S	S	.	.			trans	-81.1	114	173.9	-171	-109.1	0	0	0	108.6	C291 L292 Q293 D297 T299 P301	C291-W295 PolarHBondContact O-N 3.15Å; L292-W295 HydrophobicContact CD1-CB 4.37Å; L292-W295 WeakPolarHBondContact O-CB 3.44Å; L292-W295 PolarHBondContact O-N 3.01Å; Q293-W295 PolarHBondContact O-N 2.79Å; W295-D297 PolarHBondContact O-N 2.79Å; W295-T299 PolarHBondContact NE1-O 2.76Å; W295-T299 VanDerWaalsContact NE1-O 3.12Å; W295-P301 HydrophobicContact CD2-CB 4.4Å; W295-P301 HydrophobicContact CD2-CG 3.97Å; W295-P301 HydrophobicContact CG-CG 3.93Å
296	D	72.7	Confident	81.2	Confident	170 Å²	170	75.6 Å²	75.6	91%	0.909	38%	0.376	S	S	*	.			trans	-76.1	-12.1	-171	-157.4	25.9	0	0	0	113.3	R294	R294-D296 PolarHBondContact O-N 2.81Å
297	D	77	Confident	80.4	Confident	83 Å²	83	75.3 Å²	75.3	44%	0.444	37%	0.37	S	S	.	.	S	Bend	trans	-100.5	148.1	-178.3	-168.9	8.2	0	0	0	111.3	W295 T299	W295-D297 PolarHBondContact O-N 2.79Å; D297-T299 VanDerWaalsContact CG-OG1 3.22Å; D297-T299 PolarHBondContact O-N 2.92Å; D297-T299 VanDerWaalsContact O-N 3.17Å; D297-T299 WeakPolarHBondContact OD2-CB 3.41Å; D297-T299 VanDerWaalsContact OD2-CG2 3.26Å; D297-T299 WeakPolarHBondContact OD2-CG2 3.3Å; D297-T299 PolarHBondContact OD2-OG1 2.79Å
298	T	77.6	Confident	79.3	Confident	78 Å²	78	79 Å²	79	48%	0.479	39%	0.393	S	S	.	.	S	Bend	trans	-77.1	3.7	176.7	61.1	0	0	0	0	112.7	Q307	T298-Q307 VanDerWaalsContact O-CB 3.32Å; T298-Q307 WeakPolarHBondContact O-CB 3.25Å; T298-Q307 VanDerWaalsContact O-CG 3.31Å; T298-Q307 WeakPolarHBondContact O-CG 3.46Å; T298-Q307 PolarHBondContact O-N 3.09Å
299	T	83.6	Confident	78.1	Confident	13 Å²	13	84.4 Å²	84.4	8%	0.08	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-90.3	156.2	-179.3	68	0	0	0	0	112.5	W295 D297 P301 R304 Y305 Q307	W295-T299 PolarHBondContact NE1-O 2.76Å; W295-T299 VanDerWaalsContact NE1-O 3.12Å; D297-T299 VanDerWaalsContact CG-OG1 3.22Å; D297-T299 PolarHBondContact O-N 2.92Å; D297-T299 VanDerWaalsContact O-N 3.17Å; D297-T299 WeakPolarHBondContact OD2-CB 3.41Å; D297-T299 VanDerWaalsContact OD2-CG2 3.26Å; D297-T299 WeakPolarHBondContact OD2-CG2 3.3Å; D297-T299 PolarHBondContact OD2-OG1 2.79Å; T299-P301 WeakPolarHBondContact O-CD 3.46Å; T299-R304 WeakPolarHBondContact CB-O 3.46Å; T299-R304 WeakPolarHBondContact CG2-O 3.41Å; T299-Y305 CarbonylContact C-O 3.55Å; T299-Y305 WeakPolarHBondContact CA-O 3.47Å; T299-Q307 PolarHBondContact O-NE2 2.86Å; T299-Q307 VanDerWaalsContact O-NE2 3.09Å
300	C	82.9	Confident	77	Confident	0 Å²	0	89.3 Å²	89.3	0%	0	45%	0.445	C	S	.	.			trans	-64.4	127.9	170.6	-178.7	0	0	0	0	111.6	C283 H285 V302 C303 R304 Y305 Q307	C283-C300 PolarHBondContact SG-SG 2.87Å; H285-C300 PolarHBondContact ND1-SG 3.01Å; C300-V302 PolarHBondContact O-N 2.91Å; C300-V302 VanDerWaalsContact O-N 3.08Å; C300-V302 PolarHBondContact SG-N 2.95Å; C300-C303 VanDerWaalsContact CB-SG 3.58Å; C300-C303 VanDerWaalsContact SG-SG 3.7Å; C300-R304 WeakPolarHBondContact O-CA 2.9Å; C300-R304 PolarHBondContact O-N 2.82Å; C300-Y305 PolarHBondContact N-O 2.82Å; C300-Q307 VanDerWaalsContact CA-NE2 3.27Å
301	P	85.1	Confident	75.7	Confident	32 Å²	32	90.8 Å²	90.8	21%	0.208	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.6	175.5	-26.6	33.7	0	0	0	114.4	V266 F287 L292 W295 T299	V266-P301 HydrophobicContact CG2-CB 4.2Å; V266-P301 HydrophobicContact CG2-CG 4.22Å; F287-P301 HydrophobicContact CE1-CB 4.09Å; F287-P301 HydrophobicContact CE1-CG 4.06Å; F287-P301 HydrophobicContact CZ-CB 4.31Å; F287-P301 HydrophobicContact CZ-CG 4.13Å; L292-P301 HydrophobicContact CD1-CG 3.97Å; W295-P301 HydrophobicContact CD2-CB 4.4Å; W295-P301 HydrophobicContact CD2-CG 3.97Å; W295-P301 HydrophobicContact CG-CG 3.93Å; T299-P301 WeakPolarHBondContact O-CD 3.46Å
302	V	85.1	Confident	74.5	Confident	70 Å²	70	95.6 Å²	95.6	42%	0.424	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-51.7	-177.6	178.2	0	0	0	0	111.9	T265 H285 F287 C300	T265-V302 HydrophobicContact CG2-CG2 4.26Å; H285-V302 HydrophobicContact CB-CG2 4.46Å; H285-V302 WeakPolarHBondContact NE2-CG1 3.36Å; F287-V302 HydrophobicContact CE1-CG2 3.75Å; F287-V302 HydrophobicContact CZ-CB 4.47Å; F287-V302 HydrophobicContact CZ-CG2 3.72Å; C300-V302 PolarHBondContact O-N 2.91Å; C300-V302 VanDerWaalsContact O-N 3.08Å; C300-V302 PolarHBondContact SG-N 2.95Å
303	C	83.8	Confident	73.4	Confident	62 Å²	62	102.8 Å²	102.8	42%	0.419	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	1	-172.1	68.6	0	0	0	0	114.9	C283 C300 Y305	C283-C303 PolarHBondContact SG-SG 2.76Å; C300-C303 VanDerWaalsContact CB-SG 3.58Å; C300-C303 VanDerWaalsContact SG-SG 3.7Å; C303-Y305 PolarHBondContact O-N 3.44Å; C303-Y305 VanDerWaalsContact SG-CB 3.52Å
304	R	81.9	Confident	72.6	Confident	191 Å²	191	102.4 Å²	102.4	72%	0.721	52%	0.523	S	S	*	.			trans	55.2	16.6	-176.8	-60.1	-171.3	175.6	-161.6	-2.4	115.6	T299 C300 C306	T299-R304 WeakPolarHBondContact CB-O 3.46Å; T299-R304 WeakPolarHBondContact CG2-O 3.41Å; C300-R304 WeakPolarHBondContact O-CA 2.9Å; C300-R304 PolarHBondContact O-N 2.82Å; R304-C306 PolarHBondContact O-N 3.15Å
305	Y	80.1	Confident	72.2	Confident	138 Å²	138	96.9 Å²	96.9	54%	0.541	51%	0.508	S	S	.	.			trans	-66.4	127.5	172.5	-172.5	-100.7	0	0	0	109.9	L282 C283 T299 C300 C303 Q307	L282-Y305 HydrophobicContact CB-CE1 4.48Å; C283-Y305 HydrophobicContact CB-CD1 4.22Å; C283-Y305 HydrophobicContact CB-CG 4.39Å; T299-Y305 CarbonylContact C-O 3.55Å; T299-Y305 WeakPolarHBondContact CA-O 3.47Å; C300-Y305 PolarHBondContact N-O 2.82Å; C303-Y305 PolarHBondContact O-N 3.44Å; C303-Y305 VanDerWaalsContact SG-CB 3.52Å; Y305-Q307 PolarHBondContact O-N 2.81Å
306	C	73.7	Confident	72.4	Confident	76 Å²	76	97.2 Å²	97.2	51%	0.514	51%	0.512	S	S	.	.	B	Isolated β-bridge	trans	-62.5	123.3	177.2	-63	0	0	0	0	110	R304	R304-C306 PolarHBondContact O-N 3.15Å
307	Q	62.9	Low	73.2	Confident	33 Å²	33	89.2 Å²	89.2	15%	0.154	47%	0.469	C	S	.	.	S	Bend	trans	-85.7	-17	-170	-58.9	-177	23.5	0	0	113.3	T281 L282 T298 T299 C300 Y305	T281-Q307 VanDerWaalsContact CG2-CD 3.46Å; T281-Q307 HydrophobicContact CG2-CG 4.32Å; L282-Q307 VanDerWaalsContact CD1-O 3.3Å; L282-Q307 WeakPolarHBondContact CD1-O 3.5Å; T298-Q307 VanDerWaalsContact O-CB 3.32Å; T298-Q307 WeakPolarHBondContact O-CB 3.25Å; T298-Q307 VanDerWaalsContact O-CG 3.31Å; T298-Q307 WeakPolarHBondContact O-CG 3.46Å; T298-Q307 PolarHBondContact O-N 3.09Å; T299-Q307 PolarHBondContact O-NE2 2.86Å; T299-Q307 VanDerWaalsContact O-NE2 3.09Å; C300-Q307 VanDerWaalsContact CA-NE2 3.27Å; Y305-Q307 PolarHBondContact O-N 2.81Å
308	T	59.8	Low	73.8	Confident	79 Å²	79	91.7 Å²	91.7	49%	0.485	48%	0.476	S	S	.	.	S	Bend	trans	-121.6	122.4	-178.4	47.8	0	0	0	0	110	E310	T308-E310 PolarHBondContact O-N 3.45Å; T308-E310 VanDerWaalsContact O-N 3.15Å
309	P	57.2	Low	74.2	Confident	118 Å²	118	92.4 Å²	92.4	77%	0.766	47%	0.474	S	S	*	.			trans	-62.7	117.4	166.8	21.3	-23.3	0	0	0	107.8
310	E	56.9	Low	74.5	Confident	161 Å²	161	94.3 Å²	94.3	75%	0.752	49%	0.488	S	S	*	.			trans	-59.9	136.3	173	-73.8	-175.1	160.8	0	0	108.8	T308 V312	T308-E310 PolarHBondContact O-N 3.45Å; T308-E310 VanDerWaalsContact O-N 3.15Å; E310-V312 PolarHBondContact O-N 3.03Å
311	P	53.4	Low	74.5	Confident	125 Å²	125	96.1 Å²	96.1	81%	0.812	51%	0.506	S	S	*	.			trans	-64.1	102.1	171	26.6	-31	0	0	0	107.8	E313	P311-E313 PolarHBondContact O-N 3.38Å; P311-E313 VanDerWaalsContact O-N 3.13Å
312	V	57.9	Low	74.7	Confident	116 Å²	116	96.9 Å²	96.9	70%	0.703	51%	0.51	S	S	*	.			trans	-71.4	107.3	171.9	-173	0	0	0	0	106.3	E310 E314	E310-V312 PolarHBondContact O-N 3.03Å; V312-E314 PolarHBondContact O-N 2.84Å
313	E	59.7	Low	74.6	Confident	173 Å²	173	98.7 Å²	98.7	81%	0.808	51%	0.514	S	S	*	.			trans	-47.6	123.5	166.2	-73	-89.8	139.7	0	0	108.1	P311 N315	P311-E313 PolarHBondContact O-N 3.38Å; P311-E313 VanDerWaalsContact O-N 3.13Å; E313-N315 PolarHBondContact O-N 3.44Å
314	E	65.3	Low	74.6	Confident	138 Å²	138	102.6 Å²	102.6	65%	0.645	53%	0.526	S	S	*	.			trans	-60.6	105.9	-176	-70.4	-177.2	176.8	0	0	110	V312 K316 Q323	V312-E314 PolarHBondContact O-N 2.84Å; E314-K316 PolarHBondContact O-N 3.15Å; E314-Q323 PolarHBondContact OE2-NE2 3.17Å
315	N	76.8	Confident	74.8	Confident	77 Å²	77	97.1 Å²	97.1	41%	0.412	51%	0.511	S	S	.	.			trans	-60.2	114.4	174.7	-70	-38.5	0	0	0	108.6	E313 L326 L360	E313-N315 PolarHBondContact O-N 3.44Å; N315-L326 HydrophobicContact CB-CD1 3.99Å; N315-L326 WeakPolarHBondContact O-CD1 3.4Å; N315-L360 HydrophobicContact CB-CD1 3.87Å
316	K	88	Confident	75.3	Confident	108 Å²	108	90.8 Å²	90.8	47%	0.47	49%	0.486	S	S	.	.			trans	-137.1	151.3	178.9	65.7	-171.9	174.4	-167.9	0	110.7	E314 F318 V322 Q323	E314-K316 PolarHBondContact O-N 3.15Å; K316-F318 PolarHBondContact O-N 3.37Å; K316-V322 WeakPolarHBondContact CA-O 3.47Å; K316-Q323 HydrophobicContact CB-CG 4.13Å
317	C	88.8	Confident	76.1	Confident	2 Å²	2	88.4 Å²	88.4	1%	0.014	47%	0.466	C	S	.	.			trans	-62.3	131.2	174.2	176.5	0	0	0	0	110.2	E319 G321 V322 L326 I335 C337 H344	C317-E319 PolarHBondContact O-N 3.05Å; C317-G321 VanDerWaalsContact O-CA 3.26Å; C317-G321 WeakPolarHBondContact O-CA 3.19Å; C317-G321 PolarHBondContact O-N 2.78Å; C317-V322 PolarHBondContact N-O 2.81Å; C317-L326 HydrophobicContact CB-CD2 3.82Å; C317-I335 WeakPolarHBondContact CA-O 3.44Å; C317-C337 HydrophobicContact CB-CB 4.08Å; C317-C337 PolarHBondContact SG-N 2.88Å; C317-H344 PolarHBondContact SG-ND1 3.08Å; C317-H344 VanDerWaalsContact SG-ND1 3.43Å
318	F	88.8	Confident	77.5	Confident	135 Å²	135	88.8 Å²	88.8	59%	0.592	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-21.6	-176.4	-71.6	-3.3	0	0	0	114.1	K316 H334 I335	K316-F318 PolarHBondContact O-N 3.37Å; F318-H334 AromaticContact CD2-CE1 3.92Å; F318-H334 AromaticContact CD2-ND1 3.6Å; F318-I335 HydrophobicContact CD1-CB 4.38Å; F318-I335 HydrophobicContact CE1-CB 4.23Å; F318-I335 HydrophobicContact CE1-CD1 4.35Å; F318-I335 HydrophobicContact CE1-CG1 4.44Å; F318-I335 HydrophobicContact CZ-CG1 4.41Å; F318-I335 PolarHBondContact N-O 3.21Å
319	E	86.9	Confident	79	Confident	93 Å²	93	85.3 Å²	85.3	44%	0.435	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-46	-179.7	-71.3	178.3	-124.3	0	0	113.2	C317 H344	C317-E319 PolarHBondContact O-N 3.05Å; E319-H344 HydrophobicContact CB-CB 4.33Å; E319-H344 VanDerWaalsContact CD-CD2 3.4Å; E319-H344 HydrophobicContact CG-CB 4.44Å; E319-H344 WeakPolarHBondContact OE1-CB 3.32Å; E319-H344 IonicContact OE1-CD2 3.85Å; E319-H344 IonicContact OE1-CG 2.84Å; E319-H344 IonicContact OE2-CD2 2.76Å; E319-H344 PolarHBondContact OE2-CD2 3.46Å; E319-H344 IonicContact OE2-CE1 2.72Å; E319-H344 IonicContact OE2-CG 2.87Å; E319-H344 IonicContact OE2-NE2 3.21Å; E319-H344 PolarHBondContact OE2-NE2 3.13Å
320	C	88.7	Confident	80.4	Confident	54 Å²	54	82.7 Å²	82.7	37%	0.365	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-4.4	-174.4	59.6	0	0	0	0	115.5	V322 H344	C320-V322 HydrophobicContact CB-CG2 4.41Å; C320-V322 PolarHBondContact O-N 2.9Å; C320-V322 VanDerWaalsContact O-N 3.15Å; C320-V322 VanDerWaalsContact SG-CG2 3.58Å; C320-H344 VanDerWaalsContact SG-CE1 3.57Å; C320-H344 PolarHBondContact SG-ND1 3.5Å
321	G	84.5	Confident	81.7	Confident	37 Å²	37	79 Å²	79	38%	0.381	41%	0.412	S	S	.	.			trans	70.2	4.9	178.5	0	0	0	0	0	115.6	C317	C317-G321 VanDerWaalsContact O-CA 3.26Å; C317-G321 WeakPolarHBondContact O-CA 3.19Å; C317-G321 PolarHBondContact O-N 2.78Å
322	V	87.9	Confident	83.1	Confident	48 Å²	48	76.1 Å²	76.1	29%	0.291	39%	0.394	S	S	.	.			trans	-58.9	139.5	174	172.5	0	0	0	0	109.5	K316 C317 C320 E324 L326 V341	K316-V322 WeakPolarHBondContact CA-O 3.47Å; C317-V322 PolarHBondContact N-O 2.81Å; C320-V322 HydrophobicContact CB-CG2 4.41Å; C320-V322 PolarHBondContact O-N 2.9Å; C320-V322 VanDerWaalsContact O-N 3.15Å; C320-V322 VanDerWaalsContact SG-CG2 3.58Å; V322-E324 HydrophobicContact CG1-CB 4.47Å; V322-E324 WeakPolarHBondContact CG1-O 3.45Å; V322-L326 WeakPolarHBondContact O-CD2 3.19Å; V322-V341 HydrophobicContact CG1-CG1 4.39Å; V322-V341 HydrophobicContact CG2-CG1 4.23Å
323	Q	84.6	Confident	84.5	Confident	109 Å²	109	72.3 Å²	72.3	51%	0.509	38%	0.378	S	S	.	.			trans	-102.4	-7	-178	-66.7	179.8	-14.5	0	0	113.3	E314 K316	E314-Q323 PolarHBondContact OE2-NE2 3.17Å; K316-Q323 HydrophobicContact CB-CG 4.13Å
324	E	82.3	Confident	85.9	Confident	144 Å²	144	65.8 Å²	65.8	67%	0.673	35%	0.348	S	S	*	.	S	Bend	trans	-109	152.9	-177.7	-63.4	-172.1	172.6	0	0	112.5	V322 L326	V322-E324 HydrophobicContact CG1-CB 4.47Å; V322-E324 WeakPolarHBondContact CG1-O 3.45Å; E324-L326 VanDerWaalsContact C-N 3.34Å; E324-L326 PolarHBondContact O-N 3.02Å
325	N	86.1	Confident	87.2	Confident	76 Å²	76	60 Å²	60	41%	0.406	32%	0.321	S	S	.	.	S	Bend	trans	52.3	50.4	179.3	-68.4	-60.7	0	0	0	113	W327 G338 V341	N325-W327 PolarHBondContact O-NE1 2.72Å; N325-G338 PolarHBondContact O-N 3.38Å; N325-V341 HydrophobicContact CB-CG2 4.34Å
326	L	90.2	Very high	87.9	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	144	-178.3	-66	-179.5	0	0	0	113	N315 C317 V322 E324 I335 Q359 L360	N315-L326 HydrophobicContact CB-CD1 3.99Å; N315-L326 WeakPolarHBondContact O-CD1 3.4Å; C317-L326 HydrophobicContact CB-CD2 3.82Å; V322-L326 WeakPolarHBondContact O-CD2 3.19Å; E324-L326 VanDerWaalsContact C-N 3.34Å; E324-L326 PolarHBondContact O-N 3.02Å; L326-I335 HydrophobicContact CB-CG2 4.12Å; L326-I335 HydrophobicContact CD1-CG2 4.17Å; L326-I335 HydrophobicContact CD2-CG2 4.1Å; L326-I335 HydrophobicContact CG-CG2 4.38Å; L326-Q359 WeakPolarHBondContact O-CA 3.37Å; L326-L360 HydrophobicContact CB-CB 4.47Å; L326-L360 HydrophobicContact CB-CD1 3.76Å; L326-L360 HydrophobicContact CB-CG 4.3Å; L326-L360 HydrophobicContact CD1-CD1 4.24Å; L326-L360 PolarHBondContact O-N 3.2Å
327	W	92	Very high	88.1	Confident	25 Å²	25	51.1 Å²	51.1	10%	0.095	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	125.1	-178.8	-61.2	75.2	0	0	0	108.8	N325 I335 G336 G338 A345 A357 M358 Q359 W366 Y373	N325-W327 PolarHBondContact O-NE1 2.72Å; W327-I335 WeakPolarHBondContact O-CA 3.4Å; W327-G336 PolarHBondContact N-O 2.84Å; W327-G336 PolarHBondContact O-N 3.05Å; W327-G338 VanDerWaalsContact CD1-CA 3.42Å; W327-A345 HydrophobicContact CB-CB 3.79Å; W327-A345 HydrophobicContact CG-CB 4.26Å; W327-A357 HydrophobicContact CB-CB 4.33Å; W327-A357 HydrophobicContact CE3-CB 4.49Å; W327-M358 CarbonylContact C-O 3.59Å; W327-M358 VanDerWaalsContact CA-O 3.28Å; W327-M358 WeakPolarHBondContact CA-O 3.31Å; W327-Q359 HydrophobicContact CD2-CB 4.04Å; W327-Q359 HydrophobicContact CD2-CG 4.4Å; W327-Q359 HydrophobicContact CE3-CB 3.83Å; W327-Q359 HydrophobicContact CH2-CB 3.86Å; W327-Q359 HydrophobicContact CH2-CG 4.35Å; W327-Q359 HydrophobicContact CZ2-CB 4.05Å; W327-Q359 HydrophobicContact CZ2-CG 4.07Å; W327-Q359 HydrophobicContact CZ3-CB 3.73Å; W327-W366 HydrophobicContact CE3-CB 4.29Å; W327-W366 HydrophobicContact CH2-CB 4.31Å; W327-W366 HydrophobicContact CZ3-CB 3.59Å; W327-W366 HydrophobicContact CZ3-CG 4.48Å; W327-Y373 HydrophobicContact CH2-CE1 4.27Å
328	I	92.1	Very high	88	Confident	42 Å²	42	51.2 Å²	51.2	22%	0.215	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.6	175.6	-173.2	168.3	0	0	0	109.9	L330 H334 I335 A357 M358 L360	I328-L330 PolarHBondContact O-N 2.79Å; I328-H334 CarbonylContact C-O 3.47Å; I328-H334 WeakPolarHBondContact CA-O 3.35Å; I328-I335 HydrophobicContact CB-CG1 4.27Å; I328-I335 HydrophobicContact CD1-CG1 4.29Å; I328-I335 HydrophobicContact CG1-CG1 4.1Å; I328-A357 CarbonylContact O-C 3.49Å; I328-A357 VanDerWaalsContact O-CA 3.27Å; I328-A357 WeakPolarHBondContact O-CA 3.48Å; I328-M358 HydrophobicContact CG2-CB 4.04Å; I328-M358 HydrophobicContact CG2-CE 3.9Å; I328-M358 WeakPolarHBondContact CG2-O 3.31Å; I328-M358 PolarHBondContact N-O 2.66Å; I328-M358 PolarHBondContact O-N 2.88Å; I328-L360 HydrophobicContact CB-CD2 4.1Å; I328-L360 HydrophobicContact CG2-CD2 3.67Å; I328-L360 HydrophobicContact CG2-CG 4.43Å
329	C	91.1	Very high	87.6	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	125.5	173.7	178.1	0	0	0	0	110	I331 G333 H334 H354	C329-I331 PolarHBondContact O-N 3.43Å; C329-I331 PolarHBondContact SG-N 3.3Å; C329-G333 VanDerWaalsContact O-CA 3.24Å; C329-G333 WeakPolarHBondContact O-CA 3.41Å; C329-G333 PolarHBondContact O-N 2.87Å; C329-H334 HydrophobicContact CB-CB 4.26Å; C329-H334 PolarHBondContact N-O 3.09Å; C329-H354 WeakPolarHBondContact SG-CB 3.25Å
330	L	86.1	Confident	87.3	Confident	62 Å²	62	54.8 Å²	54.8	33%	0.325	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.3	-178.3	-66.4	-179.2	0	0	0	113.5	I328 Y356 M358 V365 L377 I386	I328-L330 PolarHBondContact O-N 2.79Å; L330-Y356 PolarHBondContact N-O 2.92Å; L330-M358 HydrophobicContact CD1-CB 4.45Å; L330-M358 HydrophobicContact CD2-CB 3.94Å; L330-M358 HydrophobicContact CD2-CE 4.41Å; L330-M358 HydrophobicContact CG-CB 4.24Å; L330-V365 HydrophobicContact CD1-CG1 3.79Å; L330-V365 HydrophobicContact CD1-CG2 4Å; L330-L377 HydrophobicContact CD1-CD1 3.89Å; L330-I386 HydrophobicContact CB-CD1 4.46Å
331	I	83.8	Confident	87	Confident	83 Å²	83	55.2 Å²	55.2	43%	0.426	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-42	-178.3	-59.2	164.3	0	0	0	110.9	C329 H354	C329-I331 PolarHBondContact O-N 3.43Å; C329-I331 PolarHBondContact SG-N 3.3Å; I331-H354 HydrophobicContact CB-CB 4.35Å; I331-H354 HydrophobicContact CD1-CB 3.8Å; I331-H354 WeakPolarHBondContact CG2-CD2 3.37Å; I331-H354 WeakPolarHBondContact CG2-NE2 2.98Å
332	C	84.8	Confident	87	Confident	66 Å²	66	56 Å²	56	45%	0.446	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128	1.3	-174	76.2	0	0	0	0	115	H334 H348 H354	C332-H334 VanDerWaalsContact C-N 3.28Å; C332-H334 PolarHBondContact O-N 2.93Å; C332-H348 PolarHBondContact SG-CE1 3.33Å; C332-H348 PolarHBondContact SG-NE2 2.8Å; C332-H354 VanDerWaalsContact CB-CE1 3.47Å; C332-H354 WeakPolarHBondContact CB-CE1 3.19Å; C332-H354 VanDerWaalsContact SG-CE1 3.54Å; C332-H354 PolarHBondContact SG-ND1 2.81Å; C332-H354 VanDerWaalsContact SG-ND1 3.41Å
333	G	86	Confident	87.1	Confident	36 Å²	36	60.6 Å²	60.6	37%	0.371	30%	0.3	S	S	.	.			trans	74	7.5	177.9	0	0	0	0	0	115.9	C329	C329-G333 VanDerWaalsContact O-CA 3.24Å; C329-G333 WeakPolarHBondContact O-CA 3.41Å; C329-G333 PolarHBondContact O-N 2.87Å
