A0A077Z924_TRITR Loading...

histidine kinase

AlphaFold DB , UniProt , Accession A0A077Z924, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 535 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	63.3	Low	242 Å²	242	141.7 Å²	141.7	100%	1.192	66%	0.661	S	S	*	*				0	110.1	0	-92.5	174.2	155.1	0	0	108.9	R3	M1-R3 PolarHBondContact O-N 2.79Å
2	L	41.1	Very low	65	Low	181 Å²	181	135.5 Å²	135.5	95%	0.948	64%	0.64	S	S	*	*			trans	-64.1	101.1	173.4	-82.4	138.5	0	0	0	108.8	K4	L2-K4 PolarHBondContact O-N 3.07Å
3	R	47.2	Very low	66.5	Low	243 Å²	243	126.8 Å²	126.8	92%	0.917	60%	0.601	S	S	*	*			trans	-65.3	103.5	177.8	-144.6	175.3	-175.8	-171.8	-0.3	107.2	M1 R5	M1-R3 PolarHBondContact O-N 2.79Å; R3-R5 PolarHBondContact O-N 3.05Å
4	K	55.5	Low	67.7	Low	198 Å²	198	121.9 Å²	121.9	86%	0.861	58%	0.58	S	S	*	*			trans	-55.4	114.9	175.6	-74.9	-176.1	177.4	-179.6	0	107.7	L2	L2-K4 PolarHBondContact O-N 3.07Å
5	R	60.3	Low	68.9	Low	236 Å²	236	121.2 Å²	121.2	89%	0.891	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-61.5	123.9	173.1	-73.8	-177.4	174.4	179.2	-2.6	107.5	R3 M7	R3-R5 PolarHBondContact O-N 3.05Å; R5-M7 PolarHBondContact O-N 3.21Å
6	P	66.7	Low	70	Confident	82 Å²	82	121.1 Å²	121.1	53%	0.532	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-57.8	141.4	175.7	24.5	-32.1	0	0	0	109.1	K8 Y207	P6-K8 PolarHBondContact O-N 2.96Å; P6-Y207 HydrophobicContact CG-CD1 3.99Å; P6-Y207 HydrophobicContact CG-CG 4.17Å
7	M	69.4	Low	71	Confident	119 Å²	119	116.5 Å²	116.5	59%	0.586	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-61.3	138.3	175.7	-74.7	178.8	63.5	0	0	109.6	R5 L9 T11	R5-M7 PolarHBondContact O-N 3.21Å; M7-L9 PolarHBondContact O-N 3.2Å; M7-T11 HydrophobicContact CE-CG2 3.65Å
8	K	79.4	Confident	71.7	Confident	111 Å²	111	112.2 Å²	112.2	48%	0.483	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-56.6	137.8	178.4	-58.6	-165.5	159	-159.8	0	110.4	P6 S10 T11 T12 E205	P6-K8 PolarHBondContact O-N 2.96Å; K8-S10 PolarHBondContact O-N 3.33Å; K8-S10 VanDerWaalsContact O-N 3.1Å; K8-T11 WeakPolarHBondContact O-CA 3.17Å; K8-T11 WeakPolarHBondContact O-CB 3.08Å; K8-T11 PolarHBondContact O-N 3.06Å; K8-T12 PolarHBondContact O-N 2.79Å; K8-T12 PolarHBondContact O-OG1 3.23Å; K8-E205 VanDerWaalsContact CA-OE2 3.3Å; K8-E205 WeakPolarHBondContact CA-OE2 3.34Å; K8-E205 WeakPolarHBondContact CD-OE1 3.29Å; K8-E205 WeakPolarHBondContact CE-OE1 3.44Å; K8-E205 WeakPolarHBondContact CG-OE1 3.38Å; K8-E205 WeakPolarHBondContact CG-OE2 3.03Å; K8-E205 IonicContact NZ-OE1 3.3Å
