A0A3Q0KLN5_SCHMA Loading...

RING-type domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KLN5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 318 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	43.4	Very low	81.3	Confident	173 Å²	173	69 Å²	69	85%	0.852	37%	0.371	S	S	*	.				0	138.5	0	-61.1	-174.7	-148.3	0	0	107.7	V3 P8	M1-V3 VanDerWaalsContact C-N 3.34Å; M1-V3 WeakPolarHBondContact O-CG2 3.31Å; M1-V3 PolarHBondContact O-N 3.4Å; M1-P8 HydrophobicContact SD-CG 4.3Å
2	N	50.6	Low	82.6	Confident	126 Å²	126	64.7 Å²	64.7	67%	0.674	35%	0.346	S	S	*	.			trans	-65.7	97.2	176.2	-76.1	-16.2	0	0	0	108.2	N4 M5	N2-N4 PolarHBondContact O-N 3.46Å; N2-M5 HydrophobicContact CB-CG 3.84Å; N2-M5 PolarHBondContact O-N 2.93Å
3	V	60.4	Low	83.8	Confident	57 Å²	57	63.6 Å²	63.6	35%	0.345	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-12.2	-174.2	-169.2	0	0	0	0	112.7	M1	M1-V3 VanDerWaalsContact C-N 3.34Å; M1-V3 WeakPolarHBondContact O-CG2 3.31Å; M1-V3 PolarHBondContact O-N 3.4Å
4	N	73.8	Confident	84.6	Confident	104 Å²	104	66.8 Å²	66.8	56%	0.556	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-2.3	-175.1	-58	-4.6	0	0	0	113.5	N2 N44	N2-N4 PolarHBondContact O-N 3.46Å; N4-N44 HydrophobicContact CB-CB 4.17Å; N4-N44 WeakPolarHBondContact CB-ND2 3.46Å; N4-N44 WeakPolarHBondContact O-CB 3.3Å
5	M	91.2	Very high	85.4	Confident	39 Å²	39	71.3 Å²	71.3	19%	0.192	39%	0.394	C	S	.	.	S	Bend	trans	-88.8	-173.1	174.3	-59	-56.5	-136.8	0	0	111.2	N2 C25 I30 N44 C45 I48	N2-M5 HydrophobicContact CB-CG 3.84Å; N2-M5 PolarHBondContact O-N 2.93Å; M5-C25 HydrophobicContact CB-CB 4.14Å; M5-I30 WeakPolarHBondContact O-CD1 3.42Å; M5-I30 WeakPolarHBondContact O-CG1 3.41Å; M5-N44 HydrophobicContact SD-CB 4.49Å; M5-N44 PolarHBondContact SD-ND2 3.33Å; M5-N44 VanDerWaalsContact SD-ND2 3.44Å; M5-C45 HydrophobicContact SD-CB 4.34Å; M5-C45 PolarHBondContact SD-SG 2.89Å; M5-I48 HydrophobicContact CE-CD1 3.44Å; M5-I48 VanDerWaalsContact CE-CD1 3.44Å; M5-I48 HydrophobicContact SD-CD1 3.92Å
6	G	95.3	Very high	86.1	Confident	13 Å²	13	68.3 Å²	68.3	13%	0.134	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-63.1	158	175.8	0	0	0	0	0	113.9	C25 V28 C42	G6-C25 VanDerWaalsContact CA-SG 3.54Å; G6-C25 PolarHBondContact N-SG 3.37Å; G6-V28 CarbonylContact C-O 3.57Å; G6-V28 WeakPolarHBondContact CA-O 3.38Å; G6-C42 VanDerWaalsContact CA-SG 3.56Å
7	I	96	Very high	86.6	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.021	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-76.1	127.9	177	-55.2	177.3	0	0	0	108.9	I9 R11 F12 G27 V28 I30 V147 H151	I7-I9 PolarHBondContact O-N 3.3Å; I7-R11 HydrophobicContact CG2-CB 4.42Å; I7-F12 HydrophobicContact CB-CE2 3.84Å; I7-F12 HydrophobicContact CB-CZ 3.97Å; I7-F12 HydrophobicContact CD1-CZ 4.31Å; I7-F12 HydrophobicContact CG2-CE2 3.54Å; I7-F12 HydrophobicContact CG2-CZ 3.88Å; I7-G27 CarbonylContact O-C 3.59Å; I7-G27 WeakPolarHBondContact O-CA 3.38Å; I7-V28 HydrophobicContact CB-CB 4.45Å; I7-V28 PolarHBondContact N-O 2.87Å; I7-V28 PolarHBondContact O-N 2.94Å; I7-I30 HydrophobicContact CD1-CD1 4.44Å; I7-I30 HydrophobicContact CD1-CG1 4.41Å; I7-I30 HydrophobicContact CG1-CD1 3.71Å; I7-I30 HydrophobicContact CG1-CG1 3.81Å; I7-V147 HydrophobicContact CD1-CB 4.33Å; I7-V147 HydrophobicContact CD1-CG1 3.46Å; I7-V147 VanDerWaalsContact CD1-CG1 3.46Å; I7-V147 HydrophobicContact CD1-CG2 3.89Å; I7-H151 HydrophobicContact CD1-CB 4.35Å
8	P	96	Very high	87.1	Confident	43 Å²	43	74.8 Å²	74.8	28%	0.279	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-56.1	134.2	176.7	-26	34.4	0	0	0	112.6	M1 D10 R11	M1-P8 HydrophobicContact SD-CG 4.3Å; P8-D10 VanDerWaalsContact C-N 3.26Å; P8-D10 WeakPolarHBondContact CB-OD1 3.34Å; P8-D10 PolarHBondContact O-N 3.46Å; P8-R11 HydrophobicContact CB-CG 4.32Å; P8-R11 WeakPolarHBondContact O-CB 3.49Å; P8-R11 PolarHBondContact O-N 3.38Å; P8-R11 VanDerWaalsContact O-N 3.13Å
9	I	95.7	Very high	87.6	Confident	71 Å²	71	77.9 Å²	77.9	36%	0.364	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-63.4	-32.7	-173.7	-59.2	168.1	0	0	0	111.5	I7 R11 F12 V16 I21 H26 V28	I7-I9 PolarHBondContact O-N 3.3Å; I9-R11 PolarHBondContact O-N 3.33Å; I9-F12 PolarHBondContact O-N 3.33Å; I9-V16 HydrophobicContact CG2-CG2 4.48Å; I9-I21 HydrophobicContact CD1-CD1 3.64Å; I9-I21 HydrophobicContact CD1-CG1 4.13Å; I9-I21 HydrophobicContact CD1-CG2 4.31Å; I9-H26 WeakPolarHBondContact CD1-O 3.47Å; I9-V28 HydrophobicContact CG1-CG2 4.38Å
10	D	95.1	Very high	88	Confident	110 Å²	110	74.7 Å²	74.7	59%	0.588	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-65	-10.4	178.6	65.5	-52	0	0	0	113.7	P8 K138	P8-D10 VanDerWaalsContact C-N 3.26Å; P8-D10 WeakPolarHBondContact CB-OD1 3.34Å; P8-D10 PolarHBondContact O-N 3.46Å; D10-K138 IonicContact OD2-NZ 3.97Å
11	R	96.4	Very high	88.4	Confident	19 Å²	19	73.3 Å²	73.3	7%	0.072	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-84.5	-14.6	173.6	-63.9	-175.3	62.3	-152	-6.6	113.4	I7 P8 I9 I132 Y133	I7-R11 HydrophobicContact CG2-CB 4.42Å; P8-R11 HydrophobicContact CB-CG 4.32Å; P8-R11 WeakPolarHBondContact O-CB 3.49Å; P8-R11 PolarHBondContact O-N 3.38Å; P8-R11 VanDerWaalsContact O-N 3.13Å; I9-R11 PolarHBondContact O-N 3.33Å; R11-I132 VanDerWaalsContact NH2-CD1 3.34Å; R11-I132 CarbonylContact O-C 3.6Å; R11-I132 WeakPolarHBondContact O-CA 3.47Å; R11-I132 WeakPolarHBondContact O-CB 3.31Å; R11-Y133 PolarHBondContact NE-O 3.5Å; R11-Y133 PolarHBondContact NH2-O 3.19Å; R11-Y133 WeakPolarHBondContact O-CD2 3.48Å; R11-Y133 PolarHBondContact O-N 3.12Å
12	F	97.7	Very high	91	Very high	17 Å²	17	65.1 Å²	65.1	8%	0.075	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-82.5	136.7	-176.5	-70.4	-98.4	0	0	0	110.9	I7 I9 V16 V28 L130 I132 V147	I7-F12 HydrophobicContact CB-CE2 3.84Å; I7-F12 HydrophobicContact CB-CZ 3.97Å; I7-F12 HydrophobicContact CD1-CZ 4.31Å; I7-F12 HydrophobicContact CG2-CE2 3.54Å; I7-F12 HydrophobicContact CG2-CZ 3.88Å; I9-F12 PolarHBondContact O-N 3.33Å; F12-V16 HydrophobicContact CB-CG2 3.48Å; F12-V16 VanDerWaalsContact CB-CG2 3.48Å; F12-V16 HydrophobicContact CD1-CG2 3.67Å; F12-V16 HydrophobicContact CD2-CG2 3.81Å; F12-V16 HydrophobicContact CE1-CG2 4.38Å; F12-V16 HydrophobicContact CE2-CG2 4.49Å; F12-V16 HydrophobicContact CG-CG2 3.34Å; F12-V28 HydrophobicContact CD2-CG2 3.88Å; F12-V28 HydrophobicContact CE1-CB 4.45Å; F12-V28 HydrophobicContact CE1-CG1 4.27Å; F12-V28 HydrophobicContact CE1-CG2 4.22Å; F12-V28 HydrophobicContact CE2-CB 3.69Å; F12-V28 HydrophobicContact CE2-CG1 4.38Å; F12-V28 HydrophobicContact CE2-CG2 3.23Å; F12-V28 HydrophobicContact CZ-CB 3.51Å; F12-V28 HydrophobicContact CZ-CG1 3.72Å; F12-V28 HydrophobicContact CZ-CG2 3.44Å; F12-V28 VanDerWaalsContact CZ-CG2 3.44Å; F12-L130 HydrophobicContact CD1-CB 3.95Å; F12-L130 HydrophobicContact CD1-CD1 4.1Å; F12-L130 HydrophobicContact CE1-CB 3.66Å; F12-L130 HydrophobicContact CE1-CD1 3.54Å; F12-L130 HydrophobicContact CE1-CG 4.23Å; F12-L130 HydrophobicContact CZ-CD1 4.45Å; F12-I132 HydrophobicContact CD1-CG2 3.5Å; F12-I132 HydrophobicContact CD2-CG2 4.2Å; F12-I132 HydrophobicContact CE1-CG2 3.48Å; F12-I132 VanDerWaalsContact CE1-CG2 3.48Å; F12-I132 HydrophobicContact CE2-CG2 4.19Å; F12-I132 HydrophobicContact CG-CG2 3.87Å; F12-I132 HydrophobicContact CZ-CG2 3.84Å; F12-V147 HydrophobicContact CE1-CG2 3.95Å; F12-V147 HydrophobicContact CZ-CG2 4.24Å
13	V	97.5	Very high	93.2	Very high	51 Å²	51	61.3 Å²	61.3	31%	0.309	35%	0.346	S	S	.	.	S	Bend	trans	-69.8	-39.9	179.9	178.8	0	0	0	0	110.7	Q131 Y133 I144	V13-Q131 HydrophobicContact CB-CB 4.15Å; V13-Q131 HydrophobicContact CG2-CB 3.97Å; V13-Q131 PolarHBondContact N-O 3.35Å; V13-Y133 HydrophobicContact CB-CE2 4.31Å; V13-Y133 HydrophobicContact CG2-CD2 4.18Å; V13-Y133 HydrophobicContact CG2-CE1 4.33Å; V13-Y133 HydrophobicContact CG2-CE2 3.84Å; V13-I144 HydrophobicContact CG2-CG2 3.61Å
14	N	95.9	Very high	94.9	Very high	108 Å²	108	60.8 Å²	60.8	58%	0.578	34%	0.341	S	S	*	.	S	Bend	trans	-105.9	154.2	179.5	-61.8	-41.2	0	0	0	110.1	V16	N14-V16 PolarHBondContact O-N 3.33Å
15	P	96	Very high	96	Very high	134 Å²	134	57.7 Å²	57.7	87%	0.87	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-51.6	134.6	169.7	-24.7	34.2	0	0	0	111.1
16	V	96.2	Very high	96.2	Very high	24 Å²	24	62.1 Å²	62.1	15%	0.145	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-96.9	135.6	179.5	-172.3	0	0	0	0	109.4	I9 F12 N14 E18 L20 V28	I9-V16 HydrophobicContact CG2-CG2 4.48Å; F12-V16 HydrophobicContact CB-CG2 3.48Å; F12-V16 VanDerWaalsContact CB-CG2 3.48Å; F12-V16 HydrophobicContact CD1-CG2 3.67Å; F12-V16 HydrophobicContact CD2-CG2 3.81Å; F12-V16 HydrophobicContact CE1-CG2 4.38Å; F12-V16 HydrophobicContact CE2-CG2 4.49Å; F12-V16 HydrophobicContact CG-CG2 3.34Å; N14-V16 PolarHBondContact O-N 3.33Å; V16-E18 PolarHBondContact O-N 3.32Å; V16-L20 HydrophobicContact CG1-CB 4.11Å; V16-L20 HydrophobicContact CG1-CD1 3.95Å; V16-V28 HydrophobicContact CB-CG2 4.26Å; V16-V28 HydrophobicContact CG1-CG1 4.44Å; V16-V28 HydrophobicContact CG1-CG2 3.69Å; V16-V28 HydrophobicContact CG2-CG2 4.06Å
17	D	95.9	Very high	96.3	Very high	90 Å²	90	61.7 Å²	61.7	48%	0.481	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-58.6	131	172.9	-172.2	-39	0	0	0	110.6	N19 L20	D17-N19 PolarHBondContact O-N 3.4Å; D17-N19 VanDerWaalsContact O-N 3.15Å; D17-N19 VanDerWaalsContact OD1-CB 3.29Å; D17-N19 WeakPolarHBondContact OD1-CB 3.45Å; D17-N19 PolarHBondContact OD1-N 2.93Å; D17-N19 PolarHBondContact OD1-ND2 3.21Å; D17-L20 HydrophobicContact CB-CD1 3.9Å; D17-L20 HydrophobicContact CB-CG 4.09Å; D17-L20 WeakPolarHBondContact O-CB 3.49Å; D17-L20 PolarHBondContact O-N 2.89Å
18	E	95.4	Very high	96.3	Very high	164 Å²	164	61.6 Å²	61.6	77%	0.766	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-57.9	-28.8	-178.6	-62.9	-177.5	176.1	0	0	112.7	V16 L20 I21	V16-E18 PolarHBondContact O-N 3.32Å; E18-L20 PolarHBondContact O-N 3.16Å; E18-L20 VanDerWaalsContact O-N 3.16Å; E18-I21 WeakPolarHBondContact O-CB 3.47Å; E18-I21 PolarHBondContact O-N 3.27Å
19	N	95.3	Very high	96.4	Very high	133 Å²	133	60 Å²	60	71%	0.711	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-69.5	-8.2	177.8	-61.9	-64.7	0	0	0	113.6	D17 F29	D17-N19 PolarHBondContact O-N 3.4Å; D17-N19 VanDerWaalsContact O-N 3.15Å; D17-N19 VanDerWaalsContact OD1-CB 3.29Å; D17-N19 WeakPolarHBondContact OD1-CB 3.45Å; D17-N19 PolarHBondContact OD1-N 2.93Å; D17-N19 PolarHBondContact OD1-ND2 3.21Å; N19-F29 WeakPolarHBondContact O-CE2 3.3Å
20	L	96.8	Very high	96.4	Very high	13 Å²	13	57.3 Å²	57.3	7%	0.068	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-99.7	2.6	177.5	-53.2	171.2	0	0	0	112.7	V16 D17 E18 V28 F29 L123 F126 L127	V16-L20 HydrophobicContact CG1-CB 4.11Å; V16-L20 HydrophobicContact CG1-CD1 3.95Å; D17-L20 HydrophobicContact CB-CD1 3.9Å; D17-L20 HydrophobicContact CB-CG 4.09Å; D17-L20 WeakPolarHBondContact O-CB 3.49Å; D17-L20 PolarHBondContact O-N 2.89Å; E18-L20 PolarHBondContact O-N 3.16Å; E18-L20 VanDerWaalsContact O-N 3.16Å; L20-V28 HydrophobicContact CB-CG1 4.43Å; L20-V28 WeakPolarHBondContact O-CA 3.49Å; L20-F29 VanDerWaalsContact C-CD2 3.45Å; L20-F29 VanDerWaalsContact C-CE2 3.4Å; L20-F29 WeakPolarHBondContact O-CD2 3.47Å; L20-F29 WeakPolarHBondContact O-CG 3.4Å; L20-F29 PolarHBondContact O-N 3.14Å; L20-L123 HydrophobicContact CD2-CD2 4.22Å; L20-F126 HydrophobicContact CD1-CD1 4.39Å; L20-F126 HydrophobicContact CD1-CE1 3.58Å; L20-F126 HydrophobicContact CD1-CZ 4.44Å; L20-F126 HydrophobicContact CD2-CD1 4.41Å; L20-F126 HydrophobicContact CD2-CE1 4.17Å; L20-L127 HydrophobicContact CB-CD2 4.36Å; L20-L127 HydrophobicContact CD2-CD2 4.26Å
21	I	97	Very high	96.3	Very high	47 Å²	47	57.5 Å²	57.5	24%	0.241	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-95.2	130.9	-175.1	-57.6	174	0	0	0	110.1	I9 E18 G23 F29	I9-I21 HydrophobicContact CD1-CD1 3.64Å; I9-I21 HydrophobicContact CD1-CG1 4.13Å; I9-I21 HydrophobicContact CD1-CG2 4.31Å; E18-I21 WeakPolarHBondContact O-CB 3.47Å; E18-I21 PolarHBondContact O-N 3.27Å; I21-G23 PolarHBondContact O-N 3.41Å; I21-F29 WeakPolarHBondContact O-CZ 3.38Å
22	C	97.8	Very high	96.3	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.316	C	S	.	.			trans	-75.6	120.6	175.7	179.2	0	0	0	0	111.9	I24 C25 H26 G27 F29 C42	C22-I24 PolarHBondContact O-N 3.28Å; C22-C25 VanDerWaalsContact CB-SG 3.6Å; C22-C25 PolarHBondContact O-N 2.98Å; C22-H26 VanDerWaalsContact O-CA 3.25Å; C22-H26 WeakPolarHBondContact O-CA 3.34Å; C22-H26 PolarHBondContact O-N 3.04Å; C22-G27 WeakPolarHBondContact CB-O 3.42Å; C22-G27 PolarHBondContact N-O 3.43Å; C22-F29 HydrophobicContact CB-CD1 3.7Å; C22-F29 HydrophobicContact CB-CE1 3.62Å; C22-C42 VanDerWaalsContact CB-SG 3.57Å; C22-C42 PolarHBondContact SG-N 3.02Å; C22-C42 VanDerWaalsContact SG-N 3.42Å
23	G	95.2	Very high	96.3	Very high	46 Å²	46	56.3 Å²	56.3	47%	0.474	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	5.4	176.8	0	0	0	0	0	116.6	I21	I21-G23 PolarHBondContact O-N 3.41Å
24	I	96.2	Very high	96.2	Very high	46 Å²	46	55.9 Å²	55.9	24%	0.236	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-52.1	173.6	-62.6	166.1	0	0	0	110.9	C22 F41 C45 W49 P75	C22-I24 PolarHBondContact O-N 3.28Å; I24-F41 HydrophobicContact CD1-CB 4.19Å; I24-F41 HydrophobicContact CD1-CD1 3.47Å; I24-F41 VanDerWaalsContact CD1-CD1 3.47Å; I24-F41 HydrophobicContact CD1-CE1 4.06Å; I24-F41 HydrophobicContact CD1-CG 3.93Å; I24-F41 HydrophobicContact CG1-CD1 3.62Å; I24-F41 HydrophobicContact CG1-CE1 3.94Å; I24-C45 HydrophobicContact CB-CB 3.89Å; I24-C45 HydrophobicContact CD1-CB 3.66Å; I24-C45 HydrophobicContact CG1-CB 4.39Å; I24-C45 HydrophobicContact CG2-CB 3.91Å; I24-W49 HydrophobicContact CD1-CB 4.4Å; I24-P75 HydrophobicContact CD1-CB 4.19Å; I24-P75 HydrophobicContact CD1-CG 3.77Å; I24-P75 HydrophobicContact CG1-CB 3.98Å; I24-P75 HydrophobicContact CG1-CG 4.14Å
25	C	97	Very high	96.2	Very high	40 Å²	40	50.9 Å²	50.9	27%	0.27	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-8.7	-175.9	66	0	0	0	0	113.9	M5 G6 C22 G27	M5-C25 HydrophobicContact CB-CB 4.14Å; G6-C25 VanDerWaalsContact CA-SG 3.54Å; G6-C25 PolarHBondContact N-SG 3.37Å; C22-C25 VanDerWaalsContact CB-SG 3.6Å; C22-C25 PolarHBondContact O-N 2.98Å; C25-G27 PolarHBondContact O-N 3.09Å; C25-G27 VanDerWaalsContact O-N 3.16Å
26	H	96.1	Very high	96.1	Very high	132 Å²	132	50 Å²	50	61%	0.611	27%	0.268	S	S	*	.	S	Bend	trans	57.5	21.3	-175.5	-48.1	112.9	0	0	0	114.3	I9 C22	I9-H26 WeakPolarHBondContact CD1-O 3.47Å; C22-H26 VanDerWaalsContact O-CA 3.25Å; C22-H26 WeakPolarHBondContact O-CA 3.34Å; C22-H26 PolarHBondContact O-N 3.04Å
27	G	97	Very high	96	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.031	27%	0.273	C	S	.	.	S	Bend	trans	-106.5	164.5	171.2	0	0	0	0	0	111.8	I7 C22 C25	I7-G27 CarbonylContact O-C 3.59Å; I7-G27 WeakPolarHBondContact O-CA 3.38Å; C22-G27 WeakPolarHBondContact CB-O 3.42Å; C22-G27 PolarHBondContact N-O 3.43Å; C25-G27 PolarHBondContact O-N 3.09Å; C25-G27 VanDerWaalsContact O-N 3.16Å
28	V	97.3	Very high	96	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.012	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-63	138.8	174.2	-178	0	0	0	0	110	G6 I7 I9 F12 V16 L20 I30 L127 L130	G6-V28 CarbonylContact C-O 3.57Å; G6-V28 WeakPolarHBondContact CA-O 3.38Å; I7-V28 HydrophobicContact CB-CB 4.45Å; I7-V28 PolarHBondContact N-O 2.87Å; I7-V28 PolarHBondContact O-N 2.94Å; I9-V28 HydrophobicContact CG1-CG2 4.38Å; F12-V28 HydrophobicContact CD2-CG2 3.88Å; F12-V28 HydrophobicContact CE1-CB 4.45Å; F12-V28 HydrophobicContact CE1-CG1 4.27Å; F12-V28 HydrophobicContact CE1-CG2 4.22Å; F12-V28 HydrophobicContact CE2-CB 3.69Å; F12-V28 HydrophobicContact CE2-CG1 4.38Å; F12-V28 HydrophobicContact CE2-CG2 3.23Å; F12-V28 HydrophobicContact CZ-CB 3.51Å; F12-V28 HydrophobicContact CZ-CG1 3.72Å; F12-V28 HydrophobicContact CZ-CG2 3.44Å; F12-V28 VanDerWaalsContact CZ-CG2 3.44Å; V16-V28 HydrophobicContact CB-CG2 4.26Å; V16-V28 HydrophobicContact CG1-CG1 4.44Å; V16-V28 HydrophobicContact CG1-CG2 3.69Å; V16-V28 HydrophobicContact CG2-CG2 4.06Å; L20-V28 HydrophobicContact CB-CG1 4.43Å; L20-V28 WeakPolarHBondContact O-CA 3.49Å; V28-I30 PolarHBondContact O-N 3Å; V28-L127 HydrophobicContact CG1-CD2 3.7Å; V28-L130 HydrophobicContact CG1-CD1 4.28Å
29	F	97.5	Very high	96.1	Very high	11 Å²	11	43.8 Å²	43.8	5%	0.048	25%	0.252	C	S	.	.			trans	-52.8	131.1	-172.1	-66.7	-56.6	0	0	0	114.1	N19 L20 I21 C22 P32 T40 L127	N19-F29 WeakPolarHBondContact O-CE2 3.3Å; L20-F29 VanDerWaalsContact C-CD2 3.45Å; L20-F29 VanDerWaalsContact C-CE2 3.4Å; L20-F29 WeakPolarHBondContact O-CD2 3.47Å; L20-F29 WeakPolarHBondContact O-CG 3.4Å; L20-F29 PolarHBondContact O-N 3.14Å; I21-F29 WeakPolarHBondContact O-CZ 3.38Å; C22-F29 HydrophobicContact CB-CD1 3.7Å; C22-F29 HydrophobicContact CB-CE1 3.62Å; F29-P32 HydrophobicContact CB-CB 3.88Å; F29-P32 HydrophobicContact CB-CG 4.31Å; F29-P32 HydrophobicContact CD1-CB 4.46Å; F29-P32 HydrophobicContact CD2-CB 4.27Å; F29-P32 HydrophobicContact CG-CB 3.98Å; F29-T40 HydrophobicContact CD1-CG2 4.26Å; F29-T40 HydrophobicContact CD2-CG2 4.24Å; F29-T40 HydrophobicContact CE1-CG2 3.83Å; F29-T40 VanDerWaalsContact CE1-O 3.29Å; F29-T40 WeakPolarHBondContact CE1-O 3.29Å; F29-T40 HydrophobicContact CE2-CG2 3.8Å; F29-T40 HydrophobicContact CG-CG2 4.48Å; F29-T40 HydrophobicContact CZ-CG2 3.61Å; F29-T40 WeakPolarHBondContact CZ-O 3.34Å; F29-L127 HydrophobicContact CB-CD1 3.92Å
30	I	95.3	Very high	96.2	Very high	13 Å²	13	39.2 Å²	39.2	7%	0.067	23%	0.229	C	C	.	.	S	Bend	trans	-108.4	122.2	160.1	-65.8	-165.2	0	0	0	108.1	M5 I7 V28 C42 A43 H151 F152	M5-I30 WeakPolarHBondContact O-CD1 3.42Å; M5-I30 WeakPolarHBondContact O-CG1 3.41Å; I7-I30 HydrophobicContact CD1-CD1 4.44Å; I7-I30 HydrophobicContact CD1-CG1 4.41Å; I7-I30 HydrophobicContact CG1-CD1 3.71Å; I7-I30 HydrophobicContact CG1-CG1 3.81Å; V28-I30 PolarHBondContact O-N 3Å; I30-C42 PolarHBondContact N-SG 3.17Å; I30-C42 VanDerWaalsContact O-CA 3.28Å; I30-C42 WeakPolarHBondContact O-CA 3.33Å; I30-C42 VanDerWaalsContact O-CB 3.3Å; I30-C42 WeakPolarHBondContact O-CB 3.49Å; I30-A43 PolarHBondContact O-N 2.9Å; I30-H151 WeakPolarHBondContact CD1-NE2 3.4Å; I30-F152 HydrophobicContact CD1-CE1 4.5Å; I30-F152 HydrophobicContact CD1-CZ 4.17Å; I30-F152 HydrophobicContact CG1-CZ 4.35Å; I30-F152 HydrophobicContact CG2-CE1 4.33Å; I30-F152 HydrophobicContact CG2-CZ 4Å
31	I	93.9	Very high	96.2	Very high	114 Å²	114	38.7 Å²	38.7	59%	0.585	23%	0.226	S	C	*	.	S	Bend	trans	47.7	69	-176.8	-53	172.9	0	0	0	109.3	V33 A43	I31-V33 PolarHBondContact O-N 3.22Å; I31-A43 HydrophobicContact CB-CB 4.05Å; I31-A43 HydrophobicContact CG2-CB 3.92Å; I31-A43 WeakPolarHBondContact O-CB 3.45Å; I31-A43 PolarHBondContact O-N 3.35Å