334	H	90	Very high	87.5	Confident	35 Å²	35	56.1 Å²	56.1	16%	0.162	28%	0.279	C	S	.	.			trans	-65.8	133	178	-179.7	90.9	0	0	0	111.6	F318 I328 C329 C332 H348	F318-H334 AromaticContact CD2-CE1 3.92Å; F318-H334 AromaticContact CD2-ND1 3.6Å; I328-H334 CarbonylContact C-O 3.47Å; I328-H334 WeakPolarHBondContact CA-O 3.35Å; C329-H334 HydrophobicContact CB-CB 4.26Å; C329-H334 PolarHBondContact N-O 3.09Å; C332-H334 VanDerWaalsContact C-N 3.28Å; C332-H334 PolarHBondContact O-N 2.93Å; H334-H348 AromaticContact CD2-CG 3.66Å; H334-H348 AromaticContact CD2-ND1 3.68Å; H334-H348 AromaticContact CG-CE1 3.81Å; H334-H348 AromaticContact CG-CG 4Å; H334-H348 AromaticContact CG-ND1 3.58Å
335	I	91.4	Very high	87.9	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.082	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113.4	179.8	-56.6	176.5	0	0	0	110.6	C317 F318 L326 W327 I328 L360	C317-I335 WeakPolarHBondContact CA-O 3.44Å; F318-I335 HydrophobicContact CD1-CB 4.38Å; F318-I335 HydrophobicContact CE1-CB 4.23Å; F318-I335 HydrophobicContact CE1-CD1 4.35Å; F318-I335 HydrophobicContact CE1-CG1 4.44Å; F318-I335 HydrophobicContact CZ-CG1 4.41Å; F318-I335 PolarHBondContact N-O 3.21Å; L326-I335 HydrophobicContact CB-CG2 4.12Å; L326-I335 HydrophobicContact CD1-CG2 4.17Å; L326-I335 HydrophobicContact CD2-CG2 4.1Å; L326-I335 HydrophobicContact CG-CG2 4.38Å; W327-I335 WeakPolarHBondContact O-CA 3.4Å; I328-I335 HydrophobicContact CB-CG1 4.27Å; I328-I335 HydrophobicContact CD1-CG1 4.29Å; I328-I335 HydrophobicContact CG1-CG1 4.1Å; I335-L360 HydrophobicContact CG2-CD1 4.35Å
336	G	90.9	Very high	88	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	152.4	179.5	0	0	0	0	0	113.3	W327	W327-G336 PolarHBondContact N-O 2.84Å; W327-G336 PolarHBondContact O-N 3.05Å
337	C	92.4	Very high	88.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	150.6	171.8	68.8	0	0	0	0	111.6	C317 V341 S342 H344 A345	C317-C337 HydrophobicContact CB-CB 4.08Å; C317-C337 PolarHBondContact SG-N 2.88Å; C337-V341 HydrophobicContact CB-CB 4.07Å; C337-V341 HydrophobicContact CB-CG1 4.19Å; C337-S342 PolarHBondContact SG-N 2.93Å; C337-S342 VanDerWaalsContact SG-N 3.41Å; C337-H344 PolarHBondContact O-N 3.24Å; C337-H344 PolarHBondContact SG-ND1 2.97Å; C337-H344 VanDerWaalsContact SG-ND1 3.38Å; C337-A345 PolarHBondContact O-N 2.99Å
338	G	86.7	Confident	88	Confident	4 Å²	4	53 Å²	53	4%	0.041	26%	0.259	C	S	.	.			trans	-66.8	173.8	-174.3	0	0	0	0	0	116.2	N325 W327 Y340 V341 R343	N325-G338 PolarHBondContact O-N 3.38Å; W327-G338 VanDerWaalsContact CD1-CA 3.42Å; G338-Y340 PolarHBondContact O-N 3.32Å; G338-Y340 VanDerWaalsContact O-N 3.15Å; G338-V341 PolarHBondContact O-N 2.91Å; G338-R343 PolarHBondContact O-N 2.86Å
339	R	81.8	Confident	88	Confident	74 Å²	74	52.1 Å²	52.1	28%	0.279	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.7	-175.1	-65.7	-177.5	179.6	-157	-4.9	114.7	R343 D371	R339-R343 VanDerWaalsContact O-CG 3.26Å; R339-R343 WeakPolarHBondContact O-CG 3.34Å; R339-R343 PolarHBondContact O-NE 2.82Å; R339-D371 IonicContact CZ-OD1 3.69Å; R339-D371 IonicContact NH1-OD1 3.09Å; R339-D371 PolarHBondContact NH1-OD1 3.45Å; R339-D371 IonicContact NH2-OD1 3.75Å; R339-D371 PolarHBondContact NH2-OD1 3.21Å
340	Y	80.3	Confident	88	Confident	229 Å²	229	56.8 Å²	56.8	90%	0.898	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	1.2	-179.1	-58.2	-72.3	0	0	0	113.7	G338	G338-Y340 PolarHBondContact O-N 3.32Å; G338-Y340 VanDerWaalsContact O-N 3.15Å
341	V	82.6	Confident	88.3	Confident	62 Å²	62	61 Å²	61	38%	0.376	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-105.8	175.8	-169.5	0	0	0	0	108.7	V322 N325 C337 G338	V322-V341 HydrophobicContact CG1-CG1 4.39Å; V322-V341 HydrophobicContact CG2-CG1 4.23Å; N325-V341 HydrophobicContact CB-CG2 4.34Å; C337-V341 HydrophobicContact CB-CB 4.07Å; C337-V341 HydrophobicContact CB-CG1 4.19Å; G338-V341 PolarHBondContact O-N 2.91Å
342	S	84.5	Confident	88.6	Confident	53 Å²	53	59.7 Å²	59.7	37%	0.371	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	5.3	179	-51.3	0	0	0	0	113.1	C337 H344	C337-S342 PolarHBondContact SG-N 2.93Å; C337-S342 VanDerWaalsContact SG-N 3.41Å; S342-H344 VanDerWaalsContact C-N 3.26Å; S342-H344 WeakPolarHBondContact CB-CE1 3.4Å; S342-H344 PolarHBondContact O-N 3.25Å
343	R	89.1	Confident	88.8	Confident	146 Å²	146	62.6 Å²	62.6	55%	0.551	30%	0.296	S	S	*	.			trans	59.4	25.4	175	-44.9	-163.5	169.7	166.9	-0.6	115.7	G338 R339 A345 Y346 K347	G338-R343 PolarHBondContact O-N 2.86Å; R339-R343 VanDerWaalsContact O-CG 3.26Å; R339-R343 WeakPolarHBondContact O-CG 3.34Å; R339-R343 PolarHBondContact O-NE 2.82Å; R343-A345 PolarHBondContact O-N 2.89Å; R343-Y346 WeakPolarHBondContact O-CA 3.16Å; R343-Y346 WeakPolarHBondContact O-CB 3.43Å; R343-Y346 PolarHBondContact O-N 2.86Å; R343-K347 PolarHBondContact O-N 3.27Å
344	H	92.9	Very high	88.9	Confident	15 Å²	15	62.9 Å²	62.9	7%	0.069	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-32.3	179.8	-61.9	143.5	0	0	0	113.3	C317 E319 C320 C337 S342 Y346 K347 H348	C317-H344 PolarHBondContact SG-ND1 3.08Å; C317-H344 VanDerWaalsContact SG-ND1 3.43Å; E319-H344 HydrophobicContact CB-CB 4.33Å; E319-H344 VanDerWaalsContact CD-CD2 3.4Å; E319-H344 HydrophobicContact CG-CB 4.44Å; E319-H344 WeakPolarHBondContact OE1-CB 3.32Å; E319-H344 IonicContact OE1-CD2 3.85Å; E319-H344 IonicContact OE1-CG 2.84Å; E319-H344 IonicContact OE2-CD2 2.76Å; E319-H344 PolarHBondContact OE2-CD2 3.46Å; E319-H344 IonicContact OE2-CE1 2.72Å; E319-H344 IonicContact OE2-CG 2.87Å; E319-H344 IonicContact OE2-NE2 3.21Å; E319-H344 PolarHBondContact OE2-NE2 3.13Å; C320-H344 VanDerWaalsContact SG-CE1 3.57Å; C320-H344 PolarHBondContact SG-ND1 3.5Å; C337-H344 PolarHBondContact O-N 3.24Å; C337-H344 PolarHBondContact SG-ND1 2.97Å; C337-H344 VanDerWaalsContact SG-ND1 3.38Å; S342-H344 VanDerWaalsContact C-N 3.26Å; S342-H344 WeakPolarHBondContact CB-CE1 3.4Å; S342-H344 PolarHBondContact O-N 3.25Å; H344-Y346 VanDerWaalsContact C-N 3.27Å; H344-Y346 PolarHBondContact O-N 2.87Å; H344-K347 PolarHBondContact O-N 2.76Å; H344-H348 VanDerWaalsContact O-CB 3.29Å; H344-H348 WeakPolarHBondContact O-CB 3.23Å; H344-H348 PolarHBondContact O-N 2.88Å
345	A	90.3	Very high	88.8	Confident	5 Å²	5	62.9 Å²	62.9	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-30.1	172.3	0	0	0	0	0	113.3	W327 C337 R343 F349 Y368	W327-A345 HydrophobicContact CB-CB 3.79Å; W327-A345 HydrophobicContact CG-CB 4.26Å; C337-A345 PolarHBondContact O-N 2.99Å; R343-A345 PolarHBondContact O-N 2.89Å; A345-F349 PolarHBondContact O-N 3.1Å; A345-Y368 VanDerWaalsContact CB-OH 3.3Å; A345-Y368 WeakPolarHBondContact CB-OH 3.45Å
346	Y	90	Very high	88.6	Confident	78 Å²	78	62.8 Å²	62.8	31%	0.306	29%	0.289	S	S	.	.	H	α-helix	trans	-81.3	-42.3	176.9	-177.3	-100.3	0	0	0	111.7	R343 H344 H348 F349 E350 Y368	R343-Y346 WeakPolarHBondContact O-CA 3.16Å; R343-Y346 WeakPolarHBondContact O-CB 3.43Å; R343-Y346 PolarHBondContact O-N 2.86Å; H344-Y346 VanDerWaalsContact C-N 3.27Å; H344-Y346 PolarHBondContact O-N 2.87Å; Y346-H348 VanDerWaalsContact C-N 3.29Å; Y346-H348 PolarHBondContact O-N 2.82Å; Y346-F349 HydrophobicContact CD2-CD1 4.23Å; Y346-F349 HydrophobicContact CE2-CD1 4.08Å; Y346-F349 HydrophobicContact CE2-CE1 4.36Å; Y346-F349 WeakPolarHBondContact O-CA 3.16Å; Y346-F349 WeakPolarHBondContact O-CB 3.5Å; Y346-F349 PolarHBondContact O-N 3.08Å; Y346-E350 HydrophobicContact CD1-CG 4.19Å; Y346-E350 HydrophobicContact CE1-CG 3.82Å; Y346-E350 WeakPolarHBondContact CE1-OE1 3.37Å; Y346-E350 PolarHBondContact O-N 3Å; Y346-Y368 AromaticContact CD2-CD1 3.61Å; Y346-Y368 HydrophobicContact CD2-CD1 3.61Å; Y346-Y368 AromaticContact CD2-CE1 3.68Å; Y346-Y368 HydrophobicContact CD2-CE1 3.68Å; Y346-Y368 HydrophobicContact CE2-CD1 4.19Å; Y346-Y368 HydrophobicContact CG-CE1 4.43Å
347	K	90.6	Very high	88.5	Confident	83 Å²	83	63 Å²	63	36%	0.361	29%	0.291	S	S	.	.	H	α-helix	trans	-58.5	-43.4	173.7	-68.7	-172.1	-168.8	166.3	0	111.5	R343 H344 F349 E350 E351	R343-K347 PolarHBondContact O-N 3.27Å; H344-K347 PolarHBondContact O-N 2.76Å; K347-F349 VanDerWaalsContact C-N 3.26Å; K347-F349 PolarHBondContact O-N 3.37Å; K347-E350 PolarHBondContact O-N 3.35Å; K347-E351 WeakPolarHBondContact O-CG 3.37Å; K347-E351 PolarHBondContact O-N 3.37Å
348	H	91.6	Very high	88.4	Confident	17 Å²	17	65.1 Å²	65.1	8%	0.079	30%	0.301	C	S	.	.	H	α-helix	trans	-54.9	-43	173.5	175.6	74.4	0	0	0	111.8	C332 H334 H344 Y346 T352 H354	C332-H348 PolarHBondContact SG-CE1 3.33Å; C332-H348 PolarHBondContact SG-NE2 2.8Å; H334-H348 AromaticContact CD2-CG 3.66Å; H334-H348 AromaticContact CD2-ND1 3.68Å; H334-H348 AromaticContact CG-CE1 3.81Å; H334-H348 AromaticContact CG-CG 4Å; H334-H348 AromaticContact CG-ND1 3.58Å; H344-H348 VanDerWaalsContact O-CB 3.29Å; H344-H348 WeakPolarHBondContact O-CB 3.23Å; H344-H348 PolarHBondContact O-N 2.88Å; Y346-H348 VanDerWaalsContact C-N 3.29Å; Y346-H348 PolarHBondContact O-N 2.82Å; H348-T352 PolarHBondContact CE1-OG1 3.31Å; H348-T352 PolarHBondContact NE2-OG1 2.81Å; H348-T352 WeakPolarHBondContact O-CB 3.18Å; H348-T352 PolarHBondContact O-N 3.42Å; H348-T352 PolarHBondContact O-OG1 2.93Å; H348-H354 AromaticContact CE1-ND1 3.57Å; H348-H354 AromaticContact NE2-CG 3.94Å; H348-H354 AromaticContact NE2-ND1 3.15Å; H348-H354 PolarHBondContact NE2-ND1 3.48Å; H348-H354 VanDerWaalsContact NE2-ND1 3.15Å
349	F	91.1	Very high	88.5	Confident	25 Å²	25	65.8 Å²	65.8	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-46.5	173.5	159	-109.2	0	0	0	112.2	A345 Y346 K347 E351 Q353 H354 T355 Y368	A345-F349 PolarHBondContact O-N 3.1Å; Y346-F349 HydrophobicContact CD2-CD1 4.23Å; Y346-F349 HydrophobicContact CE2-CD1 4.08Å; Y346-F349 HydrophobicContact CE2-CE1 4.36Å; Y346-F349 WeakPolarHBondContact O-CA 3.16Å; Y346-F349 WeakPolarHBondContact O-CB 3.5Å; Y346-F349 PolarHBondContact O-N 3.08Å; K347-F349 VanDerWaalsContact C-N 3.26Å; K347-F349 PolarHBondContact O-N 3.37Å; F349-E351 VanDerWaalsContact C-N 3.3Å; F349-E351 PolarHBondContact O-N 3.15Å; F349-Q353 WeakPolarHBondContact O-CA 3.47Å; F349-Q353 PolarHBondContact O-N 2.92Å; F349-H354 VanDerWaalsContact CD2-O 3.32Å; F349-H354 WeakPolarHBondContact CD2-O 3.38Å; F349-T355 HydrophobicContact CE2-CG2 3.9Å; F349-Y368 HydrophobicContact CB-CD2 3.89Å; F349-Y368 HydrophobicContact CB-CE2 4.38Å; F349-Y368 HydrophobicContact CB-CG 4.02Å; F349-Y368 HydrophobicContact CD1-CD1 4.31Å; F349-Y368 AromaticContact CD1-CG 3.98Å; F349-Y368 HydrophobicContact CD1-CG 3.98Å; F349-Y368 HydrophobicContact CD2-CG 4.39Å; F349-Y368 HydrophobicContact CG-CD2 4.12Å; F349-Y368 AromaticContact CG-CG 3.85Å; F349-Y368 HydrophobicContact CG-CG 3.85Å
350	E	91.4	Very high	88.7	Confident	103 Å²	103	64.4 Å²	64.4	48%	0.481	30%	0.301	S	S	.	.	H	α-helix	trans	-59.5	-41.1	178.9	-70.2	-177.5	127	0	0	112.2	Y346 K347 Q353	Y346-E350 HydrophobicContact CD1-CG 4.19Å; Y346-E350 HydrophobicContact CE1-CG 3.82Å; Y346-E350 WeakPolarHBondContact CE1-OE1 3.37Å; Y346-E350 PolarHBondContact O-N 3Å; K347-E350 PolarHBondContact O-N 3.35Å; E350-Q353 PolarHBondContact O-NE2 2.78Å
351	E	92.5	Very high	88.5	Confident	151 Å²	151	58.2 Å²	58.2	71%	0.706	29%	0.287	S	S	*	.	H	α-helix	trans	-77.2	-40	-177.3	-69.1	175.7	-173.8	0	0	113.3	K347 F349	K347-E351 WeakPolarHBondContact O-CG 3.37Å; K347-E351 PolarHBondContact O-N 3.37Å; F349-E351 VanDerWaalsContact C-N 3.3Å; F349-E351 PolarHBondContact O-N 3.15Å
352	T	89.2	Confident	88.5	Confident	56 Å²	56	58.4 Å²	58.4	34%	0.344	29%	0.286	S	S	.	.	H	α-helix	trans	-106.4	-9.9	-170.7	65.6	0	0	0	0	114.2	H348 H354	H348-T352 PolarHBondContact CE1-OG1 3.31Å; H348-T352 PolarHBondContact NE2-OG1 2.81Å; H348-T352 WeakPolarHBondContact O-CB 3.18Å; H348-T352 PolarHBondContact O-N 3.42Å; H348-T352 PolarHBondContact O-OG1 2.93Å; T352-H354 WeakPolarHBondContact CB-ND1 3.44Å; T352-H354 PolarHBondContact O-N 2.99Å; T352-H354 WeakPolarHBondContact OG1-CB 3.28Å; T352-H354 VanDerWaalsContact OG1-CG 3.24Å; T352-H354 PolarHBondContact OG1-N 2.88Å; T352-H354 PolarHBondContact OG1-ND1 2.76Å
353	Q	89.3	Confident	88.3	Confident	126 Å²	126	62.2 Å²	62.2	59%	0.589	30%	0.298	S	S	*	.			trans	57.8	26.4	-172.8	-59	-62.9	-52.7	0	0	113.3	F349 E350 T355	F349-Q353 WeakPolarHBondContact O-CA 3.47Å; F349-Q353 PolarHBondContact O-N 2.92Å; E350-Q353 PolarHBondContact O-NE2 2.78Å; Q353-T355 PolarHBondContact O-N 2.96Å
354	H	88.3	Confident	88	Confident	43 Å²	43	62.2 Å²	62.2	20%	0.199	30%	0.298	C	S	.	.			trans	-81	101.1	173	-69.4	146.7	0	0	0	111.4	C329 I331 C332 H348 F349 T352 Y356	C329-H354 WeakPolarHBondContact SG-CB 3.25Å; I331-H354 HydrophobicContact CB-CB 4.35Å; I331-H354 HydrophobicContact CD1-CB 3.8Å; I331-H354 WeakPolarHBondContact CG2-CD2 3.37Å; I331-H354 WeakPolarHBondContact CG2-NE2 2.98Å; C332-H354 VanDerWaalsContact CB-CE1 3.47Å; C332-H354 WeakPolarHBondContact CB-CE1 3.19Å; C332-H354 VanDerWaalsContact SG-CE1 3.54Å; C332-H354 PolarHBondContact SG-ND1 2.81Å; C332-H354 VanDerWaalsContact SG-ND1 3.41Å; H348-H354 AromaticContact CE1-ND1 3.57Å; H348-H354 AromaticContact NE2-CG 3.94Å; H348-H354 AromaticContact NE2-ND1 3.15Å; H348-H354 PolarHBondContact NE2-ND1 3.48Å; H348-H354 VanDerWaalsContact NE2-ND1 3.15Å; F349-H354 VanDerWaalsContact CD2-O 3.32Å; F349-H354 WeakPolarHBondContact CD2-O 3.38Å; T352-H354 WeakPolarHBondContact CB-ND1 3.44Å; T352-H354 PolarHBondContact O-N 2.99Å; T352-H354 WeakPolarHBondContact OG1-CB 3.28Å; T352-H354 VanDerWaalsContact OG1-CG 3.24Å; T352-H354 PolarHBondContact OG1-N 2.88Å; T352-H354 PolarHBondContact OG1-ND1 2.76Å; H354-Y356 PolarHBondContact O-N 2.87Å
355	T	88.1	Confident	87.7	Confident	34 Å²	34	62.4 Å²	62.4	21%	0.209	30%	0.3	C	S	.	.			trans	-73.4	-22.6	-168.6	51.3	0	0	0	0	114.7	F349 Q353 Y368 A369	F349-T355 HydrophobicContact CE2-CG2 3.9Å; Q353-T355 PolarHBondContact O-N 2.96Å; T355-Y368 PolarHBondContact O-N 2.88Å; T355-A369 HydrophobicContact CG2-CB 3.81Å
356	Y	86.6	Confident	87.7	Confident	15 Å²	15	63.7 Å²	63.7	6%	0.059	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.2	-172	-59.7	-67.3	0	0	0	113.7	L330 H354 D367 V374 L377 I386	L330-Y356 PolarHBondContact N-O 2.92Å; H354-Y356 PolarHBondContact O-N 2.87Å; Y356-D367 HydrophobicContact CD1-CB 4.1Å; Y356-D367 HydrophobicContact CE1-CB 3.77Å; Y356-D367 VanDerWaalsContact CE1-CG 3.42Å; Y356-D367 VanDerWaalsContact CE1-OD2 3.23Å; Y356-D367 WeakPolarHBondContact CE1-OD2 3.22Å; Y356-D367 PolarHBondContact OH-OD2 2.87Å; Y356-V374 HydrophobicContact CD1-CG2 4.32Å; Y356-V374 HydrophobicContact CE1-CG2 4.09Å; Y356-L377 HydrophobicContact CD1-CD2 4.3Å; Y356-L377 HydrophobicContact CE1-CD2 4.22Å; Y356-I386 HydrophobicContact CD2-CB 4.25Å; Y356-I386 HydrophobicContact CD2-CG2 4.33Å; Y356-I386 HydrophobicContact CE2-CB 4.27Å; Y356-I386 HydrophobicContact CE2-CG2 4.3Å; Y356-I386 VanDerWaalsContact CE2-O 3.25Å; Y356-I386 WeakPolarHBondContact CE2-O 3.3Å
357	A	89.7	Confident	87.7	Confident	5 Å²	5	60.3 Å²	60.3	4%	0.041	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142.2	171.8	0	0	0	0	0	112.3	W327 I328 V365 W366 Y368	W327-A357 HydrophobicContact CB-CB 4.33Å; W327-A357 HydrophobicContact CE3-CB 4.49Å; I328-A357 CarbonylContact O-C 3.49Å; I328-A357 VanDerWaalsContact O-CA 3.27Å; I328-A357 WeakPolarHBondContact O-CA 3.48Å; A357-V365 WeakPolarHBondContact O-CA 3.36Å; A357-W366 PolarHBondContact N-O 2.78Å; A357-W366 VanDerWaalsContact N-O 3.13Å; A357-W366 PolarHBondContact O-N 2.72Å; A357-Y368 HydrophobicContact CB-CD2 4.47Å; A357-Y368 HydrophobicContact CB-CE2 3.67Å
358	M	90.7	Very high	87.4	Confident	44 Å²	44	57 Å²	57	22%	0.217	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133	-179.9	-176.7	178.2	64.3	0	0	111	W327 I328 L330 H363 R364 V365	W327-M358 CarbonylContact C-O 3.59Å; W327-M358 VanDerWaalsContact CA-O 3.28Å; W327-M358 WeakPolarHBondContact CA-O 3.31Å; I328-M358 HydrophobicContact CG2-CB 4.04Å; I328-M358 HydrophobicContact CG2-CE 3.9Å; I328-M358 WeakPolarHBondContact CG2-O 3.31Å; I328-M358 PolarHBondContact N-O 2.66Å; I328-M358 PolarHBondContact O-N 2.88Å; L330-M358 HydrophobicContact CD1-CB 4.45Å; L330-M358 HydrophobicContact CD2-CB 3.94Å; L330-M358 HydrophobicContact CD2-CE 4.41Å; L330-M358 HydrophobicContact CG-CB 4.24Å; M358-H363 HydrophobicContact SD-CB 4.25Å; M358-R364 CarbonylContact C-O 3.51Å; M358-R364 WeakPolarHBondContact CA-O 3.34Å; M358-V365 HydrophobicContact CB-CG2 4.16Å; M358-V365 HydrophobicContact CG-CG2 4.14Å
359	Q	88.7	Confident	87	Confident	18 Å²	18	59.7 Å²	59.7	8%	0.084	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.7	174.5	-171	174.5	17.1	0	0	110.6	L326 W327 T361 N362 H363 R364	L326-Q359 WeakPolarHBondContact O-CA 3.37Å; W327-Q359 HydrophobicContact CD2-CB 4.04Å; W327-Q359 HydrophobicContact CD2-CG 4.4Å; W327-Q359 HydrophobicContact CE3-CB 3.83Å; W327-Q359 HydrophobicContact CH2-CB 3.86Å; W327-Q359 HydrophobicContact CH2-CG 4.35Å; W327-Q359 HydrophobicContact CZ2-CB 4.05Å; W327-Q359 HydrophobicContact CZ2-CG 4.07Å; W327-Q359 HydrophobicContact CZ3-CB 3.73Å; Q359-T361 VanDerWaalsContact C-N 3.3Å; Q359-T361 PolarHBondContact NE2-OG1 2.89Å; Q359-T361 PolarHBondContact O-N 2.83Å; Q359-N362 WeakPolarHBondContact CB-OD1 3.38Å; Q359-N362 PolarHBondContact OE1-ND2 3.47Å; Q359-N362 PolarHBondContact OE1-OD1 2.84Å; Q359-N362 VanDerWaalsContact OE1-OD1 3.1Å; Q359-H363 VanDerWaalsContact O-CA 3.3Å; Q359-H363 WeakPolarHBondContact O-CA 3.12Å; Q359-H363 PolarHBondContact O-N 3.05Å; Q359-R364 PolarHBondContact N-O 2.9Å
360	L	84.9	Confident	86.5	Confident	44 Å²	44	60.3 Å²	60.3	23%	0.23	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-22.6	-174.4	-70.3	-179.9	0	0	0	114.1	N315 L326 I328 I335	N315-L360 HydrophobicContact CB-CD1 3.87Å; L326-L360 HydrophobicContact CB-CB 4.47Å; L326-L360 HydrophobicContact CB-CD1 3.76Å; L326-L360 HydrophobicContact CB-CG 4.3Å; L326-L360 HydrophobicContact CD1-CD1 4.24Å; L326-L360 PolarHBondContact O-N 3.2Å; I328-L360 HydrophobicContact CB-CD2 4.1Å; I328-L360 HydrophobicContact CG2-CD2 3.67Å; I328-L360 HydrophobicContact CG2-CG 4.43Å; I335-L360 HydrophobicContact CG2-CD1 4.35Å
361	T	77.3	Confident	86.1	Confident	99 Å²	99	60.1 Å²	60.1	61%	0.607	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-31.1	-175.3	52.9	0	0	0	0	114.4	Q359	Q359-T361 VanDerWaalsContact C-N 3.3Å; Q359-T361 PolarHBondContact NE2-OG1 2.89Å; Q359-T361 PolarHBondContact O-N 2.83Å