9	L	76.7	Confident	72.5	Confident	62 Å²	62	109.1 Å²	109.1	33%	0.325	54%	0.54	S	S	.	.	H	α-helix	trans	-50.7	-40.4	177.5	-178.1	71.3	0	0	0	111.5	M7 T11 T12 V13 P206	M7-L9 PolarHBondContact O-N 3.2Å; L9-T11 VanDerWaalsContact C-N 3.3Å; L9-T11 PolarHBondContact O-N 3.49Å; L9-T12 PolarHBondContact O-N 2.88Å; L9-V13 HydrophobicContact CD1-CG2 4.06Å; L9-V13 HydrophobicContact CG-CG2 4.16Å; L9-V13 WeakPolarHBondContact O-CB 3.37Å; L9-V13 VanDerWaalsContact O-CG2 3.29Å; L9-V13 WeakPolarHBondContact O-CG2 3.07Å; L9-V13 PolarHBondContact O-N 2.9Å; L9-P206 HydrophobicContact CB-CG 4.42Å; L9-P206 HydrophobicContact CD1-CG 4.47Å; L9-P206 HydrophobicContact CD2-CG 4.06Å
10	S	76.8	Confident	73.3	Confident	22 Å²	22	108.1 Å²	108.1	15%	0.154	54%	0.54	C	S	.	.	H	α-helix	trans	-56.1	-44.6	176.2	54	0	0	0	0	112.4	K8 I14 V194	K8-S10 PolarHBondContact O-N 3.33Å; K8-S10 VanDerWaalsContact O-N 3.1Å; S10-I14 VanDerWaalsContact O-CB 3.29Å; S10-I14 WeakPolarHBondContact O-CB 3.45Å; S10-I14 VanDerWaalsContact O-CD1 3.25Å; S10-I14 WeakPolarHBondContact O-CD1 3.5Å; S10-I14 WeakPolarHBondContact O-CG1 3.49Å; S10-I14 PolarHBondContact O-N 2.99Å; S10-V194 VanDerWaalsContact CB-CG1 3.44Å
11	T	82.4	Confident	74	Confident	63 Å²	63	105.2 Å²	105.2	39%	0.387	53%	0.526	S	S	.	.	H	α-helix	trans	-70.7	-43.1	-178	-50.7	0	0	0	0	110.7	M7 K8 L9 I14 L15	M7-T11 HydrophobicContact CE-CG2 3.65Å; K8-T11 WeakPolarHBondContact O-CA 3.17Å; K8-T11 WeakPolarHBondContact O-CB 3.08Å; K8-T11 PolarHBondContact O-N 3.06Å; L9-T11 VanDerWaalsContact C-N 3.3Å; L9-T11 PolarHBondContact O-N 3.49Å; T11-I14 PolarHBondContact O-N 3.31Å; T11-L15 VanDerWaalsContact O-CB 3.28Å; T11-L15 WeakPolarHBondContact O-CB 3.43Å; T11-L15 PolarHBondContact O-N 3.1Å
12	T	83.9	Confident	76.1	Confident	67 Å²	67	99.9 Å²	99.9	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-64	-45.9	179.2	-50.5	0	0	0	0	111.4	K8 L9 L15 M16	K8-T12 PolarHBondContact O-N 2.79Å; K8-T12 PolarHBondContact O-OG1 3.23Å; L9-T12 PolarHBondContact O-N 2.88Å; T12-L15 PolarHBondContact O-N 2.98Å; T12-M16 VanDerWaalsContact O-CB 3.32Å; T12-M16 WeakPolarHBondContact O-CB 3.34Å; T12-M16 PolarHBondContact O-N 2.93Å