32	P	96.3	Very high	96.2	Very high	9 Å²	9	36.4 Å²	36.4	6%	0.058	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	133.9	-176.9	23.2	-32.7	0	0	0	111.1	F29 T40 F41 V120 L123 L127	F29-P32 HydrophobicContact CB-CB 3.88Å; F29-P32 HydrophobicContact CB-CG 4.31Å; F29-P32 HydrophobicContact CD1-CB 4.46Å; F29-P32 HydrophobicContact CD2-CB 4.27Å; F29-P32 HydrophobicContact CG-CB 3.98Å; P32-T40 HydrophobicContact CB-CG2 3.7Å; P32-F41 CarbonylContact C-O 3.4Å; P32-F41 WeakPolarHBondContact CA-O 3.47Å; P32-V120 HydrophobicContact CB-CB 4.1Å; P32-V120 HydrophobicContact CB-CG2 4.35Å; P32-V120 HydrophobicContact CG-CB 4.07Å; P32-V120 PolarHBondContact O-N 3.28Å; P32-L123 HydrophobicContact CB-CD1 4.42Å; P32-L123 HydrophobicContact CG-CB 4.08Å; P32-L123 HydrophobicContact CG-CD1 4.28Å; P32-L127 HydrophobicContact CG-CD1 3.85Å
33	V	96.3	Very high	96.1	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.8	172.7	-63.5	0	0	0	0	109.6	I31 T40 F41 A43 L46 L113 A117 R118	I31-V33 PolarHBondContact O-N 3.22Å; V33-T40 CarbonylContact O-C 3.58Å; V33-T40 VanDerWaalsContact O-CA 3.3Å; V33-T40 WeakPolarHBondContact O-CA 3.43Å; V33-F41 PolarHBondContact N-O 3.37Å; V33-F41 PolarHBondContact O-N 2.87Å; V33-A43 HydrophobicContact CG1-CB 3.93Å; V33-L46 HydrophobicContact CG2-CB 4.24Å; V33-L46 HydrophobicContact CG2-CD2 3.81Å; V33-L113 HydrophobicContact CG1-CD2 4.21Å; V33-L113 HydrophobicContact CG2-CD2 4.4Å; V33-A117 HydrophobicContact CB-CB 3.84Å; V33-A117 HydrophobicContact CG2-CB 3.99Å; V33-R118 CarbonylContact C-O 3.54Å; V33-R118 VanDerWaalsContact CA-O 3.3Å; V33-R118 WeakPolarHBondContact CA-O 3.48Å
34	V	96.5	Very high	96	Very high	41 Å²	41	37.1 Å²	37.1	25%	0.248	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.2	179.4	66.9	0	0	0	0	110.1	H39 A117 R118 V120	V34-H39 WeakPolarHBondContact CA-O 3.42Å; V34-A117 CarbonylContact O-C 3.52Å; V34-A117 WeakPolarHBondContact O-CA 3.38Å; V34-A117 WeakPolarHBondContact O-CB 3.38Å; V34-R118 HydrophobicContact CG1-CB 4.3Å; V34-R118 PolarHBondContact N-O 3.39Å; V34-R118 PolarHBondContact O-N 3.07Å; V34-V120 HydrophobicContact CB-CG2 3.69Å; V34-V120 HydrophobicContact CG1-CG2 3.82Å
35	T	95.3	Very high	96	Very high	4 Å²	4	35 Å²	35	3%	0.025	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	162.6	173.4	55.3	0	0	0	0	110.8	C37 G38 H39 F41 L46 L81 A117	T35-C37 PolarHBondContact O-N 3.47Å; T35-C37 VanDerWaalsContact O-N 3.14Å; T35-C37 PolarHBondContact OG1-SG 3.03Å; T35-G38 PolarHBondContact O-N 3.32Å; T35-H39 PolarHBondContact N-O 2.92Å; T35-H39 PolarHBondContact OG1-N 3.19Å; T35-H39 PolarHBondContact OG1-O 3.48Å; T35-F41 HydrophobicContact CG2-CD2 4.18Å; T35-F41 HydrophobicContact CG2-CE2 3.96Å; T35-L46 HydrophobicContact CG2-CD1 4.5Å; T35-L46 HydrophobicContact CG2-CD2 3.81Å; T35-L81 HydrophobicContact CG2-CD1 3.91Å; T35-L81 HydrophobicContact CG2-CD2 4.1Å; T35-A117 HydrophobicContact CG2-CB 4.47Å
36	E	93.7	Very high	95.9	Very high	115 Å²	115	33 Å²	33	54%	0.537	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.3	178.3	65.2	-178.6	179.7	0	0	113.9	G38 R80 L81 S82	E36-G38 PolarHBondContact O-N 3Å; E36-R80 VanDerWaalsContact OE1-O 3.11Å; E36-L81 HydrophobicContact CG-CD2 4.12Å; E36-L81 WeakPolarHBondContact OE1-CA 3Å; E36-S82 WeakPolarHBondContact OE1-CB 3.47Å; E36-S82 PolarHBondContact OE1-N 3.05Å; E36-S82 PolarHBondContact OE1-OG 3.03Å; E36-S82 WeakPolarHBondContact OE2-CB 3.23Å; E36-S82 PolarHBondContact OE2-OG 3.37Å
37	C	95.4	Very high	95.7	Very high	37 Å²	37	30.1 Å²	30.1	25%	0.25	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	2.9	174.3	70.5	0	0	0	0	114.1	T35 H39 C74 C77 T79	T35-C37 PolarHBondContact O-N 3.47Å; T35-C37 VanDerWaalsContact O-N 3.14Å; T35-C37 PolarHBondContact OG1-SG 3.03Å; C37-H39 PolarHBondContact SG-ND1 3.34Å; C37-C74 VanDerWaalsContact SG-CB 3.56Å; C37-C74 PolarHBondContact SG-SG 3.36Å; C37-C77 PolarHBondContact SG-SG 3.02Å; C37-T79 HydrophobicContact CB-CG2 3.97Å
38	G	95	Very high	95.4	Very high	51 Å²	51	33.6 Å²	33.6	53%	0.526	19%	0.188	S	C	.	.	S	Bend	trans	90.1	-5.4	174.8	0	0	0	0	0	116.1	T35 E36	T35-G38 PolarHBondContact O-N 3.32Å; E36-G38 PolarHBondContact O-N 3Å
39	H	96.8	Very high	95.1	Very high	60 Å²	60	37.3 Å²	37.3	28%	0.278	20%	0.203	S	C	.	.			trans	-81.5	137.8	179	-65.3	93.7	0	0	0	112	V34 T35 C37 F41 T76 C77	V34-H39 WeakPolarHBondContact CA-O 3.42Å; T35-H39 PolarHBondContact N-O 2.92Å; T35-H39 PolarHBondContact OG1-N 3.19Å; T35-H39 PolarHBondContact OG1-O 3.48Å; C37-H39 PolarHBondContact SG-ND1 3.34Å; H39-F41 HydrophobicContact CB-CE2 3.74Å; H39-F41 HydrophobicContact CB-CZ 3.8Å; H39-T76 VanDerWaalsContact CD2-CB 3.47Å; H39-T76 WeakPolarHBondContact CD2-CB 3.33Å; H39-T76 WeakPolarHBondContact CD2-CG2 3.18Å; H39-T76 WeakPolarHBondContact NE2-CG2 3.48Å; H39-C77 WeakPolarHBondContact CE1-CB 3.24Å; H39-C77 PolarHBondContact CE1-SG 3.48Å; H39-C77 PolarHBondContact ND1-SG 3.18Å
40	T	97.4	Very high	94.6	Very high	37 Å²	37	36.8 Å²	36.8	23%	0.227	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	139.3	-176.6	-56.3	0	0	0	0	111.6	F29 P32 V33 V120	F29-T40 HydrophobicContact CD1-CG2 4.26Å; F29-T40 HydrophobicContact CD2-CG2 4.24Å; F29-T40 HydrophobicContact CE1-CG2 3.83Å; F29-T40 VanDerWaalsContact CE1-O 3.29Å; F29-T40 WeakPolarHBondContact CE1-O 3.29Å; F29-T40 HydrophobicContact CE2-CG2 3.8Å; F29-T40 HydrophobicContact CG-CG2 4.48Å; F29-T40 HydrophobicContact CZ-CG2 3.61Å; F29-T40 WeakPolarHBondContact CZ-O 3.34Å; P32-T40 HydrophobicContact CB-CG2 3.7Å; V33-T40 CarbonylContact O-C 3.58Å; V33-T40 VanDerWaalsContact O-CA 3.3Å; V33-T40 WeakPolarHBondContact O-CA 3.43Å; T40-V120 HydrophobicContact CG2-CG2 4.22Å
41	F	97.1	Very high	94.1	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	162.9	179.9	-54.9	-78.6	0	0	0	110.8	I24 P32 V33 T35 H39 L46 P75 T76	I24-F41 HydrophobicContact CD1-CB 4.19Å; I24-F41 HydrophobicContact CD1-CD1 3.47Å; I24-F41 VanDerWaalsContact CD1-CD1 3.47Å; I24-F41 HydrophobicContact CD1-CE1 4.06Å; I24-F41 HydrophobicContact CD1-CG 3.93Å; I24-F41 HydrophobicContact CG1-CD1 3.62Å; I24-F41 HydrophobicContact CG1-CE1 3.94Å; P32-F41 CarbonylContact C-O 3.4Å; P32-F41 WeakPolarHBondContact CA-O 3.47Å; V33-F41 PolarHBondContact N-O 3.37Å; V33-F41 PolarHBondContact O-N 2.87Å; T35-F41 HydrophobicContact CG2-CD2 4.18Å; T35-F41 HydrophobicContact CG2-CE2 3.96Å; H39-F41 HydrophobicContact CB-CE2 3.74Å; H39-F41 HydrophobicContact CB-CZ 3.8Å; F41-L46 HydrophobicContact CB-CB 4.03Å; F41-L46 HydrophobicContact CD2-CD1 4.19Å; F41-L46 HydrophobicContact CD2-CD2 4.26Å; F41-L46 HydrophobicContact CG-CB 4.47Å; F41-P75 HydrophobicContact CD1-CG 4.33Å; F41-P75 HydrophobicContact CE1-CB 3.79Å; F41-P75 HydrophobicContact CE1-CG 3.77Å; F41-P75 HydrophobicContact CE2-CG 4.06Å; F41-P75 HydrophobicContact CZ-CB 3.86Å; F41-P75 HydrophobicContact CZ-CG 3.61Å; F41-T76 VanDerWaalsContact CE1-OG1 3.29Å; F41-T76 WeakPolarHBondContact CE1-OG1 3.4Å; F41-T76 WeakPolarHBondContact CZ-OG1 3.31Å
42	C	97.4	Very high	93.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	140.8	162.2	-50.8	0	0	0	0	109.1	G6 C22 I30 N44 C45 L46	G6-C42 VanDerWaalsContact CA-SG 3.56Å; C22-C42 VanDerWaalsContact CB-SG 3.57Å; C22-C42 PolarHBondContact SG-N 3.02Å; C22-C42 VanDerWaalsContact SG-N 3.42Å; I30-C42 PolarHBondContact N-SG 3.17Å; I30-C42 VanDerWaalsContact O-CA 3.28Å; I30-C42 WeakPolarHBondContact O-CA 3.33Å; I30-C42 VanDerWaalsContact O-CB 3.3Å; I30-C42 WeakPolarHBondContact O-CB 3.49Å; C42-N44 VanDerWaalsContact C-N 3.29Å; C42-N44 PolarHBondContact O-N 2.77Å; C42-C45 HydrophobicContact CB-CB 4.05Å; C42-C45 WeakPolarHBondContact O-CB 3.44Å; C42-C45 PolarHBondContact O-N 2.86Å; C42-L46 PolarHBondContact O-N 3.32Å
43	A	95	Very high	92.6	Very high	18 Å²	18	38.1 Å²	38.1	15%	0.149	21%	0.207	C	C	.	.	H	α-helix	trans	-51.1	-47.9	-179	0	0	0	0	0	112.8	I30 I31 V33 L46 K47 L113	I30-A43 PolarHBondContact O-N 2.9Å; I31-A43 HydrophobicContact CB-CB 4.05Å; I31-A43 HydrophobicContact CG2-CB 3.92Å; I31-A43 WeakPolarHBondContact O-CB 3.45Å; I31-A43 PolarHBondContact O-N 3.35Å; V33-A43 HydrophobicContact CG1-CB 3.93Å; A43-L46 PolarHBondContact O-N 3.16Å; A43-K47 WeakPolarHBondContact O-CB 3.32Å; A43-K47 PolarHBondContact O-N 2.86Å; A43-L113 HydrophobicContact CB-CD2 3.66Å; A43-L113 VanDerWaalsContact O-CD2 3.3Å; A43-L113 WeakPolarHBondContact O-CD2 3.31Å
44	N	94	Very high	91.3	Very high	42 Å²	42	38.1 Å²	38.1	23%	0.225	21%	0.207	C	C	.	.	H	α-helix	trans	-69.6	-34.1	-179.6	-167	56.9	0	0	0	112.9	N4 M5 C42 K47 I48	N4-N44 HydrophobicContact CB-CB 4.17Å; N4-N44 WeakPolarHBondContact CB-ND2 3.46Å; N4-N44 WeakPolarHBondContact O-CB 3.3Å; M5-N44 HydrophobicContact SD-CB 4.49Å; M5-N44 PolarHBondContact SD-ND2 3.33Å; M5-N44 VanDerWaalsContact SD-ND2 3.44Å; C42-N44 VanDerWaalsContact C-N 3.29Å; C42-N44 PolarHBondContact O-N 2.77Å; N44-K47 PolarHBondContact O-N 3.3Å; N44-I48 VanDerWaalsContact ND2-CD1 3.31Å; N44-I48 WeakPolarHBondContact ND2-CD1 3.36Å; N44-I48 WeakPolarHBondContact O-CB 3.46Å; N44-I48 VanDerWaalsContact O-CG1 3.29Å; N44-I48 WeakPolarHBondContact O-CG1 3.34Å; N44-I48 PolarHBondContact O-N 3.5Å
45	C	96.3	Very high	89.7	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.007	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-48.1	176.9	-65.7	0	0	0	0	110.8	M5 I24 C42 I48 W49	M5-C45 HydrophobicContact SD-CB 4.34Å; M5-C45 PolarHBondContact SD-SG 2.89Å; I24-C45 HydrophobicContact CB-CB 3.89Å; I24-C45 HydrophobicContact CD1-CB 3.66Å; I24-C45 HydrophobicContact CG1-CB 4.39Å; I24-C45 HydrophobicContact CG2-CB 3.91Å; C42-C45 HydrophobicContact CB-CB 4.05Å; C42-C45 WeakPolarHBondContact O-CB 3.44Å; C42-C45 PolarHBondContact O-N 2.86Å; C45-I48 PolarHBondContact O-N 2.99Å; C45-W49 WeakPolarHBondContact O-CB 3.16Å; C45-W49 PolarHBondContact O-N 2.86Å
46	L	94.4	Very high	88.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-41.2	177	-177.2	59.4	0	0	0	111.2	V33 T35 F41 C42 A43 I48 W49 L50 P75 L113 A117	V33-L46 HydrophobicContact CG2-CB 4.24Å; V33-L46 HydrophobicContact CG2-CD2 3.81Å; T35-L46 HydrophobicContact CG2-CD1 4.5Å; T35-L46 HydrophobicContact CG2-CD2 3.81Å; F41-L46 HydrophobicContact CB-CB 4.03Å; F41-L46 HydrophobicContact CD2-CD1 4.19Å; F41-L46 HydrophobicContact CD2-CD2 4.26Å; F41-L46 HydrophobicContact CG-CB 4.47Å; C42-L46 PolarHBondContact O-N 3.32Å; A43-L46 PolarHBondContact O-N 3.16Å; L46-I48 PolarHBondContact O-N 3.29Å; L46-W49 WeakPolarHBondContact O-CB 3.46Å; L46-W49 PolarHBondContact O-N 3.47Å; L46-L50 HydrophobicContact CD1-CD1 4.19Å; L46-L50 HydrophobicContact CD1-CD2 4.43Å; L46-L50 HydrophobicContact CD1-CG 4.09Å; L46-L50 HydrophobicContact CG-CD1 3.93Å; L46-L50 HydrophobicContact CG-CG 4.29Å; L46-L50 VanDerWaalsContact O-CG 3.26Å; L46-L50 WeakPolarHBondContact O-CG 3.24Å; L46-L50 PolarHBondContact O-N 3.16Å; L46-P75 HydrophobicContact CD1-CG 4.05Å; L46-L113 HydrophobicContact CB-CD1 4.06Å; L46-L113 HydrophobicContact CD2-CD1 3.84Å; L46-L113 HydrophobicContact CG-CD1 3.81Å; L46-A117 HydrophobicContact CD2-CB 3.59Å
47	K	91.2	Very high	86.5	Confident	70 Å²	70	42.8 Å²	42.8	30%	0.304	23%	0.226	S	C	.	.	H	α-helix	trans	-57.7	-48.1	176.1	-173.5	-178.2	-179.7	-174.8	0	112.4	A43 N44 W49 L50 N51 N110 L113	A43-K47 WeakPolarHBondContact O-CB 3.32Å; A43-K47 PolarHBondContact O-N 2.86Å; N44-K47 PolarHBondContact O-N 3.3Å; K47-W49 VanDerWaalsContact C-N 3.35Å; K47-L50 PolarHBondContact O-N 3.42Å; K47-N51 WeakPolarHBondContact O-CB 3.43Å; K47-N51 PolarHBondContact O-N 2.9Å; K47-N110 WeakPolarHBondContact CE-OD1 3.35Å; K47-L113 HydrophobicContact CB-CD1 4.4Å
48	I	90.5	Very high	84.5	Confident	76 Å²	76	45 Å²	45	39%	0.39	24%	0.236	S	C	.	.	H	α-helix	trans	-62.1	-43.8	177.4	-71.2	166.3	0	0	0	110.6	M5 N44 C45 L46 L50 N51 S52	M5-I48 HydrophobicContact CE-CD1 3.44Å; M5-I48 VanDerWaalsContact CE-CD1 3.44Å; M5-I48 HydrophobicContact SD-CD1 3.92Å; N44-I48 VanDerWaalsContact ND2-CD1 3.31Å; N44-I48 WeakPolarHBondContact ND2-CD1 3.36Å; N44-I48 WeakPolarHBondContact O-CB 3.46Å; N44-I48 VanDerWaalsContact O-CG1 3.29Å; N44-I48 WeakPolarHBondContact O-CG1 3.34Å; N44-I48 PolarHBondContact O-N 3.5Å; C45-I48 PolarHBondContact O-N 2.99Å; L46-I48 PolarHBondContact O-N 3.29Å; I48-L50 PolarHBondContact O-N 3.04Å; I48-N51 PolarHBondContact O-N 2.86Å; I48-S52 PolarHBondContact O-N 3.43Å
49	W	91.1	Very high	82.6	Confident	81 Å²	81	51.1 Å²	51.1	31%	0.307	25%	0.25	S	S	.	.	H	α-helix	trans	-57.3	-49.7	176.6	176.2	-93.3	0	0	0	112	I24 C45 L46 K47 S52 T73 P75	I24-W49 HydrophobicContact CD1-CB 4.4Å; C45-W49 WeakPolarHBondContact O-CB 3.16Å; C45-W49 PolarHBondContact O-N 2.86Å; L46-W49 WeakPolarHBondContact O-CB 3.46Å; L46-W49 PolarHBondContact O-N 3.47Å; K47-W49 VanDerWaalsContact C-N 3.35Å; W49-S52 PolarHBondContact O-N 2.87Å; W49-S52 PolarHBondContact O-OG 3.46Å; W49-T73 PolarHBondContact NE1-O 3.38Å; W49-P75 HydrophobicContact CB-CG 4.46Å; W49-P75 HydrophobicContact CD2-CB 4.05Å; W49-P75 HydrophobicContact CD2-CG 3.92Å; W49-P75 HydrophobicContact CE3-CB 4.41Å; W49-P75 HydrophobicContact CG-CB 4.44Å; W49-P75 HydrophobicContact CG-CG 3.78Å; W49-P75 HydrophobicContact CZ2-CB 4.18Å
50	L	88.2	Confident	80.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.3	-43.7	-179.9	-62.9	170.2	0	0	0	111.6	L46 K47 I48 S52 K53 F72 L81 I111 L113 V116	L46-L50 HydrophobicContact CD1-CD1 4.19Å; L46-L50 HydrophobicContact CD1-CD2 4.43Å; L46-L50 HydrophobicContact CD1-CG 4.09Å; L46-L50 HydrophobicContact CG-CD1 3.93Å; L46-L50 HydrophobicContact CG-CG 4.29Å; L46-L50 VanDerWaalsContact O-CG 3.26Å; L46-L50 WeakPolarHBondContact O-CG 3.24Å; L46-L50 PolarHBondContact O-N 3.16Å; K47-L50 PolarHBondContact O-N 3.42Å; I48-L50 PolarHBondContact O-N 3.04Å; L50-S52 VanDerWaalsContact C-N 3.31Å; L50-S52 PolarHBondContact O-N 2.98Å; L50-K53 WeakPolarHBondContact O-CB 3.42Å; L50-K53 PolarHBondContact O-N 3.46Å; L50-K53 VanDerWaalsContact O-N 3.14Å; L50-F72 HydrophobicContact CB-CD1 4.03Å; L50-F72 HydrophobicContact CB-CE1 4.19Å; L50-F72 HydrophobicContact CD2-CB 3.73Å; L50-F72 HydrophobicContact CD2-CD1 3.48Å; L50-F72 VanDerWaalsContact CD2-CD1 3.48Å; L50-F72 HydrophobicContact CD2-CE1 4.43Å; L50-F72 HydrophobicContact CD2-CG 3.9Å; L50-F72 HydrophobicContact CG-CD1 4.34Å; L50-F72 WeakPolarHBondContact O-CE1 3.47Å; L50-L81 HydrophobicContact CD2-CD1 4.44Å; L50-I111 HydrophobicContact CB-CG2 3.75Å; L50-I111 HydrophobicContact CD1-CD1 4.37Å; L50-I111 HydrophobicContact CD1-CG2 3.96Å; L50-L113 HydrophobicContact CD1-CD1 4.11Å; L50-V116 HydrophobicContact CD1-CB 4.09Å; L50-V116 HydrophobicContact CD1-CG1 4.01Å; L50-V116 HydrophobicContact CD1-CG2 4.13Å; L50-V116 HydrophobicContact CD2-CG1 4.33Å
51	N	83.4	Confident	78.6	Confident	34 Å²	34	56.7 Å²	56.7	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-31.9	178.6	-73.6	-11.3	0	0	0	112.7	K47 I48 K53 L54 E55 N110 I111	K47-N51 WeakPolarHBondContact O-CB 3.43Å; K47-N51 PolarHBondContact O-N 2.9Å; I48-N51 PolarHBondContact O-N 2.86Å; N51-K53 PolarHBondContact O-N 2.98Å; N51-L54 WeakPolarHBondContact O-CA 3.43Å; N51-L54 WeakPolarHBondContact O-CB 3.25Å; N51-L54 PolarHBondContact O-N 3.41Å; N51-E55 PolarHBondContact O-N 3.27Å; N51-N110 PolarHBondContact ND2-OD1 2.87Å; N51-I111 WeakPolarHBondContact OD1-CG2 3.41Å; N51-I111 PolarHBondContact OD1-N 3.14Å
52	S	82.1	Confident	76.7	Confident	42 Å²	42	58.1 Å²	58.1	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-28.1	174.6	76.3	0	0	0	0	113	I48 W49 L50 L54 H56	I48-S52 PolarHBondContact O-N 3.43Å; W49-S52 PolarHBondContact O-N 2.87Å; W49-S52 PolarHBondContact O-OG 3.46Å; L50-S52 VanDerWaalsContact C-N 3.31Å; L50-S52 PolarHBondContact O-N 2.98Å; S52-L54 VanDerWaalsContact C-N 3.3Å; S52-H56 PolarHBondContact O-CD2 3.09Å
53	K	77.1	Confident	74.6	Confident	88 Å²	88	63 Å²	63	38%	0.383	32%	0.318	S	S	.	.	H	α-helix	trans	-75.3	-21.1	174.9	-59	-57.8	-177	-172.7	0	112.7	L50 N51	L50-K53 WeakPolarHBondContact O-CB 3.42Å; L50-K53 PolarHBondContact O-N 3.46Å; L50-K53 VanDerWaalsContact O-N 3.14Å; N51-K53 PolarHBondContact O-N 2.98Å
54	L	69	Low	72.7	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-81.9	-33.3	176.4	-65.8	172.3	0	0	0	112.3	N51 S52 H56 L57 L70 F72 V91 P109	N51-L54 WeakPolarHBondContact O-CA 3.43Å; N51-L54 WeakPolarHBondContact O-CB 3.25Å; N51-L54 PolarHBondContact O-N 3.41Å; S52-L54 VanDerWaalsContact C-N 3.3Å; L54-H56 PolarHBondContact O-N 2.99Å; L54-L57 HydrophobicContact CD2-CD1 3.76Å; L54-L57 WeakPolarHBondContact O-CB 3.22Å; L54-L57 PolarHBondContact O-N 3.25Å; L54-L70 HydrophobicContact CD2-CD2 4.04Å; L54-F72 HydrophobicContact CD1-CZ 4.41Å; L54-F72 HydrophobicContact CD2-CE1 4.28Å; L54-F72 HydrophobicContact CD2-CZ 3.81Å; L54-F72 HydrophobicContact CG-CE1 4.18Å; L54-F72 HydrophobicContact CG-CZ 4.13Å; L54-V91 HydrophobicContact CD1-CG1 3.66Å; L54-V91 HydrophobicContact CD2-CG1 3.71Å; L54-V91 HydrophobicContact CG-CG1 4.35Å; L54-P109 HydrophobicContact CB-CG 4.09Å; L54-P109 HydrophobicContact CD1-CB 4.23Å; L54-P109 HydrophobicContact CD1-CG 4.5Å
55	E	64	Low	70.8	Confident	99 Å²	99	72 Å²	72	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-29.7	-178.8	-67.9	-172.9	154.2	0	0	112.7	N51 L57 K108	N51-E55 PolarHBondContact O-N 3.27Å; E55-L57 PolarHBondContact O-N 3.4Å; E55-K108 IonicContact OE1-NZ 3.37Å; E55-K108 PolarHBondContact OE1-NZ 3.08Å
56	H	62.2	Low	68.8	Low	141 Å²	141	73.2 Å²	73.2	65%	0.653	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-8.7	175.6	-67.2	-60.8	0	0	0	114.8	S52 L54	S52-H56 PolarHBondContact O-CD2 3.09Å; L54-H56 PolarHBondContact O-N 2.99Å
57	L	58.7	Low	66.9	Low	19 Å²	19	77.4 Å²	77.4	10%	0.099	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-18	-176.1	-55.5	167.8	0	0	0	113.3	L54 E55 H59 L60 L70 V95	L54-L57 HydrophobicContact CD2-CD1 3.76Å; L54-L57 WeakPolarHBondContact O-CB 3.22Å; L54-L57 PolarHBondContact O-N 3.25Å; E55-L57 PolarHBondContact O-N 3.4Å; L57-H59 PolarHBondContact O-N 3.38Å; L57-L60 PolarHBondContact O-N 3.41Å; L57-L60 VanDerWaalsContact O-N 3.15Å; L57-L70 HydrophobicContact CD1-CD1 3.73Å; L57-L70 HydrophobicContact CD1-CD2 3.15Å; L57-L70 HydrophobicContact CD1-CG 3.31Å; L57-L70 HydrophobicContact CD2-CD1 3.56Å; L57-L70 HydrophobicContact CD2-CG 3.83Å; L57-L70 HydrophobicContact CG-CD1 4.26Å; L57-L70 HydrophobicContact CG-CD2 4.43Å; L57-L70 HydrophobicContact CG-CG 4.18Å; L57-V95 HydrophobicContact CB-CG1 4.33Å