362	N	80.8	Confident	85.6	Confident	67 Å²	67	55.8 Å²	55.8	36%	0.358	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.8	7.2	-173.1	65.6	14.5	0	0	0	113.3	Q359 R364	Q359-N362 WeakPolarHBondContact CB-OD1 3.38Å; Q359-N362 PolarHBondContact OE1-ND2 3.47Å; Q359-N362 PolarHBondContact OE1-OD1 2.84Å; Q359-N362 VanDerWaalsContact OE1-OD1 3.1Å; N362-R364 PolarHBondContact O-N 3.36Å; N362-R364 VanDerWaalsContact O-N 3.07Å; N362-R364 WeakPolarHBondContact OD1-CB 3.36Å; N362-R364 WeakPolarHBondContact OD1-CG 3.47Å; N362-R364 PolarHBondContact OD1-N 3.36Å; N362-R364 VanDerWaalsContact OD1-N 3.12Å
363	H	80.8	Confident	85.3	Confident	133 Å²	133	57.7 Å²	57.7	62%	0.616	30%	0.3	S	S	*	.			trans	54.4	24.8	178	-54	-69.2	0	0	0	115	M358 Q359	M358-H363 HydrophobicContact SD-CB 4.25Å; Q359-H363 VanDerWaalsContact O-CA 3.3Å; Q359-H363 WeakPolarHBondContact O-CA 3.12Å; Q359-H363 PolarHBondContact O-N 3.05Å
364	R	82.3	Confident	84.8	Confident	145 Å²	145	52.9 Å²	52.9	55%	0.547	28%	0.279	S	S	.	.			trans	-81.7	136.1	175.1	-66.1	-176.6	-177.2	-159	0.8	110.5	M358 Q359 N362 Y373	M358-R364 CarbonylContact C-O 3.51Å; M358-R364 WeakPolarHBondContact CA-O 3.34Å; Q359-R364 PolarHBondContact N-O 2.9Å; N362-R364 PolarHBondContact O-N 3.36Å; N362-R364 VanDerWaalsContact O-N 3.07Å; N362-R364 WeakPolarHBondContact OD1-CB 3.36Å; N362-R364 WeakPolarHBondContact OD1-CG 3.47Å; N362-R364 PolarHBondContact OD1-N 3.36Å; N362-R364 VanDerWaalsContact OD1-N 3.12Å; R364-Y373 HydrophobicContact CB-CD1 3.99Å; R364-Y373 HydrophobicContact CB-CE1 3.9Å
365	V	88.3	Confident	83.3	Confident	19 Å²	19	59.8 Å²	59.8	12%	0.115	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.9	177	-171.9	0	0	0	0	110.4	L330 A357 M358 Y373 V374 L377	L330-V365 HydrophobicContact CD1-CG1 3.79Å; L330-V365 HydrophobicContact CD1-CG2 4Å; A357-V365 WeakPolarHBondContact O-CA 3.36Å; M358-V365 HydrophobicContact CB-CG2 4.16Å; M358-V365 HydrophobicContact CG-CG2 4.14Å; V365-Y373 WeakPolarHBondContact O-CA 3.26Å; V365-Y373 WeakPolarHBondContact O-CD1 3.49Å; V365-V374 HydrophobicContact CB-CB 4.46Å; V365-V374 PolarHBondContact O-N 3.1Å; V365-L377 HydrophobicContact CB-CD1 4.45Å; V365-L377 HydrophobicContact CG1-CD1 4.12Å; V365-L377 HydrophobicContact CG2-CD1 4.15Å
366	W	89.6	Confident	81.8	Confident	33 Å²	33	68.3 Å²	68.3	13%	0.125	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.7	174.5	-173.7	-85.2	0	0	0	110.3	W327 A357 Y368 D371 Y373	W327-W366 HydrophobicContact CE3-CB 4.29Å; W327-W366 HydrophobicContact CH2-CB 4.31Å; W327-W366 HydrophobicContact CZ3-CB 3.59Å; W327-W366 HydrophobicContact CZ3-CG 4.48Å; A357-W366 PolarHBondContact N-O 2.78Å; A357-W366 VanDerWaalsContact N-O 3.13Å; A357-W366 PolarHBondContact O-N 2.72Å; W366-Y368 AromaticContact CD1-CD1 3.73Å; W366-Y368 AromaticContact CD1-CE1 3.87Å; W366-Y368 AromaticContact CD1-CG 3.91Å; W366-Y368 AromaticContact NE1-CD1 3.88Å; W366-D371 VanDerWaalsContact CZ2-C 3.42Å; W366-D371 HydrophobicContact CZ2-CB 4.49Å; W366-D371 WeakPolarHBondContact CZ2-O 3.44Å; W366-D371 VanDerWaalsContact CZ2-OD1 3.31Å; W366-D371 WeakPolarHBondContact CZ2-OD1 3.28Å; W366-Y373 AromaticContact CE3-CD1 3.73Å; W366-Y373 HydrophobicContact CE3-CD1 3.73Å; W366-Y373 AromaticContact CE3-CD2 3.77Å; W366-Y373 HydrophobicContact CE3-CD2 3.77Å; W366-Y373 AromaticContact CE3-CE1 3.59Å; W366-Y373 HydrophobicContact CE3-CE1 3.59Å; W366-Y373 AromaticContact CE3-CE2 3.63Å; W366-Y373 HydrophobicContact CE3-CE2 3.63Å; W366-Y373 AromaticContact CE3-CG 3.8Å; W366-Y373 HydrophobicContact CE3-CG 3.8Å; W366-Y373 AromaticContact CE3-CZ 3.5Å; W366-Y373 VanDerWaalsContact CE3-CZ 3.5Å; W366-Y373 HydrophobicContact CZ3-CD1 4.32Å; W366-Y373 AromaticContact CZ3-CD2 3.48Å; W366-Y373 HydrophobicContact CZ3-CD2 3.48Å; W366-Y373 VanDerWaalsContact CZ3-CD2 3.48Å; W366-Y373 HydrophobicContact CZ3-CE1 4.2Å; W366-Y373 AromaticContact CZ3-CE2 3.32Å; W366-Y373 HydrophobicContact CZ3-CE2 3.32Å; W366-Y373 AromaticContact CZ3-CG 3.98Å; W366-Y373 HydrophobicContact CZ3-CG 3.98Å; W366-Y373 AromaticContact CZ3-CZ 3.68Å
367	D	89.3	Confident	80.2	Confident	6 Å²	6	70.4 Å²	70.4	3%	0.032	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	116.6	168	-170.7	-19.8	0	0	0	109.5	Y356 A369 G370 D371 N372 V374	Y356-D367 HydrophobicContact CD1-CB 4.1Å; Y356-D367 HydrophobicContact CE1-CB 3.77Å; Y356-D367 VanDerWaalsContact CE1-CG 3.42Å; Y356-D367 VanDerWaalsContact CE1-OD2 3.23Å; Y356-D367 WeakPolarHBondContact CE1-OD2 3.22Å; Y356-D367 PolarHBondContact OH-OD2 2.87Å; D367-A369 WeakPolarHBondContact OD1-CA 3.32Å; D367-A369 WeakPolarHBondContact OD1-CB 3.41Å; D367-A369 PolarHBondContact OD1-N 2.87Å; D367-G370 VanDerWaalsContact CG-N 3.35Å; D367-G370 PolarHBondContact OD1-N 3.04Å; D367-D371 VanDerWaalsContact O-CA 3.3Å; D367-D371 WeakPolarHBondContact O-CA 3.02Å; D367-D371 PolarHBondContact O-N 3.04Å; D367-N372 PolarHBondContact N-O 3.23Å; D367-N372 PolarHBondContact O-N 2.57Å; D367-V374 HydrophobicContact CB-CG2 3.77Å
368	Y	85.6	Confident	78.5	Confident	15 Å²	15	74.2 Å²	74.2	6%	0.059	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-24.1	176.9	-74.8	-71	0	0	0	113.7	A345 Y346 F349 T355 A357 W366	A345-Y368 VanDerWaalsContact CB-OH 3.3Å; A345-Y368 WeakPolarHBondContact CB-OH 3.45Å; Y346-Y368 AromaticContact CD2-CD1 3.61Å; Y346-Y368 HydrophobicContact CD2-CD1 3.61Å; Y346-Y368 AromaticContact CD2-CE1 3.68Å; Y346-Y368 HydrophobicContact CD2-CE1 3.68Å; Y346-Y368 HydrophobicContact CE2-CD1 4.19Å; Y346-Y368 HydrophobicContact CG-CE1 4.43Å; F349-Y368 HydrophobicContact CB-CD2 3.89Å; F349-Y368 HydrophobicContact CB-CE2 4.38Å; F349-Y368 HydrophobicContact CB-CG 4.02Å; F349-Y368 HydrophobicContact CD1-CD1 4.31Å; F349-Y368 AromaticContact CD1-CG 3.98Å; F349-Y368 HydrophobicContact CD1-CG 3.98Å; F349-Y368 HydrophobicContact CD2-CG 4.39Å; F349-Y368 HydrophobicContact CG-CD2 4.12Å; F349-Y368 AromaticContact CG-CG 3.85Å; F349-Y368 HydrophobicContact CG-CG 3.85Å; T355-Y368 PolarHBondContact O-N 2.88Å; A357-Y368 HydrophobicContact CB-CD2 4.47Å; A357-Y368 HydrophobicContact CB-CE2 3.67Å; W366-Y368 AromaticContact CD1-CD1 3.73Å; W366-Y368 AromaticContact CD1-CE1 3.87Å; W366-Y368 AromaticContact CD1-CG 3.91Å; W366-Y368 AromaticContact NE1-CD1 3.88Å
369	A	83.1	Confident	76.1	Confident	72 Å²	72	75.4 Å²	75.4	60%	0.595	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-40.7	175.2	0	0	0	0	0	111.6	T355 D367	T355-A369 HydrophobicContact CG2-CB 3.81Å; D367-A369 WeakPolarHBondContact OD1-CA 3.32Å; D367-A369 WeakPolarHBondContact OD1-CB 3.41Å; D367-A369 PolarHBondContact OD1-N 2.87Å
370	G	79.3	Confident	73.9	Confident	39 Å²	39	77.6 Å²	77.6	40%	0.402	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-9.6	177	0	0	0	0	0	115.3	D367 N372	D367-G370 VanDerWaalsContact CG-N 3.35Å; D367-G370 PolarHBondContact OD1-N 3.04Å; G370-N372 PolarHBondContact O-N 3.5Å; G370-N372 PolarHBondContact O-OD1 3.23Å
371	D	83.1	Confident	72	Confident	98 Å²	98	85.6 Å²	85.6	52%	0.524	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.4	39.7	-174.3	-154.8	49	0	0	0	113.8	R339 W366 D367	R339-D371 IonicContact CZ-OD1 3.69Å; R339-D371 IonicContact NH1-OD1 3.09Å; R339-D371 PolarHBondContact NH1-OD1 3.45Å; R339-D371 IonicContact NH2-OD1 3.75Å; R339-D371 PolarHBondContact NH2-OD1 3.21Å; W366-D371 VanDerWaalsContact CZ2-C 3.42Å; W366-D371 HydrophobicContact CZ2-CB 4.49Å; W366-D371 WeakPolarHBondContact CZ2-O 3.44Å; W366-D371 VanDerWaalsContact CZ2-OD1 3.31Å; W366-D371 WeakPolarHBondContact CZ2-OD1 3.28Å; D367-D371 VanDerWaalsContact O-CA 3.3Å; D367-D371 WeakPolarHBondContact O-CA 3.02Å; D367-D371 PolarHBondContact O-N 3.04Å
372	N	83.1	Confident	70.2	Confident	60 Å²	60	87.1 Å²	87.1	32%	0.321	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	165.2	-176.3	62.1	-13.8	0	0	0	112	D367 G370	D367-N372 PolarHBondContact N-O 3.23Å; D367-N372 PolarHBondContact O-N 2.57Å; G370-N372 PolarHBondContact O-N 3.5Å; G370-N372 PolarHBondContact O-OD1 3.23Å
373	Y	82.2	Confident	68.7	Low	97 Å²	97	89.7 Å²	89.7	38%	0.38	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	132.1	171.5	-77.4	-76.7	0	0	0	110.4	W327 R364 V365 W366	W327-Y373 HydrophobicContact CH2-CE1 4.27Å; R364-Y373 HydrophobicContact CB-CD1 3.99Å; R364-Y373 HydrophobicContact CB-CE1 3.9Å; V365-Y373 WeakPolarHBondContact O-CA 3.26Å; V365-Y373 WeakPolarHBondContact O-CD1 3.49Å; W366-Y373 AromaticContact CE3-CD1 3.73Å; W366-Y373 HydrophobicContact CE3-CD1 3.73Å; W366-Y373 AromaticContact CE3-CD2 3.77Å; W366-Y373 HydrophobicContact CE3-CD2 3.77Å; W366-Y373 AromaticContact CE3-CE1 3.59Å; W366-Y373 HydrophobicContact CE3-CE1 3.59Å; W366-Y373 AromaticContact CE3-CE2 3.63Å; W366-Y373 HydrophobicContact CE3-CE2 3.63Å; W366-Y373 AromaticContact CE3-CG 3.8Å; W366-Y373 HydrophobicContact CE3-CG 3.8Å; W366-Y373 AromaticContact CE3-CZ 3.5Å; W366-Y373 VanDerWaalsContact CE3-CZ 3.5Å; W366-Y373 HydrophobicContact CZ3-CD1 4.32Å; W366-Y373 AromaticContact CZ3-CD2 3.48Å; W366-Y373 HydrophobicContact CZ3-CD2 3.48Å; W366-Y373 VanDerWaalsContact CZ3-CD2 3.48Å; W366-Y373 HydrophobicContact CZ3-CE1 4.2Å; W366-Y373 AromaticContact CZ3-CE2 3.32Å; W366-Y373 HydrophobicContact CZ3-CE2 3.32Å; W366-Y373 AromaticContact CZ3-CG 3.98Å; W366-Y373 HydrophobicContact CZ3-CG 3.98Å; W366-Y373 AromaticContact CZ3-CZ 3.68Å
374	V	79.8	Confident	67.2	Low	24 Å²	24	86.2 Å²	86.2	15%	0.145	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.6	178.6	-173.7	0	0	0	0	110.4	Y356 V365 D367 R376 L377	Y356-V374 HydrophobicContact CD1-CG2 4.32Å; Y356-V374 HydrophobicContact CE1-CG2 4.09Å; V365-V374 HydrophobicContact CB-CB 4.46Å; V365-V374 PolarHBondContact O-N 3.1Å; D367-V374 HydrophobicContact CB-CG2 3.77Å; V374-R376 WeakPolarHBondContact CG1-O 3.27Å; V374-L377 HydrophobicContact CB-CD2 4.28Å; V374-L377 HydrophobicContact CG1-CD2 3.59Å; V374-L377 HydrophobicContact CG1-CG 3.88Å; V374-L377 HydrophobicContact CG2-CD2 4.38Å
375	H	56.6	Low	65.5	Low	189 Å²	189	86.3 Å²	86.3	88%	0.875	47%	0.469	S	S	*	.	S	Bend	trans	-92	-14.9	178.7	-87	-93	0	0	0	114.1
376	R	55.4	Low	63.6	Low	212 Å²	212	87.7 Å²	87.7	80%	0.8	48%	0.475	S	S	*	.			trans	-162.3	128.6	174.6	-168.6	176.4	-67.2	-146.1	-0	111.3	V374 V378	V374-R376 WeakPolarHBondContact CG1-O 3.27Å; R376-V378 HydrophobicContact CG-CG2 4.49Å
377	L	54.8	Low	61.7	Low	59 Å²	59	90.3 Å²	90.3	31%	0.309	49%	0.494	S	S	.	.			trans	-108.5	133.5	173.5	-64.3	165.9	0	0	0	109.4	L330 Y356 V365 V374 I386	L330-L377 HydrophobicContact CD1-CD1 3.89Å; Y356-L377 HydrophobicContact CD1-CD2 4.3Å; Y356-L377 HydrophobicContact CE1-CD2 4.22Å; V365-L377 HydrophobicContact CB-CD1 4.45Å; V365-L377 HydrophobicContact CG1-CD1 4.12Å; V365-L377 HydrophobicContact CG2-CD1 4.15Å; V374-L377 HydrophobicContact CB-CD2 4.28Å; V374-L377 HydrophobicContact CG1-CD2 3.59Å; V374-L377 HydrophobicContact CG1-CG 3.88Å; V374-L377 HydrophobicContact CG2-CD2 4.38Å; L377-I386 HydrophobicContact CB-CG2 4.07Å; L377-I386 HydrophobicContact CD1-CG2 4.41Å; L377-I386 HydrophobicContact CD2-CG2 3.64Å; L377-I386 HydrophobicContact CG-CG2 4.25Å
378	V	52.4	Low	59.5	Low	86 Å²	86	93.2 Å²	93.2	52%	0.521	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.3	173.6	-175.3	0	0	0	0	108.2	R376	R376-V378 HydrophobicContact CG-CG2 4.49Å
379	A	39.8	Very low	57.5	Low	68 Å²	68	100 Å²	100	56%	0.562	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	127.2	178.7	0	0	0	0	0	110.5
380	S	43.8	Very low	55.5	Low	64 Å²	64	104.4 Å²	104.4	45%	0.448	54%	0.543	S	S	.	.			trans	-69.4	131.9	172.4	-178.6	0	0	0	0	110.4	T382 G384	S380-T382 VanDerWaalsContact C-N 3.26Å; S380-T382 PolarHBondContact O-N 2.98Å; S380-G384 PolarHBondContact O-N 2.96Å
381	K	44	Very low	53.8	Low	213 Å²	213	106.1 Å²	106.1	93%	0.926	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-11.1	-171.7	-73.4	-176.1	178.6	176.7	0	115.1
382	T	39.9	Very low	52.1	Low	131 Å²	131	111 Å²	111	80%	0.804	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-18	-171.7	47.4	0	0	0	0	115.2	S380	S380-T382 VanDerWaalsContact C-N 3.26Å; S380-T382 PolarHBondContact O-N 2.98Å
383	D	48.8	Very low	50.4	Low	121 Å²	121	111.4 Å²	111.4	65%	0.647	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.4	4.2	-175.6	-155.6	29.3	0	0	0	114.5	K385	D383-K385 PolarHBondContact O-N 3.23Å
384	G	51	Low	48.7	Very low	60 Å²	60	111.7 Å²	111.7	62%	0.619	59%	0.594	S	S	*	*			trans	64.6	-6.4	174.3	0	0	0	0	0	116.2	S380 I386	S380-G384 PolarHBondContact O-N 2.96Å; G384-I386 PolarHBondContact O-N 2.85Å
385	K	46.2	Very low	47.2	Very low	147 Å²	147	115.7 Å²	115.7	64%	0.639	62%	0.619	S	S	*	*			trans	-68.2	126.8	172	-89.7	-179.6	175.5	176	0	110.5	D383 V387	D383-K385 PolarHBondContact O-N 3.23Å; K385-V387 HydrophobicContact CB-CG2 4.35Å
386	I	48.3	Very low	46.8	Very low	47 Å²	47	110.9 Å²	110.9	24%	0.241	61%	0.606	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-80	118.7	174.2	-52.2	167.5	0	0	0	106	L330 Y356 L377 G384	L330-I386 HydrophobicContact CB-CD1 4.46Å; Y356-I386 HydrophobicContact CD2-CB 4.25Å; Y356-I386 HydrophobicContact CD2-CG2 4.33Å; Y356-I386 HydrophobicContact CE2-CB 4.27Å; Y356-I386 HydrophobicContact CE2-CG2 4.3Å; Y356-I386 VanDerWaalsContact CE2-O 3.25Å; Y356-I386 WeakPolarHBondContact CE2-O 3.3Å; L377-I386 HydrophobicContact CB-CG2 4.07Å; L377-I386 HydrophobicContact CD1-CG2 4.41Å; L377-I386 HydrophobicContact CD2-CG2 3.64Å; L377-I386 HydrophobicContact CG-CG2 4.25Å; G384-I386 PolarHBondContact O-N 2.85Å
387	V	49.7	Very low	46.5	Very low	88 Å²	88	107.1 Å²	107.1	53%	0.533	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.2	138.6	-177.8	-170.3	0	0	0	0	108.4	K385 Y389	K385-V387 HydrophobicContact CB-CG2 4.35Å; V387-Y389 PolarHBondContact O-N 2.91Å
388	Q	43.7	Very low	46.3	Very low	67 Å²	67	107.5 Å²	107.5	31%	0.313	60%	0.597	S	S	.	*			trans	-65	126.7	168.9	-178.4	174.8	-29.8	0	0	109	E390	Q388-E390 PolarHBondContact O-N 2.76Å
389	Y	43.6	Very low	46.4	Very low	159 Å²	159	109.8 Å²	109.8	62%	0.624	60%	0.602	S	S	*	*			trans	-67.7	97.5	178.2	-170.7	-102.2	0	0	0	109.8	V387 C391 E398	V387-Y389 PolarHBondContact O-N 2.91Å; Y389-C391 HydrophobicContact CE1-CB 4.24Å; Y389-C391 WeakPolarHBondContact CE1-SG 3.44Å; Y389-C391 PolarHBondContact OH-SG 3.24Å; Y389-E398 PolarHBondContact OH-OE1 2.94Å
390	E	41.1	Very low	47.3	Very low	163 Å²	163	113.2 Å²	113.2	76%	0.762	61%	0.605	S	S	*	*			trans	-102	106.3	164.1	-69.4	-171.9	166.5	0	0	108.1	Q388 E392	Q388-E390 PolarHBondContact O-N 2.76Å; E390-E392 PolarHBondContact O-N 2.87Å
391	C	43.5	Very low	48.3	Very low	76 Å²	76	114.9 Å²	114.9	51%	0.514	61%	0.607	S	S	.	*			trans	-73.6	100.9	174.1	-102.3	0	0	0	0	109.9	Y389	Y389-C391 HydrophobicContact CE1-CB 4.24Å; Y389-C391 WeakPolarHBondContact CE1-SG 3.44Å; Y389-C391 PolarHBondContact OH-SG 3.24Å
392	E	47.2	Very low	49.4	Very low	199 Å²	199	108.9 Å²	108.9	93%	0.93	59%	0.586	S	S	*	*			trans	-146.4	91.8	155	-69.5	-162.4	164.8	0	0	111.4	E390	E390-E392 PolarHBondContact O-N 2.87Å
393	G	46.3	Very low	51	Low	70 Å²	70	105 Å²	105	72%	0.722	57%	0.567	S	S	*	*			trans	105.9	79.4	144.1	0	0	0	0	0	119
394	D	46.2	Very low	52.1	Low	103 Å²	103	105.3 Å²	105.3	55%	0.551	57%	0.568	S	S	*	*			trans	-147.7	67.7	148.2	-154.5	6.3	0	0	0	111.7	C396 E398	D394-C396 PolarHBondContact O-N 3.37Å; D394-E398 WeakPolarHBondContact O-CB 3.34Å; D394-E398 PolarHBondContact O-N 3.35Å
395	T	47.9	Very low	53.2	Low	107 Å²	107	108.3 Å²	108.3	66%	0.656	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	5.3	-167.8	45.4	0	0	0	0	116.5	E399	T395-E399 WeakPolarHBondContact O-CG 3.39Å
396	C	48.4	Very low	54.9	Low	89 Å²	89	107.2 Å²	107.2	60%	0.601	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.2	-20.6	-176.8	-159.2	0	0	0	0	115.3	D394	D394-C396 PolarHBondContact O-N 3.37Å
397	Q	50.6	Low	56.4	Low	133 Å²	133	111 Å²	111	62%	0.621	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-30.3	172.8	-66.2	-166	11	0	0	112.5	K400 I401	Q397-K400 PolarHBondContact O-N 3.45Å; Q397-I401 WeakPolarHBondContact O-CG1 3.06Å; Q397-I401 PolarHBondContact O-N 3.42Å
398	E	50.2	Low	57.9	Low	66 Å²	66	114 Å²	114	31%	0.308	59%	0.585	S	S	.	*	H	α-helix	trans	-65.3	-43	177.2	-153.9	168.9	-157.9	0	0	111.1	Y389 D394 K400 I401 D402	Y389-E398 PolarHBondContact OH-OE1 2.94Å; D394-E398 WeakPolarHBondContact O-CB 3.34Å; D394-E398 PolarHBondContact O-N 3.35Å; E398-K400 VanDerWaalsContact C-N 3.25Å; E398-K400 PolarHBondContact O-N 2.83Å; E398-I401 PolarHBondContact O-N 3.15Å; E398-I401 VanDerWaalsContact O-N 3.14Å; E398-D402 VanDerWaalsContact O-CB 3.27Å; E398-D402 WeakPolarHBondContact O-CB 3.36Å; E398-D402 PolarHBondContact O-N 3.1Å
399	E	54.5	Low	59.9	Low	134 Å²	134	113.6 Å²	113.6	63%	0.626	59%	0.59	S	S	*	*	H	α-helix	trans	-60.2	-32.4	174.7	-67.7	-177.1	172.3	0	0	113.3	T395 A403	T395-E399 WeakPolarHBondContact O-CG 3.39Å; E399-A403 WeakPolarHBondContact O-CB 3.48Å; E399-A403 PolarHBondContact O-N 3.35Å
400	K	58.8	Low	62.1	Low	141 Å²	141	113.8 Å²	113.8	61%	0.613	59%	0.591	S	S	*	*	H	α-helix	trans	-78.5	-37	176.7	-74.2	179.1	-177.5	169.7	0	112.1	Q397 E398 L404	Q397-K400 PolarHBondContact O-N 3.45Å; E398-K400 VanDerWaalsContact C-N 3.25Å; E398-K400 PolarHBondContact O-N 2.83Å; K400-L404 VanDerWaalsContact O-CB 3.31Å; K400-L404 WeakPolarHBondContact O-CB 3.38Å; K400-L404 WeakPolarHBondContact O-CG 3.33Å; K400-L404 PolarHBondContact O-N 3.42Å
401	I	63.7	Low	64.4	Low	98 Å²	98	110.8 Å²	110.8	50%	0.503	58%	0.579	S	S	.	*	H	α-helix	trans	-70.8	-41.3	175.9	-69.5	171.1	0	0	0	109.8	Q397 E398 L404 Q405	Q397-I401 WeakPolarHBondContact O-CG1 3.06Å; Q397-I401 PolarHBondContact O-N 3.42Å; E398-I401 PolarHBondContact O-N 3.15Å; E398-I401 VanDerWaalsContact O-N 3.14Å; I401-L404 CarbonylContact O-C 3.52Å; I401-L404 PolarHBondContact O-N 2.94Å; I401-Q405 WeakPolarHBondContact O-CB 3.17Å; I401-Q405 PolarHBondContact O-N 3.02Å
402	D	67.9	Low	66.6	Low	88 Å²	88	111.1 Å²	111.1	47%	0.471	58%	0.576	S	S	.	*	H	α-helix	trans	-66.3	-40.4	173.6	-76.9	-15.1	0	0	0	111.4	E398 Q405 L406	E398-D402 VanDerWaalsContact O-CB 3.27Å; E398-D402 WeakPolarHBondContact O-CB 3.36Å; E398-D402 PolarHBondContact O-N 3.1Å; D402-Q405 PolarHBondContact O-N 3.35Å; D402-L406 WeakPolarHBondContact O-CB 3.45Å; D402-L406 PolarHBondContact O-N 3.37Å
403	A	72.6	Confident	68.6	Low	50 Å²	50	105.4 Å²	105.4	41%	0.413	55%	0.554	S	S	.	*	H	α-helix	trans	-61.8	-45.6	171.3	0	0	0	0	0	111.3	E399 Q405 L406 E407	E399-A403 WeakPolarHBondContact O-CB 3.48Å; E399-A403 PolarHBondContact O-N 3.35Å; A403-Q405 PolarHBondContact O-N 3.32Å; A403-L406 PolarHBondContact O-N 3.15Å; A403-E407 WeakPolarHBondContact O-CB 3.49Å; A403-E407 VanDerWaalsContact O-CG 3.25Å; A403-E407 WeakPolarHBondContact O-CG 3.45Å; A403-E407 PolarHBondContact O-N 3.08Å