13	V	84.5	Confident	78.2	Confident	22 Å²	22	94.4 Å²	94.4	13%	0.133	47%	0.474	C	S	.	.	H	α-helix	trans	-64.6	-44.4	176.9	173.8	0	0	0	0	110.8	L9 L15 M16 V17 L193 V194	L9-V13 HydrophobicContact CD1-CG2 4.06Å; L9-V13 HydrophobicContact CG-CG2 4.16Å; L9-V13 WeakPolarHBondContact O-CB 3.37Å; L9-V13 VanDerWaalsContact O-CG2 3.29Å; L9-V13 WeakPolarHBondContact O-CG2 3.07Å; L9-V13 PolarHBondContact O-N 2.9Å; V13-L15 VanDerWaalsContact C-N 3.35Å; V13-L15 PolarHBondContact O-N 3.36Å; V13-M16 PolarHBondContact O-N 3.37Å; V13-V17 HydrophobicContact CG1-CG2 4.19Å; V13-V17 WeakPolarHBondContact O-CB 3.27Å; V13-V17 VanDerWaalsContact O-CG2 3.32Å; V13-V17 WeakPolarHBondContact O-CG2 3.31Å; V13-V17 PolarHBondContact O-N 2.75Å; V13-L193 HydrophobicContact CG1-CD2 4.07Å; V13-V194 HydrophobicContact CB-CG2 4.38Å; V13-V194 HydrophobicContact CG1-CG2 4.21Å
14	I	83.7	Confident	80.2	Confident	59 Å²	59	86.9 Å²	86.9	30%	0.303	46%	0.455	S	S	.	.	H	α-helix	trans	-59.8	-47.1	177.9	-71.8	162.2	0	0	0	111.1	S10 T11 S18 T190 V194	S10-I14 VanDerWaalsContact O-CB 3.29Å; S10-I14 WeakPolarHBondContact O-CB 3.45Å; S10-I14 VanDerWaalsContact O-CD1 3.25Å; S10-I14 WeakPolarHBondContact O-CD1 3.5Å; S10-I14 WeakPolarHBondContact O-CG1 3.49Å; S10-I14 PolarHBondContact O-N 2.99Å; T11-I14 PolarHBondContact O-N 3.31Å; I14-S18 WeakPolarHBondContact O-CB 3.22Å; I14-S18 PolarHBondContact O-N 3.17Å; I14-S18 PolarHBondContact O-OG 3.5Å; I14-T190 HydrophobicContact CB-CG2 4.15Å; I14-T190 HydrophobicContact CG1-CG2 3.66Å; I14-V194 HydrophobicContact CD1-CG2 4.38Å; I14-V194 HydrophobicContact CG1-CG2 4.07Å
15	L	85.2	Confident	81.6	Confident	111 Å²	111	79.1 Å²	79.1	58%	0.581	42%	0.422	S	S	*	.	H	α-helix	trans	-66.1	-43.7	-177.8	-164.3	150.9	0	0	0	111.2	T11 T12 V13 A19	T11-L15 VanDerWaalsContact O-CB 3.28Å; T11-L15 WeakPolarHBondContact O-CB 3.43Å; T11-L15 PolarHBondContact O-N 3.1Å; T12-L15 PolarHBondContact O-N 2.98Å; V13-L15 VanDerWaalsContact C-N 3.35Å; V13-L15 PolarHBondContact O-N 3.36Å; L15-A19 VanDerWaalsContact O-CB 3.26Å; L15-A19 WeakPolarHBondContact O-CB 3.28Å; L15-A19 PolarHBondContact O-N 2.99Å
16	M	87.1	Confident	82.8	Confident	120 Å²	120	71.9 Å²	71.9	59%	0.591	40%	0.401	S	S	*	.	H	α-helix	trans	-63.6	-50	178.9	-170.6	-178.1	79.2	0	0	111.8	T12 V13 S18 A19 V20	T12-M16 VanDerWaalsContact O-CB 3.32Å; T12-M16 WeakPolarHBondContact O-CB 3.34Å; T12-M16 PolarHBondContact O-N 2.93Å; V13-M16 PolarHBondContact O-N 3.37Å; M16-S18 PolarHBondContact O-N 2.79Å; M16-A19 PolarHBondContact O-N 3.36Å; M16-V20 WeakPolarHBondContact O-CG2 3.1Å; M16-V20 PolarHBondContact O-N 2.71Å