58	N	54.5	Low	65.1	Low	84 Å²	84	80.8 Å²	80.8	45%	0.449	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-7.2	-176.6	-68.2	-21	0	0	0	113.6	V95	N58-V95 VanDerWaalsContact OD1-CG1 3.27Å; N58-V95 WeakPolarHBondContact OD1-CG1 3.47Å
59	H	55	Low	63.3	Low	179 Å²	179	86 Å²	86	83%	0.829	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	8.2	177.8	-73.3	-66.9	0	0	0	114	L57	L57-H59 PolarHBondContact O-N 3.38Å
60	L	54.5	Low	61.9	Low	92 Å²	92	82.8 Å²	82.8	48%	0.482	41%	0.406	S	S	.	.	S	Bend	trans	-116.1	128.5	-174.6	-65.3	169.3	0	0	0	110.8	L57 I62	L57-L60 PolarHBondContact O-N 3.41Å; L57-L60 VanDerWaalsContact O-N 3.15Å; L60-I62 PolarHBondContact O-N 3.16Å
61	T	54.9	Low	61	Low	121 Å²	121	86.1 Å²	86.1	74%	0.742	42%	0.422	S	S	*	.			trans	-64.9	100.4	160	48.3	0	0	0	0	107.1	N63	T61-N63 PolarHBondContact O-N 3.29Å
62	I	56.9	Low	61	Low	31 Å²	31	84.9 Å²	84.9	16%	0.159	42%	0.415	C	S	.	.			trans	-68.5	98.9	-174.8	-66.6	171.4	0	0	0	108.9	L60 D66 R67 I92 V95 V96	L60-I62 PolarHBondContact O-N 3.16Å; I62-D66 HydrophobicContact CG2-CB 4.31Å; I62-R67 HydrophobicContact CG2-CG 3.6Å; I62-I92 HydrophobicContact CD1-CG2 4.28Å; I62-V95 HydrophobicContact CD1-CG1 4.49Å; I62-V96 HydrophobicContact CB-CG2 3.87Å; I62-V96 HydrophobicContact CD1-CG2 3.16Å; I62-V96 HydrophobicContact CG1-CG2 3.91Å; I62-V96 HydrophobicContact CG2-CG2 4.41Å
63	N	53.9	Low	61.4	Low	104 Å²	104	84.3 Å²	84.3	56%	0.556	41%	0.41	S	S	*	.			trans	-72.4	157	162.5	-67.6	-24.1	0	0	0	108.7	T61 N65 D66	T61-N63 PolarHBondContact O-N 3.29Å; N63-N65 PolarHBondContact O-N 2.9Å; N63-D66 PolarHBondContact O-N 3.14Å
64	D	55.7	Low	62.2	Low	132 Å²	132	80.1 Å²	80.1	71%	0.706	39%	0.391	S	S	*	.	H	α-helix	trans	-53.6	-26.9	-179.5	-74.1	-49.6	0	0	0	113.6
65	N	53.5	Low	63.5	Low	115 Å²	115	81.3 Å²	81.3	62%	0.615	40%	0.399	S	S	*	.	H	α-helix	trans	-70	-29.5	174.8	-63.8	-29.2	0	0	0	113.5	N63 Q68	N63-N65 PolarHBondContact O-N 2.9Å; N65-Q68 PolarHBondContact O-N 3.2Å
66	D	53.8	Low	64.9	Low	27 Å²	27	80.1 Å²	80.1	14%	0.144	40%	0.399	C	S	.	.	H	α-helix	trans	-80.2	-23.9	179.3	-74.2	-34	0	0	0	112.2	I62 N63 Q68 R69 L70	I62-D66 HydrophobicContact CG2-CB 4.31Å; N63-D66 PolarHBondContact O-N 3.14Å; D66-Q68 PolarHBondContact O-N 2.87Å; D66-R69 WeakPolarHBondContact O-CB 3.39Å; D66-R69 PolarHBondContact O-N 3.31Å; D66-R69 IonicContact OD1-NH1 2.93Å; D66-R69 PolarHBondContact OD1-NH1 2.95Å; D66-R69 VanDerWaalsContact OD1-NH1 3.08Å; D66-L70 VanDerWaalsContact O-CD1 3.28Å; D66-L70 WeakPolarHBondContact O-CD1 3.24Å; D66-L70 PolarHBondContact O-N 3.37Å
67	R	54.9	Low	66.5	Low	88 Å²	88	75.7 Å²	75.7	33%	0.332	38%	0.383	S	S	.	.	H	α-helix	trans	-58.3	-34.4	168.3	-73.2	-170.9	154.4	-169.4	-8.6	112.1	I62 R69 I92 N93	I62-R67 HydrophobicContact CG2-CG 3.6Å; R67-R69 VanDerWaalsContact C-N 3.28Å; R67-R69 PolarHBondContact O-N 2.92Å; R67-I92 HydrophobicContact CG-CD1 4.27Å; R67-I92 HydrophobicContact CG-CG2 4.41Å; R67-N93 PolarHBondContact NH2-OD1 3.04Å
68	Q	52.5	Low	68.2	Low	141 Å²	141	84.5 Å²	84.5	66%	0.659	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-20.5	174.4	-68.4	-178	-1.5	0	0	112.9	N65 D66 Q71	N65-Q68 PolarHBondContact O-N 3.2Å; D66-Q68 PolarHBondContact O-N 2.87Å; Q68-Q71 WeakPolarHBondContact O-CG 3.49Å; Q68-Q71 PolarHBondContact O-NE2 3.01Å
69	R	53	Low	70	Confident	186 Å²	186	83.8 Å²	83.8	70%	0.702	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-14.6	178.5	-71.5	-172	165.1	120.7	-2.7	114.1	D66 R67 Q71	D66-R69 WeakPolarHBondContact O-CB 3.39Å; D66-R69 PolarHBondContact O-N 3.31Å; D66-R69 IonicContact OD1-NH1 2.93Å; D66-R69 PolarHBondContact OD1-NH1 2.95Å; D66-R69 VanDerWaalsContact OD1-NH1 3.08Å; R67-R69 VanDerWaalsContact C-N 3.28Å; R67-R69 PolarHBondContact O-N 2.92Å; R69-Q71 PolarHBondContact O-N 3.49Å
70	L	61.3	Low	71.6	Confident	13 Å²	13	82.6 Å²	82.6	7%	0.068	40%	0.402	C	S	.	.			trans	-71.9	61.4	170.7	-84.4	93	0	0	0	112	L54 L57 D66 Q88 I92	L54-L70 HydrophobicContact CD2-CD2 4.04Å; L57-L70 HydrophobicContact CD1-CD1 3.73Å; L57-L70 HydrophobicContact CD1-CD2 3.15Å; L57-L70 HydrophobicContact CD1-CG 3.31Å; L57-L70 HydrophobicContact CD2-CD1 3.56Å; L57-L70 HydrophobicContact CD2-CG 3.83Å; L57-L70 HydrophobicContact CG-CD1 4.26Å; L57-L70 HydrophobicContact CG-CD2 4.43Å; L57-L70 HydrophobicContact CG-CG 4.18Å; D66-L70 VanDerWaalsContact O-CD1 3.28Å; D66-L70 WeakPolarHBondContact O-CD1 3.24Å; D66-L70 PolarHBondContact O-N 3.37Å; L70-Q88 PolarHBondContact O-NE2 2.89Å; L70-I92 HydrophobicContact CD2-CD1 4.01Å; L70-I92 HydrophobicContact CD2-CG1 3.57Å
71	Q	69.4	Low	73.2	Confident	71 Å²	71	78.7 Å²	78.7	33%	0.332	38%	0.382	S	S	.	.			trans	-97	108.6	178.5	-67.1	162.3	21	0	0	108.8	Q68 R69 T73 R80	Q68-Q71 WeakPolarHBondContact O-CG 3.49Å; Q68-Q71 PolarHBondContact O-NE2 3.01Å; R69-Q71 PolarHBondContact O-N 3.49Å; Q71-T73 PolarHBondContact O-N 3.47Å; Q71-R80 VanDerWaalsContact CD-NH2 3.32Å; Q71-R80 VanDerWaalsContact NE2-NH2 3.2Å; Q71-R80 VanDerWaalsContact OE1-NH1 3.13Å
72	F	84.3	Confident	74.4	Confident	7 Å²	7	76.6 Å²	76.6	3%	0.031	37%	0.372	C	S	.	.			trans	-66.1	130	165.3	-61.9	-71.9	0	0	0	108.6	L50 L54 R80 L81 V83 I111	L50-F72 HydrophobicContact CB-CD1 4.03Å; L50-F72 HydrophobicContact CB-CE1 4.19Å; L50-F72 HydrophobicContact CD2-CB 3.73Å; L50-F72 HydrophobicContact CD2-CD1 3.48Å; L50-F72 VanDerWaalsContact CD2-CD1 3.48Å; L50-F72 HydrophobicContact CD2-CE1 4.43Å; L50-F72 HydrophobicContact CD2-CG 3.9Å; L50-F72 HydrophobicContact CG-CD1 4.34Å; L50-F72 WeakPolarHBondContact O-CE1 3.47Å; L54-F72 HydrophobicContact CD1-CZ 4.41Å; L54-F72 HydrophobicContact CD2-CE1 4.28Å; L54-F72 HydrophobicContact CD2-CZ 3.81Å; L54-F72 HydrophobicContact CG-CE1 4.18Å; L54-F72 HydrophobicContact CG-CZ 4.13Å; F72-R80 WeakPolarHBondContact O-CA 3.35Å; F72-L81 HydrophobicContact CB-CB 4.39Å; F72-L81 PolarHBondContact O-N 3.34Å; F72-V83 HydrophobicContact CB-CG2 4.26Å; F72-V83 HydrophobicContact CD2-CB 4.41Å; F72-V83 HydrophobicContact CD2-CG2 3.33Å; F72-V83 HydrophobicContact CE2-CG2 3.95Å; F72-V83 HydrophobicContact CG-CG2 4.08Å; F72-I111 HydrophobicContact CD1-CD1 4.17Å; F72-I111 HydrophobicContact CD2-CD1 4.02Å; F72-I111 HydrophobicContact CE1-CD1 3.81Å; F72-I111 HydrophobicContact CE2-CD1 3.63Å; F72-I111 HydrophobicContact CG-CD1 4.24Å; F72-I111 HydrophobicContact CZ-CD1 3.51Å
73	T	90.9	Very high	75.2	Confident	31 Å²	31	75.7 Å²	75.7	19%	0.19	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-126.8	143.7	-177.8	46.6	0	0	0	0	109.7	W49 Q71 P75 R78 T79	W49-T73 PolarHBondContact NE1-O 3.38Å; Q71-T73 PolarHBondContact O-N 3.47Å; T73-P75 WeakPolarHBondContact O-CD 3.42Å; T73-R78 WeakPolarHBondContact CG2-O 3.46Å; T73-T79 WeakPolarHBondContact CA-O 3.44Å
74	C	94.4	Very high	75.6	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.367	C	S	.	.			trans	-58	127.5	173.5	178.2	0	0	0	0	110.1	C37 T76 C77 R78 T79 L81	C37-C74 VanDerWaalsContact SG-CB 3.56Å; C37-C74 PolarHBondContact SG-SG 3.36Å; C74-T76 PolarHBondContact O-N 3.22Å; C74-T76 PolarHBondContact SG-N 3.34Å; C74-T76 VanDerWaalsContact SG-N 3.39Å; C74-C77 VanDerWaalsContact CB-SG 3.54Å; C74-R78 WeakPolarHBondContact O-CA 3.49Å; C74-R78 PolarHBondContact O-N 3.27Å; C74-T79 PolarHBondContact N-O 3.39Å; C74-L81 HydrophobicContact CB-CD2 4.14Å; C74-L81 HydrophobicContact CB-CG 4.46Å
75	P	94.3	Very high	75.5	Confident	27 Å²	27	75 Å²	75	18%	0.175	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-32.4	175.4	-18.3	21.1	0	0	0	113.8	I24 F41 L46 W49 T73	I24-P75 HydrophobicContact CD1-CB 4.19Å; I24-P75 HydrophobicContact CD1-CG 3.77Å; I24-P75 HydrophobicContact CG1-CB 3.98Å; I24-P75 HydrophobicContact CG1-CG 4.14Å; F41-P75 HydrophobicContact CD1-CG 4.33Å; F41-P75 HydrophobicContact CE1-CB 3.79Å; F41-P75 HydrophobicContact CE1-CG 3.77Å; F41-P75 HydrophobicContact CE2-CG 4.06Å; F41-P75 HydrophobicContact CZ-CB 3.86Å; F41-P75 HydrophobicContact CZ-CG 3.61Å; L46-P75 HydrophobicContact CD1-CG 4.05Å; W49-P75 HydrophobicContact CB-CG 4.46Å; W49-P75 HydrophobicContact CD2-CB 4.05Å; W49-P75 HydrophobicContact CD2-CG 3.92Å; W49-P75 HydrophobicContact CE3-CB 4.41Å; W49-P75 HydrophobicContact CG-CB 4.44Å; W49-P75 HydrophobicContact CG-CG 3.78Å; W49-P75 HydrophobicContact CZ2-CB 4.18Å; T73-P75 WeakPolarHBondContact O-CD 3.42Å
76	T	95	Very high	75.7	Confident	73 Å²	73	77 Å²	77	45%	0.448	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-60.9	-175.7	-53.4	0	0	0	0	112.3	H39 F41 C74	H39-T76 VanDerWaalsContact CD2-CB 3.47Å; H39-T76 WeakPolarHBondContact CD2-CB 3.33Å; H39-T76 WeakPolarHBondContact CD2-CG2 3.18Å; H39-T76 WeakPolarHBondContact NE2-CG2 3.48Å; F41-T76 VanDerWaalsContact CE1-OG1 3.29Å; F41-T76 WeakPolarHBondContact CE1-OG1 3.4Å; F41-T76 WeakPolarHBondContact CZ-OG1 3.31Å; C74-T76 PolarHBondContact O-N 3.22Å; C74-T76 PolarHBondContact SG-N 3.34Å; C74-T76 VanDerWaalsContact SG-N 3.39Å
77	C	95.9	Very high	75.6	Confident	49 Å²	49	78.2 Å²	78.2	33%	0.331	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-4	-173.5	63.7	0	0	0	0	114.9	C37 H39 C74 T79	C37-C77 PolarHBondContact SG-SG 3.02Å; H39-C77 WeakPolarHBondContact CE1-CB 3.24Å; H39-C77 PolarHBondContact CE1-SG 3.48Å; H39-C77 PolarHBondContact ND1-SG 3.18Å; C74-C77 VanDerWaalsContact CB-SG 3.54Å; C77-T79 PolarHBondContact O-N 3.31Å; C77-T79 VanDerWaalsContact SG-CB 3.54Å; C77-T79 PolarHBondContact SG-OG1 3.03Å
78	R	93.1	Very high	75.7	Confident	204 Å²	204	76.1 Å²	76.1	77%	0.77	37%	0.368	S	S	*	.			trans	61.6	7.2	-176.6	-50.2	178.2	-178.4	177.5	0	115.2	T73 C74 R80	T73-R78 WeakPolarHBondContact CG2-O 3.46Å; C74-R78 WeakPolarHBondContact O-CA 3.49Å; C74-R78 PolarHBondContact O-N 3.27Å; R78-R80 PolarHBondContact O-N 3.36Å
79	T	92.5	Very high	75.6	Confident	69 Å²	69	72 Å²	72	42%	0.423	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-54.6	136.9	169.6	-58.2	0	0	0	0	109.5	C37 T73 C74 C77 L81	C37-T79 HydrophobicContact CB-CG2 3.97Å; T73-T79 WeakPolarHBondContact CA-O 3.44Å; C74-T79 PolarHBondContact N-O 3.39Å; C77-T79 PolarHBondContact O-N 3.31Å; C77-T79 VanDerWaalsContact SG-CB 3.54Å; C77-T79 PolarHBondContact SG-OG1 3.03Å; T79-L81 PolarHBondContact O-N 3.45Å
80	R	89.8	Confident	75.8	Confident	154 Å²	154	68.2 Å²	68.2	58%	0.581	35%	0.347	S	S	*	.	B	Isolated β-bridge	trans	-63.7	134.1	174.9	-66.6	177.2	-176.7	-135.2	-2.2	109.1	E36 Q71 F72 R78	E36-R80 VanDerWaalsContact OE1-O 3.11Å; Q71-R80 VanDerWaalsContact CD-NH2 3.32Å; Q71-R80 VanDerWaalsContact NE2-NH2 3.2Å; Q71-R80 VanDerWaalsContact OE1-NH1 3.13Å; F72-R80 WeakPolarHBondContact O-CA 3.35Å; R78-R80 PolarHBondContact O-N 3.36Å
81	L	88.4	Confident	75.6	Confident	9 Å²	9	68.4 Å²	68.4	5%	0.047	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-99.9	119.5	177.9	-57	177.2	0	0	0	108.5	T35 E36 L50 F72 C74 T79 V83 V116	T35-L81 HydrophobicContact CG2-CD1 3.91Å; T35-L81 HydrophobicContact CG2-CD2 4.1Å; E36-L81 HydrophobicContact CG-CD2 4.12Å; E36-L81 WeakPolarHBondContact OE1-CA 3Å; L50-L81 HydrophobicContact CD2-CD1 4.44Å; F72-L81 HydrophobicContact CB-CB 4.39Å; F72-L81 PolarHBondContact O-N 3.34Å; C74-L81 HydrophobicContact CB-CD2 4.14Å; C74-L81 HydrophobicContact CB-CG 4.46Å; T79-L81 PolarHBondContact O-N 3.45Å; L81-V83 PolarHBondContact O-N 2.96Å; L81-V116 HydrophobicContact CB-CG1 3.58Å; L81-V116 HydrophobicContact CD1-CG1 3.57Å; L81-V116 HydrophobicContact CG-CG1 4.18Å
82	S	79	Confident	75	Confident	78 Å²	78	65.4 Å²	65.4	55%	0.545	33%	0.334	S	S	.	.			trans	-67.5	108.7	178.3	-54.4	0	0	0	0	109.2	E36	E36-S82 WeakPolarHBondContact OE1-CB 3.47Å; E36-S82 PolarHBondContact OE1-N 3.05Å; E36-S82 PolarHBondContact OE1-OG 3.03Å; E36-S82 WeakPolarHBondContact OE2-CB 3.23Å; E36-S82 PolarHBondContact OE2-OG 3.37Å
83	V	73	Confident	73.6	Confident	11 Å²	11	68.2 Å²	68.2	7%	0.067	35%	0.35	C	S	.	.			trans	-96	126.2	172	-173.2	0	0	0	0	107.2	F72 L81 N85 Q87 Q88 I111 V116	F72-V83 HydrophobicContact CB-CG2 4.26Å; F72-V83 HydrophobicContact CD2-CB 4.41Å; F72-V83 HydrophobicContact CD2-CG2 3.33Å; F72-V83 HydrophobicContact CE2-CG2 3.95Å; F72-V83 HydrophobicContact CG-CG2 4.08Å; L81-V83 PolarHBondContact O-N 2.96Å; V83-N85 PolarHBondContact O-N 3.22Å; V83-N85 VanDerWaalsContact O-N 3.08Å; V83-Q87 HydrophobicContact CG1-CB 4.5Å; V83-Q88 HydrophobicContact CG1-CB 4.42Å; V83-I111 HydrophobicContact CG1-CD1 4.32Å; V83-I111 HydrophobicContact CG2-CD1 4.25Å; V83-V116 HydrophobicContact CG1-CG2 4.36Å; V83-V116 HydrophobicContact CG2-CG2 3.75Å
84	N	62.8	Low	71.9	Confident	102 Å²	102	70.4 Å²	70.4	55%	0.545	37%	0.366	S	S	.	.			trans	-49.6	121.8	177.7	-72.7	-12.1	0	0	0	110.2	H86 Q87 Q88	N84-H86 PolarHBondContact O-N 2.85Å; N84-Q87 PolarHBondContact O-N 2.58Å; N84-Q88 PolarHBondContact O-N 2.91Å
85	N	53.4	Low	70.1	Confident	120 Å²	120	71.3 Å²	71.3	64%	0.642	37%	0.372	S	S	*	.	H	α-helix	trans	-50.9	-34.2	-170.5	-75.2	-9.8	0	0	0	113.6	V83 Q87 Q88 T89	V83-N85 PolarHBondContact O-N 3.22Å; V83-N85 VanDerWaalsContact O-N 3.08Å; N85-Q87 PolarHBondContact O-N 2.85Å; N85-Q88 PolarHBondContact O-N 3.36Å; N85-T89 WeakPolarHBondContact O-CG2 3.35Å; N85-T89 PolarHBondContact O-N 3.38Å; N85-T89 PolarHBondContact O-OG1 3.38Å; N85-T89 VanDerWaalsContact O-OG1 3.04Å
86	H	57.3	Low	68.2	Low	156 Å²	156	72.8 Å²	72.8	72%	0.722	38%	0.38	S	S	*	.	H	α-helix	trans	-60.8	-29.5	176.5	-65.2	-62	0	0	0	114.1	N84 T89 N90	N84-H86 PolarHBondContact O-N 2.85Å; H86-T89 PolarHBondContact O-OG1 2.89Å; H86-N90 PolarHBondContact O-N 3.42Å; H86-N90 PolarHBondContact O-ND2 3.46Å; H86-N90 PolarHBondContact O-OD1 2.87Å
87	Q	53.3	Low	66	Low	54 Å²	54	71.8 Å²	71.8	25%	0.252	38%	0.376	S	S	.	.	H	α-helix	trans	-91.3	-33.6	179.3	-64.2	-172.8	6.1	0	0	111.9	V83 N84 N85 T89 N90 V91 S115	V83-Q87 HydrophobicContact CG1-CB 4.5Å; N84-Q87 PolarHBondContact O-N 2.58Å; N85-Q87 PolarHBondContact O-N 2.85Å; Q87-T89 VanDerWaalsContact C-N 3.28Å; Q87-T89 PolarHBondContact O-N 3.47Å; Q87-N90 PolarHBondContact O-N 3.23Å; Q87-V91 WeakPolarHBondContact O-CB 3.47Å; Q87-V91 VanDerWaalsContact O-CG2 3.23Å; Q87-V91 WeakPolarHBondContact O-CG2 3.09Å; Q87-V91 PolarHBondContact O-N 3.16Å; Q87-S115 PolarHBondContact OE1-OG 3.06Å
88	Q	56	Low	63.9	Low	44 Å²	44	75.5 Å²	75.5	21%	0.206	40%	0.397	C	S	.	.	H	α-helix	trans	-63.5	-39	173.3	-159.1	175	31.4	0	0	110.6	L70 V83 N84 N85 I92	L70-Q88 PolarHBondContact O-NE2 2.89Å; V83-Q88 HydrophobicContact CG1-CB 4.42Å; N84-Q88 PolarHBondContact O-N 2.91Å; N85-Q88 PolarHBondContact O-N 3.36Å; Q88-I92 HydrophobicContact CG-CD1 3.82Å; Q88-I92 HydrophobicContact CG-CG1 4.48Å; Q88-I92 VanDerWaalsContact O-CB 3.28Å; Q88-I92 WeakPolarHBondContact O-CB 3.48Å; Q88-I92 WeakPolarHBondContact O-CD1 3.46Å; Q88-I92 WeakPolarHBondContact O-CG1 3.33Å; Q88-I92 PolarHBondContact O-N 2.79Å
89	T	51.4	Low	61.8	Low	54 Å²	54	72.1 Å²	72.1	33%	0.331	40%	0.4	S	S	.	.	H	α-helix	trans	-64.3	-40	172.6	50.2	0	0	0	0	112.5	N85 H86 Q87 N93	N85-T89 WeakPolarHBondContact O-CG2 3.35Å; N85-T89 PolarHBondContact O-N 3.38Å; N85-T89 PolarHBondContact O-OG1 3.38Å; N85-T89 VanDerWaalsContact O-OG1 3.04Å; H86-T89 PolarHBondContact O-OG1 2.89Å; Q87-T89 VanDerWaalsContact C-N 3.28Å; Q87-T89 PolarHBondContact O-N 3.47Å; T89-N93 WeakPolarHBondContact O-CA 3.4Å; T89-N93 WeakPolarHBondContact O-CB 3.36Å; T89-N93 PolarHBondContact O-N 3.28Å; T89-N93 PolarHBondContact O-ND2 3.23Å; T89-N93 PolarHBondContact O-OD1 3.24Å
90	N	56.5	Low	59.8	Low	107 Å²	107	74.9 Å²	74.9	57%	0.572	41%	0.412	S	S	*	.	H	α-helix	trans	-71	-38.7	179.6	-70.4	-6.6	0	0	0	112.4	H86 Q87 S94	H86-N90 PolarHBondContact O-N 3.42Å; H86-N90 PolarHBondContact O-ND2 3.46Å; H86-N90 PolarHBondContact O-OD1 2.87Å; Q87-N90 PolarHBondContact O-N 3.23Å; N90-S94 VanDerWaalsContact O-CB 3.31Å; N90-S94 WeakPolarHBondContact O-CB 3.43Å; N90-S94 PolarHBondContact O-N 2.87Å; N90-S94 PolarHBondContact O-OG 3.39Å
91	V	58.1	Low	57.7	Low	16 Å²	16	74.4 Å²	74.4	10%	0.097	42%	0.421	C	S	.	.	H	α-helix	trans	-67.6	-44.5	175.3	177.6	0	0	0	0	110.2	L54 Q87 S94 V95 P109	L54-V91 HydrophobicContact CD1-CG1 3.66Å; L54-V91 HydrophobicContact CD2-CG1 3.71Å; L54-V91 HydrophobicContact CG-CG1 4.35Å; Q87-V91 WeakPolarHBondContact O-CB 3.47Å; Q87-V91 VanDerWaalsContact O-CG2 3.23Å; Q87-V91 WeakPolarHBondContact O-CG2 3.09Å; Q87-V91 PolarHBondContact O-N 3.16Å; V91-S94 PolarHBondContact O-N 3.33Å; V91-S94 PolarHBondContact O-OG 3.21Å; V91-V95 WeakPolarHBondContact O-CG2 3.19Å; V91-V95 PolarHBondContact O-N 2.9Å; V91-P109 HydrophobicContact CG1-CB 4.15Å
92	I	56.8	Low	56	Low	8 Å²	8	81.4 Å²	81.4	4%	0.041	46%	0.458	C	S	.	.	H	α-helix	trans	-65	-44.9	175.4	-66.8	165.4	0	0	0	110.7	I62 R67 L70 Q88 S94 V95 V96	I62-I92 HydrophobicContact CD1-CG2 4.28Å; R67-I92 HydrophobicContact CG-CD1 4.27Å; R67-I92 HydrophobicContact CG-CG2 4.41Å; L70-I92 HydrophobicContact CD2-CD1 4.01Å; L70-I92 HydrophobicContact CD2-CG1 3.57Å; Q88-I92 HydrophobicContact CG-CD1 3.82Å; Q88-I92 HydrophobicContact CG-CG1 4.48Å; Q88-I92 VanDerWaalsContact O-CB 3.28Å; Q88-I92 WeakPolarHBondContact O-CB 3.48Å; Q88-I92 WeakPolarHBondContact O-CD1 3.46Å; Q88-I92 WeakPolarHBondContact O-CG1 3.33Å; Q88-I92 PolarHBondContact O-N 2.79Å; I92-S94 VanDerWaalsContact C-N 3.28Å; I92-S94 PolarHBondContact O-N 3.39Å; I92-V95 CarbonylContact O-C 3.58Å; I92-V95 PolarHBondContact O-N 2.94Å; I92-V96 HydrophobicContact CG2-CG2 3.68Å; I92-V96 WeakPolarHBondContact O-CB 3.45Å; I92-V96 WeakPolarHBondContact O-CG2 3.41Å; I92-V96 PolarHBondContact O-N 3.33Å
93	N	54.7	Low	54.6	Low	67 Å²	67	86 Å²	86	36%	0.358	47%	0.465	S	S	.	.	H	α-helix	trans	-65.5	-32.6	179.4	-67.1	-9.2	0	0	0	111.5	R67 T89 V95 V96 S97	R67-N93 PolarHBondContact NH2-OD1 3.04Å; T89-N93 WeakPolarHBondContact O-CA 3.4Å; T89-N93 WeakPolarHBondContact O-CB 3.36Å; T89-N93 PolarHBondContact O-N 3.28Å; T89-N93 PolarHBondContact O-ND2 3.23Å; T89-N93 PolarHBondContact O-OD1 3.24Å; N93-V95 PolarHBondContact O-N 2.9Å; N93-V96 PolarHBondContact O-N 3.02Å; N93-S97 VanDerWaalsContact O-CB 3.23Å; N93-S97 WeakPolarHBondContact O-CB 3.28Å; N93-S97 PolarHBondContact O-N 2.96Å; N93-S97 PolarHBondContact O-OG 3.02Å
94	S	55.3	Low	53.5	Low	77 Å²	77	90 Å²	90	54%	0.538	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-28.6	172	72.3	0	0	0	0	113.1	N90 V91 I92	N90-S94 VanDerWaalsContact O-CB 3.31Å; N90-S94 WeakPolarHBondContact O-CB 3.43Å; N90-S94 PolarHBondContact O-N 2.87Å; N90-S94 PolarHBondContact O-OG 3.39Å; V91-S94 PolarHBondContact O-N 3.33Å; V91-S94 PolarHBondContact O-OG 3.21Å; I92-S94 VanDerWaalsContact C-N 3.28Å; I92-S94 PolarHBondContact O-N 3.39Å