404	L	71.8	Confident	70.8	Confident	126 Å²	126	104.6 Å²	104.6	66%	0.66	54%	0.538	S	S	*	.	H	α-helix	trans	-66.2	-36	176.6	-76.2	169	0	0	0	112.6	K400 I401 Y408	K400-L404 VanDerWaalsContact O-CB 3.31Å; K400-L404 WeakPolarHBondContact O-CB 3.38Å; K400-L404 WeakPolarHBondContact O-CG 3.33Å; K400-L404 PolarHBondContact O-N 3.42Å; I401-L404 CarbonylContact O-C 3.52Å; I401-L404 PolarHBondContact O-N 2.94Å; L404-Y408 VanDerWaalsContact O-CB 3.24Å; L404-Y408 WeakPolarHBondContact O-CB 3.45Å; L404-Y408 PolarHBondContact O-N 3.11Å
405	Q	75.6	Confident	73	Confident	124 Å²	124	105 Å²	105	58%	0.579	54%	0.536	S	S	*	.	H	α-helix	trans	-71.9	-35	176.9	-174.9	170.4	-23.3	0	0	111.1	I401 D402 A403 S409	I401-Q405 WeakPolarHBondContact O-CB 3.17Å; I401-Q405 PolarHBondContact O-N 3.02Å; D402-Q405 PolarHBondContact O-N 3.35Å; A403-Q405 PolarHBondContact O-N 3.32Å; Q405-S409 WeakPolarHBondContact O-CB 3.49Å; Q405-S409 PolarHBondContact O-N 2.95Å
406	L	80.7	Confident	75.1	Confident	123 Å²	123	104.5 Å²	104.5	64%	0.644	53%	0.529	S	S	*	.	H	α-helix	trans	-67.9	-44.8	172.4	-172.7	69.2	0	0	0	111	D402 A403 S409 Y410	D402-L406 WeakPolarHBondContact O-CB 3.45Å; D402-L406 PolarHBondContact O-N 3.37Å; A403-L406 PolarHBondContact O-N 3.15Å; L406-S409 PolarHBondContact O-N 3.45Å; L406-Y410 VanDerWaalsContact O-CB 3.25Å; L406-Y410 WeakPolarHBondContact O-CB 3.44Å; L406-Y410 PolarHBondContact O-N 3.26Å
407	E	81.1	Confident	77.2	Confident	126 Å²	126	104.3 Å²	104.3	59%	0.589	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-41.6	174.4	-72.2	-63.6	155.9	0	0	111.6	A403 Y410 L411	A403-E407 WeakPolarHBondContact O-CB 3.49Å; A403-E407 VanDerWaalsContact O-CG 3.25Å; A403-E407 WeakPolarHBondContact O-CG 3.45Å; A403-E407 PolarHBondContact O-N 3.08Å; E407-Y410 PolarHBondContact O-N 2.79Å; E407-L411 VanDerWaalsContact O-CB 3.29Å; E407-L411 WeakPolarHBondContact O-CB 3.44Å; E407-L411 PolarHBondContact O-N 2.92Å
408	Y	80.4	Confident	79.3	Confident	152 Å²	152	101.4 Å²	101.4	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-66.4	-42.4	175	-178.9	-105.6	0	0	0	112	L404 Y410 L411 L412	L404-Y408 VanDerWaalsContact O-CB 3.24Å; L404-Y408 WeakPolarHBondContact O-CB 3.45Å; L404-Y408 PolarHBondContact O-N 3.11Å; Y408-Y410 VanDerWaalsContact C-N 3.34Å; Y408-L411 PolarHBondContact O-N 2.84Å; Y408-L412 VanDerWaalsContact O-CB 3.31Å; Y408-L412 WeakPolarHBondContact O-CB 3.27Å; Y408-L412 PolarHBondContact O-N 3.11Å
409	S	86.9	Confident	81.3	Confident	59 Å²	59	102.9 Å²	102.9	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-42.1	174.8	-175.8	0	0	0	0	111.3	Q405 L406 L412 T413	Q405-S409 WeakPolarHBondContact O-CB 3.49Å; Q405-S409 PolarHBondContact O-N 2.95Å; L406-S409 PolarHBondContact O-N 3.45Å; S409-L412 PolarHBondContact O-N 2.77Å; S409-T413 WeakPolarHBondContact O-CB 3.47Å; S409-T413 PolarHBondContact O-N 2.84Å; S409-T413 PolarHBondContact O-OG1 3.07Å
410	Y	87.9	Confident	83.2	Confident	162 Å²	162	102.9 Å²	102.9	64%	0.635	52%	0.515	S	S	*	.	H	α-helix	trans	-65.6	-42.6	175.8	-174	-101	0	0	0	111.8	L406 E407 Y408 T413 S414	L406-Y410 VanDerWaalsContact O-CB 3.25Å; L406-Y410 WeakPolarHBondContact O-CB 3.44Å; L406-Y410 PolarHBondContact O-N 3.26Å; E407-Y410 PolarHBondContact O-N 2.79Å; Y408-Y410 VanDerWaalsContact C-N 3.34Å; Y410-T413 WeakPolarHBondContact CA-OG1 3.47Å; Y410-T413 PolarHBondContact O-OG1 3.16Å; Y410-S414 WeakPolarHBondContact O-CB 3.49Å; Y410-S414 PolarHBondContact O-N 3.43Å
411	L	90.5	Very high	85	Confident	100 Å²	100	99.8 Å²	99.8	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-44.9	174.9	-174.8	69	0	0	0	111.1	E407 Y408 S414 Q415	E407-L411 VanDerWaalsContact O-CB 3.29Å; E407-L411 WeakPolarHBondContact O-CB 3.44Å; E407-L411 PolarHBondContact O-N 2.92Å; Y408-L411 PolarHBondContact O-N 2.84Å; L411-S414 PolarHBondContact O-N 2.86Å; L411-Q415 VanDerWaalsContact O-CB 3.26Å; L411-Q415 WeakPolarHBondContact O-CB 3.43Å; L411-Q415 PolarHBondContact O-N 2.89Å
412	L	89.2	Confident	86.5	Confident	84 Å²	84	100.9 Å²	100.9	44%	0.44	50%	0.503	S	S	.	.	H	α-helix	trans	-64.8	-46.5	178.8	-173.7	70.4	0	0	0	111.3	Y408 S409 Q415 L416	Y408-L412 VanDerWaalsContact O-CB 3.31Å; Y408-L412 WeakPolarHBondContact O-CB 3.27Å; Y408-L412 PolarHBondContact O-N 3.11Å; S409-L412 PolarHBondContact O-N 2.77Å; L412-Q415 PolarHBondContact O-N 3.27Å; L412-L416 HydrophobicContact CG-CD1 4.22Å; L412-L416 WeakPolarHBondContact O-CB 3.25Å; L412-L416 VanDerWaalsContact O-CG 3.3Å; L412-L416 WeakPolarHBondContact O-CG 3.04Å; L412-L416 PolarHBondContact O-N 3.33Å
413	T	90.1	Very high	87.8	Confident	78 Å²	78	103.1 Å²	103.1	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-65.1	-41.6	175.8	35.6	0	0	0	0	111.8	S409 Y410 Q415 L416 E417	S409-T413 WeakPolarHBondContact O-CB 3.47Å; S409-T413 PolarHBondContact O-N 2.84Å; S409-T413 PolarHBondContact O-OG1 3.07Å; Y410-T413 WeakPolarHBondContact CA-OG1 3.47Å; Y410-T413 PolarHBondContact O-OG1 3.16Å; T413-Q415 VanDerWaalsContact C-N 3.3Å; T413-Q415 PolarHBondContact O-N 2.96Å; T413-L416 PolarHBondContact O-N 2.99Å; T413-E417 VanDerWaalsContact O-CB 3.25Å; T413-E417 WeakPolarHBondContact O-CB 3.43Å; T413-E417 PolarHBondContact O-N 2.83Å
414	S	92.3	Very high	89	Confident	54 Å²	54	104.8 Å²	104.8	38%	0.378	50%	0.504	S	S	.	.	H	α-helix	trans	-59.5	-40.9	173.9	-179.7	0	0	0	0	111.9	Y410 L411 S418	Y410-S414 WeakPolarHBondContact O-CB 3.49Å; Y410-S414 PolarHBondContact O-N 3.43Å; L411-S414 PolarHBondContact O-N 2.86Å; S414-S418 WeakPolarHBondContact O-CB 3.5Å; S414-S418 PolarHBondContact O-N 2.78Å; S414-S418 PolarHBondContact O-OG 3.09Å
415	Q	92.7	Very high	90.2	Very high	110 Å²	110	102.7 Å²	102.7	51%	0.514	49%	0.494	S	S	.	.	H	α-helix	trans	-72.2	-41.4	179.2	-167.1	131.4	13.5	0	0	112.3	L411 L412 T413 S418 Q419	L411-Q415 VanDerWaalsContact O-CB 3.26Å; L411-Q415 WeakPolarHBondContact O-CB 3.43Å; L411-Q415 PolarHBondContact O-N 2.89Å; L412-Q415 PolarHBondContact O-N 3.27Å; T413-Q415 VanDerWaalsContact C-N 3.3Å; T413-Q415 PolarHBondContact O-N 2.96Å; Q415-S418 PolarHBondContact O-N 3.37Å; Q415-Q419 WeakPolarHBondContact O-CG 3.45Å; Q415-Q419 PolarHBondContact O-N 2.77Å
416	L	91.5	Very high	91.1	Very high	97 Å²	97	100.5 Å²	100.5	51%	0.508	48%	0.482	S	S	.	.	H	α-helix	trans	-64.6	-40.8	174.1	-72	174.6	0	0	0	111.6	L412 T413 Q419 R420	L412-L416 HydrophobicContact CG-CD1 4.22Å; L412-L416 WeakPolarHBondContact O-CB 3.25Å; L412-L416 VanDerWaalsContact O-CG 3.3Å; L412-L416 WeakPolarHBondContact O-CG 3.04Å; L412-L416 PolarHBondContact O-N 3.33Å; T413-L416 PolarHBondContact O-N 2.99Å; L416-Q419 PolarHBondContact O-N 2.8Å; L416-R420 WeakPolarHBondContact O-CB 3.46Å; L416-R420 PolarHBondContact O-N 3.27Å
417	E	92.8	Very high	91.8	Very high	85 Å²	85	98.9 Å²	98.9	40%	0.397	47%	0.473	S	S	.	.	H	α-helix	trans	-66.2	-40.6	176.3	-167.7	60.4	-151.5	0	0	111	T413 Q419 R420 I421	T413-E417 VanDerWaalsContact O-CB 3.25Å; T413-E417 WeakPolarHBondContact O-CB 3.43Å; T413-E417 PolarHBondContact O-N 2.83Å; E417-Q419 PolarHBondContact O-N 2.84Å; E417-R420 PolarHBondContact O-N 3.15Å; E417-R420 IonicContact OE1-NH1 2.76Å; E417-R420 IonicContact OE2-NH1 3.9Å; E417-I421 HydrophobicContact CG-CD1 3.99Å; E417-I421 WeakPolarHBondContact O-CB 3.15Å; E417-I421 VanDerWaalsContact O-CG1 3.25Å; E417-I421 WeakPolarHBondContact O-CG1 3.36Å; E417-I421 PolarHBondContact O-N 3.47Å
418	S	93.9	Very high	92.6	Very high	72 Å²	72	96.9 Å²	96.9	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-61.9	-41.8	174.1	-61.9	0	0	0	0	112.2	S414 Q415 Y422	S414-S418 WeakPolarHBondContact O-CB 3.5Å; S414-S418 PolarHBondContact O-N 2.78Å; S414-S418 PolarHBondContact O-OG 3.09Å; Q415-S418 PolarHBondContact O-N 3.37Å; S418-Y422 WeakPolarHBondContact O-CB 3.35Å; S418-Y422 PolarHBondContact O-N 3.08Å
419	Q	91.7	Very high	93.3	Very high	98 Å²	98	96.3 Å²	96.3	46%	0.458	47%	0.467	S	S	.	.	H	α-helix	trans	-66.6	-44.1	175.4	-73.7	-178.6	28.4	0	0	111.6	Q415 L416 E417 Y422 W423	Q415-Q419 WeakPolarHBondContact O-CG 3.45Å; Q415-Q419 PolarHBondContact O-N 2.77Å; L416-Q419 PolarHBondContact O-N 2.8Å; E417-Q419 PolarHBondContact O-N 2.84Å; Q419-Y422 WeakPolarHBondContact O-CB 3.45Å; Q419-Y422 PolarHBondContact O-N 2.83Å; Q419-W423 PolarHBondContact O-N 3.33Å
420	R	95.9	Very high	93.6	Very high	133 Å²	133	98 Å²	98	50%	0.502	47%	0.47	S	S	.	.	H	α-helix	trans	-56.4	-53.5	175.9	179.2	-174.2	173.5	-157.5	-5.3	110.7	L416 E417 Y422 W423 E424	L416-R420 WeakPolarHBondContact O-CB 3.46Å; L416-R420 PolarHBondContact O-N 3.27Å; E417-R420 PolarHBondContact O-N 3.15Å; E417-R420 IonicContact OE1-NH1 2.76Å; E417-R420 IonicContact OE2-NH1 3.9Å; R420-Y422 VanDerWaalsContact C-N 3.29Å; R420-Y422 PolarHBondContact O-N 3.36Å; R420-W423 PolarHBondContact O-N 2.84Å; R420-E424 HydrophobicContact CG-CG 4.26Å; R420-E424 IonicContact CZ-OE1 3.75Å; R420-E424 IonicContact NE-OE1 3.35Å; R420-E424 PolarHBondContact NE-OE1 2.93Å; R420-E424 IonicContact NE-OE2 2.78Å; R420-E424 IonicContact NH2-OE1 2.81Å; R420-E424 PolarHBondContact NH2-OE1 3.13Å; R420-E424 WeakPolarHBondContact O-CB 3.32Å; R420-E424 WeakPolarHBondContact O-CG 3.48Å; R420-E424 PolarHBondContact O-N 3.05Å
421	I	95.9	Very high	94	Very high	77 Å²	77	96 Å²	96	40%	0.395	47%	0.466	S	S	.	.	H	α-helix	trans	-59	-40.8	178.2	-68.6	167.8	0	0	0	110.9	E417 N425	E417-I421 HydrophobicContact CG-CD1 3.99Å; E417-I421 WeakPolarHBondContact O-CB 3.15Å; E417-I421 VanDerWaalsContact O-CG1 3.25Å; E417-I421 WeakPolarHBondContact O-CG1 3.36Å; E417-I421 PolarHBondContact O-N 3.47Å; I421-N425 VanDerWaalsContact CG2-ND2 3.28Å; I421-N425 WeakPolarHBondContact CG2-ND2 3.16Å; I421-N425 VanDerWaalsContact O-CB 3.26Å; I421-N425 WeakPolarHBondContact O-CB 3.48Å; I421-N425 VanDerWaalsContact O-CG 3.25Å; I421-N425 PolarHBondContact O-N 3.37Å; I421-N425 PolarHBondContact O-ND2 3.49Å
422	Y	95.3	Very high	94.3	Very high	121 Å²	121	97.1 Å²	97.1	48%	0.475	47%	0.467	S	S	.	.	H	α-helix	trans	-60.7	-47.8	177	173.5	-93.1	0	0	0	112	S418 Q419 R420 N425 K426	S418-Y422 WeakPolarHBondContact O-CB 3.35Å; S418-Y422 PolarHBondContact O-N 3.08Å; Q419-Y422 WeakPolarHBondContact O-CB 3.45Å; Q419-Y422 PolarHBondContact O-N 2.83Å; R420-Y422 VanDerWaalsContact C-N 3.29Å; R420-Y422 PolarHBondContact O-N 3.36Å; Y422-N425 PolarHBondContact O-N 3Å; Y422-K426 HydrophobicContact CE1-CD 4.19Å; Y422-K426 WeakPolarHBondContact O-CB 3.38Å; Y422-K426 PolarHBondContact O-N 3.03Å
423	W	95.6	Very high	94.6	Very high	135 Å²	135	97.2 Å²	97.2	51%	0.511	47%	0.468	S	S	.	.	H	α-helix	trans	-72.5	-40.3	-178.6	-72.5	114.5	0	0	0	112.4	Q419 R420 N425 K426 I427	Q419-W423 PolarHBondContact O-N 3.33Å; R420-W423 PolarHBondContact O-N 2.84Å; W423-N425 VanDerWaalsContact C-N 3.33Å; W423-N425 PolarHBondContact O-N 2.88Å; W423-K426 HydrophobicContact CE3-CB 4.47Å; W423-K426 HydrophobicContact CE3-CD 3.85Å; W423-K426 HydrophobicContact CZ3-CD 3.64Å; W423-K426 PolarHBondContact O-N 2.96Å; W423-K426 VanDerWaalsContact O-N 3.09Å; W423-I427 VanDerWaalsContact O-CG1 3.28Å; W423-I427 WeakPolarHBondContact O-CG1 3.23Å; W423-I427 PolarHBondContact O-N 3.33Å
424	E	96.6	Very high	94.6	Very high	84 Å²	84	96.5 Å²	96.5	39%	0.393	46%	0.463	S	S	.	.	H	α-helix	trans	-57.5	-46.7	172	-74.7	178.9	171.3	0	0	110.4	R420 K426 I427 V428	R420-E424 HydrophobicContact CG-CG 4.26Å; R420-E424 IonicContact CZ-OE1 3.75Å; R420-E424 IonicContact NE-OE1 3.35Å; R420-E424 PolarHBondContact NE-OE1 2.93Å; R420-E424 IonicContact NE-OE2 2.78Å; R420-E424 IonicContact NH2-OE1 2.81Å; R420-E424 PolarHBondContact NH2-OE1 3.13Å; R420-E424 WeakPolarHBondContact O-CB 3.32Å; R420-E424 WeakPolarHBondContact O-CG 3.48Å; R420-E424 PolarHBondContact O-N 3.05Å; E424-K426 VanDerWaalsContact C-N 3.29Å; E424-K426 PolarHBondContact O-N 3.28Å; E424-I427 PolarHBondContact O-N 3.42Å; E424-V428 VanDerWaalsContact O-CG2 3.31Å; E424-V428 WeakPolarHBondContact O-CG2 3.44Å; E424-V428 PolarHBondContact O-N 3.08Å
425	N	96.9	Very high	94.8	Very high	83 Å²	83	96 Å²	96	44%	0.444	46%	0.462	S	S	.	.	H	α-helix	trans	-66.3	-28.8	175.7	-76.8	-48.3	0	0	0	113.7	I421 Y422 W423 R429	I421-N425 VanDerWaalsContact CG2-ND2 3.28Å; I421-N425 WeakPolarHBondContact CG2-ND2 3.16Å; I421-N425 VanDerWaalsContact O-CB 3.26Å; I421-N425 WeakPolarHBondContact O-CB 3.48Å; I421-N425 VanDerWaalsContact O-CG 3.25Å; I421-N425 PolarHBondContact O-N 3.37Å; I421-N425 PolarHBondContact O-ND2 3.49Å; Y422-N425 PolarHBondContact O-N 3Å; W423-N425 VanDerWaalsContact C-N 3.33Å; W423-N425 PolarHBondContact O-N 2.88Å; N425-R429 WeakPolarHBondContact O-CB 3.16Å; N425-R429 WeakPolarHBondContact O-CG 3.24Å; N425-R429 PolarHBondContact O-N 3.27Å; N425-R429 VanDerWaalsContact O-N 3.17Å; N425-R429 PolarHBondContact O-NE 3.46Å; N425-R429 VanDerWaalsContact O-NE 3.14Å
426	K	96.3	Very high	95	Very high	77 Å²	77	95.8 Å²	95.8	34%	0.335	46%	0.462	S	S	.	.	H	α-helix	trans	-74.1	-41.1	175.4	-170.2	172	177.3	179.8	0	110.8	Y422 W423 E424 R429 I430	Y422-K426 HydrophobicContact CE1-CD 4.19Å; Y422-K426 WeakPolarHBondContact O-CB 3.38Å; Y422-K426 PolarHBondContact O-N 3.03Å; W423-K426 HydrophobicContact CE3-CB 4.47Å; W423-K426 HydrophobicContact CE3-CD 3.85Å; W423-K426 HydrophobicContact CZ3-CD 3.64Å; W423-K426 PolarHBondContact O-N 2.96Å; W423-K426 VanDerWaalsContact O-N 3.09Å; E424-K426 VanDerWaalsContact C-N 3.29Å; E424-K426 PolarHBondContact O-N 3.28Å; K426-R429 PolarHBondContact O-N 3.34Å; K426-I430 HydrophobicContact CG-CD1 4.18Å; K426-I430 VanDerWaalsContact O-CG1 3.32Å; K426-I430 WeakPolarHBondContact O-CG1 3.29Å; K426-I430 PolarHBondContact O-N 2.87Å
427	I	94.8	Very high	95.1	Very high	89 Å²	89	97.3 Å²	97.3	46%	0.456	47%	0.466	S	S	.	.	H	α-helix	trans	-60.6	-51.5	173.7	-68.7	164.8	0	0	0	109.6	W423 E424 R429 I430 E431	W423-I427 VanDerWaalsContact O-CG1 3.28Å; W423-I427 WeakPolarHBondContact O-CG1 3.23Å; W423-I427 PolarHBondContact O-N 3.33Å; E424-I427 PolarHBondContact O-N 3.42Å; I427-R429 VanDerWaalsContact C-N 3.27Å; I427-R429 PolarHBondContact O-N 3.11Å; I427-I430 PolarHBondContact O-N 3.35Å; I427-I430 VanDerWaalsContact O-N 3.07Å; I427-E431 HydrophobicContact CG2-CG 4.18Å; I427-E431 WeakPolarHBondContact O-CG 3.38Å; I427-E431 PolarHBondContact O-N 3.46Å
428	V	97.1	Very high	95.2	Very high	84 Å²	84	98.7 Å²	98.7	51%	0.509	48%	0.475	S	S	.	.	H	α-helix	trans	-58.8	-37.7	179.1	171	0	0	0	0	112.1	E424 K432	E424-V428 VanDerWaalsContact O-CG2 3.31Å; E424-V428 WeakPolarHBondContact O-CG2 3.44Å; E424-V428 PolarHBondContact O-N 3.08Å; V428-K432 VanDerWaalsContact O-CB 3.3Å; V428-K432 WeakPolarHBondContact O-CB 3.49Å; V428-K432 PolarHBondContact O-N 2.87Å
429	R	95.8	Very high	95.3	Very high	141 Å²	141	99.9 Å²	99.9	53%	0.532	48%	0.476	S	S	.	.	H	α-helix	trans	-64.8	-47	174.3	-84.6	-178.2	-78.4	-160.1	-1.4	112.1	N425 K426 I427 E431 K432 D433	N425-R429 WeakPolarHBondContact O-CB 3.16Å; N425-R429 WeakPolarHBondContact O-CG 3.24Å; N425-R429 PolarHBondContact O-N 3.27Å; N425-R429 VanDerWaalsContact O-N 3.17Å; N425-R429 PolarHBondContact O-NE 3.46Å; N425-R429 VanDerWaalsContact O-NE 3.14Å; K426-R429 PolarHBondContact O-N 3.34Å; I427-R429 VanDerWaalsContact C-N 3.27Å; I427-R429 PolarHBondContact O-N 3.11Å; R429-E431 VanDerWaalsContact C-N 3.34Å; R429-E431 PolarHBondContact O-N 3.46Å; R429-K432 PolarHBondContact O-N 2.74Å; R429-D433 WeakPolarHBondContact O-CB 3.4Å; R429-D433 PolarHBondContact O-N 2.81Å
430	I	93.4	Very high	95.5	Very high	94 Å²	94	99.2 Å²	99.2	48%	0.482	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-42.7	177.4	-67.5	166.9	0	0	0	110.7	K426 I427 K432 D433 T434	K426-I430 HydrophobicContact CG-CD1 4.18Å; K426-I430 VanDerWaalsContact O-CG1 3.32Å; K426-I430 WeakPolarHBondContact O-CG1 3.29Å; K426-I430 PolarHBondContact O-N 2.87Å; I427-I430 PolarHBondContact O-N 3.35Å; I427-I430 VanDerWaalsContact O-N 3.07Å; I430-K432 VanDerWaalsContact C-N 3.3Å; I430-K432 PolarHBondContact O-N 3.41Å; I430-D433 PolarHBondContact O-N 2.84Å; I430-T434 HydrophobicContact CG2-CG2 4.26Å; I430-T434 WeakPolarHBondContact O-CB 3.36Å; I430-T434 VanDerWaalsContact O-CG2 3.24Å; I430-T434 WeakPolarHBondContact O-CG2 3.46Å; I430-T434 PolarHBondContact O-N 3.02Å; I430-T434 PolarHBondContact O-OG1 2.97Å
431	E	95.3	Very high	95.3	Very high	119 Å²	119	98.8 Å²	98.8	56%	0.556	48%	0.48	S	S	*	.	H	α-helix	trans	-61.4	-39.2	175.4	-73.2	178.7	162.1	0	0	111.9	I427 R429 T434 A435	I427-E431 HydrophobicContact CG2-CG 4.18Å; I427-E431 WeakPolarHBondContact O-CG 3.38Å; I427-E431 PolarHBondContact O-N 3.46Å; R429-E431 VanDerWaalsContact C-N 3.34Å; R429-E431 PolarHBondContact O-N 3.46Å; E431-T434 WeakPolarHBondContact CA-OG1 3.41Å; E431-T434 PolarHBondContact O-OG1 3.17Å; E431-A435 VanDerWaalsContact O-CB 3.24Å; E431-A435 WeakPolarHBondContact O-CB 3.45Å; E431-A435 PolarHBondContact O-N 3.24Å
432	K	97.1	Very high	95.4	Very high	125 Å²	125	102.1 Å²	102.1	54%	0.543	49%	0.492	S	S	.	.	H	α-helix	trans	-67	-49.1	175.2	-175.7	-176.6	171	-170.9	0	111.8	V428 R429 I430 T434 A435 E436	V428-K432 VanDerWaalsContact O-CB 3.3Å; V428-K432 WeakPolarHBondContact O-CB 3.49Å; V428-K432 PolarHBondContact O-N 2.87Å; R429-K432 PolarHBondContact O-N 2.74Å; I430-K432 VanDerWaalsContact C-N 3.3Å; I430-K432 PolarHBondContact O-N 3.41Å; K432-T434 VanDerWaalsContact C-N 3.34Å; K432-T434 PolarHBondContact O-N 3.44Å; K432-A435 PolarHBondContact O-N 3.4Å; K432-E436 WeakPolarHBondContact CE-OE1 3.48Å; K432-E436 IonicContact NZ-OE1 3.57Å; K432-E436 WeakPolarHBondContact O-CG 3.32Å; K432-E436 PolarHBondContact O-N 2.86Å
433	D	95.1	Very high	95.4	Very high	86 Å²	86	99.9 Å²	99.9	46%	0.46	49%	0.491	S	S	.	.	H	α-helix	trans	-61.7	-44.1	-179.1	-65.6	-14.7	0	0	0	110.4	R429 I430 A435 E436 E437	R429-D433 WeakPolarHBondContact O-CB 3.4Å; R429-D433 PolarHBondContact O-N 2.81Å; I430-D433 PolarHBondContact O-N 2.84Å; D433-A435 PolarHBondContact O-N 2.81Å; D433-E436 PolarHBondContact O-N 3.35Å; D433-E437 WeakPolarHBondContact O-CG 3.28Å; D433-E437 PolarHBondContact O-N 3.5Å