17	V	87.1	Confident	83.8	Confident	43 Å²	43	71.5 Å²	71.5	26%	0.261	40%	0.397	S	S	.	.	H	α-helix	trans	-66.4	-40.2	-179.7	177.7	0	0	0	0	111	V13 A19 V20 L21 T190	V13-V17 HydrophobicContact CG1-CG2 4.19Å; V13-V17 WeakPolarHBondContact O-CB 3.27Å; V13-V17 VanDerWaalsContact O-CG2 3.32Å; V13-V17 WeakPolarHBondContact O-CG2 3.31Å; V13-V17 PolarHBondContact O-N 2.75Å; V17-A19 VanDerWaalsContact C-N 3.35Å; V17-A19 PolarHBondContact O-N 3.36Å; V17-V20 PolarHBondContact O-N 3.25Å; V17-L21 VanDerWaalsContact O-CB 3.31Å; V17-L21 WeakPolarHBondContact O-CB 3.35Å; V17-L21 PolarHBondContact O-N 2.99Å; V17-T190 HydrophobicContact CB-CG2 4.13Å; V17-T190 HydrophobicContact CG1-CG2 4.38Å; V17-T190 WeakPolarHBondContact CG1-OG1 3.49Å
18	S	83.7	Confident	84.5	Confident	38 Å²	38	69.6 Å²	69.6	27%	0.266	39%	0.392	S	S	.	.	H	α-helix	trans	-64.7	-38.7	176.9	-57.1	0	0	0	0	112.1	I14 M16 L21 F22	I14-S18 WeakPolarHBondContact O-CB 3.22Å; I14-S18 PolarHBondContact O-N 3.17Å; I14-S18 PolarHBondContact O-OG 3.5Å; M16-S18 PolarHBondContact O-N 2.79Å; S18-L21 PolarHBondContact O-N 3.37Å; S18-F22 VanDerWaalsContact O-CB 3.22Å; S18-F22 WeakPolarHBondContact O-CB 3.3Å; S18-F22 PolarHBondContact O-N 2.92Å
19	A	86.5	Confident	84.6	Confident	54 Å²	54	67.5 Å²	67.5	45%	0.446	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-43.6	176.9	0	0	0	0	0	111.8	L15 M16 V17 F22 S23	L15-A19 VanDerWaalsContact O-CB 3.26Å; L15-A19 WeakPolarHBondContact O-CB 3.28Å; L15-A19 PolarHBondContact O-N 2.99Å; M16-A19 PolarHBondContact O-N 3.36Å; V17-A19 VanDerWaalsContact C-N 3.35Å; V17-A19 PolarHBondContact O-N 3.36Å; A19-F22 PolarHBondContact O-N 2.91Å; A19-S23 WeakPolarHBondContact O-CB 3.43Å; A19-S23 PolarHBondContact O-N 2.99Å
20	V	87.9	Confident	84.9	Confident	88 Å²	88	69.5 Å²	69.5	53%	0.533	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-48	175.1	173.3	0	0	0	0	110.5	M16 V17 F22 S23 V24	M16-V20 WeakPolarHBondContact O-CG2 3.1Å; M16-V20 PolarHBondContact O-N 2.71Å; V17-V20 PolarHBondContact O-N 3.25Å; V20-F22 PolarHBondContact O-N 3.42Å; V20-S23 PolarHBondContact O-N 3.37Å; V20-V24 WeakPolarHBondContact O-CG2 3.3Å; V20-V24 PolarHBondContact O-N 3.11Å