95	V	56.3	Low	53	Low	19 Å²	19	91 Å²	91	12%	0.115	51%	0.506	C	S	.	.	H	α-helix	trans	-87.3	-35.2	177.1	178.2	0	0	0	0	112	L57 N58 I62 V91 I92 N93 T98 P109	L57-V95 HydrophobicContact CB-CG1 4.33Å; N58-V95 VanDerWaalsContact OD1-CG1 3.27Å; N58-V95 WeakPolarHBondContact OD1-CG1 3.47Å; I62-V95 HydrophobicContact CD1-CG1 4.49Å; V91-V95 WeakPolarHBondContact O-CG2 3.19Å; V91-V95 PolarHBondContact O-N 2.9Å; I92-V95 CarbonylContact O-C 3.58Å; I92-V95 PolarHBondContact O-N 2.94Å; N93-V95 PolarHBondContact O-N 2.9Å; V95-T98 PolarHBondContact O-OG1 2.83Å; V95-P109 HydrophobicContact CG2-CB 3.56Å; V95-P109 HydrophobicContact CG2-CG 3.64Å
96	V	53.9	Low	53	Low	57 Å²	57	92.2 Å²	92.2	35%	0.345	51%	0.507	S	S	.	.	H	α-helix	trans	-89.6	-18.2	-172.9	177.4	0	0	0	0	113.6	I62 I92 N93 T98	I62-V96 HydrophobicContact CB-CG2 3.87Å; I62-V96 HydrophobicContact CD1-CG2 3.16Å; I62-V96 HydrophobicContact CG1-CG2 3.91Å; I62-V96 HydrophobicContact CG2-CG2 4.41Å; I92-V96 HydrophobicContact CG2-CG2 3.68Å; I92-V96 WeakPolarHBondContact O-CB 3.45Å; I92-V96 WeakPolarHBondContact O-CG2 3.41Å; I92-V96 PolarHBondContact O-N 3.33Å; N93-V96 PolarHBondContact O-N 3.02Å; V96-T98 PolarHBondContact O-N 3.12Å
97	S	48.8	Very low	53	Low	52 Å²	52	91.4 Å²	91.4	36%	0.364	51%	0.508	S	S	.	.			trans	-73.3	26.9	-176.9	-58.9	0	0	0	0	114.6	N93 T99 N100	N93-S97 VanDerWaalsContact O-CB 3.23Å; N93-S97 WeakPolarHBondContact O-CB 3.28Å; N93-S97 PolarHBondContact O-N 2.96Å; N93-S97 PolarHBondContact O-OG 3.02Å; S97-T99 PolarHBondContact O-N 2.73Å; S97-N100 PolarHBondContact O-N 2.98Å
98	T	50.7	Low	53.2	Low	127 Å²	127	96 Å²	96	78%	0.779	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	8.2	177.3	-19.9	0	0	0	0	114.1	V95 V96	V95-T98 PolarHBondContact O-OG1 2.83Å; V96-T98 PolarHBondContact O-N 3.12Å
99	T	50.9	Low	53.4	Low	134 Å²	134	94.8 Å²	94.8	82%	0.822	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	6.7	178.6	65	0	0	0	0	114.7	S97	S97-T99 PolarHBondContact O-N 2.73Å
100	N	48.6	Very low	54.2	Low	127 Å²	127	96.3 Å²	96.3	68%	0.679	53%	0.529	S	S	*	.	S	Bend	trans	-139.4	123.9	171	-137.7	-6	0	0	0	112	S97	S97-N100 PolarHBondContact O-N 2.98Å
101	N	47	Very low	55.1	Low	143 Å²	143	91.5 Å²	91.5	77%	0.765	50%	0.503	S	S	*	.	S	Bend	trans	-57.3	142.3	-167.3	-65.9	-39.2	0	0	0	114.2
102	N	52.9	Low	56.2	Low	156 Å²	156	94.4 Å²	94.4	83%	0.834	52%	0.519	S	S	*	.			trans	113.1	37.2	165.6	-59.3	-14.2	0	0	0	118.7
103	Y	48.3	Very low	57.6	Low	175 Å²	175	95.2 Å²	95.2	69%	0.686	52%	0.523	S	S	*	.			trans	-118.2	121.9	163.2	-47.9	-72.9	0	0	0	109.6	C105	Y103-C105 PolarHBondContact O-N 3.45Å
104	C	49.6	Very low	59.1	Low	95 Å²	95	97.6 Å²	97.6	64%	0.642	54%	0.535	S	S	*	.			trans	-59.5	136.5	169.9	-79.2	0	0	0	0	108.7	H106 D107	C104-H106 PolarHBondContact O-N 3.38Å; C104-D107 PolarHBondContact O-N 3.11Å
105	C	53.8	Low	60.4	Low	122 Å²	122	94.6 Å²	94.6	82%	0.824	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	19	176.8	58.5	0	0	0	0	114.9	Y103	Y103-C105 PolarHBondContact O-N 3.45Å
106	H	52.9	Low	61.9	Low	147 Å²	147	94.1 Å²	94.1	68%	0.681	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-18.9	-175.3	-64	-49.7	0	0	0	113.2	C104 K108	C104-H106 PolarHBondContact O-N 3.38Å; H106-K108 PolarHBondContact O-N 3.05Å
107	D	56.2	Low	63.7	Low	138 Å²	138	91.6 Å²	91.6	74%	0.738	50%	0.496	S	S	*	.			trans	-84	84.7	-179.6	-68.7	-29.5	0	0	0	110.6	C104	C104-D107 PolarHBondContact O-N 3.11Å
108	K	59.6	Low	65.9	Low	152 Å²	152	98.4 Å²	98.4	66%	0.661	51%	0.514	S	S	*	.			trans	-58.6	134	172.1	-73.9	-169.2	173.3	-160	0	109.6	E55 H106 N110	E55-K108 IonicContact OE1-NZ 3.37Å; E55-K108 PolarHBondContact OE1-NZ 3.08Å; H106-K108 PolarHBondContact O-N 3.05Å; K108-N110 PolarHBondContact O-N 3.12Å; K108-N110 VanDerWaalsContact O-N 3.16Å
109	P	59.7	Low	68.1	Low	17 Å²	17	95.3 Å²	95.3	11%	0.11	50%	0.496	C	S	.	.			trans	-57.4	125.8	174.5	27.9	-36.9	0	0	0	109	L54 V91 V95	L54-P109 HydrophobicContact CB-CG 4.09Å; L54-P109 HydrophobicContact CD1-CB 4.23Å; L54-P109 HydrophobicContact CD1-CG 4.5Å; V91-P109 HydrophobicContact CG1-CB 4.15Å; V95-P109 HydrophobicContact CG2-CB 3.56Å; V95-P109 HydrophobicContact CG2-CG 3.64Å
110	N	68	Low	70.2	Confident	87 Å²	87	90.6 Å²	90.6	47%	0.465	47%	0.467	S	S	.	.			trans	-125.6	115.1	-174	-176.9	11.7	0	0	0	109.3	K47 N51 K108	K47-N110 WeakPolarHBondContact CE-OD1 3.35Å; N51-N110 PolarHBondContact ND2-OD1 2.87Å; K108-N110 PolarHBondContact O-N 3.12Å; K108-N110 VanDerWaalsContact O-N 3.16Å
111	I	74.2	Confident	72.4	Confident	5 Å²	5	90.9 Å²	90.9	3%	0.026	47%	0.468	C	S	.	.			trans	-69.5	134.5	176.3	-164.5	159.4	0	0	0	110.4	L50 N51 F72 V83 L113 V116	L50-I111 HydrophobicContact CB-CG2 3.75Å; L50-I111 HydrophobicContact CD1-CD1 4.37Å; L50-I111 HydrophobicContact CD1-CG2 3.96Å; N51-I111 WeakPolarHBondContact OD1-CG2 3.41Å; N51-I111 PolarHBondContact OD1-N 3.14Å; F72-I111 HydrophobicContact CD1-CD1 4.17Å; F72-I111 HydrophobicContact CD2-CD1 4.02Å; F72-I111 HydrophobicContact CE1-CD1 3.81Å; F72-I111 HydrophobicContact CE2-CD1 3.63Å; F72-I111 HydrophobicContact CG-CD1 4.24Å; F72-I111 HydrophobicContact CZ-CD1 3.51Å; V83-I111 HydrophobicContact CG1-CD1 4.32Å; V83-I111 HydrophobicContact CG2-CD1 4.25Å; I111-L113 PolarHBondContact O-N 2.92Å; I111-L113 VanDerWaalsContact O-N 3.09Å; I111-V116 HydrophobicContact CD1-CG2 3.6Å; I111-V116 HydrophobicContact CG1-CG2 4.1Å
112	N	82	Confident	74.7	Confident	78 Å²	78	88.6 Å²	88.6	42%	0.417	47%	0.468	S	S	.	.			trans	-70.5	106.2	167.1	178.2	-5.2	0	0	0	108.2	L114 S115	N112-L114 PolarHBondContact O-N 3.1Å; N112-L114 WeakPolarHBondContact OD1-CB 3.48Å; N112-L114 PolarHBondContact OD1-N 3.24Å; N112-L114 VanDerWaalsContact OD1-N 3.09Å; N112-S115 PolarHBondContact O-N 2.71Å; N112-S115 PolarHBondContact O-OG 3.03Å
113	L	85.7	Confident	76.7	Confident	25 Å²	25	83.3 Å²	83.3	13%	0.131	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-53.6	-32.3	-177.1	-173.8	65.1	0	0	0	113.4	V33 A43 L46 K47 L50 I111 S115 V116 A117	V33-L113 HydrophobicContact CG1-CD2 4.21Å; V33-L113 HydrophobicContact CG2-CD2 4.4Å; A43-L113 HydrophobicContact CB-CD2 3.66Å; A43-L113 VanDerWaalsContact O-CD2 3.3Å; A43-L113 WeakPolarHBondContact O-CD2 3.31Å; L46-L113 HydrophobicContact CB-CD1 4.06Å; L46-L113 HydrophobicContact CD2-CD1 3.84Å; L46-L113 HydrophobicContact CG-CD1 3.81Å; K47-L113 HydrophobicContact CB-CD1 4.4Å; L50-L113 HydrophobicContact CD1-CD1 4.11Å; I111-L113 PolarHBondContact O-N 2.92Å; I111-L113 VanDerWaalsContact O-N 3.09Å; L113-S115 PolarHBondContact O-N 3.23Å; L113-V116 PolarHBondContact O-N 3.26Å; L113-V116 VanDerWaalsContact O-N 3.08Å; L113-A117 PolarHBondContact O-N 3Å
114	L	85.8	Confident	78.9	Confident	116 Å²	116	80.9 Å²	80.9	61%	0.607	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-69.4	-12.9	-178.1	-64.4	172.9	0	0	0	113.8	N112 V116 A117 P119	N112-L114 PolarHBondContact O-N 3.1Å; N112-L114 WeakPolarHBondContact OD1-CB 3.48Å; N112-L114 PolarHBondContact OD1-N 3.24Å; N112-L114 VanDerWaalsContact OD1-N 3.09Å; L114-V116 VanDerWaalsContact C-N 3.33Å; L114-A117 WeakPolarHBondContact CA-O 3.5Å; L114-P119 HydrophobicContact CD2-CG 3.86Å
115	S	83.6	Confident	81	Confident	14 Å²	14	82.4 Å²	82.4	10%	0.098	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-84.5	-9.6	171.7	61.8	0	0	0	0	114.2	Q87 N112 L113	Q87-S115 PolarHBondContact OE1-OG 3.06Å; N112-S115 PolarHBondContact O-N 2.71Å; N112-S115 PolarHBondContact O-OG 3.03Å; L113-S115 PolarHBondContact O-N 3.23Å
116	V	87.2	Confident	83	Confident	10 Å²	10	81.6 Å²	81.6	6%	0.061	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-25.1	-175	-165.3	0	0	0	0	111.6	L50 L81 V83 I111 L113 L114	L50-V116 HydrophobicContact CD1-CB 4.09Å; L50-V116 HydrophobicContact CD1-CG1 4.01Å; L50-V116 HydrophobicContact CD1-CG2 4.13Å; L50-V116 HydrophobicContact CD2-CG1 4.33Å; L81-V116 HydrophobicContact CB-CG1 3.58Å; L81-V116 HydrophobicContact CD1-CG1 3.57Å; L81-V116 HydrophobicContact CG-CG1 4.18Å; V83-V116 HydrophobicContact CG1-CG2 4.36Å; V83-V116 HydrophobicContact CG2-CG2 3.75Å; I111-V116 HydrophobicContact CD1-CG2 3.6Å; I111-V116 HydrophobicContact CG1-CG2 4.1Å; L113-V116 PolarHBondContact O-N 3.26Å; L113-V116 VanDerWaalsContact O-N 3.08Å; L114-V116 VanDerWaalsContact C-N 3.33Å
117	A	92.9	Very high	85.1	Confident	4 Å²	4	75 Å²	75	3%	0.033	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	155.9	-178.2	0	0	0	0	0	112.2	V33 V34 T35 L46 L113 L114	V33-A117 HydrophobicContact CB-CB 3.84Å; V33-A117 HydrophobicContact CG2-CB 3.99Å; V34-A117 CarbonylContact O-C 3.52Å; V34-A117 WeakPolarHBondContact O-CA 3.38Å; V34-A117 WeakPolarHBondContact O-CB 3.38Å; T35-A117 HydrophobicContact CG2-CB 4.47Å; L46-A117 HydrophobicContact CD2-CB 3.59Å; L113-A117 PolarHBondContact O-N 3Å; L114-A117 WeakPolarHBondContact CA-O 3.5Å
118	R	94.7	Very high	86.9	Confident	195 Å²	195	69.4 Å²	69.4	74%	0.736	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	138.2	178.4	-57.3	-176.2	79.8	91.5	-2.7	110.3	V33 V34	V33-R118 CarbonylContact C-O 3.54Å; V33-R118 VanDerWaalsContact CA-O 3.3Å; V33-R118 WeakPolarHBondContact CA-O 3.48Å; V34-R118 HydrophobicContact CG1-CB 4.3Å; V34-R118 PolarHBondContact N-O 3.39Å; V34-R118 PolarHBondContact O-N 3.07Å
119	P	95.5	Very high	88.7	Confident	62 Å²	62	65.4 Å²	65.4	40%	0.403	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	136.4	173.6	-23.5	34.2	0	0	0	112.5	L114 L121	L114-P119 HydrophobicContact CD2-CG 3.86Å; P119-L121 HydrophobicContact CB-CD2 4.03Å; P119-L121 HydrophobicContact CB-CG 4.47Å; P119-L121 PolarHBondContact O-N 3.16Å
120	V	96.3	Very high	90.4	Very high	35 Å²	35	66.2 Å²	66.2	21%	0.212	35%	0.352	C	S	.	.			trans	-93.5	79.4	175.9	-170.3	0	0	0	0	109.4	P32 V34 T40 A122 L123	P32-V120 HydrophobicContact CB-CB 4.1Å; P32-V120 HydrophobicContact CB-CG2 4.35Å; P32-V120 HydrophobicContact CG-CB 4.07Å; P32-V120 PolarHBondContact O-N 3.28Å; V34-V120 HydrophobicContact CB-CG2 3.69Å; V34-V120 HydrophobicContact CG1-CG2 3.82Å; T40-V120 HydrophobicContact CG2-CG2 4.22Å; V120-A122 VanDerWaalsContact C-N 3.27Å; V120-A122 PolarHBondContact O-N 3Å; V120-L123 HydrophobicContact CB-CD1 4.42Å; V120-L123 HydrophobicContact CG1-CB 4.35Å; V120-L123 HydrophobicContact CG1-CD1 3.8Å; V120-L123 HydrophobicContact CG1-CG 3.8Å; V120-L123 PolarHBondContact O-N 2.78Å
121	L	94.6	Very high	91.9	Very high	133 Å²	133	65.8 Å²	65.8	70%	0.696	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-64.4	-30.1	-173.6	-59.7	-179.5	0	0	0	113.5	P119 L123 K124	P119-L121 HydrophobicContact CB-CD2 4.03Å; P119-L121 HydrophobicContact CB-CG 4.47Å; P119-L121 PolarHBondContact O-N 3.16Å; L121-L123 PolarHBondContact O-N 3.21Å; L121-K124 VanDerWaalsContact O-CB 3.28Å; L121-K124 WeakPolarHBondContact O-CB 3.47Å; L121-K124 PolarHBondContact O-N 2.72Å
122	A	95.5	Very high	93	Very high	94 Å²	94	65.6 Å²	65.6	78%	0.777	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-60.1	-27.9	-180	0	0	0	0	0	113.3	V120	V120-A122 VanDerWaalsContact C-N 3.27Å; V120-A122 PolarHBondContact O-N 3Å
123	L	95	Very high	93.7	Very high	45 Å²	45	66.1 Å²	66.1	24%	0.236	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-84.5	-13	178.9	-66.7	179.5	0	0	0	113.3	L20 P32 V120 L121 N125 F126 L127	L20-L123 HydrophobicContact CD2-CD2 4.22Å; P32-L123 HydrophobicContact CB-CD1 4.42Å; P32-L123 HydrophobicContact CG-CB 4.08Å; P32-L123 HydrophobicContact CG-CD1 4.28Å; V120-L123 HydrophobicContact CB-CD1 4.42Å; V120-L123 HydrophobicContact CG1-CB 4.35Å; V120-L123 HydrophobicContact CG1-CD1 3.8Å; V120-L123 HydrophobicContact CG1-CG 3.8Å; V120-L123 PolarHBondContact O-N 2.78Å; L121-L123 PolarHBondContact O-N 3.21Å; L123-N125 PolarHBondContact O-N 3.17Å; L123-F126 PolarHBondContact O-N 2.79Å; L123-L127 HydrophobicContact CB-CD1 3.87Å; L123-L127 HydrophobicContact CB-CG 4.25Å; L123-L127 WeakPolarHBondContact O-CB 3.45Å; L123-L127 VanDerWaalsContact O-CG 3.23Å; L123-L127 WeakPolarHBondContact O-CG 3.44Å; L123-L127 PolarHBondContact O-N 2.9Å
124	K	93.7	Very high	94.2	Very high	124 Å²	124	65.1 Å²	65.1	54%	0.539	34%	0.337	S	S	.	.	H	α-helix	trans	-57.3	-55.9	-170.1	-176.6	-175.7	176.1	-171.9	0	112.4	L121 F126 N128	L121-K124 VanDerWaalsContact O-CB 3.28Å; L121-K124 WeakPolarHBondContact O-CB 3.47Å; L121-K124 PolarHBondContact O-N 2.72Å; K124-F126 VanDerWaalsContact C-N 3.31Å; K124-F126 PolarHBondContact O-N 3.09Å; K124-N128 VanDerWaalsContact O-CB 3.27Å; K124-N128 WeakPolarHBondContact O-CB 3.41Å; K124-N128 VanDerWaalsContact O-CG 3.29Å; K124-N128 PolarHBondContact O-N 3.31Å
125	N	94.2	Very high	94.6	Very high	127 Å²	127	61.9 Å²	61.9	68%	0.679	32%	0.319	S	S	*	.	H	α-helix	trans	-69	-34.6	-175.5	-66.5	-9.3	0	0	0	111.8	L123 N128 S129	L123-N125 PolarHBondContact O-N 3.17Å; N125-N128 PolarHBondContact O-N 3.25Å; N125-S129 WeakPolarHBondContact O-CB 3.2Å; N125-S129 PolarHBondContact O-N 2.97Å; N125-S129 VanDerWaalsContact O-N 3.09Å; N125-S129 PolarHBondContact O-OG 3.21Å
126	F	95.3	Very high	95.2	Very high	105 Å²	105	62.9 Å²	62.9	46%	0.461	32%	0.321	S	S	.	.	H	α-helix	trans	-67.1	-48.5	177.6	179.6	-109.5	0	0	0	111.8	L20 L123 K124 N128 S129 L130	L20-F126 HydrophobicContact CD1-CD1 4.39Å; L20-F126 HydrophobicContact CD1-CE1 3.58Å; L20-F126 HydrophobicContact CD1-CZ 4.44Å; L20-F126 HydrophobicContact CD2-CD1 4.41Å; L20-F126 HydrophobicContact CD2-CE1 4.17Å; L123-F126 PolarHBondContact O-N 2.79Å; K124-F126 VanDerWaalsContact C-N 3.31Å; K124-F126 PolarHBondContact O-N 3.09Å; F126-N128 VanDerWaalsContact C-N 3.29Å; F126-N128 PolarHBondContact O-N 3.35Å; F126-S129 PolarHBondContact O-N 3.48Å; F126-S129 PolarHBondContact O-OG 3.39Å; F126-L130 HydrophobicContact CZ-CD2 4.44Å
127	L	96.5	Very high	95.6	Very high	8 Å²	8	64.3 Å²	64.3	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-40.1	175.6	-68.5	169.9	0	0	0	111.4	L20 V28 F29 P32 L123 S129 L130 V147	L20-L127 HydrophobicContact CB-CD2 4.36Å; L20-L127 HydrophobicContact CD2-CD2 4.26Å; V28-L127 HydrophobicContact CG1-CD2 3.7Å; F29-L127 HydrophobicContact CB-CD1 3.92Å; P32-L127 HydrophobicContact CG-CD1 3.85Å; L123-L127 HydrophobicContact CB-CD1 3.87Å; L123-L127 HydrophobicContact CB-CG 4.25Å; L123-L127 WeakPolarHBondContact O-CB 3.45Å; L123-L127 VanDerWaalsContact O-CG 3.23Å; L123-L127 WeakPolarHBondContact O-CG 3.44Å; L123-L127 PolarHBondContact O-N 2.9Å; L127-S129 VanDerWaalsContact C-N 3.29Å; L127-S129 PolarHBondContact O-N 2.86Å; L127-L130 HydrophobicContact CD2-CD1 4.24Å; L127-L130 PolarHBondContact O-N 3.44Å; L127-V147 WeakPolarHBondContact O-CB 3.33Å; L127-V147 WeakPolarHBondContact O-CG2 3.44Å
128	N	95.3	Very high	95.7	Very high	22 Å²	22	73.1 Å²	73.1	12%	0.118	37%	0.372	C	S	.	.	H	α-helix	trans	-66.6	-26.8	179.4	-83.1	6.8	0	0	0	113.8	K124 N125 F126 S146 V147 E148	K124-N128 VanDerWaalsContact O-CB 3.27Å; K124-N128 WeakPolarHBondContact O-CB 3.41Å; K124-N128 VanDerWaalsContact O-CG 3.29Å; K124-N128 PolarHBondContact O-N 3.31Å; N125-N128 PolarHBondContact O-N 3.25Å; F126-N128 VanDerWaalsContact C-N 3.29Å; F126-N128 PolarHBondContact O-N 3.35Å; N128-S146 VanDerWaalsContact O-CB 3.3Å; N128-S146 WeakPolarHBondContact O-CB 3.44Å; N128-V147 PolarHBondContact O-N 2.9Å; N128-E148 HydrophobicContact CB-CB 4.06Å; N128-E148 PolarHBondContact O-N 2.8Å; N128-E148 VanDerWaalsContact O-N 3.1Å
129	S	96.1	Very high	95.8	Very high	67 Å²	67	68 Å²	68	47%	0.469	35%	0.353	S	S	.	.	H	α-helix	trans	-85.6	-15.3	-178.4	72.3	0	0	0	0	114.2	N125 F126 L127 Q131	N125-S129 WeakPolarHBondContact O-CB 3.2Å; N125-S129 PolarHBondContact O-N 2.97Å; N125-S129 VanDerWaalsContact O-N 3.09Å; N125-S129 PolarHBondContact O-OG 3.21Å; F126-S129 PolarHBondContact O-N 3.48Å; F126-S129 PolarHBondContact O-OG 3.39Å; L127-S129 VanDerWaalsContact C-N 3.29Å; L127-S129 PolarHBondContact O-N 2.86Å; S129-Q131 PolarHBondContact O-NE2 2.82Å
130	L	97.1	Very high	95.8	Very high	35 Å²	35	66.6 Å²	66.6	18%	0.183	35%	0.349	C	S	.	.	S	Bend	trans	-57.1	138	178.3	-64.8	177.9	0	0	0	111.2	F12 V28 F126 L127 S146 V147	F12-L130 HydrophobicContact CD1-CB 3.95Å; F12-L130 HydrophobicContact CD1-CD1 4.1Å; F12-L130 HydrophobicContact CE1-CB 3.66Å; F12-L130 HydrophobicContact CE1-CD1 3.54Å; F12-L130 HydrophobicContact CE1-CG 4.23Å; F12-L130 HydrophobicContact CZ-CD1 4.45Å; V28-L130 HydrophobicContact CG1-CD1 4.28Å; F126-L130 HydrophobicContact CZ-CD2 4.44Å; L127-L130 HydrophobicContact CD2-CD1 4.24Å; L127-L130 PolarHBondContact O-N 3.44Å; L130-S146 CarbonylContact O-C 3.57Å; L130-S146 VanDerWaalsContact O-CA 3.26Å; L130-S146 WeakPolarHBondContact O-CA 3.49Å; L130-V147 HydrophobicContact CB-CG2 4.04Å; L130-V147 PolarHBondContact O-N 3.46Å
131	Q	97.8	Very high	95.9	Very high	78 Å²	78	65.3 Å²	65.3	36%	0.364	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128.6	-179.4	-62.5	-61.8	-57.1	0	0	110.8	V13 S129 I144 G145	V13-Q131 HydrophobicContact CB-CB 4.15Å; V13-Q131 HydrophobicContact CG2-CB 3.97Å; V13-Q131 PolarHBondContact N-O 3.35Å; S129-Q131 PolarHBondContact O-NE2 2.82Å; Q131-I144 HydrophobicContact CB-CG2 4.45Å; Q131-G145 CarbonylContact C-O 3.4Å; Q131-G145 WeakPolarHBondContact CA-O 3.35Å; Q131-G145 VanDerWaalsContact OE1-C 3.26Å
132	I	97.6	Very high	95.9	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	151	179.8	65.7	172.6	0	0	0	112.1	R11 F12 I144 G145 V147 I150 H151	R11-I132 VanDerWaalsContact NH2-CD1 3.34Å; R11-I132 CarbonylContact O-C 3.6Å; R11-I132 WeakPolarHBondContact O-CA 3.47Å; R11-I132 WeakPolarHBondContact O-CB 3.31Å; F12-I132 HydrophobicContact CD1-CG2 3.5Å; F12-I132 HydrophobicContact CD2-CG2 4.2Å; F12-I132 HydrophobicContact CE1-CG2 3.48Å; F12-I132 VanDerWaalsContact CE1-CG2 3.48Å; F12-I132 HydrophobicContact CE2-CG2 4.19Å; F12-I132 HydrophobicContact CG-CG2 3.87Å; F12-I132 HydrophobicContact CZ-CG2 3.84Å; I132-I144 WeakPolarHBondContact O-CA 3.41Å; I132-G145 PolarHBondContact N-O 3.38Å; I132-G145 PolarHBondContact O-N 3.18Å; I132-G145 VanDerWaalsContact O-N 3.16Å; I132-V147 HydrophobicContact CD1-CB 4.48Å; I132-V147 HydrophobicContact CD1-CG2 4.09Å; I132-V147 HydrophobicContact CG1-CG2 4.39Å; I132-V147 HydrophobicContact CG2-CG2 3.66Å; I132-I150 HydrophobicContact CD1-CB 3.94Å; I132-I150 HydrophobicContact CD1-CG2 3.92Å; I132-I150 HydrophobicContact CG1-CB 3.82Å; I132-I150 HydrophobicContact CG1-CG1 4.32Å; I132-I150 HydrophobicContact CG1-CG2 3.91Å; I132-H151 HydrophobicContact CD1-CB 3.88Å
133	Y	97.5	Very high	96	Very high	90 Å²	90	63.1 Å²	63.1	35%	0.353	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	149.7	164	-59.3	-78.7	0	0	0	110.7	R11 V13 I144	R11-Y133 PolarHBondContact NE-O 3.5Å; R11-Y133 PolarHBondContact NH2-O 3.19Å; R11-Y133 WeakPolarHBondContact O-CD2 3.48Å; R11-Y133 PolarHBondContact O-N 3.12Å; V13-Y133 HydrophobicContact CB-CE2 4.31Å; V13-Y133 HydrophobicContact CG2-CD2 4.18Å; V13-Y133 HydrophobicContact CG2-CE1 4.33Å; V13-Y133 HydrophobicContact CG2-CE2 3.84Å; Y133-I144 HydrophobicContact CD1-CD1 3.93Å; Y133-I144 HydrophobicContact CD1-CG1 3.59Å; Y133-I144 HydrophobicContact CE1-CD1 3.5Å; Y133-I144 VanDerWaalsContact CE1-CD1 3.5Å; Y133-I144 HydrophobicContact CE1-CG1 3.74Å