434	T	90.5	Very high	95.4	Very high	62 Å²	62	98.2 Å²	98.2	38%	0.38	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-38.4	175.1	53.2	0	0	0	0	112.5	I430 E431 K432 E437 I438	I430-T434 HydrophobicContact CG2-CG2 4.26Å; I430-T434 WeakPolarHBondContact O-CB 3.36Å; I430-T434 VanDerWaalsContact O-CG2 3.24Å; I430-T434 WeakPolarHBondContact O-CG2 3.46Å; I430-T434 PolarHBondContact O-N 3.02Å; I430-T434 PolarHBondContact O-OG1 2.97Å; E431-T434 WeakPolarHBondContact CA-OG1 3.41Å; E431-T434 PolarHBondContact O-OG1 3.17Å; K432-T434 VanDerWaalsContact C-N 3.34Å; K432-T434 PolarHBondContact O-N 3.44Å; T434-E437 PolarHBondContact O-N 3.49Å; T434-I438 WeakPolarHBondContact O-CB 3.41Å; T434-I438 VanDerWaalsContact O-CG1 3.22Å; T434-I438 WeakPolarHBondContact O-CG1 3.26Å; T434-I438 PolarHBondContact O-N 3.33Å
435	A	96.5	Very high	95.2	Very high	43 Å²	43	100.9 Å²	100.9	36%	0.355	50%	0.498	S	S	.	.	H	α-helix	trans	-65.6	-37.6	174.3	0	0	0	0	0	112.5	E431 K432 D433 N439	E431-A435 VanDerWaalsContact O-CB 3.24Å; E431-A435 WeakPolarHBondContact O-CB 3.45Å; E431-A435 PolarHBondContact O-N 3.24Å; K432-A435 PolarHBondContact O-N 3.4Å; D433-A435 PolarHBondContact O-N 2.81Å; A435-N439 WeakPolarHBondContact O-CB 3.48Å; A435-N439 PolarHBondContact O-N 3.07Å; A435-N439 PolarHBondContact O-ND2 3.31Å
436	E	96.6	Very high	95.2	Very high	107 Å²	107	103.2 Å²	103.2	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-66	-43.1	174.4	-73.8	-179.3	-172.4	0	0	111.6	K432 D433 N439 N440	K432-E436 WeakPolarHBondContact CE-OE1 3.48Å; K432-E436 IonicContact NZ-OE1 3.57Å; K432-E436 WeakPolarHBondContact O-CG 3.32Å; K432-E436 PolarHBondContact O-N 2.86Å; D433-E436 PolarHBondContact O-N 3.35Å; E436-N439 PolarHBondContact O-N 3.48Å; E436-N440 WeakPolarHBondContact O-CB 3.16Å; E436-N440 PolarHBondContact O-N 3.16Å
437	E	94.3	Very high	95.2	Very high	129 Å²	129	104.3 Å²	104.3	60%	0.603	51%	0.511	S	S	*	.	H	α-helix	trans	-61	-46.9	174	-74.4	177.4	179.8	0	0	112.1	D433 T434 N439 N440 M441	D433-E437 WeakPolarHBondContact O-CG 3.28Å; D433-E437 PolarHBondContact O-N 3.5Å; T434-E437 PolarHBondContact O-N 3.49Å; E437-N439 VanDerWaalsContact C-N 3.31Å; E437-N439 PolarHBondContact O-N 3.42Å; E437-N440 PolarHBondContact O-N 2.9Å; E437-M441 WeakPolarHBondContact O-CG 3.45Å; E437-M441 PolarHBondContact O-N 3.49Å
438	I	94.1	Very high	95.1	Very high	113 Å²	113	103.6 Å²	103.6	58%	0.579	51%	0.51	S	S	*	.	H	α-helix	trans	-59.1	-44.3	176.4	-71.8	166.6	0	0	0	110.5	T434 M441 K442	T434-I438 WeakPolarHBondContact O-CB 3.41Å; T434-I438 VanDerWaalsContact O-CG1 3.22Å; T434-I438 WeakPolarHBondContact O-CG1 3.26Å; T434-I438 PolarHBondContact O-N 3.33Å; I438-M441 PolarHBondContact O-N 3.22Å; I438-K442 VanDerWaalsContact O-CB 3.3Å; I438-K442 WeakPolarHBondContact O-CB 3.43Å; I438-K442 PolarHBondContact O-N 3.49Å
439	N	96.3	Very high	95.1	Very high	98 Å²	98	103 Å²	103	52%	0.524	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-41.1	178	-80.5	-36.1	0	0	0	112.2	A435 E436 E437 K442 T443	A435-N439 WeakPolarHBondContact O-CB 3.48Å; A435-N439 PolarHBondContact O-N 3.07Å; A435-N439 PolarHBondContact O-ND2 3.31Å; E436-N439 PolarHBondContact O-N 3.48Å; E437-N439 VanDerWaalsContact C-N 3.31Å; E437-N439 PolarHBondContact O-N 3.42Å; N439-K442 WeakPolarHBondContact O-CB 3.46Å; N439-K442 PolarHBondContact O-N 3.28Å; N439-T443 WeakPolarHBondContact O-CG2 3.36Å; N439-T443 PolarHBondContact O-N 3.14Å; N439-T443 PolarHBondContact O-OG1 3.15Å
440	N	96.4	Very high	95.1	Very high	84 Å²	84	100.9 Å²	100.9	45%	0.449	50%	0.5	S	S	.	.	H	α-helix	trans	-65.5	-38.4	175.8	-169.2	9.4	0	0	0	112	E436 E437 T443 K444	E436-N440 WeakPolarHBondContact O-CB 3.16Å; E436-N440 PolarHBondContact O-N 3.16Å; E437-N440 PolarHBondContact O-N 2.9Å; N440-T443 WeakPolarHBondContact CA-OG1 3.25Å; N440-T443 PolarHBondContact O-OG1 3.45Å; N440-K444 VanDerWaalsContact O-CG 3.31Å; N440-K444 WeakPolarHBondContact O-CG 3.31Å; N440-K444 PolarHBondContact O-N 3.01Å; N440-K444 VanDerWaalsContact O-N 3.11Å; N440-K444 WeakPolarHBondContact OD1-CE 3.48Å
441	M	92.4	Very high	95.2	Very high	123 Å²	123	102.1 Å²	102.1	61%	0.606	50%	0.502	S	S	*	.	H	α-helix	trans	-67.2	-38.9	173.7	-70.2	-58.6	-72.4	0	0	111.4	E437 I438 K444 F445	E437-M441 WeakPolarHBondContact O-CG 3.45Å; E437-M441 PolarHBondContact O-N 3.49Å; I438-M441 PolarHBondContact O-N 3.22Å; M441-K444 PolarHBondContact O-N 3.1Å; M441-K444 HydrophobicContact SD-CD 4.41Å; M441-F445 WeakPolarHBondContact O-CB 3.43Å; M441-F445 PolarHBondContact O-N 3.48Å
442	K	96	Very high	95.2	Very high	148 Å²	148	99.4 Å²	99.4	64%	0.643	50%	0.495	S	S	*	.	H	α-helix	trans	-64.8	-40.2	176.8	-171.4	176.1	-178.6	177.8	0	112.5	I438 N439 F445 K446	I438-K442 VanDerWaalsContact O-CB 3.3Å; I438-K442 WeakPolarHBondContact O-CB 3.43Å; I438-K442 PolarHBondContact O-N 3.49Å; N439-K442 WeakPolarHBondContact O-CB 3.46Å; N439-K442 PolarHBondContact O-N 3.28Å; K442-F445 PolarHBondContact O-N 2.92Å; K442-K446 PolarHBondContact O-N 2.86Å
443	T	96.6	Very high	95.1	Very high	73 Å²	73	97 Å²	97	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-66.2	-46.4	175.2	51.4	0	0	0	0	111.3	N439 N440 F445 K446 E447	N439-T443 WeakPolarHBondContact O-CG2 3.36Å; N439-T443 PolarHBondContact O-N 3.14Å; N439-T443 PolarHBondContact O-OG1 3.15Å; N440-T443 WeakPolarHBondContact CA-OG1 3.25Å; N440-T443 PolarHBondContact O-OG1 3.45Å; T443-F445 VanDerWaalsContact C-N 3.3Å; T443-F445 PolarHBondContact O-N 3.23Å; T443-K446 WeakPolarHBondContact O-CB 3.43Å; T443-K446 PolarHBondContact O-N 3.28Å; T443-K446 VanDerWaalsContact O-N 3.16Å; T443-E447 WeakPolarHBondContact O-CG 3.49Å; T443-E447 PolarHBondContact O-N 2.75Å
444	K	95.9	Very high	95.2	Very high	101 Å²	101	97.4 Å²	97.4	44%	0.439	49%	0.49	S	S	.	.	H	α-helix	trans	-58.9	-40.3	175	-72.4	174.8	-177.2	175.8	0	112.6	N440 M441 E447 T448	N440-K444 VanDerWaalsContact O-CG 3.31Å; N440-K444 WeakPolarHBondContact O-CG 3.31Å; N440-K444 PolarHBondContact O-N 3.01Å; N440-K444 VanDerWaalsContact O-N 3.11Å; N440-K444 WeakPolarHBondContact OD1-CE 3.48Å; M441-K444 PolarHBondContact O-N 3.1Å; M441-K444 HydrophobicContact SD-CD 4.41Å; K444-E447 PolarHBondContact O-N 3.5Å; K444-T448 WeakPolarHBondContact O-CB 3.23Å; K444-T448 PolarHBondContact O-N 2.8Å; K444-T448 PolarHBondContact O-OG1 2.97Å
445	F	92.2	Very high	95.4	Very high	139 Å²	139	99.8 Å²	99.8	61%	0.61	50%	0.5	S	S	*	.	H	α-helix	trans	-63.8	-44.6	176.4	-171.4	-106.7	0	0	0	111.2	M441 K442 T443 E447 T448 I449	M441-F445 WeakPolarHBondContact O-CB 3.43Å; M441-F445 PolarHBondContact O-N 3.48Å; K442-F445 PolarHBondContact O-N 2.92Å; T443-F445 VanDerWaalsContact C-N 3.3Å; T443-F445 PolarHBondContact O-N 3.23Å; F445-E447 PolarHBondContact O-N 3.2Å; F445-T448 PolarHBondContact O-N 3.05Å; F445-T448 VanDerWaalsContact O-N 3.15Å; F445-I449 HydrophobicContact CD1-CD1 3.53Å; F445-I449 HydrophobicContact CD1-CG1 4.37Å; F445-I449 HydrophobicContact CE1-CD1 3.26Å; F445-I449 HydrophobicContact CE1-CG1 4.15Å; F445-I449 HydrophobicContact CG-CD1 4.41Å; F445-I449 HydrophobicContact CZ-CD1 3.92Å; F445-I449 HydrophobicContact CZ-CG1 4.4Å; F445-I449 WeakPolarHBondContact O-CG1 3.49Å; F445-I449 PolarHBondContact O-N 2.96Å
446	K	96.9	Very high	95.3	Very high	132 Å²	132	103.2 Å²	103.2	57%	0.574	51%	0.509	S	S	*	.	H	α-helix	trans	-60.8	-45.4	175.5	-168.1	-178	177.2	-170.7	0	112.4	K442 T443 T448 I449 E450	K442-K446 PolarHBondContact O-N 2.86Å; T443-K446 WeakPolarHBondContact O-CB 3.43Å; T443-K446 PolarHBondContact O-N 3.28Å; T443-K446 VanDerWaalsContact O-N 3.16Å; K446-T448 PolarHBondContact O-N 3.09Å; K446-I449 PolarHBondContact O-N 3.45Å; K446-E450 WeakPolarHBondContact CE-OE1 3.37Å; K446-E450 WeakPolarHBondContact O-CG 3.49Å; K446-E450 PolarHBondContact O-N 2.98Å
447	E	96.3	Very high	95.3	Very high	101 Å²	101	103.9 Å²	103.9	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-61.1	-34.8	174.9	-72	177.5	-167.4	0	0	112.5	T443 K444 F445 K451	T443-E447 WeakPolarHBondContact O-CG 3.49Å; T443-E447 PolarHBondContact O-N 2.75Å; K444-E447 PolarHBondContact O-N 3.5Å; F445-E447 PolarHBondContact O-N 3.2Å; E447-K451 WeakPolarHBondContact O-CD 3.21Å; E447-K451 VanDerWaalsContact O-CG 3.24Å; E447-K451 WeakPolarHBondContact O-CG 3.41Å; E447-K451 PolarHBondContact O-N 2.79Å
448	T	92.6	Very high	95.4	Very high	73 Å²	73	104.1 Å²	104.1	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-71.3	-42.1	178.3	-55.1	0	0	0	0	110.8	K444 F445 K446 K451 C452	K444-T448 WeakPolarHBondContact O-CB 3.23Å; K444-T448 PolarHBondContact O-N 2.8Å; K444-T448 PolarHBondContact O-OG1 2.97Å; F445-T448 PolarHBondContact O-N 3.05Å; F445-T448 VanDerWaalsContact O-N 3.15Å; K446-T448 PolarHBondContact O-N 3.09Å; T448-K451 WeakPolarHBondContact O-CB 3.5Å; T448-K451 PolarHBondContact O-N 2.76Å; T448-C452 PolarHBondContact O-N 3.39Å; T448-C452 PolarHBondContact O-SG 3.28Å; T448-C452 VanDerWaalsContact O-SG 3.37Å
449	I	96.3	Very high	95.4	Very high	72 Å²	72	103.6 Å²	103.6	37%	0.369	51%	0.509	S	S	.	.	H	α-helix	trans	-58.8	-49.4	172.9	-69.3	166.2	0	0	0	110.4	F445 K446 K451 C452 D453	F445-I449 HydrophobicContact CD1-CD1 3.53Å; F445-I449 HydrophobicContact CD1-CG1 4.37Å; F445-I449 HydrophobicContact CE1-CD1 3.26Å; F445-I449 HydrophobicContact CE1-CG1 4.15Å; F445-I449 HydrophobicContact CG-CD1 4.41Å; F445-I449 HydrophobicContact CZ-CD1 3.92Å; F445-I449 HydrophobicContact CZ-CG1 4.4Å; F445-I449 WeakPolarHBondContact O-CG1 3.49Å; F445-I449 PolarHBondContact O-N 2.96Å; K446-I449 PolarHBondContact O-N 3.45Å; I449-K451 PolarHBondContact O-N 2.75Å; I449-C452 CarbonylContact O-C 3.59Å; I449-C452 WeakPolarHBondContact O-CA 3.26Å; I449-C452 WeakPolarHBondContact O-CB 3.46Å; I449-C452 PolarHBondContact O-N 3.31Å; I449-D453 PolarHBondContact O-N 2.85Å
450	E	96.6	Very high	95.4	Very high	96 Å²	96	102.8 Å²	102.8	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-34.4	178.6	-71.7	174	-170.4	0	0	111.9	K446 N454	K446-E450 WeakPolarHBondContact CE-OE1 3.37Å; K446-E450 WeakPolarHBondContact O-CG 3.49Å; K446-E450 PolarHBondContact O-N 2.98Å; E450-N454 WeakPolarHBondContact O-CB 3.39Å; E450-N454 PolarHBondContact O-N 2.95Å; E450-N454 VanDerWaalsContact O-N 3.09Å; E450-N454 PolarHBondContact O-ND2 2.84Å
451	K	96.3	Very high	95.4	Very high	121 Å²	121	102.9 Å²	102.9	53%	0.526	51%	0.505	S	S	.	.	H	α-helix	trans	-68.6	-41.2	172.5	-73.5	166.2	-171.3	164	0	112.1	E447 T448 I449 N454 L455	E447-K451 WeakPolarHBondContact O-CD 3.21Å; E447-K451 VanDerWaalsContact O-CG 3.24Å; E447-K451 WeakPolarHBondContact O-CG 3.41Å; E447-K451 PolarHBondContact O-N 2.79Å; T448-K451 WeakPolarHBondContact O-CB 3.5Å; T448-K451 PolarHBondContact O-N 2.76Å; I449-K451 PolarHBondContact O-N 2.75Å; K451-N454 PolarHBondContact O-N 3.04Å; K451-L455 VanDerWaalsContact O-CG 3.32Å; K451-L455 WeakPolarHBondContact O-CG 3.48Å; K451-L455 PolarHBondContact O-N 3.33Å
452	C	93.6	Very high	95.6	Very high	62 Å²	62	102.1 Å²	102.1	42%	0.419	50%	0.502	S	S	.	.	H	α-helix	trans	-60.7	-49.6	174.9	-73.2	0	0	0	0	111.1	T448 I449 N454 L455 E456	T448-C452 PolarHBondContact O-N 3.39Å; T448-C452 PolarHBondContact O-SG 3.28Å; T448-C452 VanDerWaalsContact O-SG 3.37Å; I449-C452 CarbonylContact O-C 3.59Å; I449-C452 WeakPolarHBondContact O-CA 3.26Å; I449-C452 WeakPolarHBondContact O-CB 3.46Å; I449-C452 PolarHBondContact O-N 3.31Å; C452-N454 VanDerWaalsContact C-N 3.3Å; C452-N454 PolarHBondContact O-N 3.19Å; C452-L455 CarbonylContact O-C 3.6Å; C452-L455 WeakPolarHBondContact O-CB 3.24Å; C452-L455 PolarHBondContact O-N 3.06Å; C452-E456 WeakPolarHBondContact O-CG 3.34Å; C452-E456 PolarHBondContact O-N 3.16Å
453	D	96.3	Very high	95.6	Very high	74 Å²	74	99.2 Å²	99.2	40%	0.396	49%	0.494	S	S	.	.	H	α-helix	trans	-58.5	-42.6	177.7	-65.7	-14.8	0	0	0	111.4	I449 L455 E456 H457	I449-D453 PolarHBondContact O-N 2.85Å; D453-L455 VanDerWaalsContact C-N 3.34Å; D453-L455 PolarHBondContact O-N 3.47Å; D453-E456 PolarHBondContact O-N 3.02Å; D453-H457 PolarHBondContact O-CD2 2.94Å; D453-H457 VanDerWaalsContact O-CD2 3.28Å; D453-H457 PolarHBondContact O-N 3.35Å
454	N	96.6	Very high	95.6	Very high	94 Å²	94	102 Å²	102	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-37.3	175.7	-78.8	-45.3	0	0	0	112.8	E450 K451 C452 K458	E450-N454 WeakPolarHBondContact O-CB 3.39Å; E450-N454 PolarHBondContact O-N 2.95Å; E450-N454 VanDerWaalsContact O-N 3.09Å; E450-N454 PolarHBondContact O-ND2 2.84Å; K451-N454 PolarHBondContact O-N 3.04Å; C452-N454 VanDerWaalsContact C-N 3.3Å; C452-N454 PolarHBondContact O-N 3.19Å; N454-K458 WeakPolarHBondContact O-CG 3.44Å; N454-K458 PolarHBondContact O-N 3.22Å; N454-K458 VanDerWaalsContact O-N 3.11Å
455	L	94.6	Very high	95.6	Very high	112 Å²	112	103.1 Å²	103.1	59%	0.586	51%	0.506	S	S	*	.	H	α-helix	trans	-70.7	-39	175.5	-74	171.6	0	0	0	111.4	K451 C452 D453 K458 L459	K451-L455 VanDerWaalsContact O-CG 3.32Å; K451-L455 WeakPolarHBondContact O-CG 3.48Å; K451-L455 PolarHBondContact O-N 3.33Å; C452-L455 CarbonylContact O-C 3.6Å; C452-L455 WeakPolarHBondContact O-CB 3.24Å; C452-L455 PolarHBondContact O-N 3.06Å; D453-L455 VanDerWaalsContact C-N 3.34Å; D453-L455 PolarHBondContact O-N 3.47Å; L455-K458 PolarHBondContact O-N 3.35Å; L455-L459 WeakPolarHBondContact O-CB 3.41Å; L455-L459 PolarHBondContact O-N 3.41Å
456	E	95.2	Very high	95.8	Very high	115 Å²	115	102 Å²	102	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-42.1	174.2	-74.5	-173.2	-178.3	0	0	111.9	C452 D453 L459 N460	C452-E456 WeakPolarHBondContact O-CG 3.34Å; C452-E456 PolarHBondContact O-N 3.16Å; D453-E456 PolarHBondContact O-N 3.02Å; E456-L459 PolarHBondContact O-N 2.85Å; E456-N460 WeakPolarHBondContact O-CB 3.35Å; E456-N460 PolarHBondContact O-N 3.34Å; E456-N460 PolarHBondContact O-ND2 2.85Å
457	H	96.1	Very high	95.8	Very high	122 Å²	122	100.4 Å²	100.4	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-60.8	-47.3	173.2	-79.1	-48.7	0	0	0	112.1	D453 L459 N460 D461	D453-H457 PolarHBondContact O-CD2 2.94Å; D453-H457 VanDerWaalsContact O-CD2 3.28Å; D453-H457 PolarHBondContact O-N 3.35Å; H457-L459 VanDerWaalsContact C-N 3.32Å; H457-L459 PolarHBondContact O-N 3.27Å; H457-N460 PolarHBondContact O-N 3.11Å; H457-D461 PolarHBondContact O-N 3.36Å
458	K	96.4	Very high	95.8	Very high	133 Å²	133	97.8 Å²	97.8	58%	0.578	49%	0.489	S	S	*	.	H	α-helix	trans	-60.9	-40.8	176	-73.7	173.1	-177.2	177.1	0	112.4	N454 L455 N460 D461 L462	N454-K458 WeakPolarHBondContact O-CG 3.44Å; N454-K458 PolarHBondContact O-N 3.22Å; N454-K458 VanDerWaalsContact O-N 3.11Å; L455-K458 PolarHBondContact O-N 3.35Å; K458-N460 VanDerWaalsContact C-N 3.35Å; K458-D461 PolarHBondContact O-N 3.48Å; K458-L462 WeakPolarHBondContact O-CB 3.37Å; K458-L462 WeakPolarHBondContact O-CG 3.43Å; K458-L462 PolarHBondContact O-N 3.32Å
459	L	94.9	Very high	96	Very high	103 Å²	103	98.5 Å²	98.5	54%	0.539	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-44.4	177.3	-178.6	63.4	0	0	0	110.8	L455 E456 H457 D461 L462 L463	L455-L459 WeakPolarHBondContact O-CB 3.41Å; L455-L459 PolarHBondContact O-N 3.41Å; E456-L459 PolarHBondContact O-N 2.85Å; H457-L459 VanDerWaalsContact C-N 3.32Å; H457-L459 PolarHBondContact O-N 3.27Å; L459-D461 VanDerWaalsContact C-N 3.33Å; L459-D461 PolarHBondContact O-N 2.86Å; L459-L462 PolarHBondContact O-N 2.88Å; L459-L463 HydrophobicContact CG-CD1 4.29Å; L459-L463 WeakPolarHBondContact O-CB 3.36Å; L459-L463 VanDerWaalsContact O-CG 3.27Å; L459-L463 WeakPolarHBondContact O-CG 3.32Å; L459-L463 PolarHBondContact O-N 3.42Å
460	N	96.2	Very high	95.9	Very high	81 Å²	81	99.7 Å²	99.7	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-38.8	177	-79.7	-44.8	0	0	0	112.7	E456 H457 K458 L463 K464	E456-N460 WeakPolarHBondContact O-CB 3.35Å; E456-N460 PolarHBondContact O-N 3.34Å; E456-N460 PolarHBondContact O-ND2 2.85Å; H457-N460 PolarHBondContact O-N 3.11Å; K458-N460 VanDerWaalsContact C-N 3.35Å; N460-L463 PolarHBondContact O-N 2.94Å; N460-K464 WeakPolarHBondContact O-CG 3.47Å; N460-K464 PolarHBondContact O-N 2.82Å; N460-K464 VanDerWaalsContact O-N 3.1Å
461	D	96.3	Very high	96	Very high	86 Å²	86	101.9 Å²	101.9	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-70.6	-42.3	176.8	-70.4	-21.7	0	0	0	111.9	H457 K458 L459 L463 K464 E465	H457-D461 PolarHBondContact O-N 3.36Å; K458-D461 PolarHBondContact O-N 3.48Å; L459-D461 VanDerWaalsContact C-N 3.33Å; L459-D461 PolarHBondContact O-N 2.86Å; D461-L463 VanDerWaalsContact C-N 3.28Å; D461-L463 PolarHBondContact O-N 3.16Å; D461-K464 WeakPolarHBondContact O-CB 3.48Å; D461-K464 PolarHBondContact O-N 3.28Å; D461-K464 VanDerWaalsContact O-N 3.15Å; D461-K464 IonicContact OD1-NZ 3.46Å; D461-K464 PolarHBondContact OD1-NZ 3.4Å; D461-K464 VanDerWaalsContact OD1-NZ 3.13Å; D461-E465 PolarHBondContact O-N 3.09Å
462	L	95.3	Very high	96	Very high	106 Å²	106	103.5 Å²	103.5	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-60.7	-36.1	172.4	-74.2	173.1	0	0	0	112.3	K458 L459 E465 K466	K458-L462 WeakPolarHBondContact O-CB 3.37Å; K458-L462 WeakPolarHBondContact O-CG 3.43Å; K458-L462 PolarHBondContact O-N 3.32Å; L459-L462 PolarHBondContact O-N 2.88Å; L462-E465 PolarHBondContact O-N 2.92Å; L462-K466 VanDerWaalsContact O-CB 3.25Å; L462-K466 WeakPolarHBondContact O-CB 3.43Å; L462-K466 PolarHBondContact O-N 2.89Å
463	L	96.3	Very high	96	Very high	88 Å²	88	103.7 Å²	103.7	46%	0.461	51%	0.505	S	S	.	.	H	α-helix	trans	-65.2	-41	174.7	-76.9	171.9	0	0	0	112	L459 N460 D461 K466 Q467	L459-L463 HydrophobicContact CG-CD1 4.29Å; L459-L463 WeakPolarHBondContact O-CB 3.36Å; L459-L463 VanDerWaalsContact O-CG 3.27Å; L459-L463 WeakPolarHBondContact O-CG 3.32Å; L459-L463 PolarHBondContact O-N 3.42Å; N460-L463 PolarHBondContact O-N 2.94Å; D461-L463 VanDerWaalsContact C-N 3.28Å; D461-L463 PolarHBondContact O-N 3.16Å; L463-K466 PolarHBondContact O-N 3.15Å; L463-Q467 WeakPolarHBondContact O-CB 3.31Å; L463-Q467 PolarHBondContact O-N 3.31Å
464	K	97	Very high	96	Very high	130 Å²	130	104.1 Å²	104.1	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-64.4	-43.4	174.5	-68.5	168.6	-166.6	157.5	0	111.5	N460 D461 Q467 S468	N460-K464 WeakPolarHBondContact O-CG 3.47Å; N460-K464 PolarHBondContact O-N 2.82Å; N460-K464 VanDerWaalsContact O-N 3.1Å; D461-K464 WeakPolarHBondContact O-CB 3.48Å; D461-K464 PolarHBondContact O-N 3.28Å; D461-K464 VanDerWaalsContact O-N 3.15Å; D461-K464 IonicContact OD1-NZ 3.46Å; D461-K464 PolarHBondContact OD1-NZ 3.4Å; D461-K464 VanDerWaalsContact OD1-NZ 3.13Å; K464-Q467 PolarHBondContact O-N 3.46Å; K464-S468 PolarHBondContact O-N 3.37Å