21	L	87.2	Confident	85.2	Confident	49 Å²	49	73.3 Å²	73.3	26%	0.257	41%	0.411	S	S	.	.	H	α-helix	trans	-60.8	-44.6	179.6	-166.2	108.1	0	0	0	111.7	V17 S18 S23 V24 L25	V17-L21 VanDerWaalsContact O-CB 3.31Å; V17-L21 WeakPolarHBondContact O-CB 3.35Å; V17-L21 PolarHBondContact O-N 2.99Å; S18-L21 PolarHBondContact O-N 3.37Å; L21-S23 PolarHBondContact O-N 2.83Å; L21-V24 PolarHBondContact O-N 2.77Å; L21-L25 HydrophobicContact CD2-CD1 3.79Å; L21-L25 HydrophobicContact CG-CD1 4.12Å; L21-L25 WeakPolarHBondContact O-CB 3.5Å; L21-L25 VanDerWaalsContact O-CG 3.3Å; L21-L25 WeakPolarHBondContact O-CG 3.41Å; L21-L25 PolarHBondContact O-N 2.84Å
22	F	85.1	Confident	85	Confident	129 Å²	129	76.3 Å²	76.3	57%	0.566	42%	0.417	S	S	*	.	H	α-helix	trans	-61.1	-44.4	176.4	179.5	-98	0	0	0	111.7	S18 A19 V20 L25 L26	S18-F22 VanDerWaalsContact O-CB 3.22Å; S18-F22 WeakPolarHBondContact O-CB 3.3Å; S18-F22 PolarHBondContact O-N 2.92Å; A19-F22 PolarHBondContact O-N 2.91Å; V20-F22 PolarHBondContact O-N 3.42Å; F22-L25 PolarHBondContact O-N 3.36Å; F22-L26 HydrophobicContact CE1-CD1 4.23Å; F22-L26 HydrophobicContact CZ-CD1 4.17Å; F22-L26 VanDerWaalsContact O-CB 3.3Å; F22-L26 WeakPolarHBondContact O-CB 3.36Å; F22-L26 PolarHBondContact O-N 2.92Å
23	S	85.9	Confident	84.6	Confident	67 Å²	67	77.6 Å²	77.6	47%	0.469	42%	0.417	S	S	.	.	H	α-helix	trans	-60.9	-45.7	177.3	177.7	0	0	0	0	111.9	A19 V20 L21 L26 V27	A19-S23 WeakPolarHBondContact O-CB 3.43Å; A19-S23 PolarHBondContact O-N 2.99Å; V20-S23 PolarHBondContact O-N 3.37Å; L21-S23 PolarHBondContact O-N 2.83Å; S23-L26 PolarHBondContact O-N 2.91Å; S23-V27 WeakPolarHBondContact O-CG2 3.39Å; S23-V27 PolarHBondContact O-N 3.33Å
24	V	88.3	Confident	84.2	Confident	85 Å²	85	79.9 Å²	79.9	52%	0.515	43%	0.433	S	S	.	.	H	α-helix	trans	-62.7	-47	177.3	173.1	0	0	0	0	111.1	V20 L21 L26 V27 V28	V20-V24 WeakPolarHBondContact O-CG2 3.3Å; V20-V24 PolarHBondContact O-N 3.11Å; L21-V24 PolarHBondContact O-N 2.77Å; V24-L26 VanDerWaalsContact C-N 3.3Å; V24-L26 PolarHBondContact O-N 3.4Å; V24-V27 PolarHBondContact O-N 2.91Å; V24-V28 WeakPolarHBondContact O-CG2 3.47Å; V24-V28 PolarHBondContact O-N 3.09Å