134	C	96.5	Very high	96.1	Very high	3 Å²	3	65 Å²	65	2%	0.02	33%	0.333	C	S	.	.			trans	-50.9	142.2	166.3	179.1	0	0	0	0	111.4	Y136 A137 C141 T143 H155	C134-Y136 PolarHBondContact O-N 3.33Å; C134-Y136 VanDerWaalsContact O-N 3.12Å; C134-Y136 PolarHBondContact SG-N 3.32Å; C134-A137 WeakPolarHBondContact O-CB 3.38Å; C134-A137 PolarHBondContact O-N 3.49Å; C134-C141 HydrophobicContact CB-CB 3.79Å; C134-C141 WeakPolarHBondContact CB-SG 3.4Å; C134-T143 PolarHBondContact N-O 3.03Å; C134-T143 VanDerWaalsContact N-O 3.08Å; C134-H155 WeakPolarHBondContact CB-NE2 3.39Å; C134-H155 PolarHBondContact SG-NE2 2.9Å
135	E	94.3	Very high	96.2	Very high	48 Å²	48	59.5 Å²	59.5	22%	0.224	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.7	174.3	63.6	174.7	153	0	0	113.1	R156	E135-R156 WeakPolarHBondContact OE1-CD 3.14Å; E135-R156 WeakPolarHBondContact OE1-CG 3.08Å; E135-R156 IonicContact OE1-NE 3.08Å; E135-R156 PolarHBondContact OE1-NE 3.23Å
136	Y	95.7	Very high	96.3	Very high	35 Å²	35	54.2 Å²	54.2	14%	0.137	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	22.4	177.7	-50.7	-60.5	0	0	0	113.2	C134 K138 R139 G140 C141 C159 V162 P163	C134-Y136 PolarHBondContact O-N 3.33Å; C134-Y136 VanDerWaalsContact O-N 3.12Å; C134-Y136 PolarHBondContact SG-N 3.32Å; Y136-K138 PolarHBondContact O-N 3.38Å; Y136-R139 WeakPolarHBondContact O-CA 3.39Å; Y136-R139 WeakPolarHBondContact O-CB 3.49Å; Y136-R139 PolarHBondContact O-N 2.86Å; Y136-G140 PolarHBondContact O-N 2.93Å; Y136-C141 PolarHBondContact O-N 2.93Å; Y136-C159 HydrophobicContact CD2-CB 4.38Å; Y136-V162 HydrophobicContact CD2-CB 4.08Å; Y136-V162 HydrophobicContact CD2-CG2 4.41Å; Y136-V162 HydrophobicContact CE2-CB 3.76Å; Y136-V162 HydrophobicContact CE2-CG2 3.61Å; Y136-P163 VanDerWaalsContact CD1-CD 3.46Å; Y136-P163 HydrophobicContact CD1-CG 4.08Å; Y136-P163 HydrophobicContact CE1-CG 3.74Å
137	A	96.2	Very high	96.3	Very high	41 Å²	41	49.4 Å²	49.4	34%	0.339	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-56.3	-39	175.9	0	0	0	0	0	112.6	C134 R139 G140 C141	C134-A137 WeakPolarHBondContact O-CB 3.38Å; C134-A137 PolarHBondContact O-N 3.49Å; A137-R139 PolarHBondContact O-N 3.06Å; A137-R139 VanDerWaalsContact O-N 3.17Å; A137-G140 PolarHBondContact O-N 2.89Å; A137-C141 VanDerWaalsContact CA-O 3.24Å; A137-C141 WeakPolarHBondContact CA-O 3.34Å
138	K	95.1	Very high	96.2	Very high	189 Å²	189	54.4 Å²	54.4	82%	0.822	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-64.1	-17.9	174.5	-63.9	-179.6	-177	171.5	0	113.9	D10 Y136	D10-K138 IonicContact OD2-NZ 3.97Å; Y136-K138 PolarHBondContact O-N 3.38Å
139	R	95.7	Very high	96.1	Very high	88 Å²	88	57.7 Å²	57.7	33%	0.332	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-95.6	-5.4	176	-61.4	-179.4	68.2	106.4	1.1	112.8	Y136 A137 Y161 L173 N174	Y136-R139 WeakPolarHBondContact O-CA 3.39Å; Y136-R139 WeakPolarHBondContact O-CB 3.49Å; Y136-R139 PolarHBondContact O-N 2.86Å; A137-R139 PolarHBondContact O-N 3.06Å; A137-R139 VanDerWaalsContact O-N 3.17Å; R139-Y161 WeakPolarHBondContact CD-O 3.36Å; R139-Y161 PolarHBondContact NE-O 3.45Å; R139-Y161 WeakPolarHBondContact O-CD1 3.44Å; R139-Y161 WeakPolarHBondContact O-CE1 3.45Å; R139-L173 VanDerWaalsContact NH2-C 3.28Å; R139-L173 PolarHBondContact NH2-O 2.79Å; R139-N174 VanDerWaalsContact CZ-OD1 3.23Å; R139-N174 PolarHBondContact NE-OD1 3.08Å; R139-N174 PolarHBondContact NH2-OD1 3.45Å
140	G	96.3	Very high	96	Very high	31 Å²	31	55 Å²	55	32%	0.32	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.4	-3.8	176.8	0	0	0	0	0	115.3	Y136 A137 T142 Y161	Y136-G140 PolarHBondContact O-N 2.93Å; A137-G140 PolarHBondContact O-N 2.89Å; G140-T142 PolarHBondContact O-N 2.94Å; G140-Y161 WeakPolarHBondContact O-CE2 3.27Å
141	C	97.2	Very high	95.8	Very high	8 Å²	8	54.6 Å²	54.6	5%	0.054	28%	0.282	C	S	.	.			trans	-72	116.8	178.6	-169.6	0	0	0	0	111.7	C134 Y136 A137 T143 Y161	C134-C141 HydrophobicContact CB-CB 3.79Å; C134-C141 WeakPolarHBondContact CB-SG 3.4Å; Y136-C141 PolarHBondContact O-N 2.93Å; A137-C141 VanDerWaalsContact CA-O 3.24Å; A137-C141 WeakPolarHBondContact CA-O 3.34Å; C141-T143 PolarHBondContact SG-OG1 3.32Å; C141-T143 VanDerWaalsContact SG-OG1 3.38Å; C141-Y161 VanDerWaalsContact CA-CD2 3.41Å; C141-Y161 HydrophobicContact CB-CD2 3.62Å; C141-Y161 HydrophobicContact CB-CE2 4.41Å; C141-Y161 HydrophobicContact CB-CG 4.11Å
142	T	96.3	Very high	95.4	Very high	126 Å²	126	55.8 Å²	55.8	77%	0.773	29%	0.286	S	S	*	.			trans	-93.4	3.5	178.4	55.6	0	0	0	0	113.6	G140 I144	G140-T142 PolarHBondContact O-N 2.94Å; T142-I144 PolarHBondContact O-N 3.41Å
143	T	96	Very high	95	Very high	56 Å²	56	56.7 Å²	56.7	34%	0.344	30%	0.295	S	S	.	.			trans	-67.2	129.2	-177	-49.8	0	0	0	0	111.3	C134 C141 I150 H155	C134-T143 PolarHBondContact N-O 3.03Å; C134-T143 VanDerWaalsContact N-O 3.08Å; C141-T143 PolarHBondContact SG-OG1 3.32Å; C141-T143 VanDerWaalsContact SG-OG1 3.38Å; T143-I150 HydrophobicContact CG2-CD1 3.63Å; T143-H155 PolarHBondContact OG1-CE1 3Å
144	I	96.7	Very high	94.6	Very high	84 Å²	84	55.4 Å²	55.4	43%	0.431	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.3	172.6	-59.6	170.8	0	0	0	107.5	V13 Q131 I132 Y133 T142	V13-I144 HydrophobicContact CG2-CG2 3.61Å; Q131-I144 HydrophobicContact CB-CG2 4.45Å; I132-I144 WeakPolarHBondContact O-CA 3.41Å; Y133-I144 HydrophobicContact CD1-CD1 3.93Å; Y133-I144 HydrophobicContact CD1-CG1 3.59Å; Y133-I144 HydrophobicContact CE1-CD1 3.5Å; Y133-I144 VanDerWaalsContact CE1-CD1 3.5Å; Y133-I144 HydrophobicContact CE1-CG1 3.74Å; T142-I144 PolarHBondContact O-N 3.41Å
145	G	96.1	Very high	94.4	Very high	8 Å²	8	56.6 Å²	56.6	8%	0.082	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	-177	174.5	0	0	0	0	0	111.6	Q131 I132	Q131-G145 CarbonylContact C-O 3.4Å; Q131-G145 WeakPolarHBondContact CA-O 3.35Å; Q131-G145 VanDerWaalsContact OE1-C 3.26Å; I132-G145 PolarHBondContact N-O 3.38Å; I132-G145 PolarHBondContact O-N 3.18Å; I132-G145 VanDerWaalsContact O-N 3.16Å
146	S	96.8	Very high	93.9	Very high	17 Å²	17	58.4 Å²	58.4	12%	0.119	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	154.9	177.4	71.4	0	0	0	0	111.4	N128 L130 E148 L149 I150	N128-S146 VanDerWaalsContact O-CB 3.3Å; N128-S146 WeakPolarHBondContact O-CB 3.44Å; L130-S146 CarbonylContact O-C 3.57Å; L130-S146 VanDerWaalsContact O-CA 3.26Å; L130-S146 WeakPolarHBondContact O-CA 3.49Å; S146-E148 PolarHBondContact O-N 3.36Å; S146-L149 PolarHBondContact O-N 3.04Å; S146-L149 VanDerWaalsContact O-N 3.08Å; S146-L149 WeakPolarHBondContact OG-CG 3.46Å; S146-L149 PolarHBondContact OG-N 3.31Å; S146-I150 PolarHBondContact O-N 2.92Å
147	V	95.8	Very high	93.4	Very high	4 Å²	4	61.4 Å²	61.4	2%	0.024	32%	0.32	C	S	.	.	H	α-helix	trans	-51.9	-42.2	172	166	0	0	0	0	110.7	I7 F12 L127 N128 L130 I132 L149 H151 F152	I7-V147 HydrophobicContact CD1-CB 4.33Å; I7-V147 HydrophobicContact CD1-CG1 3.46Å; I7-V147 VanDerWaalsContact CD1-CG1 3.46Å; I7-V147 HydrophobicContact CD1-CG2 3.89Å; F12-V147 HydrophobicContact CE1-CG2 3.95Å; F12-V147 HydrophobicContact CZ-CG2 4.24Å; L127-V147 WeakPolarHBondContact O-CB 3.33Å; L127-V147 WeakPolarHBondContact O-CG2 3.44Å; N128-V147 PolarHBondContact O-N 2.9Å; L130-V147 HydrophobicContact CB-CG2 4.04Å; L130-V147 PolarHBondContact O-N 3.46Å; I132-V147 HydrophobicContact CD1-CB 4.48Å; I132-V147 HydrophobicContact CD1-CG2 4.09Å; I132-V147 HydrophobicContact CG1-CG2 4.39Å; I132-V147 HydrophobicContact CG2-CG2 3.66Å; V147-L149 PolarHBondContact O-N 3.38Å; V147-H151 HydrophobicContact CG1-CB 4.25Å; V147-H151 WeakPolarHBondContact O-CA 3.26Å; V147-H151 VanDerWaalsContact O-CB 3.26Å; V147-H151 WeakPolarHBondContact O-CB 3.43Å; V147-H151 PolarHBondContact O-N 2.77Å; V147-F152 HydrophobicContact CG1-CD2 3.91Å; V147-F152 HydrophobicContact CG1-CE2 3.64Å; V147-F152 PolarHBondContact O-N 3.06Å
148	E	94.2	Very high	93.1	Very high	112 Å²	112	61.6 Å²	61.6	52%	0.523	32%	0.316	S	S	.	.	I	π-helix	trans	-57.7	-45.9	176.5	-178.1	165.9	-145.8	0	0	112.8	N128 S146 F152 G153	N128-E148 HydrophobicContact CB-CB 4.06Å; N128-E148 PolarHBondContact O-N 2.8Å; N128-E148 VanDerWaalsContact O-N 3.1Å; S146-E148 PolarHBondContact O-N 3.36Å; E148-F152 CarbonylContact O-C 3.57Å; E148-G153 WeakPolarHBondContact O-CA 3.45Å; E148-G153 PolarHBondContact O-N 3.13Å
149	L	92.8	Very high	93.1	Very high	91 Å²	91	52.8 Å²	52.8	48%	0.476	28%	0.278	S	S	.	.	I	π-helix	trans	-76.5	-42.4	-177.8	-69.9	169.7	0	0	0	112.9	S146 V147 G153	S146-L149 PolarHBondContact O-N 3.04Å; S146-L149 VanDerWaalsContact O-N 3.08Å; S146-L149 WeakPolarHBondContact OG-CG 3.46Å; S146-L149 PolarHBondContact OG-N 3.31Å; V147-L149 PolarHBondContact O-N 3.38Å; L149-G153 CarbonylContact O-C 3.44Å; L149-G153 VanDerWaalsContact O-CA 3.27Å; L149-G153 WeakPolarHBondContact O-CA 3.18Å; L149-G153 PolarHBondContact O-N 3.02Å
150	I	94.5	Very high	93.1	Very high	10 Å²	10	50.4 Å²	50.4	5%	0.051	28%	0.277	C	S	.	.	I	π-helix	trans	-87.9	-41.7	-170.2	-60.3	-60.5	0	0	0	112.2	I132 T143 S146 H155	I132-I150 HydrophobicContact CD1-CB 3.94Å; I132-I150 HydrophobicContact CD1-CG2 3.92Å; I132-I150 HydrophobicContact CG1-CB 3.82Å; I132-I150 HydrophobicContact CG1-CG1 4.32Å; I132-I150 HydrophobicContact CG1-CG2 3.91Å; T143-I150 HydrophobicContact CG2-CD1 3.63Å; S146-I150 PolarHBondContact O-N 2.92Å; I150-H155 HydrophobicContact CD1-CB 4.2Å
151	H	92.4	Very high	93.1	Very high	27 Å²	27	52.4 Å²	52.4	13%	0.125	28%	0.276	C	S	.	.	I	π-helix	trans	-93.8	-44.1	-175.1	-173	59	0	0	0	112.7	I7 I30 I132 V147	I7-H151 HydrophobicContact CD1-CB 4.35Å; I30-H151 WeakPolarHBondContact CD1-NE2 3.4Å; I132-H151 HydrophobicContact CD1-CB 3.88Å; V147-H151 HydrophobicContact CG1-CB 4.25Å; V147-H151 WeakPolarHBondContact O-CA 3.26Å; V147-H151 VanDerWaalsContact O-CB 3.26Å; V147-H151 WeakPolarHBondContact O-CB 3.43Å; V147-H151 PolarHBondContact O-N 2.77Å
152	F	90.7	Very high	93	Very high	104 Å²	104	52.8 Å²	52.8	46%	0.456	28%	0.278	S	S	.	.	I	π-helix	trans	-97.5	-18.3	-179.7	-61.6	-61.4	0	0	0	113.9	I30 V147 E148	I30-F152 HydrophobicContact CD1-CE1 4.5Å; I30-F152 HydrophobicContact CD1-CZ 4.17Å; I30-F152 HydrophobicContact CG1-CZ 4.35Å; I30-F152 HydrophobicContact CG2-CE1 4.33Å; I30-F152 HydrophobicContact CG2-CZ 4Å; V147-F152 HydrophobicContact CG1-CD2 3.91Å; V147-F152 HydrophobicContact CG1-CE2 3.64Å; V147-F152 PolarHBondContact O-N 3.06Å; E148-F152 CarbonylContact O-C 3.57Å
153	G	89	Confident	93	Very high	19 Å²	19	49 Å²	49	20%	0.196	26%	0.255	C	S	.	.	S	Bend	trans	-86.7	-171.3	-179.1	0	0	0	0	0	113.4	E148 L149 H155	E148-G153 WeakPolarHBondContact O-CA 3.45Å; E148-G153 PolarHBondContact O-N 3.13Å; L149-G153 CarbonylContact O-C 3.44Å; L149-G153 VanDerWaalsContact O-CA 3.27Å; L149-G153 WeakPolarHBondContact O-CA 3.18Å; L149-G153 PolarHBondContact O-N 3.02Å; G153-H155 PolarHBondContact O-N 3.37Å
154	N	88.1	Confident	92.8	Very high	62 Å²	62	47.7 Å²	47.7	33%	0.332	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-11.4	-171.3	-68.7	-14.4	0	0	0	114	R156 H157 V158	N154-R156 PolarHBondContact O-N 2.87Å; N154-R156 VanDerWaalsContact O-N 3.16Å; N154-H157 WeakPolarHBondContact O-CA 3.43Å; N154-H157 WeakPolarHBondContact O-CB 3.28Å; N154-H157 PolarHBondContact O-N 3.49Å; N154-V158 WeakPolarHBondContact O-CG2 3.34Å; N154-V158 PolarHBondContact O-N 2.83Å; N154-V158 VanDerWaalsContact O-N 3.09Å
155	H	92.4	Very high	92.8	Very high	28 Å²	28	48.9 Å²	48.9	13%	0.13	25%	0.254	C	S	.	.	H	α-helix	trans	-52.9	-42.6	-177	-179.9	71	0	0	0	112.2	C134 T143 I150 G153 H157 V158 C159	C134-H155 WeakPolarHBondContact CB-NE2 3.39Å; C134-H155 PolarHBondContact SG-NE2 2.9Å; T143-H155 PolarHBondContact OG1-CE1 3Å; I150-H155 HydrophobicContact CD1-CB 4.2Å; G153-H155 PolarHBondContact O-N 3.37Å; H155-H157 PolarHBondContact O-N 3.38Å; H155-V158 PolarHBondContact O-N 2.88Å; H155-V158 VanDerWaalsContact O-N 3.17Å; H155-C159 WeakPolarHBondContact O-CA 3.24Å; H155-C159 WeakPolarHBondContact O-CB 3.26Å; H155-C159 PolarHBondContact O-N 2.89Å
156	R	84.1	Confident	92.7	Very high	86 Å²	86	48.6 Å²	48.6	33%	0.325	25%	0.251	S	S	.	.	H	α-helix	trans	-56.8	-36	176.9	-178.9	172.5	-176.5	-134.6	-7.2	112.9	E135 N154	E135-R156 WeakPolarHBondContact OE1-CD 3.14Å; E135-R156 WeakPolarHBondContact OE1-CG 3.08Å; E135-R156 IonicContact OE1-NE 3.08Å; E135-R156 PolarHBondContact OE1-NE 3.23Å; N154-R156 PolarHBondContact O-N 2.87Å; N154-R156 VanDerWaalsContact O-N 3.16Å
157	H	85.2	Confident	92.4	Very high	99 Å²	99	52.4 Å²	52.4	46%	0.458	28%	0.284	S	S	.	.	H	α-helix	trans	-83.9	-21	-178.2	-63.2	-68.8	0	0	0	113.5	N154 H155 R175 I303	N154-H157 WeakPolarHBondContact O-CA 3.43Å; N154-H157 WeakPolarHBondContact O-CB 3.28Å; N154-H157 PolarHBondContact O-N 3.49Å; H155-H157 PolarHBondContact O-N 3.38Å; H157-R175 PolarHBondContact O-NH1 3.48Å; H157-R175 PolarHBondContact O-NH2 3.24Å; H157-I303 HydrophobicContact CB-CG2 4.49Å
158	V	90.8	Very high	92.1	Very high	45 Å²	45	53.4 Å²	53.4	27%	0.273	30%	0.295	S	S	.	.	H	α-helix	trans	-111.5	-7.1	-178.9	-56.3	0	0	0	0	113.9	N154 H155 A160 I303	N154-V158 WeakPolarHBondContact O-CG2 3.34Å; N154-V158 PolarHBondContact O-N 2.83Å; N154-V158 VanDerWaalsContact O-N 3.09Å; H155-V158 PolarHBondContact O-N 2.88Å; H155-V158 VanDerWaalsContact O-N 3.17Å; V158-A160 PolarHBondContact O-N 2.86Å; V158-I303 HydrophobicContact CG1-CG2 3.77Å
159	C	94.4	Very high	92	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.02	29%	0.286	C	S	.	.			trans	-57.8	124.1	-176.5	178.6	0	0	0	0	111.5	Y136 H155 Y161 V162	Y136-C159 HydrophobicContact CD2-CB 4.38Å; H155-C159 WeakPolarHBondContact O-CA 3.24Å; H155-C159 WeakPolarHBondContact O-CB 3.26Å; H155-C159 PolarHBondContact O-N 2.89Å; C159-Y161 PolarHBondContact O-N 3.16Å; C159-Y161 VanDerWaalsContact O-N 3.16Å; C159-Y161 PolarHBondContact SG-N 2.97Å; C159-Y161 VanDerWaalsContact SG-N 3.41Å; C159-V162 HydrophobicContact CB-CB 4.44Å; C159-V162 WeakPolarHBondContact O-CG1 3.3Å; C159-V162 PolarHBondContact O-N 3.3Å
160	A	95.1	Very high	92	Very high	38 Å²	38	48.5 Å²	48.5	31%	0.314	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.1	178.4	0	0	0	0	0	113.7	V158 R175 I176	V158-A160 PolarHBondContact O-N 2.86Å; A160-R175 WeakPolarHBondContact O-CB 3.33Å; A160-R175 PolarHBondContact O-N 3.25Å; A160-R175 VanDerWaalsContact O-N 3.14Å; A160-I176 HydrophobicContact CB-CB 4.18Å; A160-I176 HydrophobicContact CB-CD1 4.49Å; A160-I176 PolarHBondContact O-N 2.93Å
161	Y	97	Very high	92.1	Very high	74 Å²	74	55.5 Å²	55.5	29%	0.29	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	5.6	-176.2	-60.9	-84.3	0	0	0	113.7	R139 G140 C141 C159 N174	R139-Y161 WeakPolarHBondContact CD-O 3.36Å; R139-Y161 PolarHBondContact NE-O 3.45Å; R139-Y161 WeakPolarHBondContact O-CD1 3.44Å; R139-Y161 WeakPolarHBondContact O-CE1 3.45Å; G140-Y161 WeakPolarHBondContact O-CE2 3.27Å; C141-Y161 VanDerWaalsContact CA-CD2 3.41Å; C141-Y161 HydrophobicContact CB-CD2 3.62Å; C141-Y161 HydrophobicContact CB-CE2 4.41Å; C141-Y161 HydrophobicContact CB-CG 4.11Å; C159-Y161 PolarHBondContact O-N 3.16Å; C159-Y161 VanDerWaalsContact O-N 3.16Å; C159-Y161 PolarHBondContact SG-N 2.97Å; C159-Y161 VanDerWaalsContact SG-N 3.41Å; Y161-N174 PolarHBondContact O-OD1 3.2Å
162	V	94.2	Very high	92.3	Very high	16 Å²	16	57.9 Å²	57.9	10%	0.097	33%	0.33	C	S	.	.	S	Bend	trans	-59.7	132.4	172.4	67.7	0	0	0	0	109.4	Y136 C159 V164 R175	Y136-V162 HydrophobicContact CD2-CB 4.08Å; Y136-V162 HydrophobicContact CD2-CG2 4.41Å; Y136-V162 HydrophobicContact CE2-CB 3.76Å; Y136-V162 HydrophobicContact CE2-CG2 3.61Å; C159-V162 HydrophobicContact CB-CB 4.44Å; C159-V162 WeakPolarHBondContact O-CG1 3.3Å; C159-V162 PolarHBondContact O-N 3.3Å; V162-V164 HydrophobicContact CG1-CG1 4.08Å; V162-V164 PolarHBondContact O-N 2.76Å; V162-R175 HydrophobicContact CG1-CB 3.77Å; V162-R175 VanDerWaalsContact CG1-NE 3.29Å; V162-R175 PolarHBondContact O-N 2.9Å
163	P	95.7	Very high	92.5	Very high	46 Å²	46	54.5 Å²	54.5	30%	0.299	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	127.5	173.9	-16	25.4	0	0	0	110.2	Y136 T172 L173	Y136-P163 VanDerWaalsContact CD1-CD 3.46Å; Y136-P163 HydrophobicContact CD1-CG 4.08Å; Y136-P163 HydrophobicContact CE1-CG 3.74Å; P163-T172 HydrophobicContact CB-CG2 3.61Å; P163-L173 CarbonylContact C-O 3.41Å; P163-L173 WeakPolarHBondContact CA-O 3.47Å
164	V	93.7	Very high	92.8	Very high	28 Å²	28	54.4 Å²	54.4	17%	0.17	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.9	175.2	-64.2	0	0	0	0	109.4	V162 T172 L173 R175 L178	V162-V164 HydrophobicContact CG1-CG1 4.08Å; V162-V164 PolarHBondContact O-N 2.76Å; V164-T172 CarbonylContact O-C 3.46Å; V164-T172 WeakPolarHBondContact O-CA 3.35Å; V164-L173 PolarHBondContact N-O 3.38Å; V164-L173 PolarHBondContact O-N 3.35Å; V164-R175 HydrophobicContact CG1-CB 4.16Å; V164-R175 HydrophobicContact CG2-CB 4.34Å; V164-L178 HydrophobicContact CB-CD2 4.43Å; V164-L178 HydrophobicContact CG2-CB 3.94Å; V164-L178 HydrophobicContact CG2-CD1 4.22Å; V164-L178 HydrophobicContact CG2-CD2 3.86Å; V164-L178 HydrophobicContact CG2-CG 4.22Å
165	D	95	Very high	93.1	Very high	109 Å²	109	56 Å²	56	58%	0.583	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.4	177.7	-61.5	-29.9	0	0	0	110.1	A167 T172	D165-A167 PolarHBondContact O-N 3.48Å; D165-T172 WeakPolarHBondContact OD1-CA 3.3Å; D165-T172 VanDerWaalsContact OD1-CB 3.25Å; D165-T172 WeakPolarHBondContact OD1-CB 3.29Å; D165-T172 WeakPolarHBondContact OD1-CG2 3.48Å; D165-T172 PolarHBondContact OD1-OG1 2.83Å
166	C	94.5	Very high	93.2	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.02	33%	0.333	C	S	.	.			trans	-67.1	125.9	172.4	179	0	0	0	0	110.2	G168 G170 R171 L178 H181	C166-G168 PolarHBondContact O-N 3.19Å; C166-G168 PolarHBondContact SG-N 2.91Å; C166-G170 VanDerWaalsContact O-CA 3.22Å; C166-G170 WeakPolarHBondContact O-CA 3.27Å; C166-G170 PolarHBondContact O-N 2.83Å; C166-R171 PolarHBondContact N-O 3.49Å; C166-L178 HydrophobicContact CB-CD1 4.46Å; C166-H181 WeakPolarHBondContact CB-NE2 3.12Å; C166-H181 VanDerWaalsContact SG-CD2 3.51Å; C166-H181 PolarHBondContact SG-NE2 2.9Å
167	A	90.6	Very high	93.7	Very high	97 Å²	97	59.6 Å²	59.6	80%	0.802	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-28.5	178.6	0	0	0	0	0	114.3	D165	D165-A167 PolarHBondContact O-N 3.48Å
168	G	88.7	Confident	94	Very high	25 Å²	25	56.6 Å²	56.6	26%	0.258	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-49.5	-178.6	0	0	0	0	0	114	C166	C166-G168 PolarHBondContact O-N 3.19Å; C166-G168 PolarHBondContact SG-N 2.91Å