465	E	96.4	Very high	96	Very high	125 Å²	125	105.1 Å²	105.1	58%	0.584	51%	0.512	S	S	*	.	H	α-helix	trans	-63	-46.8	176.3	-72.8	-170.2	165	0	0	111.7	D461 L462 Q467 S468 V469	D461-E465 PolarHBondContact O-N 3.09Å; L462-E465 PolarHBondContact O-N 2.92Å; E465-Q467 VanDerWaalsContact C-N 3.31Å; E465-Q467 PolarHBondContact O-N 2.87Å; E465-S468 WeakPolarHBondContact O-CB 3.47Å; E465-S468 PolarHBondContact O-N 3.34Å; E465-S468 VanDerWaalsContact O-N 3.13Å; E465-V469 WeakPolarHBondContact O-CG2 3.22Å; E465-V469 PolarHBondContact O-N 2.63Å
466	K	96.4	Very high	96	Very high	117 Å²	117	104.9 Å²	104.9	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-53.2	-49.9	173.7	-179.5	-163.8	164.4	-172.5	0	110.6	L462 L463 S468 V469 E470	L462-K466 VanDerWaalsContact O-CB 3.25Å; L462-K466 WeakPolarHBondContact O-CB 3.43Å; L462-K466 PolarHBondContact O-N 2.89Å; L463-K466 PolarHBondContact O-N 3.15Å; K466-S468 VanDerWaalsContact C-N 3.3Å; K466-S468 PolarHBondContact O-N 3.45Å; K466-V469 PolarHBondContact O-N 3.46Å; K466-E470 WeakPolarHBondContact CE-OE1 3.24Å; K466-E470 HydrophobicContact CG-CG 4.49Å; K466-E470 IonicContact NZ-OE1 2.6Å; K466-E470 WeakPolarHBondContact O-CB 3.5Å; K466-E470 WeakPolarHBondContact O-CG 3.3Å; K466-E470 PolarHBondContact O-N 3.17Å
467	Q	96.6	Very high	96	Very high	98 Å²	98	104.2 Å²	104.2	46%	0.458	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-36.9	-179.3	-161.2	-176.5	31.9	0	0	112.1	L463 K464 E465 R471	L463-Q467 WeakPolarHBondContact O-CB 3.31Å; L463-Q467 PolarHBondContact O-N 3.31Å; K464-Q467 PolarHBondContact O-N 3.46Å; E465-Q467 VanDerWaalsContact C-N 3.31Å; E465-Q467 PolarHBondContact O-N 2.87Å; Q467-R471 VanDerWaalsContact CD-NH2 3.28Å; Q467-R471 VanDerWaalsContact O-CG 3.28Å; Q467-R471 WeakPolarHBondContact O-CG 3.26Å; Q467-R471 PolarHBondContact O-N 2.77Å
468	S	96.4	Very high	96	Very high	46 Å²	46	102.3 Å²	102.3	32%	0.322	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-44.9	174.3	-178	0	0	0	0	111.9	K464 E465 K466 R471 R472	K464-S468 PolarHBondContact O-N 3.37Å; E465-S468 WeakPolarHBondContact O-CB 3.47Å; E465-S468 PolarHBondContact O-N 3.34Å; E465-S468 VanDerWaalsContact O-N 3.13Å; K466-S468 VanDerWaalsContact C-N 3.3Å; K466-S468 PolarHBondContact O-N 3.45Å; S468-R471 PolarHBondContact O-N 2.97Å; S468-R472 WeakPolarHBondContact O-CG 3.14Å; S468-R472 PolarHBondContact O-N 3.48Å
469	V	95.3	Very high	96	Very high	88 Å²	88	101.9 Å²	101.9	53%	0.533	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-42.1	177.3	174.1	0	0	0	0	111.3	E465 K466 R471 R472 C473	E465-V469 WeakPolarHBondContact O-CG2 3.22Å; E465-V469 PolarHBondContact O-N 2.63Å; K466-V469 PolarHBondContact O-N 3.46Å; V469-R471 VanDerWaalsContact C-N 3.35Å; V469-R471 PolarHBondContact O-N 3.2Å; V469-R472 PolarHBondContact O-N 3.12Å; V469-R472 VanDerWaalsContact O-N 3.15Å; V469-C473 WeakPolarHBondContact O-CB 3.47Å; V469-C473 PolarHBondContact O-N 2.88Å
470	E	96.1	Very high	96	Very high	97 Å²	97	101 Å²	101	45%	0.453	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-42.8	174.7	-79.5	179.8	163	0	0	111.9	K466 R472 C473 T474	K466-E470 WeakPolarHBondContact CE-OE1 3.24Å; K466-E470 HydrophobicContact CG-CG 4.49Å; K466-E470 IonicContact NZ-OE1 2.6Å; K466-E470 WeakPolarHBondContact O-CB 3.5Å; K466-E470 WeakPolarHBondContact O-CG 3.3Å; K466-E470 PolarHBondContact O-N 3.17Å; E470-R472 VanDerWaalsContact C-N 3.33Å; E470-R472 PolarHBondContact O-N 3.08Å; E470-C473 PolarHBondContact O-N 3.46Å; E470-T474 WeakPolarHBondContact O-CG2 3.46Å; E470-T474 PolarHBondContact O-N 2.92Å; E470-T474 PolarHBondContact O-OG1 3.18Å
471	R	96.9	Very high	96	Very high	141 Å²	141	99.7 Å²	99.7	53%	0.532	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-40	173.8	-73	174.8	-169	168.8	7.3	112	Q467 S468 V469 T474 Q475	Q467-R471 VanDerWaalsContact CD-NH2 3.28Å; Q467-R471 VanDerWaalsContact O-CG 3.28Å; Q467-R471 WeakPolarHBondContact O-CG 3.26Å; Q467-R471 PolarHBondContact O-N 2.77Å; S468-R471 PolarHBondContact O-N 2.97Å; V469-R471 VanDerWaalsContact C-N 3.35Å; V469-R471 PolarHBondContact O-N 3.2Å; R471-T474 WeakPolarHBondContact CA-OG1 3.3Å; R471-T474 PolarHBondContact O-OG1 3Å; R471-Q475 WeakPolarHBondContact O-CB 3.36Å; R471-Q475 VanDerWaalsContact O-CG 3.25Å; R471-Q475 WeakPolarHBondContact O-CG 3.45Å; R471-Q475 PolarHBondContact O-N 2.92Å; R471-Q475 VanDerWaalsContact O-N 3.07Å
472	R	96.6	Very high	96.1	Very high	156 Å²	156	102.2 Å²	102.2	59%	0.589	51%	0.512	S	S	*	.	H	α-helix	trans	-67.4	-41.1	175	-71.1	175.5	-174.9	160.9	2	112	S468 V469 E470 Q475 L476	S468-R472 WeakPolarHBondContact O-CG 3.14Å; S468-R472 PolarHBondContact O-N 3.48Å; V469-R472 PolarHBondContact O-N 3.12Å; V469-R472 VanDerWaalsContact O-N 3.15Å; E470-R472 VanDerWaalsContact C-N 3.33Å; E470-R472 PolarHBondContact O-N 3.08Å; R472-Q475 PolarHBondContact O-N 3.31Å; R472-L476 WeakPolarHBondContact O-CG 3.42Å; R472-L476 PolarHBondContact O-N 3.26Å
473	C	94.8	Very high	96.1	Very high	65 Å²	65	102.3 Å²	102.3	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-44.1	179.4	-159.2	0	0	0	0	111.1	V469 E470 L476 N477	V469-C473 WeakPolarHBondContact O-CB 3.47Å; V469-C473 PolarHBondContact O-N 2.88Å; E470-C473 PolarHBondContact O-N 3.46Å; C473-L476 PolarHBondContact O-N 2.91Å; C473-N477 WeakPolarHBondContact O-CB 3.44Å; C473-N477 PolarHBondContact O-N 3.15Å; C473-N477 PolarHBondContact O-ND2 2.81Å
474	T	95.4	Very high	96.1	Very high	83 Å²	83	101 Å²	101	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-42.9	174.2	51.5	0	0	0	0	111.9	E470 R471 L476 N477 T478	E470-T474 WeakPolarHBondContact O-CG2 3.46Å; E470-T474 PolarHBondContact O-N 2.92Å; E470-T474 PolarHBondContact O-OG1 3.18Å; R471-T474 WeakPolarHBondContact CA-OG1 3.3Å; R471-T474 PolarHBondContact O-OG1 3Å; T474-L476 PolarHBondContact O-N 3.41Å; T474-N477 PolarHBondContact O-N 2.93Å; T474-T478 WeakPolarHBondContact O-CG2 3.49Å; T474-T478 PolarHBondContact O-N 3.48Å
475	Q	96.4	Very high	96	Very high	116 Å²	116	99.3 Å²	99.3	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-60.4	-45.1	173.7	-74.1	174	13.6	0	0	112.5	R471 R472 T478 K479	R471-Q475 WeakPolarHBondContact O-CB 3.36Å; R471-Q475 VanDerWaalsContact O-CG 3.25Å; R471-Q475 WeakPolarHBondContact O-CG 3.45Å; R471-Q475 PolarHBondContact O-N 2.92Å; R471-Q475 VanDerWaalsContact O-N 3.07Å; R472-Q475 PolarHBondContact O-N 3.31Å; Q475-T478 PolarHBondContact O-N 3.07Å; Q475-T478 PolarHBondContact O-OG1 2.98Å; Q475-K479 PolarHBondContact O-N 2.78Å; Q475-K479 VanDerWaalsContact O-N 3.14Å
476	L	94.8	Very high	96	Very high	106 Å²	106	98.2 Å²	98.2	56%	0.555	50%	0.5	S	S	*	.	H	α-helix	trans	-64	-42.2	176.8	-73.8	171.8	0	0	0	111.7	R472 C473 T474 T478 K479 V480	R472-L476 WeakPolarHBondContact O-CG 3.42Å; R472-L476 PolarHBondContact O-N 3.26Å; C473-L476 PolarHBondContact O-N 2.91Å; T474-L476 PolarHBondContact O-N 3.41Å; L476-T478 VanDerWaalsContact C-N 3.32Å; L476-T478 PolarHBondContact O-N 3.25Å; L476-K479 WeakPolarHBondContact O-CB 3.39Å; L476-K479 PolarHBondContact O-N 3.37Å; L476-K479 VanDerWaalsContact O-N 3.13Å; L476-V480 WeakPolarHBondContact O-CG2 3.24Å; L476-V480 PolarHBondContact O-N 3.43Å
477	N	94.8	Very high	95.9	Very high	101 Å²	101	97.6 Å²	97.6	54%	0.54	50%	0.502	S	S	.	.	H	α-helix	trans	-60.1	-41	176.2	-78.2	-26.3	0	0	0	112.1	C473 T474 K479 V480 A481	C473-N477 WeakPolarHBondContact O-CB 3.44Å; C473-N477 PolarHBondContact O-N 3.15Å; C473-N477 PolarHBondContact O-ND2 2.81Å; T474-N477 PolarHBondContact O-N 2.93Å; N477-K479 VanDerWaalsContact C-N 3.34Å; N477-K479 PolarHBondContact O-N 3.32Å; N477-V480 PolarHBondContact O-N 3.42Å; N477-A481 WeakPolarHBondContact O-CB 3.48Å; N477-A481 PolarHBondContact O-N 3.02Å
478	T	96.6	Very high	95.9	Very high	82 Å²	82	98.9 Å²	98.9	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-64.9	-37.6	175.6	61.5	0	0	0	0	112.3	T474 Q475 L476 K482	T474-T478 WeakPolarHBondContact O-CG2 3.49Å; T474-T478 PolarHBondContact O-N 3.48Å; Q475-T478 PolarHBondContact O-N 3.07Å; Q475-T478 PolarHBondContact O-OG1 2.98Å; L476-T478 VanDerWaalsContact C-N 3.32Å; L476-T478 PolarHBondContact O-N 3.25Å; T478-K482 WeakPolarHBondContact O-CG 3.49Å; T478-K482 PolarHBondContact O-N 2.86Å; T478-K482 VanDerWaalsContact O-N 3.08Å
479	K	96.3	Very high	95.9	Very high	125 Å²	125	102.9 Å²	102.9	54%	0.543	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-45.2	174.5	-70.9	177.8	179.9	-179.7	0	111.9	Q475 L476 N477 A481 K482 L483	Q475-K479 PolarHBondContact O-N 2.78Å; Q475-K479 VanDerWaalsContact O-N 3.14Å; L476-K479 WeakPolarHBondContact O-CB 3.39Å; L476-K479 PolarHBondContact O-N 3.37Å; L476-K479 VanDerWaalsContact O-N 3.13Å; N477-K479 VanDerWaalsContact C-N 3.34Å; N477-K479 PolarHBondContact O-N 3.32Å; K479-A481 VanDerWaalsContact C-N 3.32Å; K479-A481 PolarHBondContact O-N 3.02Å; K479-K482 PolarHBondContact O-N 3.21Å; K479-L483 WeakPolarHBondContact O-CG 3.34Å; K479-L483 PolarHBondContact O-N 3.38Å
480	V	96.1	Very high	95.8	Very high	83 Å²	83	104 Å²	104	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-60.5	-43.6	176.7	171.2	0	0	0	0	110.6	L476 N477 K482 L483 T484	L476-V480 WeakPolarHBondContact O-CG2 3.24Å; L476-V480 PolarHBondContact O-N 3.43Å; N477-V480 PolarHBondContact O-N 3.42Å; V480-K482 PolarHBondContact O-N 2.82Å; V480-L483 PolarHBondContact O-N 3.28Å; V480-T484 VanDerWaalsContact O-CB 3.3Å; V480-T484 WeakPolarHBondContact O-CB 3.42Å; V480-T484 PolarHBondContact O-N 3.17Å; V480-T484 PolarHBondContact O-OG1 2.96Å
481	A	96	Very high	95.8	Very high	55 Å²	55	104.9 Å²	104.9	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-60.7	-43.9	176.9	0	0	0	0	0	112.3	N477 K479 T484 N485	N477-A481 WeakPolarHBondContact O-CB 3.48Å; N477-A481 PolarHBondContact O-N 3.02Å; K479-A481 VanDerWaalsContact C-N 3.32Å; K479-A481 PolarHBondContact O-N 3.02Å; A481-T484 PolarHBondContact O-N 2.93Å; A481-N485 PolarHBondContact O-N 3.19Å; A481-N485 VanDerWaalsContact O-N 3.08Å
482	K	96.6	Very high	95.7	Very high	138 Å²	138	103 Å²	103	60%	0.6	52%	0.521	S	S	*	.	H	α-helix	trans	-61	-53.4	175.4	-73.7	179.5	179.9	-172.1	0	112.2	T478 K479 V480 T484 N485 E486	T478-K482 WeakPolarHBondContact O-CG 3.49Å; T478-K482 PolarHBondContact O-N 2.86Å; T478-K482 VanDerWaalsContact O-N 3.08Å; K479-K482 PolarHBondContact O-N 3.21Å; V480-K482 PolarHBondContact O-N 2.82Å; K482-T484 PolarHBondContact O-N 3.13Å; K482-N485 PolarHBondContact O-N 3.24Å; K482-E486 PolarHBondContact O-N 3.09Å
483	L	95.4	Very high	95.6	Very high	109 Å²	109	100 Å²	100	57%	0.571	51%	0.514	S	S	*	.	H	α-helix	trans	-60.1	-34	178.7	-70.2	172.8	0	0	0	112.2	K479 V480 L487	K479-L483 WeakPolarHBondContact O-CG 3.34Å; K479-L483 PolarHBondContact O-N 3.38Å; V480-L483 PolarHBondContact O-N 3.28Å; L483-L487 VanDerWaalsContact O-CB 3.24Å; L483-L487 WeakPolarHBondContact O-CB 3.3Å; L483-L487 PolarHBondContact O-N 3.35Å
484	T	96.1	Very high	95.6	Very high	61 Å²	61	100.5 Å²	100.5	37%	0.374	51%	0.512	S	S	.	.	H	α-helix	trans	-68	-37.1	176.2	-56.3	0	0	0	0	111.8	V480 A481 K482 K488	V480-T484 VanDerWaalsContact O-CB 3.3Å; V480-T484 WeakPolarHBondContact O-CB 3.42Å; V480-T484 PolarHBondContact O-N 3.17Å; V480-T484 PolarHBondContact O-OG1 2.96Å; A481-T484 PolarHBondContact O-N 2.93Å; K482-T484 PolarHBondContact O-N 3.13Å; T484-K488 WeakPolarHBondContact O-CG 3.28Å; T484-K488 PolarHBondContact O-N 2.89Å; T484-K488 VanDerWaalsContact O-N 3.16Å
485	N	95.9	Very high	95.6	Very high	93 Å²	93	102.6 Å²	102.6	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-70	-47.5	174.4	-83.9	0.5	0	0	0	111.6	A481 K482 L487 K488 E489	A481-N485 PolarHBondContact O-N 3.19Å; A481-N485 VanDerWaalsContact O-N 3.08Å; K482-N485 PolarHBondContact O-N 3.24Å; N485-L487 VanDerWaalsContact C-N 3.28Å; N485-L487 PolarHBondContact O-N 3.34Å; N485-K488 WeakPolarHBondContact O-CB 3.01Å; N485-K488 PolarHBondContact O-N 2.98Å; N485-E489 WeakPolarHBondContact O-CG 3.36Å; N485-E489 PolarHBondContact O-N 2.96Å
486	E	95.8	Very high	95.6	Very high	103 Å²	103	100.4 Å²	100.4	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-56	-44.2	175.7	-70.3	169.3	-165	0	0	111	K482 K488 E489 E490	K482-E486 PolarHBondContact O-N 3.09Å; E486-K488 VanDerWaalsContact C-N 3.33Å; E486-K488 PolarHBondContact O-N 3.44Å; E486-E489 PolarHBondContact O-N 2.82Å; E486-E490 WeakPolarHBondContact O-CB 3.32Å; E486-E490 WeakPolarHBondContact O-CG 3.46Å; E486-E490 PolarHBondContact O-N 2.95Å
487	L	95.9	Very high	95.5	Very high	103 Å²	103	100.4 Å²	100.4	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-61.1	-39.4	175.7	-178.3	65.2	0	0	0	112.6	L483 N485 Q491	L483-L487 VanDerWaalsContact O-CB 3.24Å; L483-L487 WeakPolarHBondContact O-CB 3.3Å; L483-L487 PolarHBondContact O-N 3.35Å; N485-L487 VanDerWaalsContact C-N 3.28Å; N485-L487 PolarHBondContact O-N 3.34Å; L487-Q491 WeakPolarHBondContact O-CB 3.48Å; L487-Q491 WeakPolarHBondContact O-CG 3.26Å; L487-Q491 PolarHBondContact O-N 2.89Å
488	K	96.1	Very high	95.5	Very high	125 Å²	125	103.3 Å²	103.3	54%	0.543	52%	0.515	S	S	.	.	H	α-helix	trans	-67.7	-42.6	177	-77.8	174.2	-178.1	174.8	0	111.7	T484 N485 E486 Q491 E492	T484-K488 WeakPolarHBondContact O-CG 3.28Å; T484-K488 PolarHBondContact O-N 2.89Å; T484-K488 VanDerWaalsContact O-N 3.16Å; N485-K488 WeakPolarHBondContact O-CB 3.01Å; N485-K488 PolarHBondContact O-N 2.98Å; E486-K488 VanDerWaalsContact C-N 3.33Å; E486-K488 PolarHBondContact O-N 3.44Å; K488-Q491 PolarHBondContact O-N 3.48Å; K488-E492 PolarHBondContact O-N 2.89Å
489	E	96.4	Very high	95.4	Very high	131 Å²	131	102.2 Å²	102.2	61%	0.612	51%	0.514	S	S	*	.	H	α-helix	trans	-61.6	-47.6	177.2	-71.4	172	-169.3	0	0	110.7	N485 E486 Q491 E492 M493	N485-E489 WeakPolarHBondContact O-CG 3.36Å; N485-E489 PolarHBondContact O-N 2.96Å; E486-E489 PolarHBondContact O-N 2.82Å; E489-Q491 PolarHBondContact O-N 2.84Å; E489-E492 PolarHBondContact O-N 3.06Å; E489-M493 WeakPolarHBondContact O-CB 3.31Å; E489-M493 PolarHBondContact O-N 3.32Å
490	E	93.5	Very high	95.3	Very high	112 Å²	112	100.8 Å²	100.8	52%	0.523	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-41.1	174.9	-76.1	-61.9	146.4	0	0	112.5	E486 M493 N494	E486-E490 WeakPolarHBondContact O-CB 3.32Å; E486-E490 WeakPolarHBondContact O-CG 3.46Å; E486-E490 PolarHBondContact O-N 2.95Å; E490-M493 VanDerWaalsContact CD-CE 3.49Å; E490-M493 PolarHBondContact O-N 2.96Å; E490-M493 VanDerWaalsContact OE1-CE 3.23Å; E490-M493 WeakPolarHBondContact OE1-CE 3.37Å; E490-M493 VanDerWaalsContact OE2-CE 3.27Å; E490-M493 WeakPolarHBondContact OE2-CE 3.3Å; E490-N494 VanDerWaalsContact O-CB 3.3Å; E490-N494 WeakPolarHBondContact O-CB 3.33Å; E490-N494 PolarHBondContact O-N 3.38Å
491	Q	94.8	Very high	95.2	Very high	115 Å²	115	102.1 Å²	102.1	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-45	176	-80.1	174.8	-0.9	0	0	112.3	L487 K488 E489 N494 K495	L487-Q491 WeakPolarHBondContact O-CB 3.48Å; L487-Q491 WeakPolarHBondContact O-CG 3.26Å; L487-Q491 PolarHBondContact O-N 2.89Å; K488-Q491 PolarHBondContact O-N 3.48Å; E489-Q491 PolarHBondContact O-N 2.84Å; Q491-N494 PolarHBondContact O-N 3.14Å; Q491-K495 WeakPolarHBondContact O-CB 3.43Å; Q491-K495 PolarHBondContact O-N 3.18Å
492	E	95	Very high	95.2	Very high	102 Å²	102	103.1 Å²	103.1	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-70.4	-37.8	179.3	-161.1	63.2	-150.5	0	0	111.1	K488 E489 K495 C496	K488-E492 PolarHBondContact O-N 2.89Å; E489-E492 PolarHBondContact O-N 3.06Å; E492-K495 WeakPolarHBondContact O-CB 3.39Å; E492-K495 PolarHBondContact O-N 2.77Å; E492-K495 IonicContact OE1-NZ 2.89Å; E492-K495 PolarHBondContact OE1-NZ 2.87Å; E492-K495 IonicContact OE2-NZ 3.33Å; E492-K495 PolarHBondContact OE2-NZ 3.31Å; E492-C496 PolarHBondContact O-N 2.77Å
493	M	95.4	Very high	95.1	Very high	92 Å²	92	100.8 Å²	100.8	45%	0.453	51%	0.507	S	S	.	.	H	α-helix	trans	-60.7	-47.5	172.8	-179.3	162.7	61.1	0	0	111.5	E489 E490 K495 C496 L497	E489-M493 WeakPolarHBondContact O-CB 3.31Å; E489-M493 PolarHBondContact O-N 3.32Å; E490-M493 VanDerWaalsContact CD-CE 3.49Å; E490-M493 PolarHBondContact O-N 2.96Å; E490-M493 VanDerWaalsContact OE1-CE 3.23Å; E490-M493 WeakPolarHBondContact OE1-CE 3.37Å; E490-M493 VanDerWaalsContact OE2-CE 3.27Å; E490-M493 WeakPolarHBondContact OE2-CE 3.3Å; M493-K495 VanDerWaalsContact C-N 3.28Å; M493-K495 PolarHBondContact O-N 3.45Å; M493-C496 PolarHBondContact O-N 2.91Å; M493-L497 HydrophobicContact CG-CD1 4.04Å; M493-L497 HydrophobicContact CG-CG 4.44Å; M493-L497 WeakPolarHBondContact O-CB 3.41Å; M493-L497 WeakPolarHBondContact O-CG 3.37Å; M493-L497 PolarHBondContact O-N 2.83Å
494	N	94.9	Very high	95	Very high	75 Å²	75	101 Å²	101	40%	0.401	51%	0.508	S	S	.	.	H	α-helix	trans	-60.2	-40	177.9	-159.4	-80.7	0	0	0	111.7	E490 Q491 L497 R498	E490-N494 VanDerWaalsContact O-CB 3.3Å; E490-N494 WeakPolarHBondContact O-CB 3.33Å; E490-N494 PolarHBondContact O-N 3.38Å; Q491-N494 PolarHBondContact O-N 3.14Å; N494-L497 PolarHBondContact O-N 3.06Å; N494-R498 WeakPolarHBondContact O-CB 3.42Å; N494-R498 WeakPolarHBondContact O-CG 3.34Å; N494-R498 PolarHBondContact O-N 2.85Å; N494-R498 VanDerWaalsContact OD1-CZ 3.31Å; N494-R498 PolarHBondContact OD1-NE 2.88Å; N494-R498 VanDerWaalsContact OD1-NE 3.16Å
495	K	95.5	Very high	94.9	Very high	127 Å²	127	102.6 Å²	102.6	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-64.5	-45.5	176.9	-176.5	-178.6	162.2	-146.9	0	112.1	Q491 E492 M493 R498 A499	Q491-K495 WeakPolarHBondContact O-CB 3.43Å; Q491-K495 PolarHBondContact O-N 3.18Å; E492-K495 WeakPolarHBondContact O-CB 3.39Å; E492-K495 PolarHBondContact O-N 2.77Å; E492-K495 IonicContact OE1-NZ 2.89Å; E492-K495 PolarHBondContact OE1-NZ 2.87Å; E492-K495 IonicContact OE2-NZ 3.33Å; E492-K495 PolarHBondContact OE2-NZ 3.31Å; M493-K495 VanDerWaalsContact C-N 3.28Å; M493-K495 PolarHBondContact O-N 3.45Å; K495-R498 PolarHBondContact O-N 3.4Å; K495-A499 PolarHBondContact O-N 3.31Å
496	C	95.4	Very high	94.8	Very high	70 Å²	70	102.6 Å²	102.6	47%	0.473	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-44.8	173.7	-87.7	0	0	0	0	112.3	E492 M493 R498 A499 N500	E492-C496 PolarHBondContact O-N 2.77Å; M493-C496 PolarHBondContact O-N 2.91Å; C496-R498 PolarHBondContact O-N 2.83Å; C496-A499 PolarHBondContact O-N 2.83Å; C496-N500 PolarHBondContact O-N 3.4Å
497	L	93.7	Very high	94.8	Very high	107 Å²	107	103.8 Å²	103.8	56%	0.56	52%	0.515	S	S	*	.	H	α-helix	trans	-61.6	-43	177.6	-73.5	172.4	0	0	0	111.9	M493 N494 N500 Q501	M493-L497 HydrophobicContact CG-CD1 4.04Å; M493-L497 HydrophobicContact CG-CG 4.44Å; M493-L497 WeakPolarHBondContact O-CB 3.41Å; M493-L497 WeakPolarHBondContact O-CG 3.37Å; M493-L497 PolarHBondContact O-N 2.83Å; N494-L497 PolarHBondContact O-N 3.06Å; L497-N500 PolarHBondContact O-N 2.86Å; L497-Q501 WeakPolarHBondContact O-CB 3.25Å; L497-Q501 PolarHBondContact O-N 3.37Å