25	L	86.4	Confident	83.9	Confident	35 Å²	35	82 Å²	82	18%	0.183	44%	0.442	C	S	.	.	H	α-helix	trans	-63.5	-36.3	179	-71	172.7	0	0	0	112.3	L21 F22 H29 V179 M183	L21-L25 HydrophobicContact CD2-CD1 3.79Å; L21-L25 HydrophobicContact CG-CD1 4.12Å; L21-L25 WeakPolarHBondContact O-CB 3.5Å; L21-L25 VanDerWaalsContact O-CG 3.3Å; L21-L25 WeakPolarHBondContact O-CG 3.41Å; L21-L25 PolarHBondContact O-N 2.84Å; F22-L25 PolarHBondContact O-N 3.36Å; L25-H29 VanDerWaalsContact O-CB 3.3Å; L25-H29 WeakPolarHBondContact O-CB 3.42Å; L25-H29 PolarHBondContact O-N 3.41Å; L25-V179 HydrophobicContact CB-CG1 4.32Å; L25-V179 HydrophobicContact CD1-CG1 4.35Å; L25-M183 HydrophobicContact CD1-CB 4.4Å
26	L	85.3	Confident	83.5	Confident	84 Å²	84	78.2 Å²	78.2	44%	0.44	42%	0.422	S	S	.	.	H	α-helix	trans	-63.6	-44.8	175	-174.3	110	0	0	0	111.4	F22 S23 V24 H29 L30	F22-L26 HydrophobicContact CE1-CD1 4.23Å; F22-L26 HydrophobicContact CZ-CD1 4.17Å; F22-L26 VanDerWaalsContact O-CB 3.3Å; F22-L26 WeakPolarHBondContact O-CB 3.36Å; F22-L26 PolarHBondContact O-N 2.92Å; S23-L26 PolarHBondContact O-N 2.91Å; V24-L26 VanDerWaalsContact C-N 3.3Å; V24-L26 PolarHBondContact O-N 3.4Å; L26-H29 WeakPolarHBondContact O-CB 3.37Å; L26-H29 PolarHBondContact O-N 3.44Å; L26-L30 HydrophobicContact CD2-CD1 4.24Å; L26-L30 WeakPolarHBondContact O-CG 3.35Å; L26-L30 PolarHBondContact O-N 3.4Å
27	V	87.1	Confident	82.8	Confident	74 Å²	74	74.7 Å²	74.7	45%	0.448	41%	0.41	S	S	.	.	H	α-helix	trans	-63.4	-46	177.7	173.2	0	0	0	0	110.9	S23 V24 H29 L30 I31	S23-V27 WeakPolarHBondContact O-CG2 3.39Å; S23-V27 PolarHBondContact O-N 3.33Å; V24-V27 PolarHBondContact O-N 2.91Å; V27-H29 VanDerWaalsContact C-N 3.29Å; V27-H29 PolarHBondContact O-N 3.19Å; V27-L30 PolarHBondContact O-N 3.03Å; V27-I31 HydrophobicContact CG1-CD1 3.99Å; V27-I31 WeakPolarHBondContact O-CG1 3.43Å; V27-I31 PolarHBondContact O-N 2.84Å; V27-I31 VanDerWaalsContact O-N 3.07Å
28	V	84.3	Confident	82.2	Confident	78 Å²	78	76.8 Å²	76.8	47%	0.473	42%	0.419	S	S	.	.	H	α-helix	trans	-59.5	-42.5	176.1	173.3	0	0	0	0	110.9	V24 L30 I31 Y32	V24-V28 WeakPolarHBondContact O-CG2 3.47Å; V24-V28 PolarHBondContact O-N 3.09Å; V28-L30 PolarHBondContact O-N 3.29Å; V28-I31 PolarHBondContact O-N 3.1Å; V28-Y32 WeakPolarHBondContact O-CB 3.47Å; V28-Y32 PolarHBondContact O-N 3.37Å