169	C	93.2	Very high	93.9	Very high	50 Å²	50	57.5 Å²	57.5	34%	0.338	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-5.8	-175.1	73.3	0	0	0	0	114.9	R171 H181	C169-R171 PolarHBondContact O-N 3.49Å; C169-R171 VanDerWaalsContact SG-CB 3.58Å; C169-R171 WeakPolarHBondContact SG-CG 3.42Å; C169-H181 VanDerWaalsContact SG-CE1 3.51Å; C169-H181 PolarHBondContact SG-NE2 2.79Å
170	G	93.6	Very high	93.8	Very high	49 Å²	49	60.5 Å²	60.5	51%	0.505	36%	0.36	S	S	.	.			trans	72.1	2.3	-178.3	0	0	0	0	0	115.5	C166	C166-G170 VanDerWaalsContact O-CA 3.22Å; C166-G170 WeakPolarHBondContact O-CA 3.27Å; C166-G170 PolarHBondContact O-N 2.83Å
171	R	94.8	Very high	93.7	Very high	158 Å²	158	60.1 Å²	60.1	60%	0.596	35%	0.352	S	S	*	.			trans	-68.9	132.2	178.7	-69	179.3	-176.1	-171.2	1.5	111.1	C166 C169	C166-R171 PolarHBondContact N-O 3.49Å; C169-R171 PolarHBondContact O-N 3.49Å; C169-R171 VanDerWaalsContact SG-CB 3.58Å; C169-R171 WeakPolarHBondContact SG-CG 3.42Å
172	T	96.8	Very high	93.2	Very high	76 Å²	76	60.4 Å²	60.4	47%	0.466	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124	172.6	-47.7	0	0	0	0	111.2	P163 V164 D165	P163-T172 HydrophobicContact CB-CG2 3.61Å; V164-T172 CarbonylContact O-C 3.46Å; V164-T172 WeakPolarHBondContact O-CA 3.35Å; D165-T172 WeakPolarHBondContact OD1-CA 3.3Å; D165-T172 VanDerWaalsContact OD1-CB 3.25Å; D165-T172 WeakPolarHBondContact OD1-CB 3.29Å; D165-T172 WeakPolarHBondContact OD1-CG2 3.48Å; D165-T172 PolarHBondContact OD1-OG1 2.83Å
173	L	94.5	Very high	92.9	Very high	33 Å²	33	66.7 Å²	66.7	17%	0.173	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	169.9	-177.4	-61.4	171.5	0	0	0	111.1	R139 P163 V164 E177 H181	R139-L173 VanDerWaalsContact NH2-C 3.28Å; R139-L173 PolarHBondContact NH2-O 2.79Å; P163-L173 CarbonylContact C-O 3.41Å; P163-L173 WeakPolarHBondContact CA-O 3.47Å; V164-L173 PolarHBondContact N-O 3.38Å; V164-L173 PolarHBondContact O-N 3.35Å; L173-E177 HydrophobicContact CB-CB 4.32Å; L173-H181 HydrophobicContact CD1-CB 3.35Å; L173-H181 VanDerWaalsContact CD1-CD2 3.47Å; L173-H181 WeakPolarHBondContact CD1-CD2 3.42Å
174	N	96.3	Very high	92.6	Very high	17 Å²	17	67.9 Å²	67.9	9%	0.091	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	145	163.8	-65.3	-36.6	0	0	0	109.5	R139 Y161 I176 E177 L178	R139-N174 VanDerWaalsContact CZ-OD1 3.23Å; R139-N174 PolarHBondContact NE-OD1 3.08Å; R139-N174 PolarHBondContact NH2-OD1 3.45Å; Y161-N174 PolarHBondContact O-OD1 3.2Å; N174-I176 HydrophobicContact CB-CG2 3.9Å; N174-I176 PolarHBondContact O-N 2.84Å; N174-I176 VanDerWaalsContact O-N 3.16Å; N174-E177 HydrophobicContact CB-CG 4.14Å; N174-E177 PolarHBondContact N-OE2 3.43Å; N174-E177 PolarHBondContact ND2-OE1 2.91Å; N174-E177 WeakPolarHBondContact O-CB 3.46Å; N174-E177 PolarHBondContact O-N 3.45Å; N174-L178 PolarHBondContact O-N 3.21Å
175	R	94.5	Very high	92.3	Very high	96 Å²	96	66.7 Å²	66.7	36%	0.362	39%	0.39	S	S	.	.	H	α-helix	trans	-51.1	-40.5	176	176.9	-176	-65.1	-156.8	6.1	112.9	H157 A160 V162 V164 E177 L178	H157-R175 PolarHBondContact O-NH1 3.48Å; H157-R175 PolarHBondContact O-NH2 3.24Å; A160-R175 WeakPolarHBondContact O-CB 3.33Å; A160-R175 PolarHBondContact O-N 3.25Å; A160-R175 VanDerWaalsContact O-N 3.14Å; V162-R175 HydrophobicContact CG1-CB 3.77Å; V162-R175 VanDerWaalsContact CG1-NE 3.29Å; V162-R175 PolarHBondContact O-N 2.9Å; V164-R175 HydrophobicContact CG1-CB 4.16Å; V164-R175 HydrophobicContact CG2-CB 4.34Å; R175-E177 PolarHBondContact O-N 3.08Å; R175-L178 WeakPolarHBondContact O-CB 3.05Å; R175-L178 PolarHBondContact O-N 2.87Å; R175-L178 VanDerWaalsContact O-N 3.16Å
176	I	93.9	Very high	92.1	Very high	107 Å²	107	69.1 Å²	69.1	55%	0.549	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-28.8	177.7	-164.7	169.4	0	0	0	113.4	A160 N174	A160-I176 HydrophobicContact CB-CB 4.18Å; A160-I176 HydrophobicContact CB-CD1 4.49Å; A160-I176 PolarHBondContact O-N 2.93Å; N174-I176 HydrophobicContact CB-CG2 3.9Å; N174-I176 PolarHBondContact O-N 2.84Å; N174-I176 VanDerWaalsContact O-N 3.16Å
177	E	94.3	Very high	91.6	Very high	83 Å²	83	70 Å²	70	39%	0.388	41%	0.405	S	S	.	.	H	α-helix	trans	-85.9	-17.1	179.9	-65.1	156.2	-170.2	0	0	112.3	L173 N174 R175 A179 A180 H181	L173-E177 HydrophobicContact CB-CB 4.32Å; N174-E177 HydrophobicContact CB-CG 4.14Å; N174-E177 PolarHBondContact N-OE2 3.43Å; N174-E177 PolarHBondContact ND2-OE1 2.91Å; N174-E177 WeakPolarHBondContact O-CB 3.46Å; N174-E177 PolarHBondContact O-N 3.45Å; R175-E177 PolarHBondContact O-N 3.08Å; E177-A179 PolarHBondContact O-N 3.36Å; E177-A180 PolarHBondContact O-N 3.5Å; E177-H181 WeakPolarHBondContact O-CB 3.41Å; E177-H181 PolarHBondContact O-N 3.15Å
178	L	92.1	Very high	91.2	Very high	35 Å²	35	67.2 Å²	67.2	18%	0.183	38%	0.377	C	S	.	.	H	α-helix	trans	-60.9	-45.8	-169.1	-178	63.5	0	0	0	112.2	V164 C166 N174 R175 A180 H181 Q182	V164-L178 HydrophobicContact CB-CD2 4.43Å; V164-L178 HydrophobicContact CG2-CB 3.94Å; V164-L178 HydrophobicContact CG2-CD1 4.22Å; V164-L178 HydrophobicContact CG2-CD2 3.86Å; V164-L178 HydrophobicContact CG2-CG 4.22Å; C166-L178 HydrophobicContact CB-CD1 4.46Å; N174-L178 PolarHBondContact O-N 3.21Å; R175-L178 WeakPolarHBondContact O-CB 3.05Å; R175-L178 PolarHBondContact O-N 2.87Å; R175-L178 VanDerWaalsContact O-N 3.16Å; L178-A180 PolarHBondContact O-N 3.44Å; L178-H181 PolarHBondContact O-N 2.99Å; L178-Q182 HydrophobicContact CD1-CG 4.04Å; L178-Q182 HydrophobicContact CG-CG 4.23Å; L178-Q182 WeakPolarHBondContact O-CB 3.36Å; L178-Q182 VanDerWaalsContact O-CG 3.23Å; L178-Q182 WeakPolarHBondContact O-CG 3.13Å; L178-Q182 PolarHBondContact O-N 3.19Å
179	A	88.8	Confident	90.9	Very high	64 Å²	64	70.5 Å²	70.5	53%	0.529	39%	0.385	S	S	.	.	H	α-helix	trans	-61.7	-47.1	-179	0	0	0	0	0	111.6	E177 H181 Q182 L183	E177-A179 PolarHBondContact O-N 3.36Å; A179-H181 VanDerWaalsContact C-N 3.34Å; A179-H181 PolarHBondContact O-N 2.81Å; A179-Q182 PolarHBondContact O-N 3.25Å; A179-L183 WeakPolarHBondContact O-CG 3.26Å; A179-L183 PolarHBondContact O-N 3.39Å
180	A	91.7	Very high	90.4	Very high	67 Å²	67	70.8 Å²	70.8	55%	0.554	39%	0.391	S	S	*	.	H	α-helix	trans	-62.2	-42.2	177.3	0	0	0	0	0	111.7	E177 L178	E177-A180 PolarHBondContact O-N 3.5Å; L178-A180 PolarHBondContact O-N 3.44Å
181	H	93.3	Very high	89.5	Confident	30 Å²	30	73.9 Å²	73.9	14%	0.139	39%	0.392	C	S	.	.	H	α-helix	trans	-63.7	-42.2	176.1	171.8	76.1	0	0	0	112.9	C166 C169 L173 E177 L178 A179 L183 S184 C185	C166-H181 WeakPolarHBondContact CB-NE2 3.12Å; C166-H181 VanDerWaalsContact SG-CD2 3.51Å; C166-H181 PolarHBondContact SG-NE2 2.9Å; C169-H181 VanDerWaalsContact SG-CE1 3.51Å; C169-H181 PolarHBondContact SG-NE2 2.79Å; L173-H181 HydrophobicContact CD1-CB 3.35Å; L173-H181 VanDerWaalsContact CD1-CD2 3.47Å; L173-H181 WeakPolarHBondContact CD1-CD2 3.42Å; E177-H181 WeakPolarHBondContact O-CB 3.41Å; E177-H181 PolarHBondContact O-N 3.15Å; L178-H181 PolarHBondContact O-N 2.99Å; A179-H181 VanDerWaalsContact C-N 3.34Å; A179-H181 PolarHBondContact O-N 2.81Å; H181-L183 VanDerWaalsContact C-N 3.27Å; H181-L183 PolarHBondContact O-N 3.25Å; H181-S184 CarbonylContact O-C 3.59Å; H181-S184 PolarHBondContact O-N 3.09Å; H181-S184 VanDerWaalsContact O-N 3.12Å; H181-C185 WeakPolarHBondContact O-CA 3.4Å; H181-C185 VanDerWaalsContact O-CB 3.31Å; H181-C185 WeakPolarHBondContact O-CB 3.27Å; H181-C185 PolarHBondContact O-N 3.49Å
182	Q	88.1	Confident	88.4	Confident	80 Å²	80	70.7 Å²	70.7	37%	0.374	39%	0.387	S	S	.	.	H	α-helix	trans	-62.2	-34.1	-178	-76.9	175.9	-34.5	0	0	112.4	L178 A179 S184 C185 I188	L178-Q182 HydrophobicContact CD1-CG 4.04Å; L178-Q182 HydrophobicContact CG-CG 4.23Å; L178-Q182 WeakPolarHBondContact O-CB 3.36Å; L178-Q182 VanDerWaalsContact O-CG 3.23Å; L178-Q182 WeakPolarHBondContact O-CG 3.13Å; L178-Q182 PolarHBondContact O-N 3.19Å; A179-Q182 PolarHBondContact O-N 3.25Å; Q182-S184 PolarHBondContact O-N 3.4Å; Q182-C185 PolarHBondContact O-N 2.88Å; Q182-I188 HydrophobicContact CB-CD1 3.93Å; Q182-I188 HydrophobicContact CG-CD1 3.72Å
183	L	87.3	Confident	87	Confident	148 Å²	148	68.3 Å²	68.3	78%	0.775	38%	0.377	S	S	*	.	H	α-helix	trans	-61.8	-31.3	175.5	-67.1	172.2	0	0	0	112.9	A179 H181	A179-L183 WeakPolarHBondContact O-CG 3.26Å; A179-L183 PolarHBondContact O-N 3.39Å; H181-L183 VanDerWaalsContact C-N 3.27Å; H181-L183 PolarHBondContact O-N 3.25Å
184	S	88.4	Confident	85.4	Confident	71 Å²	71	71.5 Å²	71.5	50%	0.497	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	17.6	-178	69.1	0	0	0	0	113.5	H181 Q182 F186	H181-S184 CarbonylContact O-C 3.59Å; H181-S184 PolarHBondContact O-N 3.09Å; H181-S184 VanDerWaalsContact O-N 3.12Å; Q182-S184 PolarHBondContact O-N 3.4Å; S184-F186 PolarHBondContact O-N 3.01Å
185	C	88.3	Confident	83.6	Confident	2 Å²	2	74.4 Å²	74.4	1%	0.014	41%	0.406	C	S	.	.			trans	-80.2	116.7	-174.5	177.8	0	0	0	0	111.2	H181 Q182 G187 I188 Q189	H181-C185 WeakPolarHBondContact O-CA 3.4Å; H181-C185 VanDerWaalsContact O-CB 3.31Å; H181-C185 WeakPolarHBondContact O-CB 3.27Å; H181-C185 PolarHBondContact O-N 3.49Å; Q182-C185 PolarHBondContact O-N 2.88Å; C185-G187 VanDerWaalsContact C-N 3.27Å; C185-G187 PolarHBondContact O-N 2.76Å; C185-I188 HydrophobicContact CB-CB 4.11Å; C185-I188 HydrophobicContact CB-CD1 3.93Å; C185-I188 HydrophobicContact CB-CG1 3.97Å; C185-I188 PolarHBondContact O-N 2.81Å; C185-Q189 VanDerWaalsContact O-CG 3.31Å; C185-Q189 WeakPolarHBondContact O-CG 3.1Å; C185-Q189 PolarHBondContact O-N 3.2Å
186	F	90.2	Very high	81.6	Confident	161 Å²	161	79.1 Å²	79.1	71%	0.706	42%	0.424	S	S	*	.	H	α-helix	trans	-57	-37.5	177.5	-64.5	-70.7	0	0	0	113.5	S184 Q189 A190	S184-F186 PolarHBondContact O-N 3.01Å; F186-Q189 PolarHBondContact O-N 2.95Å; F186-A190 WeakPolarHBondContact O-CB 3.2Å; F186-A190 PolarHBondContact O-N 3.1Å
187	G	85.4	Confident	79.9	Confident	21 Å²	21	81.2 Å²	81.2	22%	0.216	43%	0.425	C	S	.	.	H	α-helix	trans	-64.8	-44.2	178.6	0	0	0	0	0	112.2	C185 A190 E191	C185-G187 VanDerWaalsContact C-N 3.27Å; C185-G187 PolarHBondContact O-N 2.76Å; G187-A190 PolarHBondContact O-N 3.5Å; G187-E191 PolarHBondContact O-N 3.16Å; G187-E191 VanDerWaalsContact O-N 3.14Å
188	I	80.3	Confident	77.9	Confident	38 Å²	38	81.9 Å²	81.9	20%	0.195	43%	0.428	C	S	.	.	H	α-helix	trans	-66.5	-42.9	175.9	-62.1	179	0	0	0	110.4	Q182 C185 A190 E191 L192	Q182-I188 HydrophobicContact CB-CD1 3.93Å; Q182-I188 HydrophobicContact CG-CD1 3.72Å; C185-I188 HydrophobicContact CB-CB 4.11Å; C185-I188 HydrophobicContact CB-CD1 3.93Å; C185-I188 HydrophobicContact CB-CG1 3.97Å; C185-I188 PolarHBondContact O-N 2.81Å; I188-A190 VanDerWaalsContact C-N 3.32Å; I188-A190 PolarHBondContact O-N 2.83Å; I188-E191 PolarHBondContact O-N 3.18Å; I188-L192 HydrophobicContact CG2-CD1 3.95Å; I188-L192 HydrophobicContact CG2-CG 4.33Å; I188-L192 WeakPolarHBondContact O-CB 3.25Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.44Å; I188-L192 PolarHBondContact O-N 2.98Å
189	Q	83.6	Confident	75.8	Confident	95 Å²	95	84.9 Å²	84.9	44%	0.444	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-38.4	178.3	-71.4	174.3	-0.4	0	0	112.3	C185 F186 G193	C185-Q189 VanDerWaalsContact O-CG 3.31Å; C185-Q189 WeakPolarHBondContact O-CG 3.1Å; C185-Q189 PolarHBondContact O-N 3.2Å; F186-Q189 PolarHBondContact O-N 2.95Å; Q189-G193 PolarHBondContact O-N 3.02Å
190	A	81.9	Confident	74.1	Confident	55 Å²	55	89 Å²	89	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-64.9	-46.9	176.3	0	0	0	0	0	111.8	F186 G187 I188 G193 E194	F186-A190 WeakPolarHBondContact O-CB 3.2Å; F186-A190 PolarHBondContact O-N 3.1Å; G187-A190 PolarHBondContact O-N 3.5Å; I188-A190 VanDerWaalsContact C-N 3.32Å; I188-A190 PolarHBondContact O-N 2.83Å; A190-G193 WeakPolarHBondContact O-CA 3.45Å; A190-G193 PolarHBondContact O-N 2.86Å; A190-G193 VanDerWaalsContact O-N 3.09Å; A190-E194 PolarHBondContact O-N 3.16Å
191	E	74.7	Confident	72.5	Confident	114 Å²	114	92.2 Å²	92.2	53%	0.533	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-42	179	-167.8	171.8	-165.9	0	0	111.7	G187 I188 G193 E194 I195	G187-E191 PolarHBondContact O-N 3.16Å; G187-E191 VanDerWaalsContact O-N 3.14Å; I188-E191 PolarHBondContact O-N 3.18Å; E191-G193 VanDerWaalsContact C-N 3.28Å; E191-G193 PolarHBondContact O-N 2.84Å; E191-E194 PolarHBondContact O-N 3.46Å; E191-I195 WeakPolarHBondContact O-CG1 3.37Å; E191-I195 PolarHBondContact O-N 3.06Å; E191-I195 VanDerWaalsContact O-N 3.16Å
192	L	71.4	Confident	70.6	Confident	92 Å²	92	93.7 Å²	93.7	48%	0.482	46%	0.462	S	S	.	.	H	α-helix	trans	-64.6	-32.9	172.7	-68.3	175.2	0	0	0	112.6	I188 E194 R196	I188-L192 HydrophobicContact CG2-CD1 3.95Å; I188-L192 HydrophobicContact CG2-CG 4.33Å; I188-L192 WeakPolarHBondContact O-CB 3.25Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.44Å; I188-L192 PolarHBondContact O-N 2.98Å; L192-E194 VanDerWaalsContact C-N 3.33Å; L192-R196 WeakPolarHBondContact O-CG 3.12Å; L192-R196 PolarHBondContact O-N 3.35Å
193	G	68.2	Low	69	Low	26 Å²	26	93.3 Å²	93.3	27%	0.268	47%	0.468	S	S	.	.	H	α-helix	trans	-68.4	-30.2	175.2	0	0	0	0	0	113.4	Q189 A190 E191 R197	Q189-G193 PolarHBondContact O-N 3.02Å; A190-G193 WeakPolarHBondContact O-CA 3.45Å; A190-G193 PolarHBondContact O-N 2.86Å; A190-G193 VanDerWaalsContact O-N 3.09Å; E191-G193 VanDerWaalsContact C-N 3.28Å; E191-G193 PolarHBondContact O-N 2.84Å; G193-R197 PolarHBondContact O-N 2.83Å; G193-R197 PolarHBondContact O-NE 3.34Å
194	E	61.8	Low	67.6	Low	100 Å²	100	91 Å²	91	47%	0.467	45%	0.454	S	S	.	.	H	α-helix	trans	-70.8	-47	172.6	-72.5	176.9	179.2	0	0	111.1	A190 E191 L192 R196 R197 E198	A190-E194 PolarHBondContact O-N 3.16Å; E191-E194 PolarHBondContact O-N 3.46Å; L192-E194 VanDerWaalsContact C-N 3.33Å; E194-R196 VanDerWaalsContact C-N 3.3Å; E194-R196 PolarHBondContact O-N 3.45Å; E194-R197 WeakPolarHBondContact O-CB 2.99Å; E194-R197 PolarHBondContact O-N 3.41Å; E194-E198 WeakPolarHBondContact O-CG 3.29Å; E194-E198 PolarHBondContact O-N 3.44Å
195	I	57.6	Low	65.9	Low	77 Å²	77	93.6 Å²	93.6	40%	0.395	46%	0.458	S	S	.	.	H	α-helix	trans	-59.8	-40.2	176.9	-63.5	166.1	0	0	0	111.3	E191 R197 E198 N199	E191-I195 WeakPolarHBondContact O-CG1 3.37Å; E191-I195 PolarHBondContact O-N 3.06Å; E191-I195 VanDerWaalsContact O-N 3.16Å; I195-R197 VanDerWaalsContact C-N 3.33Å; I195-R197 PolarHBondContact O-N 3.45Å; I195-E198 PolarHBondContact O-N 3.42Å; I195-N199 WeakPolarHBondContact O-CB 3.38Å; I195-N199 PolarHBondContact O-N 3.35Å
196	R	52.2	Low	64.2	Low	196 Å²	196	98.4 Å²	98.4	74%	0.74	48%	0.482	S	S	*	.	H	α-helix	trans	-63.5	-37.9	175.3	-76.4	-179.4	-177	-175.7	2	112.4	L192 E194 Y200	L192-R196 WeakPolarHBondContact O-CG 3.12Å; L192-R196 PolarHBondContact O-N 3.35Å; E194-R196 VanDerWaalsContact C-N 3.3Å; E194-R196 PolarHBondContact O-N 3.45Å; R196-Y200 WeakPolarHBondContact O-CB 3.43Å; R196-Y200 PolarHBondContact O-N 3.34Å
197	R	57.7	Low	62.5	Low	150 Å²	150	95.8 Å²	95.8	57%	0.566	47%	0.472	S	S	*	.	H	α-helix	trans	-69.6	-39.1	176	-83.6	-178.1	-79.8	131.6	-7.6	111.8	G193 E194 I195 Y200 K201	G193-R197 PolarHBondContact O-N 2.83Å; G193-R197 PolarHBondContact O-NE 3.34Å; E194-R197 WeakPolarHBondContact O-CB 2.99Å; E194-R197 PolarHBondContact O-N 3.41Å; I195-R197 VanDerWaalsContact C-N 3.33Å; I195-R197 PolarHBondContact O-N 3.45Å; R197-Y200 PolarHBondContact O-N 2.95Å; R197-K201 WeakPolarHBondContact O-CG 3.37Å; R197-K201 PolarHBondContact O-N 2.98Å
198	E	52.3	Low	61.1	Low	98 Å²	98	97.8 Å²	97.8	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-65.4	-47	175.9	-70.3	-178.2	168	0	0	111.5	E194 I195 Y200 K201 S202	E194-E198 WeakPolarHBondContact O-CG 3.29Å; E194-E198 PolarHBondContact O-N 3.44Å; I195-E198 PolarHBondContact O-N 3.42Å; E198-Y200 VanDerWaalsContact C-N 3.31Å; E198-Y200 PolarHBondContact O-N 3.03Å; E198-K201 PolarHBondContact O-N 3.4Å; E198-S202 PolarHBondContact O-N 3.32Å; E198-S202 PolarHBondContact O-OG 3.22Å
199	N	48.8	Very low	60	Low	97 Å²	97	100.4 Å²	100.4	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-38.9	176.2	-72.3	-16.6	0	0	0	112	I195 S203	I195-N199 WeakPolarHBondContact O-CB 3.38Å; I195-N199 PolarHBondContact O-N 3.35Å; N199-S203 VanDerWaalsContact O-CB 3.29Å; N199-S203 WeakPolarHBondContact O-CB 3.23Å; N199-S203 PolarHBondContact O-N 3.06Å; N199-S203 PolarHBondContact O-OG 3.3Å
200	Y	53.2	Low	58.6	Low	151 Å²	151	99.1 Å²	99.1	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-66.5	-39.4	176.2	-167.9	-101.9	0	0	0	112.2	R196 R197 E198 Q204	R196-Y200 WeakPolarHBondContact O-CB 3.43Å; R196-Y200 PolarHBondContact O-N 3.34Å; R197-Y200 PolarHBondContact O-N 2.95Å; E198-Y200 VanDerWaalsContact C-N 3.31Å; E198-Y200 PolarHBondContact O-N 3.03Å; Y200-Q204 HydrophobicContact CD1-CG 4.33Å; Y200-Q204 HydrophobicContact CE1-CG 4.07Å; Y200-Q204 WeakPolarHBondContact O-CB 3.38Å; Y200-Q204 WeakPolarHBondContact O-CG 3.28Å; Y200-Q204 PolarHBondContact O-N 2.84Å; Y200-Q204 PolarHBondContact OH-NE2 2.86Å
201	K	57.8	Low	57.4	Low	135 Å²	135	100 Å²	100	59%	0.587	50%	0.496	S	S	*	.	H	α-helix	trans	-64.9	-47.8	174.3	-76.5	-179.4	177.5	-172.5	0	112.1	R197 E198 S203 Q204 E205	R197-K201 WeakPolarHBondContact O-CG 3.37Å; R197-K201 PolarHBondContact O-N 2.98Å; E198-K201 PolarHBondContact O-N 3.4Å; K201-S203 VanDerWaalsContact C-N 3.35Å; K201-S203 PolarHBondContact O-N 3.4Å; K201-Q204 PolarHBondContact O-N 3.2Å; K201-E205 WeakPolarHBondContact O-CG 3.29Å; K201-E205 PolarHBondContact O-N 3.01Å
202	S	54.2	Low	56.6	Low	60 Å²	60	98.7 Å²	98.7	42%	0.42	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-37.5	177	-64.1	0	0	0	0	112.2	E198 E205 I206	E198-S202 PolarHBondContact O-N 3.32Å; E198-S202 PolarHBondContact O-OG 3.22Å; S202-E205 PolarHBondContact O-N 2.93Å; S202-I206 WeakPolarHBondContact O-CB 3.39Å; S202-I206 WeakPolarHBondContact O-CD1 3.46Å; S202-I206 WeakPolarHBondContact O-CG1 3.4Å; S202-I206 PolarHBondContact O-N 3.46Å
203	S	54.2	Low	55.5	Low	72 Å²	72	95.7 Å²	95.7	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-67.1	-36.1	172.9	-67.3	0	0	0	0	112.8	N199 K201 Q207	N199-S203 VanDerWaalsContact O-CB 3.29Å; N199-S203 WeakPolarHBondContact O-CB 3.23Å; N199-S203 PolarHBondContact O-N 3.06Å; N199-S203 PolarHBondContact O-OG 3.3Å; K201-S203 VanDerWaalsContact C-N 3.35Å; K201-S203 PolarHBondContact O-N 3.4Å; S203-Q207 WeakPolarHBondContact O-CB 3.31Å; S203-Q207 PolarHBondContact O-N 3.32Å
204	Q	56.6	Low	55	Low	101 Å²	101	98.7 Å²	98.7	47%	0.472	50%	0.497	S	S	.	.	H	α-helix	trans	-68	-38.8	173.3	-80.7	-175.3	-29	0	0	112.3	Y200 K201 Q207 S208	Y200-Q204 HydrophobicContact CD1-CG 4.33Å; Y200-Q204 HydrophobicContact CE1-CG 4.07Å; Y200-Q204 WeakPolarHBondContact O-CB 3.38Å; Y200-Q204 WeakPolarHBondContact O-CG 3.28Å; Y200-Q204 PolarHBondContact O-N 2.84Å; Y200-Q204 PolarHBondContact OH-NE2 2.86Å; K201-Q204 PolarHBondContact O-N 3.2Å; Q204-Q207 PolarHBondContact O-N 3.39Å; Q204-S208 WeakPolarHBondContact O-CB 3.49Å; Q204-S208 PolarHBondContact O-N 3.19Å; Q204-S208 PolarHBondContact O-OG 3.25Å