498	R	93.7	Very high	94.7	Very high	161 Å²	161	103.9 Å²	103.9	61%	0.608	52%	0.516	S	S	*	.	H	α-helix	trans	-62.9	-41.8	174.3	-76.2	-177.2	-178.8	164.7	4.2	112.3	N494 K495 C496 Q501 V502	N494-R498 WeakPolarHBondContact O-CB 3.42Å; N494-R498 WeakPolarHBondContact O-CG 3.34Å; N494-R498 PolarHBondContact O-N 2.85Å; N494-R498 VanDerWaalsContact OD1-CZ 3.31Å; N494-R498 PolarHBondContact OD1-NE 2.88Å; N494-R498 VanDerWaalsContact OD1-NE 3.16Å; K495-R498 PolarHBondContact O-N 3.4Å; C496-R498 PolarHBondContact O-N 2.83Å; R498-Q501 PolarHBondContact O-N 2.86Å; R498-V502 WeakPolarHBondContact O-CG2 3.26Å; R498-V502 PolarHBondContact O-N 3.44Å
499	A	94.6	Very high	94.6	Very high	60 Å²	60	104.2 Å²	104.2	50%	0.496	52%	0.517	S	S	.	.	H	α-helix	trans	-61.2	-45.1	175.7	0	0	0	0	0	111.4	K495 C496 V502 L503	K495-A499 PolarHBondContact O-N 3.31Å; C496-A499 PolarHBondContact O-N 2.83Å; A499-V502 PolarHBondContact O-N 2.81Å; A499-L503 WeakPolarHBondContact O-CB 3.29Å; A499-L503 PolarHBondContact O-N 3.25Å
500	N	95	Very high	94.5	Very high	94 Å²	94	102 Å²	102	50%	0.503	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-41.3	174.9	-79.6	-19	0	0	0	112.4	C496 L497 V502 L503 L504	C496-N500 PolarHBondContact O-N 3.4Å; L497-N500 PolarHBondContact O-N 2.86Å; N500-V502 VanDerWaalsContact C-N 3.34Å; N500-V502 PolarHBondContact O-N 2.79Å; N500-L503 PolarHBondContact O-N 2.87Å; N500-L504 WeakPolarHBondContact O-CB 3.08Å; N500-L504 WeakPolarHBondContact O-CG 3.28Å; N500-L504 PolarHBondContact O-N 3.4Å
501	Q	93.6	Very high	94.4	Very high	112 Å²	112	103 Å²	103	52%	0.523	51%	0.511	S	S	.	.	H	α-helix	trans	-59.3	-45.2	176.2	-174.5	-179.2	16.9	0	0	111.3	L497 R498 L503 L504 Q505	L497-Q501 WeakPolarHBondContact O-CB 3.25Å; L497-Q501 PolarHBondContact O-N 3.37Å; R498-Q501 PolarHBondContact O-N 2.86Å; Q501-L503 VanDerWaalsContact C-N 3.34Å; Q501-L503 PolarHBondContact O-N 3Å; Q501-L504 PolarHBondContact O-N 3.3Å; Q501-Q505 WeakPolarHBondContact O-CB 3.31Å; Q501-Q505 VanDerWaalsContact O-CG 3.31Å; Q501-Q505 WeakPolarHBondContact O-CG 3.25Å; Q501-Q505 PolarHBondContact O-N 2.83Å
502	V	95.4	Very high	94.3	Very high	75 Å²	75	103 Å²	103	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-62.9	-41.9	176	171.7	0	0	0	0	111.1	R498 A499 N500 Q505 N506	R498-V502 WeakPolarHBondContact O-CG2 3.26Å; R498-V502 PolarHBondContact O-N 3.44Å; A499-V502 PolarHBondContact O-N 2.81Å; N500-V502 VanDerWaalsContact C-N 3.34Å; N500-V502 PolarHBondContact O-N 2.79Å; V502-Q505 PolarHBondContact O-N 2.87Å; V502-N506 WeakPolarHBondContact O-CB 3.4Å; V502-N506 VanDerWaalsContact O-CG 3.26Å; V502-N506 PolarHBondContact O-N 3.32Å; V502-N506 PolarHBondContact O-ND2 3.34Å
503	L	95.3	Very high	94.3	Very high	89 Å²	89	103.6 Å²	103.6	47%	0.466	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-43.4	179.2	-150.2	161	0	0	0	111.3	A499 N500 Q501 N506 K507	A499-L503 WeakPolarHBondContact O-CB 3.29Å; A499-L503 PolarHBondContact O-N 3.25Å; N500-L503 PolarHBondContact O-N 2.87Å; Q501-L503 VanDerWaalsContact C-N 3.34Å; Q501-L503 PolarHBondContact O-N 3Å; L503-N506 PolarHBondContact O-N 2.89Å; L503-K507 HydrophobicContact CD2-CD 3.99Å; L503-K507 HydrophobicContact CD2-CG 4.23Å; L503-K507 WeakPolarHBondContact O-CG 3.38Å; L503-K507 PolarHBondContact O-N 3.44Å
504	L	92.8	Very high	94.3	Very high	115 Å²	115	102 Å²	102	60%	0.602	50%	0.504	S	S	*	.	H	α-helix	trans	-64.4	-43	174.4	-73.9	169.8	0	0	0	112.1	N500 Q501 N506 K507 L508	N500-L504 WeakPolarHBondContact O-CB 3.08Å; N500-L504 WeakPolarHBondContact O-CG 3.28Å; N500-L504 PolarHBondContact O-N 3.4Å; Q501-L504 PolarHBondContact O-N 3.3Å; L504-N506 VanDerWaalsContact C-N 3.31Å; L504-N506 PolarHBondContact O-N 3.41Å; L504-K507 PolarHBondContact O-N 3.49Å; L504-L508 WeakPolarHBondContact O-CB 3.02Å; L504-L508 PolarHBondContact O-N 3.24Å
505	Q	94.1	Very high	94.2	Very high	94 Å²	94	104.4 Å²	104.4	44%	0.439	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-39.9	175.2	-77.3	177.2	-9.1	0	0	112	Q501 V502 L508 K509	Q501-Q505 WeakPolarHBondContact O-CB 3.31Å; Q501-Q505 VanDerWaalsContact O-CG 3.31Å; Q501-Q505 WeakPolarHBondContact O-CG 3.25Å; Q501-Q505 PolarHBondContact O-N 2.83Å; V502-Q505 PolarHBondContact O-N 2.87Å; Q505-L508 PolarHBondContact O-N 2.98Å; Q505-K509 WeakPolarHBondContact O-CB 3.4Å; Q505-K509 WeakPolarHBondContact O-CG 3.26Å; Q505-K509 PolarHBondContact O-N 2.99Å
506	N	94.4	Very high	94.1	Very high	93 Å²	93	105 Å²	105	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-67.8	-41.8	176.7	-71.2	-18.1	0	0	0	111.8	V502 L503 L504 K509 E510	V502-N506 WeakPolarHBondContact O-CB 3.4Å; V502-N506 VanDerWaalsContact O-CG 3.26Å; V502-N506 PolarHBondContact O-N 3.32Å; V502-N506 PolarHBondContact O-ND2 3.34Å; L503-N506 PolarHBondContact O-N 2.89Å; L504-N506 VanDerWaalsContact C-N 3.31Å; L504-N506 PolarHBondContact O-N 3.41Å; N506-K509 PolarHBondContact O-N 3.29Å; N506-E510 WeakPolarHBondContact O-CB 3.4Å; N506-E510 PolarHBondContact O-N 3.34Å
507	K	94.8	Very high	94	Very high	128 Å²	128	105.4 Å²	105.4	56%	0.557	51%	0.514	S	S	*	.	H	α-helix	trans	-61.4	-45.6	173.6	-77.1	-178.3	174.5	-177.2	0	111.6	L503 L504 K509 E510 E511	L503-K507 HydrophobicContact CD2-CD 3.99Å; L503-K507 HydrophobicContact CD2-CG 4.23Å; L503-K507 WeakPolarHBondContact O-CG 3.38Å; L503-K507 PolarHBondContact O-N 3.44Å; L504-K507 PolarHBondContact O-N 3.49Å; K507-K509 VanDerWaalsContact C-N 3.34Å; K507-K509 PolarHBondContact O-N 2.82Å; K507-E510 PolarHBondContact O-N 2.63Å; K507-E511 WeakPolarHBondContact O-CB 3.49Å; K507-E511 WeakPolarHBondContact O-CG 3.24Å; K507-E511 PolarHBondContact O-N 2.73Å
508	L	93.3	Very high	94	Very high	105 Å²	105	103.2 Å²	103.2	55%	0.55	51%	0.505	S	S	.	.	H	α-helix	trans	-58.2	-47.8	177.2	-168.6	87	0	0	0	110.9	L504 Q505 E510 E511 E512	L504-L508 WeakPolarHBondContact O-CB 3.02Å; L504-L508 PolarHBondContact O-N 3.24Å; Q505-L508 PolarHBondContact O-N 2.98Å; L508-E510 VanDerWaalsContact C-N 3.31Å; L508-E510 PolarHBondContact O-N 3.23Å; L508-E511 PolarHBondContact O-N 3.48Å; L508-E512 WeakPolarHBondContact O-CB 3.47Å; L508-E512 VanDerWaalsContact O-CG 3.29Å; L508-E512 WeakPolarHBondContact O-CG 3.17Å; L508-E512 PolarHBondContact O-N 3.38Å
509	K	94	Very high	93.9	Very high	131 Å²	131	98.5 Å²	98.5	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-61	-38.9	177.1	-76.7	176.9	179.9	179.3	0	113	Q505 N506 K507 R513	Q505-K509 WeakPolarHBondContact O-CB 3.4Å; Q505-K509 WeakPolarHBondContact O-CG 3.26Å; Q505-K509 PolarHBondContact O-N 2.99Å; N506-K509 PolarHBondContact O-N 3.29Å; K507-K509 VanDerWaalsContact C-N 3.34Å; K507-K509 PolarHBondContact O-N 2.82Å; K509-R513 WeakPolarHBondContact O-CB 3.15Å; K509-R513 PolarHBondContact O-N 2.84Å
510	E	94.4	Very high	93.8	Very high	85 Å²	85	99.4 Å²	99.4	40%	0.397	49%	0.493	S	S	.	.	H	α-helix	trans	-69.4	-43.8	178.3	-177.1	60.3	-171.1	0	0	111.3	N506 K507 L508 R513 V514	N506-E510 WeakPolarHBondContact O-CB 3.4Å; N506-E510 PolarHBondContact O-N 3.34Å; K507-E510 PolarHBondContact O-N 2.63Å; L508-E510 VanDerWaalsContact C-N 3.31Å; L508-E510 PolarHBondContact O-N 3.23Å; E510-R513 WeakPolarHBondContact O-CB 3.46Å; E510-R513 PolarHBondContact O-N 3.42Å; E510-R513 IonicContact OE1-CZ 3.48Å; E510-R513 IonicContact OE1-NE 3.47Å; E510-R513 PolarHBondContact OE1-NE 3.15Å; E510-R513 IonicContact OE1-NH2 2.67Å; E510-R513 PolarHBondContact OE1-NH2 3.4Å; E510-R513 IonicContact OE2-CZ 3.7Å; E510-R513 IonicContact OE2-NE 2.95Å; E510-R513 PolarHBondContact OE2-NE 3.38Å; E510-R513 IonicContact OE2-NH2 3.6Å; E510-V514 WeakPolarHBondContact O-CG2 3.37Å; E510-V514 PolarHBondContact O-N 3.34Å
511	E	92.4	Very high	93.6	Very high	132 Å²	132	100.4 Å²	100.4	62%	0.617	50%	0.495	S	S	*	.	H	α-helix	trans	-61.4	-43.4	173.1	-70.1	-65.5	152.4	0	0	111.4	K507 L508 R513 V514 L515	K507-E511 WeakPolarHBondContact O-CB 3.49Å; K507-E511 WeakPolarHBondContact O-CG 3.24Å; K507-E511 PolarHBondContact O-N 2.73Å; L508-E511 PolarHBondContact O-N 3.48Å; E511-R513 VanDerWaalsContact C-N 3.31Å; E511-R513 PolarHBondContact O-N 3.41Å; E511-V514 PolarHBondContact O-N 2.84Å; E511-L515 VanDerWaalsContact O-CB 3.28Å; E511-L515 WeakPolarHBondContact O-CB 3.48Å; E511-L515 PolarHBondContact O-N 3.46Å
512	E	93.3	Very high	93.5	Very high	115 Å²	115	101.5 Å²	101.5	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-40.1	173.6	-76.2	173.7	170.4	0	0	111.9	L508 K516	L508-E512 WeakPolarHBondContact O-CB 3.47Å; L508-E512 VanDerWaalsContact O-CG 3.29Å; L508-E512 WeakPolarHBondContact O-CG 3.17Å; L508-E512 PolarHBondContact O-N 3.38Å; E512-K516 WeakPolarHBondContact O-CB 3.24Å; E512-K516 PolarHBondContact O-N 3.48Å
513	R	94.4	Very high	93.3	Very high	115 Å²	115	101.8 Å²	101.8	43%	0.434	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-49.1	175.8	-175.5	-175.3	75.5	89.6	1.2	111.2	K509 E510 E511 L515 K516 E517	K509-R513 WeakPolarHBondContact O-CB 3.15Å; K509-R513 PolarHBondContact O-N 2.84Å; E510-R513 WeakPolarHBondContact O-CB 3.46Å; E510-R513 PolarHBondContact O-N 3.42Å; E510-R513 IonicContact OE1-CZ 3.48Å; E510-R513 IonicContact OE1-NE 3.47Å; E510-R513 PolarHBondContact OE1-NE 3.15Å; E510-R513 IonicContact OE1-NH2 2.67Å; E510-R513 PolarHBondContact OE1-NH2 3.4Å; E510-R513 IonicContact OE2-CZ 3.7Å; E510-R513 IonicContact OE2-NE 2.95Å; E510-R513 PolarHBondContact OE2-NE 3.38Å; E510-R513 IonicContact OE2-NH2 3.6Å; E511-R513 VanDerWaalsContact C-N 3.31Å; E511-R513 PolarHBondContact O-N 3.41Å; R513-L515 VanDerWaalsContact C-N 3.32Å; R513-L515 PolarHBondContact O-N 3.42Å; R513-K516 PolarHBondContact O-N 2.86Å; R513-E517 IonicContact CZ-OE1 3.6Å; R513-E517 VanDerWaalsContact NH1-CD 3.34Å; R513-E517 IonicContact NH1-OE1 2.62Å; R513-E517 PolarHBondContact NH1-OE1 3.43Å; R513-E517 IonicContact NH1-OE2 3.34Å; R513-E517 PolarHBondContact NH1-OE2 3.3Å; R513-E517 WeakPolarHBondContact O-CG 3.43Å; R513-E517 PolarHBondContact O-N 2.79Å
514	V	94.6	Very high	93.2	Very high	58 Å²	58	103.1 Å²	103.1	35%	0.352	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-41.2	178.4	171.5	0	0	0	0	110.9	E510 E511 K516 E517 T518	E510-V514 WeakPolarHBondContact O-CG2 3.37Å; E510-V514 PolarHBondContact O-N 3.34Å; E511-V514 PolarHBondContact O-N 2.84Å; V514-K516 VanDerWaalsContact C-N 3.31Å; V514-K516 PolarHBondContact O-N 2.86Å; V514-E517 PolarHBondContact O-N 2.84Å; V514-T518 WeakPolarHBondContact O-CB 3.42Å; V514-T518 WeakPolarHBondContact O-CG2 3.49Å; V514-T518 PolarHBondContact O-N 2.87Å; V514-T518 PolarHBondContact O-OG1 3.12Å
515	L	93.1	Very high	93.1	Very high	126 Å²	126	103.1 Å²	103.1	66%	0.66	50%	0.5	S	S	*	.	H	α-helix	trans	-63.2	-40.2	176.5	-157.8	102.5	0	0	0	111.3	E511 R513 T518 C519	E511-L515 VanDerWaalsContact O-CB 3.28Å; E511-L515 WeakPolarHBondContact O-CB 3.48Å; E511-L515 PolarHBondContact O-N 3.46Å; R513-L515 VanDerWaalsContact C-N 3.32Å; R513-L515 PolarHBondContact O-N 3.42Å; L515-T518 WeakPolarHBondContact CA-OG1 3.28Å; L515-T518 PolarHBondContact O-OG1 2.85Å; L515-C519 WeakPolarHBondContact O-CB 3.31Å; L515-C519 PolarHBondContact O-N 3.32Å
516	K	94.1	Very high	93	Very high	140 Å²	140	102.6 Å²	102.6	61%	0.609	50%	0.5	S	S	*	.	H	α-helix	trans	-66.2	-47.7	175.9	-172.1	176.1	-179	179.5	0	111.8	E512 R513 V514 T518 C519 D520	E512-K516 WeakPolarHBondContact O-CB 3.24Å; E512-K516 PolarHBondContact O-N 3.48Å; R513-K516 PolarHBondContact O-N 2.86Å; V514-K516 VanDerWaalsContact C-N 3.31Å; V514-K516 PolarHBondContact O-N 2.86Å; K516-T518 VanDerWaalsContact C-N 3.28Å; K516-T518 PolarHBondContact O-N 3.1Å; K516-C519 WeakPolarHBondContact O-CB 3.25Å; K516-C519 PolarHBondContact O-N 2.83Å; K516-C519 VanDerWaalsContact O-N 3.12Å; K516-D520 VanDerWaalsContact O-CG 3.25Å; K516-D520 PolarHBondContact O-N 3.47Å
517	E	93.8	Very high	92.8	Very high	79 Å²	79	101.3 Å²	101.3	37%	0.369	50%	0.495	S	S	.	.	H	α-helix	trans	-60	-39.2	177.6	-75.4	173	-173.5	0	0	112.1	R513 V514 Q521	R513-E517 IonicContact CZ-OE1 3.6Å; R513-E517 VanDerWaalsContact NH1-CD 3.34Å; R513-E517 IonicContact NH1-OE1 2.62Å; R513-E517 PolarHBondContact NH1-OE1 3.43Å; R513-E517 IonicContact NH1-OE2 3.34Å; R513-E517 PolarHBondContact NH1-OE2 3.3Å; R513-E517 WeakPolarHBondContact O-CG 3.43Å; R513-E517 PolarHBondContact O-N 2.79Å; V514-E517 PolarHBondContact O-N 2.84Å; E517-Q521 WeakPolarHBondContact O-CB 3.41Å; E517-Q521 VanDerWaalsContact O-CG 3.24Å; E517-Q521 WeakPolarHBondContact O-CG 3.46Å; E517-Q521 PolarHBondContact O-N 2.87Å
518	T	92.8	Very high	92.6	Very high	60 Å²	60	100.5 Å²	100.5	37%	0.368	49%	0.493	S	S	.	.	H	α-helix	trans	-71.9	-34	175.3	47.8	0	0	0	0	112.7	V514 L515 K516 K522	V514-T518 WeakPolarHBondContact O-CB 3.42Å; V514-T518 WeakPolarHBondContact O-CG2 3.49Å; V514-T518 PolarHBondContact O-N 2.87Å; V514-T518 PolarHBondContact O-OG1 3.12Å; L515-T518 WeakPolarHBondContact CA-OG1 3.28Å; L515-T518 PolarHBondContact O-OG1 2.85Å; K516-T518 VanDerWaalsContact C-N 3.28Å; K516-T518 PolarHBondContact O-N 3.1Å; T518-K522 WeakPolarHBondContact O-CB 3.43Å; T518-K522 WeakPolarHBondContact O-CG 3.41Å; T518-K522 PolarHBondContact O-N 3.5Å
519	C	91.9	Very high	92.4	Very high	63 Å²	63	99.9 Å²	99.9	43%	0.426	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-51.1	171.4	-164.5	0	0	0	0	110.6	L515 K516 Q521 K522 D523	L515-C519 WeakPolarHBondContact O-CB 3.31Å; L515-C519 PolarHBondContact O-N 3.32Å; K516-C519 WeakPolarHBondContact O-CB 3.25Å; K516-C519 PolarHBondContact O-N 2.83Å; K516-C519 VanDerWaalsContact O-N 3.12Å; C519-Q521 VanDerWaalsContact C-N 3.28Å; C519-Q521 PolarHBondContact O-N 3.41Å; C519-K522 CarbonylContact O-C 3.57Å; C519-K522 PolarHBondContact O-N 3.13Å; C519-D523 PolarHBondContact O-N 3.03Å
520	D	92.3	Very high	92.1	Very high	79 Å²	79	98.5 Å²	98.5	42%	0.422	49%	0.485	S	S	.	.	H	α-helix	trans	-58	-41.3	178.7	-66.2	-19.6	0	0	0	110.9	K516 D523 L524	K516-D520 VanDerWaalsContact O-CG 3.25Å; K516-D520 PolarHBondContact O-N 3.47Å; D520-D523 PolarHBondContact O-N 3.44Å; D520-L524 WeakPolarHBondContact O-CB 3.41Å; D520-L524 PolarHBondContact O-N 2.8Å
521	Q	92	Very high	91.7	Very high	115 Å²	115	99.9 Å²	99.9	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-41.9	174.1	-78.3	174.5	13.1	0	0	113	E517 C519 L524 Q525	E517-Q521 WeakPolarHBondContact O-CB 3.41Å; E517-Q521 VanDerWaalsContact O-CG 3.24Å; E517-Q521 WeakPolarHBondContact O-CG 3.46Å; E517-Q521 PolarHBondContact O-N 2.87Å; C519-Q521 VanDerWaalsContact C-N 3.28Å; C519-Q521 PolarHBondContact O-N 3.41Å; Q521-L524 WeakPolarHBondContact O-CB 3.47Å; Q521-L524 PolarHBondContact O-N 3.15Å; Q521-Q525 WeakPolarHBondContact O-CG 3.3Å; Q521-Q525 PolarHBondContact O-N 3.26Å
522	K	90.8	Very high	91.4	Very high	135 Å²	135	98.5 Å²	98.5	59%	0.587	49%	0.485	S	S	*	.	H	α-helix	trans	-68	-38.3	176.4	-76.4	-176.3	180	-177.3	0	111.6	T518 C519 L524 Q525 I526	T518-K522 WeakPolarHBondContact O-CB 3.43Å; T518-K522 WeakPolarHBondContact O-CG 3.41Å; T518-K522 PolarHBondContact O-N 3.5Å; C519-K522 CarbonylContact O-C 3.57Å; C519-K522 PolarHBondContact O-N 3.13Å; K522-L524 VanDerWaalsContact C-N 3.34Å; K522-Q525 PolarHBondContact O-N 2.98Å; K522-I526 WeakPolarHBondContact O-CB 3.3Å; K522-I526 VanDerWaalsContact O-CG1 3.23Å; K522-I526 WeakPolarHBondContact O-CG1 3.2Å; K522-I526 PolarHBondContact O-N 3.29Å
523	D	90.9	Very high	90.8	Very high	80 Å²	80	97.9 Å²	97.9	43%	0.428	49%	0.485	S	S	.	.	H	α-helix	trans	-65.4	-38.2	175.5	-71.2	-28.2	0	0	0	111.3	C519 D520 I526 T527	C519-D523 PolarHBondContact O-N 3.03Å; D520-D523 PolarHBondContact O-N 3.44Å; D523-I526 PolarHBondContact O-N 2.88Å; D523-T527 WeakPolarHBondContact O-CB 3.15Å; D523-T527 WeakPolarHBondContact O-CG2 3.43Å; D523-T527 PolarHBondContact O-N 2.89Å; D523-T527 PolarHBondContact O-OG1 3.14Å
524	L	92.3	Very high	90.4	Very high	117 Å²	117	100.2 Å²	100.2	61%	0.613	49%	0.494	S	S	*	.	H	α-helix	trans	-59.5	-46.8	169.1	-89.7	153.9	0	0	0	112.1	D520 Q521 K522 I526 T527 E528	D520-L524 WeakPolarHBondContact O-CB 3.41Å; D520-L524 PolarHBondContact O-N 2.8Å; Q521-L524 WeakPolarHBondContact O-CB 3.47Å; Q521-L524 PolarHBondContact O-N 3.15Å; K522-L524 VanDerWaalsContact C-N 3.34Å; L524-I526 PolarHBondContact O-N 2.82Å; L524-T527 VanDerWaalsContact CA-OG1 3.29Å; L524-T527 WeakPolarHBondContact CA-OG1 3.46Å; L524-T527 PolarHBondContact O-N 3.07Å; L524-T527 PolarHBondContact O-OG1 2.8Å; L524-E528 WeakPolarHBondContact O-CB 3.29Å; L524-E528 PolarHBondContact O-N 3.34Å
525	Q	92.4	Very high	90	Very high	115 Å²	115	102.7 Å²	102.7	54%	0.537	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-40	176.1	-72.9	178.4	3.2	0	0	112.2	Q521 K522 E528 I529	Q521-Q525 WeakPolarHBondContact O-CG 3.3Å; Q521-Q525 PolarHBondContact O-N 3.26Å; K522-Q525 PolarHBondContact O-N 2.98Å; Q525-E528 PolarHBondContact O-N 2.78Å; Q525-I529 WeakPolarHBondContact O-CB 3.27Å; Q525-I529 WeakPolarHBondContact O-CD1 3.38Å; Q525-I529 WeakPolarHBondContact O-CG1 3.49Å; Q525-I529 PolarHBondContact O-N 3.41Å
526	I	90.3	Very high	89.5	Confident	83 Å²	83	100.6 Å²	100.6	43%	0.426	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-44.5	177	-71.6	165.1	0	0	0	109.9	K522 D523 L524 I529 Q530	K522-I526 WeakPolarHBondContact O-CB 3.3Å; K522-I526 VanDerWaalsContact O-CG1 3.23Å; K522-I526 WeakPolarHBondContact O-CG1 3.2Å; K522-I526 PolarHBondContact O-N 3.29Å; D523-I526 PolarHBondContact O-N 2.88Å; L524-I526 PolarHBondContact O-N 2.82Å; I526-I529 PolarHBondContact O-N 3.07Å; I526-Q530 HydrophobicContact CG2-CG 4.24Å; I526-Q530 VanDerWaalsContact O-CB 3.25Å; I526-Q530 WeakPolarHBondContact O-CB 3.46Å; I526-Q530 WeakPolarHBondContact O-CG 3.38Å; I526-Q530 PolarHBondContact O-N 2.96Å
527	T	90.7	Very high	88.7	Confident	66 Å²	66	99 Å²	99	41%	0.405	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-43.5	178.1	42.1	0	0	0	0	111.7	D523 L524 Q530 E531	D523-T527 WeakPolarHBondContact O-CB 3.15Å; D523-T527 WeakPolarHBondContact O-CG2 3.43Å; D523-T527 PolarHBondContact O-N 2.89Å; D523-T527 PolarHBondContact O-OG1 3.14Å; L524-T527 VanDerWaalsContact CA-OG1 3.29Å; L524-T527 WeakPolarHBondContact CA-OG1 3.46Å; L524-T527 PolarHBondContact O-N 3.07Å; L524-T527 PolarHBondContact O-OG1 2.8Å; T527-Q530 WeakPolarHBondContact O-CB 3.25Å; T527-Q530 PolarHBondContact O-N 3.47Å; T527-E531 WeakPolarHBondContact O-CG 3.38Å; T527-E531 PolarHBondContact O-N 2.74Å