29	H	81.9	Confident	81.9	Confident	67 Å²	67	81 Å²	81	31%	0.31	44%	0.436	S	S	.	.	H	α-helix	trans	-59.1	-45.4	176.8	-178.3	74.3	0	0	0	112.4	L25 L26 V27 Y32 F33 I175	L25-H29 VanDerWaalsContact O-CB 3.3Å; L25-H29 WeakPolarHBondContact O-CB 3.42Å; L25-H29 PolarHBondContact O-N 3.41Å; L26-H29 WeakPolarHBondContact O-CB 3.37Å; L26-H29 PolarHBondContact O-N 3.44Å; V27-H29 VanDerWaalsContact C-N 3.29Å; V27-H29 PolarHBondContact O-N 3.19Å; H29-Y32 PolarHBondContact O-N 3.5Å; H29-F33 WeakPolarHBondContact O-CB 3.33Å; H29-F33 PolarHBondContact O-N 3.22Å; H29-I175 WeakPolarHBondContact ND1-CG2 3.45Å
30	L	82.1	Confident	81.4	Confident	105 Å²	105	79.2 Å²	79.2	55%	0.55	42%	0.42	S	S	.	.	H	α-helix	trans	-63.9	-42.8	179.2	-70.2	171.9	0	0	0	112.2	L26 V27 V28 F33 S34	L26-L30 HydrophobicContact CD2-CD1 4.24Å; L26-L30 WeakPolarHBondContact O-CG 3.35Å; L26-L30 PolarHBondContact O-N 3.4Å; V27-L30 PolarHBondContact O-N 3.03Å; V28-L30 PolarHBondContact O-N 3.29Å; L30-F33 PolarHBondContact O-N 3.29Å; L30-S34 PolarHBondContact O-N 3.49Å; L30-S34 VanDerWaalsContact O-N 3.1Å
31	I	82.8	Confident	80.9	Confident	101 Å²	101	80 Å²	80	52%	0.518	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-49.7	177.4	-66.8	169.7	0	0	0	110.3	V27 V28 F33 S34 Q35	V27-I31 HydrophobicContact CG1-CD1 3.99Å; V27-I31 WeakPolarHBondContact O-CG1 3.43Å; V27-I31 PolarHBondContact O-N 2.84Å; V27-I31 VanDerWaalsContact O-N 3.07Å; V28-I31 PolarHBondContact O-N 3.1Å; I31-F33 VanDerWaalsContact C-N 3.32Å; I31-F33 PolarHBondContact O-N 3.33Å; I31-S34 PolarHBondContact O-N 2.94Å; I31-Q35 PolarHBondContact O-N 3.06Å
32	Y	79.4	Confident	80.7	Confident	127 Å²	127	82.1 Å²	82.1	50%	0.498	43%	0.425	S	S	.	.	H	α-helix	trans	-65.3	-37.7	-177.9	-138.4	-90.3	0	0	0	112.1	V28 H29 Q35 I36 I175	V28-Y32 WeakPolarHBondContact O-CB 3.47Å; V28-Y32 PolarHBondContact O-N 3.37Å; H29-Y32 PolarHBondContact O-N 3.5Å; Y32-Q35 PolarHBondContact O-N 3.02Å; Y32-I36 HydrophobicContact CE1-CD1 4.39Å; Y32-I36 WeakPolarHBondContact O-CB 3.31Å; Y32-I36 WeakPolarHBondContact O-CG2 3.34Å; Y32-I36 PolarHBondContact O-N 2.84Å; Y32-I175 HydrophobicContact CD1-CD1 3.92Å; Y32-I175 HydrophobicContact CD1-CG1 4.15Å
33	F	74.8	Confident	80.6	Confident	94 Å²	94	77.7 Å²	77.7	41%	0.412	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176	-178	-96.5	0	0	0	112	H29 L30 I31	H29-F33 WeakPolarHBondContact O-CB 3.33Å; H29-F33 PolarHBondContact O-N 3.22Å; L30-F33 PolarHBondContact O-N 3.29Å; I31-F33 VanDerWaalsContact C-N 3.32Å; I31-F33 PolarHBondContact O-N 3.33Å