205	E	52.7	Low	54.6	Low	124 Å²	124	100.3 Å²	100.3	58%	0.579	50%	0.504	S	S	*	.	H	α-helix	trans	-64.3	-42.7	174.4	-73.9	170.2	-177.7	0	0	111.2	K201 S202 S208 T209	K201-E205 WeakPolarHBondContact O-CG 3.29Å; K201-E205 PolarHBondContact O-N 3.01Å; S202-E205 PolarHBondContact O-N 2.93Å; E205-S208 PolarHBondContact O-N 2.93Å; E205-S208 PolarHBondContact O-OG 2.92Å; E205-T209 PolarHBondContact O-N 2.97Å; E205-T209 PolarHBondContact O-OG1 3.5Å
206	I	54.5	Low	54.4	Low	104 Å²	104	100.6 Å²	100.6	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-43.6	173.9	-65.6	162.9	0	0	0	110.8	S202 S208 T209 V210	S202-I206 WeakPolarHBondContact O-CB 3.39Å; S202-I206 WeakPolarHBondContact O-CD1 3.46Å; S202-I206 WeakPolarHBondContact O-CG1 3.4Å; S202-I206 PolarHBondContact O-N 3.46Å; I206-S208 PolarHBondContact O-N 3.36Å; I206-T209 VanDerWaalsContact CA-OG1 3.31Å; I206-T209 WeakPolarHBondContact CA-OG1 3.36Å; I206-T209 PolarHBondContact O-N 3.4Å; I206-T209 PolarHBondContact O-OG1 2.83Å; I206-V210 HydrophobicContact CG2-CG2 4.35Å; I206-V210 WeakPolarHBondContact O-CB 3.3Å; I206-V210 VanDerWaalsContact O-CG2 3.24Å; I206-V210 WeakPolarHBondContact O-CG2 3.28Å; I206-V210 PolarHBondContact O-N 3.45Å
207	Q	53.1	Low	54.1	Low	106 Å²	106	96.7 Å²	96.7	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-43.1	177.8	-169.4	62.4	49.6	0	0	111.2	S203 Q204 T209 V210 D211	S203-Q207 WeakPolarHBondContact O-CB 3.31Å; S203-Q207 PolarHBondContact O-N 3.32Å; Q204-Q207 PolarHBondContact O-N 3.39Å; Q207-T209 VanDerWaalsContact C-N 3.33Å; Q207-T209 PolarHBondContact O-N 3.4Å; Q207-V210 PolarHBondContact O-N 3.47Å; Q207-D211 PolarHBondContact NE2-OD1 2.95Å; Q207-D211 WeakPolarHBondContact O-CB 3.07Å; Q207-D211 PolarHBondContact O-N 2.92Å
208	S	55.9	Low	53.8	Low	63 Å²	63	92.5 Å²	92.5	44%	0.441	49%	0.494	S	S	.	.	H	α-helix	trans	-63.8	-36.5	177.8	71.5	0	0	0	0	113	Q204 E205 I206 V212	Q204-S208 WeakPolarHBondContact O-CB 3.49Å; Q204-S208 PolarHBondContact O-N 3.19Å; Q204-S208 PolarHBondContact O-OG 3.25Å; E205-S208 PolarHBondContact O-N 2.93Å; E205-S208 PolarHBondContact O-OG 2.92Å; I206-S208 PolarHBondContact O-N 3.36Å; S208-V212 VanDerWaalsContact O-CG2 3.24Å; S208-V212 WeakPolarHBondContact O-CG2 3.46Å; S208-V212 PolarHBondContact O-N 2.94Å; S208-V212 VanDerWaalsContact O-N 3.12Å
209	T	56.9	Low	53.3	Low	93 Å²	93	91 Å²	91	57%	0.571	49%	0.493	S	S	*	.	H	α-helix	trans	-73	-35.3	176.7	40.1	0	0	0	0	112.1	E205 I206 Q207 G213	E205-T209 PolarHBondContact O-N 2.97Å; E205-T209 PolarHBondContact O-OG1 3.5Å; I206-T209 VanDerWaalsContact CA-OG1 3.31Å; I206-T209 WeakPolarHBondContact CA-OG1 3.36Å; I206-T209 PolarHBondContact O-N 3.4Å; I206-T209 PolarHBondContact O-OG1 2.83Å; Q207-T209 VanDerWaalsContact C-N 3.33Å; Q207-T209 PolarHBondContact O-N 3.4Å; T209-G213 PolarHBondContact O-N 3.38Å
210	V	54.2	Low	53.2	Low	67 Å²	67	88.9 Å²	88.9	41%	0.406	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-44.6	172.4	172.2	0	0	0	0	111.1	I206 Q207 V212 G213 I214	I206-V210 HydrophobicContact CG2-CG2 4.35Å; I206-V210 WeakPolarHBondContact O-CB 3.3Å; I206-V210 VanDerWaalsContact O-CG2 3.24Å; I206-V210 WeakPolarHBondContact O-CG2 3.28Å; I206-V210 PolarHBondContact O-N 3.45Å; Q207-V210 PolarHBondContact O-N 3.47Å; V210-V212 VanDerWaalsContact C-N 3.34Å; V210-V212 PolarHBondContact O-N 2.66Å; V210-G213 PolarHBondContact O-N 3.22Å; V210-G213 VanDerWaalsContact O-N 3.14Å; V210-I214 HydrophobicContact CG1-CD1 3.74Å; V210-I214 HydrophobicContact CG1-CG1 4.32Å; V210-I214 WeakPolarHBondContact O-CG1 3.36Å; V210-I214 PolarHBondContact O-N 3.14Å
211	D	57	Low	52.8	Low	73 Å²	73	86 Å²	86	39%	0.39	48%	0.48	S	S	.	.	H	α-helix	trans	-63.1	-39.7	180	-66.1	-17.7	0	0	0	111.6	Q207 I214 Q215	Q207-D211 PolarHBondContact NE2-OD1 2.95Å; Q207-D211 WeakPolarHBondContact O-CB 3.07Å; Q207-D211 PolarHBondContact O-N 2.92Å; D211-I214 PolarHBondContact O-N 3.4Å; D211-Q215 WeakPolarHBondContact O-CB 3.19Å; D211-Q215 PolarHBondContact O-N 3.11Å
212	V	58.4	Low	51.9	Low	87 Å²	87	85.6 Å²	85.6	53%	0.527	48%	0.48	S	S	.	.	H	α-helix	trans	-66	-40.4	173.2	172.3	0	0	0	0	111.4	S208 V210 Q215 T216	S208-V212 VanDerWaalsContact O-CG2 3.24Å; S208-V212 WeakPolarHBondContact O-CG2 3.46Å; S208-V212 PolarHBondContact O-N 2.94Å; S208-V212 VanDerWaalsContact O-N 3.12Å; V210-V212 VanDerWaalsContact C-N 3.34Å; V210-V212 PolarHBondContact O-N 2.66Å; V212-Q215 PolarHBondContact O-N 3.34Å; V212-T216 WeakPolarHBondContact O-CB 3.47Å; V212-T216 PolarHBondContact O-N 3.45Å; V212-T216 PolarHBondContact O-OG1 3.44Å
213	G	49.1	Very low	51.3	Low	30 Å²	30	88.7 Å²	88.7	31%	0.309	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-42.3	175.7	0	0	0	0	0	112.8	T209 V210 T216 L217	T209-G213 PolarHBondContact O-N 3.38Å; V210-G213 PolarHBondContact O-N 3.22Å; V210-G213 VanDerWaalsContact O-N 3.14Å; G213-T216 PolarHBondContact O-N 3.38Å; G213-L217 WeakPolarHBondContact O-CD1 3.29Å; G213-L217 WeakPolarHBondContact O-CG 3.26Å; G213-L217 PolarHBondContact O-N 3.23Å
214	I	55.9	Low	50.6	Low	89 Å²	89	92 Å²	92	46%	0.456	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-45.6	176.6	-66.2	168.2	0	0	0	110.6	V210 D211 T216 L217 T218	V210-I214 HydrophobicContact CG1-CD1 3.74Å; V210-I214 HydrophobicContact CG1-CG1 4.32Å; V210-I214 WeakPolarHBondContact O-CG1 3.36Å; V210-I214 PolarHBondContact O-N 3.14Å; D211-I214 PolarHBondContact O-N 3.4Å; I214-T216 VanDerWaalsContact C-N 3.29Å; I214-T216 PolarHBondContact O-N 3.04Å; I214-L217 PolarHBondContact O-N 2.95Å; I214-T218 HydrophobicContact CG2-CG2 4.43Å; I214-T218 PolarHBondContact O-N 2.93Å; I214-T218 PolarHBondContact O-OG1 3.39Å; I214-T218 VanDerWaalsContact O-OG1 3.09Å
215	Q	53.5	Low	49.7	Very low	134 Å²	134	94 Å²	94	63%	0.626	51%	0.505	S	S	*	.	H	α-helix	trans	-61.1	-37.8	177.2	-85.1	170.8	-2.5	0	0	112.8	D211 V212 T218 C219	D211-Q215 WeakPolarHBondContact O-CB 3.19Å; D211-Q215 PolarHBondContact O-N 3.11Å; V212-Q215 PolarHBondContact O-N 3.34Å; Q215-T218 VanDerWaalsContact CA-OG1 3.32Å; Q215-T218 WeakPolarHBondContact CA-OG1 3.33Å; Q215-T218 PolarHBondContact O-OG1 3.24Å; Q215-C219 VanDerWaalsContact O-CB 3.31Å; Q215-C219 WeakPolarHBondContact O-CB 3.29Å; Q215-C219 PolarHBondContact O-N 3.48Å
216	T	54.7	Low	49	Very low	83 Å²	83	94.2 Å²	94.2	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-44.7	176	-52.2	0	0	0	0	110.5	V212 G213 I214 C219 S220	V212-T216 WeakPolarHBondContact O-CB 3.47Å; V212-T216 PolarHBondContact O-N 3.45Å; V212-T216 PolarHBondContact O-OG1 3.44Å; G213-T216 PolarHBondContact O-N 3.38Å; I214-T216 VanDerWaalsContact C-N 3.29Å; I214-T216 PolarHBondContact O-N 3.04Å; T216-C219 PolarHBondContact O-N 2.94Å; T216-S220 PolarHBondContact O-N 2.92Å; T216-S220 PolarHBondContact O-OG 3.05Å
217	L	46	Very low	48.5	Very low	113 Å²	113	95.1 Å²	95.1	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-64.1	-43.1	176.8	-72.8	162.9	0	0	0	112.3	G213 I214 C219 S220 I221	G213-L217 WeakPolarHBondContact O-CD1 3.29Å; G213-L217 WeakPolarHBondContact O-CG 3.26Å; G213-L217 PolarHBondContact O-N 3.23Å; I214-L217 PolarHBondContact O-N 2.95Å; L217-C219 VanDerWaalsContact C-N 3.35Å; L217-S220 PolarHBondContact O-N 2.86Å; L217-I221 WeakPolarHBondContact O-CD1 3.48Å; L217-I221 WeakPolarHBondContact O-CG1 3.45Å; L217-I221 PolarHBondContact O-N 3.02Å
218	T	50.8	Low	47.8	Very low	62 Å²	62	98.3 Å²	98.3	38%	0.38	53%	0.529	S	S	.	.	H	α-helix	trans	-66.6	-36.9	177.6	48.3	0	0	0	0	112.1	I214 Q215 S220 I221 E222	I214-T218 HydrophobicContact CG2-CG2 4.43Å; I214-T218 PolarHBondContact O-N 2.93Å; I214-T218 PolarHBondContact O-OG1 3.39Å; I214-T218 VanDerWaalsContact O-OG1 3.09Å; Q215-T218 VanDerWaalsContact CA-OG1 3.32Å; Q215-T218 WeakPolarHBondContact CA-OG1 3.33Å; Q215-T218 PolarHBondContact O-OG1 3.24Å; T218-S220 VanDerWaalsContact C-N 3.35Å; T218-I221 PolarHBondContact O-N 3.14Å; T218-E222 WeakPolarHBondContact O-CB 3.49Å; T218-E222 VanDerWaalsContact O-CG 3.3Å; T218-E222 WeakPolarHBondContact O-CG 3.3Å; T218-E222 PolarHBondContact O-N 2.9Å
219	C	42.3	Very low	47.1	Very low	66 Å²	66	104 Å²	104	45%	0.446	55%	0.548	S	S	.	.	H	α-helix	trans	-68.1	-35.7	175.9	-153	0	0	0	0	111.6	Q215 T216 L217 E223	Q215-C219 VanDerWaalsContact O-CB 3.31Å; Q215-C219 WeakPolarHBondContact O-CB 3.29Å; Q215-C219 PolarHBondContact O-N 3.48Å; T216-C219 PolarHBondContact O-N 2.94Å; L217-C219 VanDerWaalsContact C-N 3.35Å; C219-E223 WeakPolarHBondContact O-CG 3.45Å; C219-E223 PolarHBondContact O-N 3.02Å; C219-E223 VanDerWaalsContact O-N 3.11Å
220	S	47.2	Very low	46.1	Very low	54 Å²	54	108.8 Å²	108.8	38%	0.378	56%	0.556	S	S	.	*	H	α-helix	trans	-71.6	-32.5	174	-58.6	0	0	0	0	113.2	T216 L217 T218 E223 E224	T216-S220 PolarHBondContact O-N 2.92Å; T216-S220 PolarHBondContact O-OG 3.05Å; L217-S220 PolarHBondContact O-N 2.86Å; T218-S220 VanDerWaalsContact C-N 3.35Å; S220-E223 PolarHBondContact O-N 2.87Å; S220-E224 WeakPolarHBondContact O-CG 3.3Å; S220-E224 PolarHBondContact O-N 3.34Å
221	I	44.6	Very low	45.2	Very low	91 Å²	91	112.7 Å²	112.7	47%	0.467	58%	0.575	S	S	.	*	H	α-helix	trans	-72.9	-36.4	175.3	-66	161.9	0	0	0	110.8	L217 T218 E223 E224 E225	L217-I221 WeakPolarHBondContact O-CD1 3.48Å; L217-I221 WeakPolarHBondContact O-CG1 3.45Å; L217-I221 PolarHBondContact O-N 3.02Å; T218-I221 PolarHBondContact O-N 3.14Å; I221-E223 VanDerWaalsContact C-N 3.33Å; I221-E224 PolarHBondContact O-N 3.09Å; I221-E225 PolarHBondContact O-N 3.37Å
222	E	39.2	Very low	43.8	Very low	125 Å²	125	115.4 Å²	115.4	58%	0.584	60%	0.598	S	S	*	*	H	α-helix	trans	-69.1	-29.8	174.2	-72.9	175.8	-168	0	0	112.5	T218	T218-E222 WeakPolarHBondContact O-CB 3.49Å; T218-E222 VanDerWaalsContact O-CG 3.3Å; T218-E222 WeakPolarHBondContact O-CG 3.3Å; T218-E222 PolarHBondContact O-N 2.9Å
223	E	41.3	Very low	42.6	Very low	125 Å²	125	116.7 Å²	116.7	58%	0.584	61%	0.606	S	S	*	*	H	α-helix	trans	-75	-34.6	172.1	-76.5	-178.8	174.8	0	0	112.8	C219 S220 I221 I227	C219-E223 WeakPolarHBondContact O-CG 3.45Å; C219-E223 PolarHBondContact O-N 3.02Å; C219-E223 VanDerWaalsContact O-N 3.11Å; S220-E223 PolarHBondContact O-N 2.87Å; I221-E223 VanDerWaalsContact C-N 3.33Å; E223-I227 WeakPolarHBondContact O-CD1 2.94Å; E223-I227 WeakPolarHBondContact O-CG1 3.35Å
224	E	37.9	Very low	41.9	Very low	141 Å²	141	123.1 Å²	123.1	66%	0.659	63%	0.628	S	S	*	*	H	α-helix	trans	-76.2	-33.1	177.6	-76	-176.1	168.3	0	0	113.2	S220 I221 L226 I227 H228	S220-E224 WeakPolarHBondContact O-CG 3.3Å; S220-E224 PolarHBondContact O-N 3.34Å; I221-E224 PolarHBondContact O-N 3.09Å; E224-L226 VanDerWaalsContact C-N 3.33Å; E224-L226 PolarHBondContact O-N 3.06Å; E224-I227 PolarHBondContact O-N 3.09Å; E224-H228 PolarHBondContact O-N 2.98Å
225	E	37.6	Very low	40.7	Very low	143 Å²	143	125.2 Å²	125.2	67%	0.668	64%	0.639	S	S	*	*	H	α-helix	trans	-71.8	-23.6	175.5	-81.5	-169.9	150.3	0	0	113.7	I221	I221-E225 PolarHBondContact O-N 3.37Å
226	L	39.9	Very low	39.5	Very low	129 Å²	129	124.1 Å²	124.1	68%	0.675	64%	0.642	S	S	*	*	H	α-helix	trans	-82.6	-15.2	175.1	-92	157.3	0	0	0	114	E224	E224-L226 VanDerWaalsContact C-N 3.33Å; E224-L226 PolarHBondContact O-N 3.06Å
227	I	43.1	Very low	38.6	Very low	124 Å²	124	128.8 Å²	128.8	64%	0.636	66%	0.658	S	S	*	*	H	α-helix	trans	-94.8	-23.2	178	-64.1	169.5	0	0	0	111.2	E223 E224 Q229	E223-I227 WeakPolarHBondContact O-CD1 2.94Å; E223-I227 WeakPolarHBondContact O-CG1 3.35Å; E224-I227 PolarHBondContact O-N 3.09Å; I227-Q229 VanDerWaalsContact C-N 3.32Å; I227-Q229 PolarHBondContact O-N 3.08Å
228	H	39.1	Very low	38	Very low	173 Å²	173	128.6 Å²	128.6	80%	0.801	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-5.7	-175	-136.7	-40.5	0	0	0	115.6	E224	E224-H228 PolarHBondContact O-N 2.98Å
229	Q	40.8	Very low	37.2	Very low	181 Å²	181	134.2 Å²	134.2	85%	0.846	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-2.5	176.5	-76.3	-177.9	-2.7	0	0	114.8	I227	I227-Q229 VanDerWaalsContact C-N 3.32Å; I227-Q229 PolarHBondContact O-N 3.08Å
230	R	35.1	Very low	36.8	Very low	194 Å²	194	138.4 Å²	138.4	73%	0.732	70%	0.703	S	S	*	*	S	Bend	trans	-126.3	119.5	175.7	-76	179.4	178.9	134.6	-0.8	109.4
231	N	34.9	Very low	35.9	Very low	150 Å²	150	143.6 Å²	143.6	80%	0.802	72%	0.723	S	S	*	*			trans	101.3	55	165.8	-47.4	-22.9	0	0	0	116.3	T233	N231-T233 PolarHBondContact O-N 3.23Å
232	C	29.1	Very low	35.4	Very low	130 Å²	130	146 Å²	146	88%	0.878	74%	0.743	S	S	*	*			trans	-63.5	103.8	132	-78.2	0	0	0	0	108.4
233	T	32.1	Very low	35	Very low	114 Å²	114	144.8 Å²	144.8	70%	0.699	74%	0.744	S	S	*	*			trans	173.5	131.9	144.1	34.9	0	0	0	0	110.3	N231	N231-T233 PolarHBondContact O-N 3.23Å
234	H	34.2	Very low	34.5	Very low	164 Å²	164	146 Å²	146	76%	0.759	75%	0.754	S	S	*	*			trans	86.3	103.1	162.8	-68.1	-74.8	0	0	0	121.3
235	L	31.1	Very low	34	Very low	134 Å²	134	146.4 Å²	146.4	70%	0.702	76%	0.76	S	S	*	*				74.1	100.9	130	-84.7	90.4	0	0	0	121.6
236	T	29	Very low	33.5	Very low	111 Å²	111	145.6 Å²	145.6	68%	0.681	77%	0.769	S	S	*	*				39.2	106.2	114.4	63.6	0	0	0	0	118.9
237	Q	34.6	Very low	33	Very low	180 Å²	180	144.4 Å²	144.4	84%	0.841	77%	0.771	S	S	*	*				162.9	141.3	108.1	-90.2	177.1	13.7	0	0	111.4
238	S	35	Very low	32.4	Very low	110 Å²	110	143.3 Å²	143.3	77%	0.769	78%	0.775	S	S	*	*			trans	72	136.6	166.7	-59.6	0	0	0	0	116.8
239	K	33.3	Very low	32.1	Very low	179 Å²	179	140.3 Å²	140.3	78%	0.778	77%	0.773	S	S	*	*			cis	-178.1	145.6	-20.6	-124.5	177.5	178.5	-178.8	0	103.7
240	D	33.6	Very low	31.4	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	77%	0.77	S	S	*	*			trans	74.1	89.8	163.2	-52.7	-29.7	0	0	0	118.9
241	M	28.6	Very low	31.2	Very low	163 Å²	163	136 Å²	136	80%	0.803	77%	0.77	S	S	*	*			trans	-88.6	125.5	160.5	177.2	-172.7	-56.5	0	0	108.5	T243	M241-T243 HydrophobicContact CG-CG2 4.45Å
242	T	34.4	Very low	30.9	Very low	142 Å²	142	134.8 Å²	134.8	87%	0.871	77%	0.768	S	S	*	*			trans	-138.2	100.1	147.4	44.8	0	0	0	0	109.5
243	T	29.5	Very low	30.8	Very low	100 Å²	100	139.4 Å²	139.4	61%	0.613	77%	0.769	S	S	*	*			trans	-59	141.6	156	49.6	0	0	0	0	110	M241	M241-T243 HydrophobicContact CG-CG2 4.45Å
244	N	31.2	Very low	30.8	Very low	149 Å²	149	141 Å²	141	80%	0.797	77%	0.773	S	S	*	*			trans	-169	98.4	146.7	-86.6	-26	0	0	0	107.6
245	L	28.6	Very low	30.5	Very low	150 Å²	150	140.8 Å²	140.8	79%	0.785	77%	0.772	S	S	*	*				59.4	114	94.1	-93.9	87.3	0	0	0	114.7
246	C	26	Very low	30.5	Very low	126 Å²	126	141.9 Å²	141.9	85%	0.851	78%	0.779	S	S	*	*			trans	-35.6	133.3	159	176.7	0	0	0	0	112.8
247	S	30.6	Very low	30.4	Very low	104 Å²	104	144.1 Å²	144.1	73%	0.727	79%	0.786	S	S	*	*			trans	-146.6	112.2	163	-72.2	0	0	0	0	109.7
248	S	29.2	Very low	30.2	Very low	101 Å²	101	145.5 Å²	145.5	71%	0.706	79%	0.789	S	S	*	*			trans	-30.5	139.8	158.6	47.2	0	0	0	0	114.5
249	S	32.4	Very low	29.9	Very low	111 Å²	111	144.8 Å²	144.8	78%	0.776	78%	0.784	S	S	*	*			trans	-134.5	88	158.5	-74.2	0	0	0	0	109.4
250	V	27.2	Very low	29.5	Very low	128 Å²	128	142.1 Å²	142.1	78%	0.776	78%	0.783	S	S	*	*			trans	-69.4	118	156.1	172.5	0	0	0	0	106.1	T252	V250-T252 HydrophobicContact CG1-CG2 4.42Å
251	Q	31.5	Very low	29.3	Very low	156 Å²	156	142.4 Å²	142.4	73%	0.729	78%	0.779	S	S	*	*			trans	-116.3	105.8	166.5	-74.5	-174.5	-10.2	0	0	108.4
252	T	27.3	Very low	29.1	Very low	125 Å²	125	140.8 Å²	140.8	77%	0.767	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-63.2	128.4	168.6	44	0	0	0	0	109.8	V250	V250-T252 HydrophobicContact CG1-CG2 4.42Å
253	Y	28.5	Very low	28.8	Very low	226 Å²	226	142.1 Å²	142.1	89%	0.886	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-90.4	118.7	167.2	-85.5	-82.3	0	0	0	109.6
254	D	31.5	Very low	28.6	Very low	147 Å²	147	144.5 Å²	144.5	79%	0.786	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-77.2	141	-177.3	-146.8	-10.9	0	0	0	111.2
255	E	27.4	Very low	28.4	Very low	160 Å²	160	142.8 Å²	142.8	75%	0.748	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-72.1	133.7	178.8	-65.2	179	145.6	0	0	110
256	N	31	Very low	28.2	Very low	158 Å²	158	143.7 Å²	143.7	85%	0.845	77%	0.767	S	S	*	*			trans	-144.6	100.4	155.2	-92.5	-60.6	0	0	0	110.9
257	L	26.8	Very low	28.3	Very low	158 Å²	158	144.1 Å²	144.1	83%	0.827	77%	0.766	S	S	*	*			trans	-44	131.3	159.6	-86.4	75.2	0	0	0	110.6
258	K	30.1	Very low	28	Very low	209 Å²	209	146.2 Å²	146.2	91%	0.909	77%	0.769	S	S	*	*			trans	-126.5	113.8	148.9	-98.3	-179.7	179.8	178	0	111
259	S	28.6	Very low	28.1	Very low	95 Å²	95	150.8 Å²	150.8	66%	0.664	78%	0.776	S	S	*	*			trans	-56.2	140.9	169.9	54.1	0	0	0	0	113.5
260	T	25.5	Very low	27.8	Very low	123 Å²	123	152.2 Å²	152.2	76%	0.755	78%	0.775	S	S	*	*			trans	58.7	141.8	131.2	60.7	0	0	0	0	121.8
261	H	28.7	Very low	28.1	Very low	159 Å²	159	156.7 Å²	156.7	74%	0.736	78%	0.78	S	S	*	*			trans	91.2	104.8	155.1	-93.1	-80.9	0	0	0	118.4
262	D	24.9	Very low	27.9	Very low	129 Å²	129	156.2 Å²	156.2	69%	0.69	78%	0.782	S	S	*	*				66.8	147.1	122.8	-80	-13.8	0	0	0	122.2
263	F	28.3	Very low	27.9	Very low	171 Å²	171	158.1 Å²	158.1	75%	0.75	79%	0.787	S	S	*	*			trans	90.7	97.8	152.8	-109.4	-101.3	0	0	0	118.5
264	Q	25.1	Very low	28.1	Very low	150 Å²	150	152.9 Å²	152.9	70%	0.701	78%	0.781	S	S	*	*				26.2	143.4	127.5	-64.4	172.7	-26.9	0	0	120.3
265	V	26.3	Very low	28	Very low	113 Å²	113	151.1 Å²	151.1	69%	0.685	78%	0.78	S	S	*	*			trans	108.4	112.7	146.9	-170.4	0	0	0	0	116.1
266	Q	24.7	Very low	27.9	Very low	168 Å²	168	149.8 Å²	149.8	79%	0.785	78%	0.782	S	S	*	*			trans	20.6	132.3	141.7	-62.4	161.1	-41.1	0	0	118.4
267	T	27.7	Very low	27.7	Very low	135 Å²	135	151.2 Å²	151.2	83%	0.828	78%	0.781	S	S	*	*				-176.2	136.3	114.8	30.4	0	0	0	0	111
268	D	24.8	Very low	27.7	Very low	149 Å²	149	150.5 Å²	150.5	80%	0.797	78%	0.777	S	S	*	*			trans	-60.5	145.2	170.5	-57.1	-62.7	0	0	0	111.7
269	F	31	Very low	27.6	Very low	197 Å²	197	147.9 Å²	147.9	86%	0.864	77%	0.772	S	S	*	*			trans	-155.6	112.3	145	-91.2	-68.8	0	0	0	112.2
270	N	26.3	Very low	27.9	Very low	141 Å²	141	151 Å²	151	75%	0.754	78%	0.776	S	S	*	*			trans	-51.4	140.7	160.9	-111.1	-27.2	0	0	0	112
271	Y	34.5	Very low	28.3	Very low	221 Å²	221	153.6 Å²	153.6	87%	0.867	78%	0.78	S	S	*	*			trans	-154.9	113.8	144	-97	-74.8	0	0	0	111.7
272	N	26.5	Very low	28.8	Very low	146 Å²	146	155.1 Å²	155.1	78%	0.781	78%	0.78	S	S	*	*			trans	-76.5	134.4	151.2	-76.9	-61.4	0	0	0	108.2
273	L	27.9	Very low	29.7	Very low	165 Å²	165	155.8 Å²	155.8	86%	0.864	78%	0.784	S	S	*	*				179.1	139.1	120.7	-154.2	61.9	0	0	0	110.8