528	E	91.6	Very high	88.1	Confident	111 Å²	111	101.6 Å²	101.6	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-60.3	-47	174.1	-174.5	178.7	-173.1	0	0	111.7	L524 Q525 Q530 E531 Q532	L524-E528 WeakPolarHBondContact O-CB 3.29Å; L524-E528 PolarHBondContact O-N 3.34Å; Q525-E528 PolarHBondContact O-N 2.78Å; E528-Q530 VanDerWaalsContact C-N 3.32Å; E528-Q530 PolarHBondContact O-N 3.31Å; E528-E531 PolarHBondContact O-N 2.81Å; E528-Q532 WeakPolarHBondContact O-CG 3.47Å; E528-Q532 PolarHBondContact O-N 3.24Å
529	I	88.3	Confident	87.5	Confident	92 Å²	92	105.8 Å²	105.8	47%	0.472	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-38.3	176.6	-69.4	167.7	0	0	0	111	Q525 I526 Q532 L533	Q525-I529 WeakPolarHBondContact O-CB 3.27Å; Q525-I529 WeakPolarHBondContact O-CD1 3.38Å; Q525-I529 WeakPolarHBondContact O-CG1 3.49Å; Q525-I529 PolarHBondContact O-N 3.41Å; I526-I529 PolarHBondContact O-N 3.07Å; I529-Q532 PolarHBondContact O-N 2.93Å; I529-L533 HydrophobicContact CG2-CD1 4.35Å; I529-L533 WeakPolarHBondContact O-CB 3.29Å; I529-L533 PolarHBondContact O-N 3.27Å
530	Q	87.6	Confident	86.8	Confident	103 Å²	103	107.1 Å²	107.1	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-39.1	175.3	-79.5	176	-4.8	0	0	111.9	I526 T527 E528 L533 R534	I526-Q530 HydrophobicContact CG2-CG 4.24Å; I526-Q530 VanDerWaalsContact O-CB 3.25Å; I526-Q530 WeakPolarHBondContact O-CB 3.46Å; I526-Q530 WeakPolarHBondContact O-CG 3.38Å; I526-Q530 PolarHBondContact O-N 2.96Å; T527-Q530 WeakPolarHBondContact O-CB 3.25Å; T527-Q530 PolarHBondContact O-N 3.47Å; E528-Q530 VanDerWaalsContact C-N 3.32Å; E528-Q530 PolarHBondContact O-N 3.31Å; Q530-L533 PolarHBondContact O-N 3.21Å; Q530-R534 WeakPolarHBondContact O-CB 3.32Å; Q530-R534 PolarHBondContact O-N 3.27Å
531	E	86.6	Confident	86.1	Confident	113 Å²	113	107.8 Å²	107.8	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-44.9	173.4	-75.4	-177.7	171.6	0	0	111	T527 E528 L533 R534 D535	T527-E531 WeakPolarHBondContact O-CG 3.38Å; T527-E531 PolarHBondContact O-N 2.74Å; E528-E531 PolarHBondContact O-N 2.81Å; E531-L533 VanDerWaalsContact C-N 3.33Å; E531-L533 PolarHBondContact O-N 3.35Å; E531-R534 CarbonylContact O-C 3.55Å; E531-R534 WeakPolarHBondContact O-CA 3.41Å; E531-R534 WeakPolarHBondContact O-CB 3.41Å; E531-R534 PolarHBondContact O-N 3.34Å; E531-D535 PolarHBondContact O-N 3.15Å
532	Q	85.1	Confident	85.1	Confident	104 Å²	104	104.6 Å²	104.6	49%	0.486	51%	0.506	S	S	.	.	H	α-helix	trans	-58.9	-42.7	173.3	-71.1	175.3	2.2	0	0	112.1	E528 I529 R534 D535 V536	E528-Q532 WeakPolarHBondContact O-CG 3.47Å; E528-Q532 PolarHBondContact O-N 3.24Å; I529-Q532 PolarHBondContact O-N 2.93Å; Q532-R534 VanDerWaalsContact C-N 3.32Å; Q532-D535 PolarHBondContact O-N 2.93Å; Q532-V536 WeakPolarHBondContact O-CB 3.33Å; Q532-V536 VanDerWaalsContact O-CG2 3.27Å; Q532-V536 WeakPolarHBondContact O-CG2 3.25Å; Q532-V536 PolarHBondContact O-N 2.92Å
533	L	82.4	Confident	84	Confident	102 Å²	102	102.1 Å²	102.1	53%	0.534	50%	0.496	S	S	.	.	H	α-helix	trans	-62.2	-40.5	173.5	-104.6	155.7	0	0	0	111.6	I529 Q530 E531 V536 M537	I529-L533 HydrophobicContact CG2-CD1 4.35Å; I529-L533 WeakPolarHBondContact O-CB 3.29Å; I529-L533 PolarHBondContact O-N 3.27Å; Q530-L533 PolarHBondContact O-N 3.21Å; E531-L533 VanDerWaalsContact C-N 3.33Å; E531-L533 PolarHBondContact O-N 3.35Å; L533-V536 PolarHBondContact O-N 2.95Å; L533-M537 WeakPolarHBondContact O-CB 3.3Å; L533-M537 VanDerWaalsContact O-CG 3.28Å; L533-M537 WeakPolarHBondContact O-CG 3.2Å; L533-M537 PolarHBondContact O-N 2.6Å
534	R	86.1	Confident	83.1	Confident	164 Å²	164	104.2 Å²	104.2	62%	0.619	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-41.8	176.6	-165.5	-177.1	-66.3	164.4	2.2	111.2	Q530 E531 Q532 M537 F538	Q530-R534 WeakPolarHBondContact O-CB 3.32Å; Q530-R534 PolarHBondContact O-N 3.27Å; E531-R534 CarbonylContact O-C 3.55Å; E531-R534 WeakPolarHBondContact O-CA 3.41Å; E531-R534 WeakPolarHBondContact O-CB 3.41Å; E531-R534 PolarHBondContact O-N 3.34Å; Q532-R534 VanDerWaalsContact C-N 3.32Å; R534-M537 PolarHBondContact O-N 3.06Å; R534-F538 WeakPolarHBondContact O-CB 3.23Å; R534-F538 PolarHBondContact O-N 3.32Å
535	D	85.4	Confident	81.8	Confident	109 Å²	109	105.4 Å²	105.4	58%	0.583	50%	0.503	S	S	*	.	H	α-helix	trans	-67.1	-41.3	176.9	-72.5	-13.4	0	0	0	111.8	E531 Q532 F538 Y539	E531-D535 PolarHBondContact O-N 3.15Å; Q532-D535 PolarHBondContact O-N 2.93Å; D535-F538 PolarHBondContact O-N 3.37Å; D535-Y539 WeakPolarHBondContact O-CB 3.42Å; D535-Y539 PolarHBondContact O-N 3.41Å
536	V	81.7	Confident	80.2	Confident	83 Å²	83	103.1 Å²	103.1	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-42.7	174.6	170.4	0	0	0	0	111.1	Q532 L533 Y539 L540	Q532-V536 WeakPolarHBondContact O-CB 3.33Å; Q532-V536 VanDerWaalsContact O-CG2 3.27Å; Q532-V536 WeakPolarHBondContact O-CG2 3.25Å; Q532-V536 PolarHBondContact O-N 2.92Å; L533-V536 PolarHBondContact O-N 2.95Å; V536-Y539 PolarHBondContact O-N 2.81Å; V536-L540 HydrophobicContact CG1-CD1 4.01Å; V536-L540 WeakPolarHBondContact O-CB 3.48Å; V536-L540 WeakPolarHBondContact O-CG 3.47Å; V536-L540 PolarHBondContact O-N 3.41Å
537	M	77.7	Confident	78.8	Confident	107 Å²	107	103.1 Å²	103.1	53%	0.527	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-42.8	173.9	-77.4	-173.5	62.8	0	0	111.5	L533 R534 L540 E541	L533-M537 WeakPolarHBondContact O-CB 3.3Å; L533-M537 VanDerWaalsContact O-CG 3.28Å; L533-M537 WeakPolarHBondContact O-CG 3.2Å; L533-M537 PolarHBondContact O-N 2.6Å; R534-M537 PolarHBondContact O-N 3.06Å; M537-L540 PolarHBondContact O-N 2.83Å; M537-E541 WeakPolarHBondContact O-CB 3.27Å; M537-E541 WeakPolarHBondContact O-CG 3.41Å; M537-E541 PolarHBondContact O-N 2.96Å
538	F	82	Confident	77.2	Confident	133 Å²	133	107.8 Å²	107.8	58%	0.583	51%	0.512	S	S	*	.	H	α-helix	trans	-62.5	-42.4	174.9	179.2	-99	0	0	0	111.7	R534 D535 E541 T542	R534-F538 WeakPolarHBondContact O-CB 3.23Å; R534-F538 PolarHBondContact O-N 3.32Å; D535-F538 PolarHBondContact O-N 3.37Å; F538-E541 PolarHBondContact O-N 2.97Å; F538-T542 VanDerWaalsContact O-CB 3.23Å; F538-T542 WeakPolarHBondContact O-CB 3.08Å; F538-T542 PolarHBondContact O-N 3.06Å; F538-T542 PolarHBondContact O-OG1 3.45Å
539	Y	79.3	Confident	75.4	Confident	148 Å²	148	106.8 Å²	106.8	58%	0.58	51%	0.51	S	S	*	.	H	α-helix	trans	-61.1	-45.2	174.5	177.4	-97.1	0	0	0	111.4	D535 V536 T542 Q543	D535-Y539 WeakPolarHBondContact O-CB 3.42Å; D535-Y539 PolarHBondContact O-N 3.41Å; V536-Y539 PolarHBondContact O-N 2.81Å; Y539-T542 PolarHBondContact O-N 3.25Å; Y539-Q543 WeakPolarHBondContact O-CB 3.26Å; Y539-Q543 PolarHBondContact O-N 3.42Å
540	L	77.6	Confident	73.7	Confident	90 Å²	90	106.6 Å²	106.6	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-63.6	-43.7	176.5	-80.4	161.7	0	0	0	112.5	V536 M537 Q543 Q544	V536-L540 HydrophobicContact CG1-CD1 4.01Å; V536-L540 WeakPolarHBondContact O-CB 3.48Å; V536-L540 WeakPolarHBondContact O-CG 3.47Å; V536-L540 PolarHBondContact O-N 3.41Å; M537-L540 PolarHBondContact O-N 2.83Å; L540-Q543 PolarHBondContact O-N 3.2Å; L540-Q544 WeakPolarHBondContact O-CB 3.1Å; L540-Q544 WeakPolarHBondContact O-CG 3.47Å; L540-Q544 PolarHBondContact O-N 3.28Å
541	E	77.5	Confident	72.1	Confident	94 Å²	94	106 Å²	106	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-41.1	175.3	-79.1	-173	-174.7	0	0	111.9	M537 F538 Q543 Q544 K545	M537-E541 WeakPolarHBondContact O-CB 3.27Å; M537-E541 WeakPolarHBondContact O-CG 3.41Å; M537-E541 PolarHBondContact O-N 2.96Å; F538-E541 PolarHBondContact O-N 2.97Å; E541-Q543 VanDerWaalsContact C-N 3.35Å; E541-Q544 PolarHBondContact O-N 3.48Å; E541-K545 WeakPolarHBondContact O-CB 3.37Å; E541-K545 WeakPolarHBondContact O-CG 3.3Å; E541-K545 PolarHBondContact O-N 2.96Å
542	T	70.1	Confident	70.4	Confident	48 Å²	48	109 Å²	109	29%	0.294	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-40.1	176.4	-54.5	0	0	0	0	110.3	F538 Y539 K545 I546	F538-T542 VanDerWaalsContact O-CB 3.23Å; F538-T542 WeakPolarHBondContact O-CB 3.08Å; F538-T542 PolarHBondContact O-N 3.06Å; F538-T542 PolarHBondContact O-OG1 3.45Å; Y539-T542 PolarHBondContact O-N 3.25Å; T542-K545 PolarHBondContact O-N 3.28Å; T542-I546 HydrophobicContact CG2-CD1 3.91Å; T542-I546 HydrophobicContact CG2-CG1 4.48Å; T542-I546 WeakPolarHBondContact O-CB 3.31Å; T542-I546 WeakPolarHBondContact O-CG1 3.48Å; T542-I546 PolarHBondContact O-N 2.97Å
543	Q	68.4	Low	68.9	Low	82 Å²	82	106.9 Å²	106.9	38%	0.383	54%	0.535	S	S	.	.	H	α-helix	trans	-67.3	-38.4	175.3	-167.4	169.7	10.1	0	0	112.1	Y539 L540 E541 N547	Y539-Q543 WeakPolarHBondContact O-CB 3.26Å; Y539-Q543 PolarHBondContact O-N 3.42Å; L540-Q543 PolarHBondContact O-N 3.2Å; E541-Q543 VanDerWaalsContact C-N 3.35Å; Q543-N547 WeakPolarHBondContact O-CB 3.44Å; Q543-N547 VanDerWaalsContact O-CG 3.25Å; Q543-N547 PolarHBondContact O-N 2.88Å; Q543-N547 PolarHBondContact O-ND2 2.87Å; Q543-N547 VanDerWaalsContact O-ND2 3.15Å
544	Q	72	Confident	67.4	Low	125 Å²	125	108.3 Å²	108.3	58%	0.584	53%	0.534	S	S	*	.	H	α-helix	trans	-65.2	-42.8	171.6	-80.3	-176.9	-11.8	0	0	111.9	L540 E541 N547 H548	L540-Q544 WeakPolarHBondContact O-CB 3.1Å; L540-Q544 WeakPolarHBondContact O-CG 3.47Å; L540-Q544 PolarHBondContact O-N 3.28Å; E541-Q544 PolarHBondContact O-N 3.48Å; Q544-N547 PolarHBondContact O-N 3.21Å; Q544-H548 PolarHBondContact O-N 2.84Å; Q544-H548 VanDerWaalsContact O-N 3.1Å
545	K	64.1	Low	65.7	Low	142 Å²	142	108 Å²	108	62%	0.617	54%	0.539	S	S	*	.	H	α-helix	trans	-65	-40.1	174.9	-76.9	174.9	-179.8	165.8	0	112.6	E541 T542 N547 H548 L549	E541-K545 WeakPolarHBondContact O-CB 3.37Å; E541-K545 WeakPolarHBondContact O-CG 3.3Å; E541-K545 PolarHBondContact O-N 2.96Å; T542-K545 PolarHBondContact O-N 3.28Å; K545-N547 VanDerWaalsContact C-N 3.32Å; K545-N547 PolarHBondContact O-N 2.87Å; K545-H548 PolarHBondContact O-N 2.96Å; K545-L549 WeakPolarHBondContact O-CG 3.44Å; K545-L549 PolarHBondContact O-N 3Å
546	I	60.4	Low	63.9	Low	66 Å²	66	110.3 Å²	110.3	34%	0.338	55%	0.546	S	S	.	.	H	α-helix	trans	-64.7	-35	173.6	-71.3	167.7	0	0	0	111.5	T542 H548	T542-I546 HydrophobicContact CG2-CD1 3.91Å; T542-I546 HydrophobicContact CG2-CG1 4.48Å; T542-I546 WeakPolarHBondContact O-CB 3.31Å; T542-I546 WeakPolarHBondContact O-CG1 3.48Å; T542-I546 PolarHBondContact O-N 2.97Å; I546-H548 VanDerWaalsContact C-N 3.33Å
547	N	59.3	Low	62.5	Low	83 Å²	83	112 Å²	112	44%	0.444	55%	0.551	S	S	.	*	H	α-helix	trans	-75.9	-17.1	176.2	-77.2	-30.8	0	0	0	114.1	Q543 Q544 K545 R554	Q543-N547 WeakPolarHBondContact O-CB 3.44Å; Q543-N547 VanDerWaalsContact O-CG 3.25Å; Q543-N547 PolarHBondContact O-N 2.88Å; Q543-N547 PolarHBondContact O-ND2 2.87Å; Q543-N547 VanDerWaalsContact O-ND2 3.15Å; Q544-N547 PolarHBondContact O-N 3.21Å; K545-N547 VanDerWaalsContact C-N 3.32Å; K545-N547 PolarHBondContact O-N 2.87Å; N547-R554 PolarHBondContact OD1-NH2 3.04Å
548	H	58.6	Low	61.1	Low	164 Å²	164	115 Å²	115	76%	0.759	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	4.7	177.8	-72.7	-10.7	0	0	0	114	Q544 K545 I546	Q544-H548 PolarHBondContact O-N 2.84Å; Q544-H548 VanDerWaalsContact O-N 3.1Å; K545-H548 PolarHBondContact O-N 2.96Å; I546-H548 VanDerWaalsContact C-N 3.33Å
549	L	52.1	Low	59.3	Low	91 Å²	91	117.2 Å²	117.2	48%	0.476	58%	0.576	S	S	.	*	S	Bend	trans	-90.6	143.5	174	-77.2	160.8	0	0	0	111.9	K545	K545-L549 WeakPolarHBondContact O-CG 3.44Å; K545-L549 PolarHBondContact O-N 3Å
550	P	54.7	Low	57.4	Low	88 Å²	88	113 Å²	113	57%	0.571	58%	0.577	S	S	*	*			trans	-60.4	153.9	177.3	-20.4	31.6	0	0	0	113.6	E552 T553	P550-E552 PolarHBondContact O-N 3.45Å; P550-T553 PolarHBondContact O-N 3.17Å
551	A	53.3	Low	55.8	Low	90 Å²	90	117.3 Å²	117.3	74%	0.744	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-16.8	-169.7	0	0	0	0	0	116.1
552	E	51	Low	53.9	Low	175 Å²	175	119.7 Å²	119.7	82%	0.818	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-26.1	-174.7	-68.7	167.5	170.9	0	0	113.3	P550	P550-E552 PolarHBondContact O-N 3.45Å
553	T	53.8	Low	52.4	Low	60 Å²	60	124.7 Å²	124.7	37%	0.368	64%	0.635	S	S	.	*	S	Bend	trans	-91.9	-4.1	-177.5	-9	0	0	0	0	113.6	P550	P550-T553 PolarHBondContact O-N 3.17Å
554	R	50.2	Low	50.9	Low	133 Å²	133	128 Å²	128	50%	0.502	65%	0.653	S	S	.	*	S	Bend	trans	-78.8	-19.9	-174.8	-143.6	173	-177.8	148	3.2	113.2	N547	N547-R554 PolarHBondContact OD1-NH2 3.04Å
555	Q	50.3	Low	48.9	Very low	157 Å²	157	126.5 Å²	126.5	73%	0.734	66%	0.662	S	S	*	*	S	Bend	trans	-86.1	-25.8	177.5	-91.5	175.9	-27.8	0	0	113.5	I557	Q555-I557 PolarHBondContact O-N 2.78Å
556	E	47.5	Very low	47.6	Very low	157 Å²	157	129.1 Å²	129.1	73%	0.734	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-16.5	-177	-71.8	-173.5	155.5	0	0	114.2
557	I	53.2	Low	46.1	Very low	119 Å²	119	130.8 Å²	130.8	61%	0.61	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-13	-178.3	-57.1	176.1	0	0	0	111.8	Q555	Q555-I557 PolarHBondContact O-N 2.78Å
558	Q	48.6	Very low	44.8	Very low	169 Å²	169	132.6 Å²	132.6	79%	0.79	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-9.8	-176.7	-152.9	166.5	5.2	0	0	113.7
559	E	42.8	Very low	43.6	Very low	180 Å²	180	129 Å²	129	84%	0.841	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	15.5	-176.9	-64.3	-172.5	167.8	0	0	114.3	Q561	E559-Q561 PolarHBondContact O-N 3.34Å; E559-Q561 VanDerWaalsContact O-N 3.12Å
560	G	39.6	Very low	42.6	Very low	59 Å²	59	130.5 Å²	130.5	61%	0.608	74%	0.738	S	S	*	*			trans	-77	95.1	178.7	0	0	0	0	0	113.4	I562	G560-I562 PolarHBondContact O-N 3.33Å
561	Q	43.8	Very low	41.6	Very low	182 Å²	182	131.3 Å²	131.3	85%	0.85	75%	0.746	S	S	*	*			trans	-77.1	107.1	172.2	-156.7	176.1	13	0	0	110.3	E559	E559-Q561 PolarHBondContact O-N 3.34Å; E559-Q561 VanDerWaalsContact O-N 3.12Å
562	I	38.5	Very low	41.6	Very low	144 Å²	144	133 Å²	133	74%	0.738	75%	0.749	S	S	*	*			trans	-100.9	106.8	177.6	-59.1	176.7	0	0	0	109.7	G560 I564	G560-I562 PolarHBondContact O-N 3.33Å; I562-I564 HydrophobicContact CG2-CG1 4.02Å
563	N	37.8	Very low	40.5	Very low	153 Å²	153	129.7 Å²	129.7	82%	0.818	75%	0.753	S	S	*	*			trans	-78.2	117.7	167.3	-92.1	-38.5	0	0	0	109.8
564	I	37.7	Very low	39.6	Very low	151 Å²	151	131.7 Å²	131.7	77%	0.774	77%	0.769	S	S	*	*			trans	-106.5	113.9	168.6	-59	178	0	0	0	108.1	I562	I562-I564 HydrophobicContact CG2-CG1 4.02Å
565	A	30.4	Very low	39.1	Very low	93 Å²	93	131 Å²	131	77%	0.769	78%	0.784	S	S	*	*			trans	-63.7	129.8	173.2	0	0	0	0	0	110.6	A567	A565-A567 PolarHBondContact O-N 3.28Å
566	M	35	Very low	38.2	Very low	197 Å²	197	127.3 Å²	127.3	97%	0.97	79%	0.788	S	S	*	*			trans	-68.6	122.1	167	-84.1	-178.4	167.6	0	0	109.8
567	A	30.6	Very low	38	Very low	101 Å²	101	123.7 Å²	123.7	84%	0.835	79%	0.793	S	S	*	*			trans	-107	126.1	154.8	0	0	0	0	0	108.8	A565	A565-A567 PolarHBondContact O-N 3.28Å
568	S	32.1	Very low	37.2	Very low	121 Å²	121	124 Å²	124	85%	0.846	81%	0.806	S	S	*	*			trans	-71.6	156.5	-170.3	43.3	0	0	0	0	114.8
569	A	32.8	Very low	36.6	Very low	88 Å²	88	119.4 Å²	119.4	73%	0.727	80%	0.804	S	S	*	*			trans	-50.1	153.5	170.7	0	0	0	0	0	115.6
570	S	30.1	Very low	36.4	Very low	123 Å²	123	119.9 Å²	119.9	86%	0.86	80%	0.803	S	S	*	*			trans	-133.9	106	142.5	59.9	0	0	0	0	109.4
571	S	34.6	Very low	36.4	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	81%	0.813	S	S	*	*			trans	-83.1	-171.2	166.7	-41.7	0	0	0	0	109.9
572	P	52.4	Low	35.9	Very low	125 Å²	125	121.2 Å²	121.2	81%	0.812	81%	0.811	S	S	*	*				-114.5	177.6	-118.2	21.4	3.8	0	0	0	112.2
573	A	29.6	Very low	35.9	Very low	107 Å²	107	119.4 Å²	119.4	88%	0.884	81%	0.811	S	S	*	*			trans	-127.8	108	158.8	0	0	0	0	0	109.7
574	S	34.8	Very low	36.1	Very low	102 Å²	102	124.2 Å²	124.2	71%	0.713	82%	0.817	S	S	*	*			trans	-81.1	152.9	170.8	51.9	0	0	0	0	111.7
575	S	39.5	Very low	36.1	Very low	118 Å²	118	127 Å²	127	83%	0.825	82%	0.824	S	S	*	*			trans	66.5	127.1	138.5	66.4	0	0	0	0	120.3
576	G	31.5	Very low	36.4	Very low	79 Å²	79	126.3 Å²	126.3	81%	0.814	83%	0.826	S	S	*	*			trans	-167.4	73.5	158.5	0	0	0	0	0	110.7
577	G	43.7	Very low	36.7	Very low	81 Å²	81	128.7 Å²	128.7	84%	0.835	82%	0.824	S	S	*	*			trans	-72.7	147	166.9	0	0	0	0	0	110.7
578	S	35.7	Very low	37	Very low	125 Å²	125	129 Å²	129	87%	0.874	82%	0.82	S	S	*	*			trans	-159.5	124.5	157.2	52	0	0	0	0	109.2
579	G	35.7	Very low	37.4	Very low	73 Å²	73	133.9 Å²	133.9	75%	0.753	82%	0.82	S	S	*	*			trans	-88	-178.5	-175.2	0	0	0	0	0	115.5
580	K	37.9	Very low	38.1	Very low	191 Å²	191	140.3 Å²	140.3	83%	0.83	83%	0.826	S	S	*	*			trans	64.7	116.1	145.8	-85.2	-179.1	170.8	176.8	0	120.7
581	L	40.9	Very low	39.2	Very low	154 Å²	154	137.4 Å²	137.4	81%	0.806	82%	0.815	S	S	*	*				74.5	115.5	126.6	-71.4	159.8	0	0	0	119.5
582	S	33.4	Very low	39.6	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	84%	0.841	S	S	*	*			trans	-148	112.7	134.2	66.1	0	0	0	0	111.9
583	S	38.4	Very low	38.9	Very low	106 Å²	106	147.4 Å²	147.4	74%	0.741	84%	0.842	S	S	*	*			trans	32.6	115.7	132.6	-178.5	0	0	0	0	118.8
584	R	40.5	Very low	39.4	Very low	253 Å²	253	149.5 Å²	149.5	96%	0.955	84%	0.84	S	S	*	*			trans	-140.7	123.6	144.8	-124.9	175.4	-179.5	179.4	-0.1	112.5
585	K	39.3	Very low	39.7	Very low	209 Å²	209	152.2 Å²	152.2	91%	0.909	85%	0.847	S	S	*	*			trans	-44.7	147.6	173.9	-78.4	165.4	164.1	172.6	0	114.5
586	G	37	Very low	39.7	Very low	80 Å²	80	154.2 Å²	154.2	83%	0.825	85%	0.848	S	S	*	*			trans	177.5	60.5	163.9	0	0	0	0	0	115.9
587	R	40.9	Very low	40.2	Very low	246 Å²	246	158.9 Å²	158.9	93%	0.928	85%	0.85	S	S	*	*			trans	-67.1	150.8	155.1	-127.2	178.1	164.1	165.3	-6.1	106.8
588	S	37.1	Very low	40	Very low	107 Å²	107	164.1 Å²	164.1	75%	0.748	85%	0.852	S	S	*	*			cis	-172.9	145.4	17.5	179.3	0	0	0	0	108.6
589	R	39.9	Very low	40.3	Very low	224 Å²	224	166.9 Å²	166.9	85%	0.845	85%	0.85	S	S	*	*			trans	-171.7	130.9	150.8	-102.3	178.6	176.5	-168.4	-0.8	104.2
590	R	47.4	Very low	40.6	Very low	224 Å²	224	174.1 Å²	174.1	85%	0.845	86%	0.857	S	S	*	*			cis	-167	147.7	39.8	-117.9	171.3	175.9	172.2	-3.7	109.3
591	G	53.8	Low	40.9	Very low	62 Å²	62	172.7 Å²	172.7	64%	0.639	86%	0.86	S	S	*	*			trans	-70.2	152.7	154.2	0	0	0	0	0	110.6
592	K	41.5	Very low	40.8	Very low	292 Å²	292	174.4 Å²	174.4	100%	1.27	86%	0.864	S	S	*	*				60.4	0	103.1	-83.8	-166.8	178.2	-175.9	0	113.2

Retrieved 592 of 592 residues in 118 ms (Link to these results)

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