274	P	32.9	Very low	30.8	Very low	117 Å²	117	151.1 Å²	151.1	76%	0.76	77%	0.767	S	S	*	*			trans	-98.1	148.8	-171.5	36.4	-32.1	0	0	0	113.8
275	S	28.2	Very low	32.1	Very low	110 Å²	110	152.5 Å²	152.5	77%	0.769	77%	0.766	S	S	*	*			trans	-157.4	112.5	163.4	41.6	0	0	0	0	113.7
276	V	25.9	Very low	33.5	Very low	131 Å²	131	150.8 Å²	150.8	79%	0.794	76%	0.759	S	S	*	*			trans	67	101.5	135.5	-167.6	0	0	0	0	119.9
277	K	27.1	Very low	35	Very low	189 Å²	189	147.1 Å²	147.1	82%	0.822	74%	0.744	S	S	*	*			trans	22.2	126.2	130.1	-50.8	-179.9	177.2	-179.1	0	116.4
278	I	26.3	Very low	36.2	Very low	143 Å²	143	146.1 Å²	146.1	73%	0.733	73%	0.73	S	S	*	*				-171.9	131.2	79.2	-77.2	149.4	0	0	0	108.2
279	D	28.6	Very low	37.9	Very low	154 Å²	154	144 Å²	144	82%	0.824	72%	0.718	S	S	*	*	S	Bend	trans	51.7	58.4	156.4	-58.6	-23.5	0	0	0	122.8
280	Q	34.2	Very low	39.6	Very low	159 Å²	159	140 Å²	140	74%	0.743	71%	0.705	S	S	*	*			trans	-135.7	12.8	165.4	-72.1	-175.9	-15.3	0	0	115.1	N284	Q280-N284 PolarHBondContact O-ND2 3.33Å
281	H	34.5	Very low	41.1	Very low	178 Å²	178	137 Å²	137	82%	0.824	69%	0.689	S	S	*	*	S	Bend	trans	-88	-11.3	-161.7	-137.1	-66.2	0	0	0	116
282	Y	39.9	Very low	42.5	Very low	191 Å²	191	129.9 Å²	129.9	75%	0.749	67%	0.668	S	S	*	*	S	Bend	trans	-98.9	-30.6	-175.1	-114.7	-96.7	0	0	0	114.6
283	N	43.1	Very low	44.5	Very low	144 Å²	144	126.3 Å²	126.3	77%	0.77	65%	0.654	S	S	*	*	H	α-helix	trans	-82.3	-11.7	179	-91.1	-14.9	0	0	0	114.8
284	N	52	Low	46.6	Very low	72 Å²	72	123.2 Å²	123.2	39%	0.385	64%	0.638	S	S	.	*	H	α-helix	trans	-86.5	-21.9	-180	-85.4	-55	0	0	0	113.5	Q280 Q288	Q280-N284 PolarHBondContact O-ND2 3.33Å; N284-Q288 WeakPolarHBondContact O-CB 3.3Å; N284-Q288 WeakPolarHBondContact O-CG 3.5Å; N284-Q288 PolarHBondContact O-N 3.21Å
285	R	51.8	Low	48.2	Very low	180 Å²	180	123.2 Å²	123.2	68%	0.679	63%	0.631	S	S	*	*	H	α-helix	trans	-73.6	-41	-172.1	-163.5	177.2	-177.7	-162.3	-1.3	112.5	Q288 L289	R285-Q288 PolarHBondContact O-N 3.25Å; R285-L289 HydrophobicContact CG-CD1 4.33Å; R285-L289 WeakPolarHBondContact O-CB 3.18Å; R285-L289 WeakPolarHBondContact O-CD1 3.48Å; R285-L289 VanDerWaalsContact O-CG 3.27Å; R285-L289 WeakPolarHBondContact O-CG 3.49Å; R285-L289 PolarHBondContact O-N 3.44Å
286	S	55.2	Low	49.9	Very low	77 Å²	77	124.7 Å²	124.7	54%	0.538	62%	0.623	S	S	.	*	H	α-helix	trans	-66.3	-42.9	174.8	48.4	0	0	0	0	111.5	L289 L290	S286-L289 PolarHBondContact O-N 3.48Å; S286-L290 WeakPolarHBondContact O-CB 3.37Å; S286-L290 PolarHBondContact O-N 2.99Å
287	L	57	Low	52.3	Low	90 Å²	90	123.4 Å²	123.4	47%	0.471	61%	0.611	S	S	.	*	H	α-helix	trans	-67.8	-38	175.5	-165.9	69.8	0	0	0	112.2	L290 N291	L287-L290 PolarHBondContact O-N 3.42Å; L287-N291 VanDerWaalsContact O-CB 3.28Å; L287-N291 WeakPolarHBondContact O-CB 3.5Å; L287-N291 VanDerWaalsContact O-CG 3.26Å; L287-N291 PolarHBondContact O-N 2.86Å
288	Q	52.6	Low	54.5	Low	115 Å²	115	118.6 Å²	118.6	54%	0.537	60%	0.598	S	S	.	*	H	α-helix	trans	-64.5	-43.4	172.7	-79	169.4	-6.1	0	0	111.5	N284 R285 L290 N291 V292	N284-Q288 WeakPolarHBondContact O-CB 3.3Å; N284-Q288 WeakPolarHBondContact O-CG 3.5Å; N284-Q288 PolarHBondContact O-N 3.21Å; R285-Q288 PolarHBondContact O-N 3.25Å; Q288-L290 VanDerWaalsContact C-N 3.33Å; Q288-N291 PolarHBondContact O-N 3.16Å; Q288-V292 WeakPolarHBondContact O-CB 3.43Å; Q288-V292 VanDerWaalsContact O-CG2 3.24Å; Q288-V292 WeakPolarHBondContact O-CG2 3.36Å; Q288-V292 PolarHBondContact O-N 2.73Å
289	L	60.6	Low	56.4	Low	105 Å²	105	117.3 Å²	117.3	55%	0.55	59%	0.588	S	S	.	*	H	α-helix	trans	-63.2	-40.6	174.9	-79	162.9	0	0	0	111.5	R285 S286 S293	R285-L289 HydrophobicContact CG-CD1 4.33Å; R285-L289 WeakPolarHBondContact O-CB 3.18Å; R285-L289 WeakPolarHBondContact O-CD1 3.48Å; R285-L289 VanDerWaalsContact O-CG 3.27Å; R285-L289 WeakPolarHBondContact O-CG 3.49Å; R285-L289 PolarHBondContact O-N 3.44Å; S286-L289 PolarHBondContact O-N 3.48Å; L289-S293 VanDerWaalsContact O-CB 3.28Å; L289-S293 WeakPolarHBondContact O-CB 3.45Å; L289-S293 PolarHBondContact O-N 2.76Å; L289-S293 PolarHBondContact O-OG 3.15Å
290	L	66.9	Low	58.4	Low	112 Å²	112	112.1 Å²	112.1	59%	0.586	57%	0.567	S	S	*	*	H	α-helix	trans	-64.7	-46.2	174.7	-157.8	88.2	0	0	0	111	S286 L287 Q288 V292 S293 L294	S286-L290 WeakPolarHBondContact O-CB 3.37Å; S286-L290 PolarHBondContact O-N 2.99Å; L287-L290 PolarHBondContact O-N 3.42Å; Q288-L290 VanDerWaalsContact C-N 3.33Å; L290-V292 PolarHBondContact O-N 3.47Å; L290-S293 CarbonylContact O-C 3.47Å; L290-S293 PolarHBondContact O-N 3.17Å; L290-L294 WeakPolarHBondContact O-CB 3.4Å; L290-L294 PolarHBondContact O-N 3.04Å
291	N	57.9	Low	60.6	Low	79 Å²	79	109.1 Å²	109.1	42%	0.422	56%	0.556	S	S	.	*	H	α-helix	trans	-61.8	-44.1	177.2	-79.6	-16.6	0	0	0	111.8	L287 Q288 S293 L294 I295	L287-N291 VanDerWaalsContact O-CB 3.28Å; L287-N291 WeakPolarHBondContact O-CB 3.5Å; L287-N291 VanDerWaalsContact O-CG 3.26Å; L287-N291 PolarHBondContact O-N 2.86Å; Q288-N291 PolarHBondContact O-N 3.16Å; N291-S293 VanDerWaalsContact C-N 3.32Å; N291-S293 PolarHBondContact O-N 2.79Å; N291-L294 PolarHBondContact O-N 2.69Å; N291-I295 WeakPolarHBondContact O-CB 3.37Å; N291-I295 WeakPolarHBondContact O-CD1 3.44Å; N291-I295 WeakPolarHBondContact O-CG1 3.21Å; N291-I295 PolarHBondContact O-N 3.48Å
292	V	63.1	Low	62.7	Low	70 Å²	70	108.6 Å²	108.6	42%	0.424	55%	0.546	S	S	.	.	H	α-helix	trans	-63.9	-40.2	175.3	170.4	0	0	0	0	110.8	Q288 L290 I295 K296	Q288-V292 WeakPolarHBondContact O-CB 3.43Å; Q288-V292 VanDerWaalsContact O-CG2 3.24Å; Q288-V292 WeakPolarHBondContact O-CG2 3.36Å; Q288-V292 PolarHBondContact O-N 2.73Å; L290-V292 PolarHBondContact O-N 3.47Å; V292-I295 PolarHBondContact O-N 2.96Å; V292-K296 HydrophobicContact CG1-CD 4.21Å; V292-K296 WeakPolarHBondContact O-CB 3.4Å; V292-K296 VanDerWaalsContact O-CG 3.26Å; V292-K296 WeakPolarHBondContact O-CG 3.5Å; V292-K296 PolarHBondContact O-N 3.42Å
293	S	70	Confident	64.2	Low	71 Å²	71	101.4 Å²	101.4	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-40	176.2	-58.3	0	0	0	0	111.6	L289 L290 N291 K296 L297	L289-S293 VanDerWaalsContact O-CB 3.28Å; L289-S293 WeakPolarHBondContact O-CB 3.45Å; L289-S293 PolarHBondContact O-N 2.76Å; L289-S293 PolarHBondContact O-OG 3.15Å; L290-S293 CarbonylContact O-C 3.47Å; L290-S293 PolarHBondContact O-N 3.17Å; N291-S293 VanDerWaalsContact C-N 3.32Å; N291-S293 PolarHBondContact O-N 2.79Å; S293-K296 PolarHBondContact O-N 2.75Å; S293-L297 WeakPolarHBondContact O-CB 3.33Å; S293-L297 PolarHBondContact O-N 3.03Å
294	L	71.6	Confident	66.1	Low	100 Å²	100	100 Å²	100	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-44.7	176	-157.5	91.5	0	0	0	111.1	L290 N291 K296 L297 V298	L290-L294 WeakPolarHBondContact O-CB 3.4Å; L290-L294 PolarHBondContact O-N 3.04Å; N291-L294 PolarHBondContact O-N 2.69Å; L294-K296 VanDerWaalsContact C-N 3.33Å; L294-K296 PolarHBondContact O-N 2.79Å; L294-L297 WeakPolarHBondContact O-CB 3.48Å; L294-L297 PolarHBondContact O-N 3.37Å; L294-V298 WeakPolarHBondContact O-CB 3.27Å; L294-V298 VanDerWaalsContact O-CG2 3.29Å; L294-V298 WeakPolarHBondContact O-CG2 3.49Å; L294-V298 PolarHBondContact O-N 3.03Å
295	I	65.4	Low	67.4	Low	117 Å²	117	101.3 Å²	101.3	60%	0.6	52%	0.516	S	S	*	.	H	α-helix	trans	-60.6	-44.2	175.5	-69.8	163.1	0	0	0	110.4	N291 V292 L297 V298 H299	N291-I295 WeakPolarHBondContact O-CB 3.37Å; N291-I295 WeakPolarHBondContact O-CD1 3.44Å; N291-I295 WeakPolarHBondContact O-CG1 3.21Å; N291-I295 PolarHBondContact O-N 3.48Å; V292-I295 PolarHBondContact O-N 2.96Å; I295-L297 VanDerWaalsContact C-N 3.34Å; I295-L297 PolarHBondContact O-N 2.94Å; I295-V298 PolarHBondContact O-N 3.4Å; I295-H299 VanDerWaalsContact O-CB 3.3Å; I295-H299 WeakPolarHBondContact O-CB 3.23Å; I295-H299 PolarHBondContact O-N 3.37Å
296	K	64.5	Low	68.7	Low	142 Å²	142	95.6 Å²	95.6	62%	0.617	50%	0.499	S	S	*	.	H	α-helix	trans	-62.1	-41.4	175.5	-75.2	174.4	179.9	-179.4	0	111.8	V292 S293 L294 H299 A300	V292-K296 HydrophobicContact CG1-CD 4.21Å; V292-K296 WeakPolarHBondContact O-CB 3.4Å; V292-K296 VanDerWaalsContact O-CG 3.26Å; V292-K296 WeakPolarHBondContact O-CG 3.5Å; V292-K296 PolarHBondContact O-N 3.42Å; S293-K296 PolarHBondContact O-N 2.75Å; L294-K296 VanDerWaalsContact C-N 3.33Å; L294-K296 PolarHBondContact O-N 2.79Å; K296-H299 PolarHBondContact O-N 3.38Å; K296-A300 WeakPolarHBondContact O-CB 3.4Å; K296-A300 PolarHBondContact O-N 3.26Å
297	L	75.5	Confident	69.9	Low	103 Å²	103	93 Å²	93	54%	0.539	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-49.4	176.9	-169.7	86.1	0	0	0	111.4	S293 L294 I295 H299 A300 L301	S293-L297 WeakPolarHBondContact O-CB 3.33Å; S293-L297 PolarHBondContact O-N 3.03Å; L294-L297 WeakPolarHBondContact O-CB 3.48Å; L294-L297 PolarHBondContact O-N 3.37Å; I295-L297 VanDerWaalsContact C-N 3.34Å; I295-L297 PolarHBondContact O-N 2.94Å; L297-H299 VanDerWaalsContact C-N 3.29Å; L297-H299 PolarHBondContact O-N 2.88Å; L297-A300 PolarHBondContact O-N 3.25Å; L297-L301 HydrophobicContact CD2-CD1 4.39Å; L297-L301 HydrophobicContact CG-CD1 4.24Å; L297-L301 WeakPolarHBondContact O-CB 3.37Å; L297-L301 WeakPolarHBondContact O-CG 3.45Å; L297-L301 PolarHBondContact O-N 3.21Å
298	V	73.9	Confident	71.1	Confident	89 Å²	89	90.9 Å²	90.9	54%	0.539	48%	0.476	S	S	.	.	H	α-helix	trans	-60.1	-41	177.8	171.1	0	0	0	0	110.7	L294 I295 L301 R302	L294-V298 WeakPolarHBondContact O-CB 3.27Å; L294-V298 VanDerWaalsContact O-CG2 3.29Å; L294-V298 WeakPolarHBondContact O-CG2 3.49Å; L294-V298 PolarHBondContact O-N 3.03Å; I295-V298 PolarHBondContact O-N 3.4Å; V298-L301 PolarHBondContact O-N 3.46Å; V298-R302 WeakPolarHBondContact O-CB 3.28Å; V298-R302 PolarHBondContact O-N 2.89Å
299	H	65.4	Low	72.6	Confident	115 Å²	115	90.6 Å²	90.6	53%	0.532	48%	0.475	S	S	.	.	H	α-helix	trans	-65.6	-42.6	175.9	-169.3	69.6	0	0	0	112.3	I295 K296 L297 R302 I303	I295-H299 VanDerWaalsContact O-CB 3.3Å; I295-H299 WeakPolarHBondContact O-CB 3.23Å; I295-H299 PolarHBondContact O-N 3.37Å; K296-H299 PolarHBondContact O-N 3.38Å; L297-H299 VanDerWaalsContact C-N 3.29Å; L297-H299 PolarHBondContact O-N 2.88Å; H299-R302 PolarHBondContact O-N 2.87Å; H299-I303 WeakPolarHBondContact O-CG1 3.12Å; H299-I303 PolarHBondContact O-N 2.66Å; H299-I303 VanDerWaalsContact O-N 3.08Å
300	A	72.3	Confident	73.5	Confident	46 Å²	46	90 Å²	90	38%	0.38	47%	0.472	S	S	.	.	H	α-helix	trans	-62.1	-45.6	175.3	0	0	0	0	0	111.9	K296 L297 R302 I303 E304	K296-A300 WeakPolarHBondContact O-CB 3.4Å; K296-A300 PolarHBondContact O-N 3.26Å; L297-A300 PolarHBondContact O-N 3.25Å; A300-R302 VanDerWaalsContact C-N 3.33Å; A300-R302 PolarHBondContact O-N 3.36Å; A300-I303 PolarHBondContact O-N 3.32Å; A300-E304 PolarHBondContact O-N 3.38Å
301	L	80	Confident	74.2	Confident	96 Å²	96	89.9 Å²	89.9	50%	0.503	47%	0.468	S	S	.	.	H	α-helix	trans	-62.7	-37.9	176.6	-72.2	173.3	0	0	0	112.3	L297 V298 E304 L305	L297-L301 HydrophobicContact CD2-CD1 4.39Å; L297-L301 HydrophobicContact CG-CD1 4.24Å; L297-L301 WeakPolarHBondContact O-CB 3.37Å; L297-L301 WeakPolarHBondContact O-CG 3.45Å; L297-L301 PolarHBondContact O-N 3.21Å; V298-L301 PolarHBondContact O-N 3.46Å; L301-E304 PolarHBondContact O-N 2.99Å; L301-L305 WeakPolarHBondContact O-CB 3.37Å; L301-L305 PolarHBondContact O-N 2.83Å
302	R	77.7	Confident	75.2	Confident	166 Å²	166	90.6 Å²	90.6	63%	0.626	47%	0.472	S	S	*	.	H	α-helix	trans	-62.4	-44.1	174.4	-174.9	179	178.5	-170.5	1.8	111.6	V298 H299 A300 E304 L305 D306	V298-R302 WeakPolarHBondContact O-CB 3.28Å; V298-R302 PolarHBondContact O-N 2.89Å; H299-R302 PolarHBondContact O-N 2.87Å; A300-R302 VanDerWaalsContact C-N 3.33Å; A300-R302 PolarHBondContact O-N 3.36Å; R302-E304 VanDerWaalsContact C-N 3.34Å; R302-L305 PolarHBondContact O-N 3.08Å; R302-D306 PolarHBondContact O-N 3.27Å
303	I	71.1	Confident	76.1	Confident	41 Å²	41	94.9 Å²	94.9	21%	0.21	48%	0.481	C	S	.	.	H	α-helix	trans	-62.4	-42.8	176.6	-67.2	165.8	0	0	0	110.8	H157 V158 H299 A300 S307	H157-I303 HydrophobicContact CB-CG2 4.49Å; V158-I303 HydrophobicContact CG1-CG2 3.77Å; H299-I303 WeakPolarHBondContact O-CG1 3.12Å; H299-I303 PolarHBondContact O-N 2.66Å; H299-I303 VanDerWaalsContact O-N 3.08Å; A300-I303 PolarHBondContact O-N 3.32Å; I303-S307 WeakPolarHBondContact O-CB 3.31Å; I303-S307 PolarHBondContact O-N 2.91Å
304	E	82.5	Confident	76.4	Confident	113 Å²	113	96.5 Å²	96.5	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-41.8	176.5	-75.3	-176.3	-176.1	0	0	112	A300 L301 R302 S307 A308	A300-E304 PolarHBondContact O-N 3.38Å; L301-E304 PolarHBondContact O-N 2.99Å; R302-E304 VanDerWaalsContact C-N 3.34Å; E304-S307 WeakPolarHBondContact O-CB 3.32Å; E304-S307 PolarHBondContact O-N 3.02Å; E304-A308 WeakPolarHBondContact O-CB 3.21Å; E304-A308 PolarHBondContact O-N 2.8Å
305	L	81.1	Confident	76.7	Confident	100 Å²	100	100 Å²	100	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-48	176.4	-174.7	66.3	0	0	0	111.8	L301 R302 S307 A308 Q309	L301-L305 WeakPolarHBondContact O-CB 3.37Å; L301-L305 PolarHBondContact O-N 2.83Å; R302-L305 PolarHBondContact O-N 3.08Å; L305-S307 VanDerWaalsContact C-N 3.26Å; L305-S307 PolarHBondContact O-N 2.91Å; L305-A308 PolarHBondContact O-N 2.82Å; L305-Q309 WeakPolarHBondContact O-CB 3.38Å; L305-Q309 WeakPolarHBondContact O-CG 3.28Å; L305-Q309 PolarHBondContact O-N 2.94Å
306	D	79.2	Confident	77.2	Confident	61 Å²	61	100.9 Å²	100.9	33%	0.326	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-37.7	176.6	-71.8	-17.2	0	0	0	110.8	R302 N310	R302-D306 PolarHBondContact O-N 3.27Å; D306-N310 WeakPolarHBondContact O-CB 3.47Å; D306-N310 VanDerWaalsContact O-CG 3.27Å; D306-N310 PolarHBondContact O-N 3.35Å; D306-N310 PolarHBondContact O-ND2 3.08Å
307	S	79.8	Confident	77.3	Confident	22 Å²	22	97.7 Å²	97.7	15%	0.154	49%	0.49	C	S	.	.	H	α-helix	trans	-63.6	-48.1	174.7	-166.7	0	0	0	0	111.7	I303 E304 L305 Q309 N310 E311	I303-S307 WeakPolarHBondContact O-CB 3.31Å; I303-S307 PolarHBondContact O-N 2.91Å; E304-S307 WeakPolarHBondContact O-CB 3.32Å; E304-S307 PolarHBondContact O-N 3.02Å; L305-S307 VanDerWaalsContact C-N 3.26Å; L305-S307 PolarHBondContact O-N 2.91Å; S307-Q309 PolarHBondContact O-N 3.44Å; S307-N310 PolarHBondContact O-N 3.27Å; S307-E311 PolarHBondContact O-N 3.42Å
308	A	82.3	Confident	76.1	Confident	46 Å²	46	104.2 Å²	104.2	38%	0.38	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-39.2	179.4	0	0	0	0	0	112.3	E304 L305 E311 L312	E304-A308 WeakPolarHBondContact O-CB 3.21Å; E304-A308 PolarHBondContact O-N 2.8Å; L305-A308 PolarHBondContact O-N 2.82Å; A308-E311 PolarHBondContact O-N 2.92Å; A308-L312 WeakPolarHBondContact O-CG 3.35Å; A308-L312 PolarHBondContact O-N 2.76Å
309	Q	84	Confident	76.2	Confident	108 Å²	108	105 Å²	105	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-63.9	-42.6	175.4	-74.8	-180	-11.8	0	0	112	L305 S307 L312 Y313	L305-Q309 WeakPolarHBondContact O-CB 3.38Å; L305-Q309 WeakPolarHBondContact O-CG 3.28Å; L305-Q309 PolarHBondContact O-N 2.94Å; S307-Q309 PolarHBondContact O-N 3.44Å; Q309-L312 PolarHBondContact O-N 2.61Å; Q309-Y313 PolarHBondContact O-N 3.42Å
310	N	79.4	Confident	76.8	Confident	92 Å²	92	104.4 Å²	104.4	49%	0.492	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-41.6	175.3	-75.8	-43.9	0	0	0	111.7	D306 S307 L312 Y313 M314	D306-N310 WeakPolarHBondContact O-CB 3.47Å; D306-N310 VanDerWaalsContact O-CG 3.27Å; D306-N310 PolarHBondContact O-N 3.35Å; D306-N310 PolarHBondContact O-ND2 3.08Å; S307-N310 PolarHBondContact O-N 3.27Å; N310-L312 VanDerWaalsContact C-N 3.34Å; N310-L312 PolarHBondContact O-N 2.99Å; N310-Y313 PolarHBondContact O-N 2.81Å; N310-M314 WeakPolarHBondContact O-CB 3.5Å; N310-M314 WeakPolarHBondContact O-CG 3.23Å; N310-M314 PolarHBondContact O-N 3.47Å
311	E	81.4	Confident	77.1	Confident	110 Å²	110	107.7 Å²	107.7	51%	0.514	52%	0.519	S	S	.	.	H	α-helix	trans	-61.3	-40.6	174.6	-74.2	-176.2	-167.3	0	0	112.6	S307 A308 M314 R315	S307-E311 PolarHBondContact O-N 3.42Å; A308-E311 PolarHBondContact O-N 2.92Å; E311-M314 PolarHBondContact O-N 3.46Å; E311-R315 WeakPolarHBondContact O-CG 3.46Å; E311-R315 PolarHBondContact O-N 3.23Å
312	L	79.8	Confident	76.9	Confident	95 Å²	95	108.4 Å²	108.4	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-44.1	175.7	-73.4	173.7	0	0	0	112.2	A308 Q309 N310 M314 R315 N316	A308-L312 WeakPolarHBondContact O-CG 3.35Å; A308-L312 PolarHBondContact O-N 2.76Å; Q309-L312 PolarHBondContact O-N 2.61Å; N310-L312 VanDerWaalsContact C-N 3.34Å; N310-L312 PolarHBondContact O-N 2.99Å; L312-M314 VanDerWaalsContact C-N 3.3Å; L312-M314 PolarHBondContact O-N 3.01Å; L312-R315 PolarHBondContact O-N 3.22Å; L312-N316 PolarHBondContact O-N 2.98Å
313	Y	81.9	Confident	76.8	Confident	159 Å²	159	104.8 Å²	104.8	62%	0.624	51%	0.514	S	S	*	.	H	α-helix	trans	-59.9	-41.4	176.6	-177	-97.9	0	0	0	111.8	Q309 N310 N316 S317	Q309-Y313 PolarHBondContact O-N 3.42Å; N310-Y313 PolarHBondContact O-N 2.81Å; Y313-N316 PolarHBondContact O-N 3.04Å; Y313-S317 WeakPolarHBondContact O-CB 3.08Å; Y313-S317 PolarHBondContact O-N 3.45Å; Y313-S317 PolarHBondContact O-OG 2.96Å
314	M	76	Confident	77.2	Confident	106 Å²	106	109 Å²	109	52%	0.522	53%	0.534	S	S	.	.	H	α-helix	trans	-71.1	-27.9	177.2	-65.2	-63.3	-105.7	0	0	113.3	N310 E311 L312	N310-M314 WeakPolarHBondContact O-CB 3.5Å; N310-M314 WeakPolarHBondContact O-CG 3.23Å; N310-M314 PolarHBondContact O-N 3.47Å; E311-M314 PolarHBondContact O-N 3.46Å; L312-M314 VanDerWaalsContact C-N 3.3Å; L312-M314 PolarHBondContact O-N 3.01Å
315	R	78	Confident	76.8	Confident	173 Å²	173	108.7 Å²	108.7	65%	0.653	53%	0.534	S	S	*	.	H	α-helix	trans	-73.1	-38.4	170.9	-78.7	-176.9	-177.6	150.1	6.5	112.5	E311 L312 S317	E311-R315 WeakPolarHBondContact O-CG 3.46Å; E311-R315 PolarHBondContact O-N 3.23Å; L312-R315 PolarHBondContact O-N 3.22Å; R315-S317 VanDerWaalsContact C-N 3.35Å
316	N	75.7	Confident	76.5	Confident	136 Å²	136	109.4 Å²	109.4	73%	0.727	54%	0.535	S	S	*	.	H	α-helix	trans	-79.1	-17.3	-179.1	-68.5	-14.8	0	0	0	113.6	L312 Y313	L312-N316 PolarHBondContact O-N 2.98Å; Y313-N316 PolarHBondContact O-N 3.04Å
317	S	66.3	Low	76.3	Confident	74 Å²	74	113.4 Å²	113.4	52%	0.517	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.4	3	177.3	-55.9	0	0	0	0	113.7	Y313 R315	Y313-S317 WeakPolarHBondContact O-CB 3.08Å; Y313-S317 PolarHBondContact O-N 3.45Å; Y313-S317 PolarHBondContact O-OG 2.96Å; R315-S317 VanDerWaalsContact C-N 3.35Å
318	K	50.8	Low	76	Confident	240 Å²	240	121.7 Å²	121.7	100%	1.043	59%	0.589	S	S	*	*			trans	-107.1	0	170.4	-75	-174.9	177.7	-178.1	0	110.1

Retrieved 318 of 318 residues in 414.9 ms (Link to these results)

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