34	S	75.7	Confident	80.5	Confident	69 Å²	69	75.8 Å²	75.8	48%	0.483	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-47.4	175	-167.6	0	0	0	0	111.1	L30 I31 I36	L30-S34 PolarHBondContact O-N 3.49Å; L30-S34 VanDerWaalsContact O-N 3.1Å; I31-S34 PolarHBondContact O-N 2.94Å; S34-I36 PolarHBondContact O-N 2.85Å
35	Q	77.9	Confident	80.4	Confident	104 Å²	104	72 Å²	72	49%	0.486	38%	0.377	S	S	.	.	H	α-helix	trans	-68.6	-38.4	-173.2	-167.6	172.8	8.7	0	0	113.1	I31 Y32 S37 D38 M39	I31-Q35 PolarHBondContact O-N 3.06Å; Y32-Q35 PolarHBondContact O-N 3.02Å; Q35-S37 PolarHBondContact O-N 3.04Å; Q35-D38 PolarHBondContact O-N 3.27Å; Q35-M39 HydrophobicContact CG-CG 4.41Å; Q35-M39 HydrophobicContact CG-SD 4.03Å; Q35-M39 WeakPolarHBondContact O-CB 3.33Å; Q35-M39 WeakPolarHBondContact O-CG 3.47Å; Q35-M39 PolarHBondContact O-N 3.26Å
36	I	76.9	Confident	80.5	Confident	31 Å²	31	75 Å²	75	16%	0.159	39%	0.394	C	S	.	.	H	α-helix	trans	-71	-32.4	-176.4	-156.5	153.9	0	0	0	112.8	Y32 S34 T40 S171	Y32-I36 HydrophobicContact CE1-CD1 4.39Å; Y32-I36 WeakPolarHBondContact O-CB 3.31Å; Y32-I36 WeakPolarHBondContact O-CG2 3.34Å; Y32-I36 PolarHBondContact O-N 2.84Å; S34-I36 PolarHBondContact O-N 2.85Å; I36-T40 VanDerWaalsContact O-CB 3.25Å; I36-T40 WeakPolarHBondContact O-CB 3.43Å; I36-T40 PolarHBondContact O-N 2.8Å; I36-T40 PolarHBondContact O-OG1 2.98Å; I36-S171 VanDerWaalsContact CD1-CB 3.47Å
37	S	72.1	Confident	80.6	Confident	47 Å²	47	77.6 Å²	77.6	33%	0.329	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-47.7	176.7	177.4	0	0	0	0	110.8	Q35 R41	Q35-S37 PolarHBondContact O-N 3.04Å; S37-R41 WeakPolarHBondContact O-CB 3.5Å; S37-R41 PolarHBondContact O-N 3.04Å; S37-R41 VanDerWaalsContact O-N 3.11Å
38	D	74.9	Confident	80.7	Confident	86 Å²	86	74.1 Å²	74.1	46%	0.46	38%	0.381	S	S	.	.	H	α-helix	trans	-69.4	-47.7	-178.2	-65.7	-23.5	0	0	0	111.4	Q35 T40 R41 D42	Q35-D38 PolarHBondContact O-N 3.27Å; D38-T40 VanDerWaalsContact C-N 3.3Å; D38-T40 PolarHBondContact O-N 3.42Å; D38-R41 PolarHBondContact O-N 3.08Å; D38-D42 PolarHBondContact O-N 2.85Å
39	M	77.1	Confident	81.1	Confident	126 Å²	126	71.1 Å²	71.1	62%	0.621	36%	0.362	S	S	*	.	H	α-helix	trans	-59.2	-39	177.2	-73.1	-175.5	71.7	0	0	112.8	Q35 G43	Q35-M39 HydrophobicContact CG-CG 4.41Å; Q35-M39 HydrophobicContact CG-SD 4.03Å; Q35-M39 WeakPolarHBondContact O-CB 3.33Å; Q35-M39 WeakPolarHBondContact O-CG 3.47Å; Q35-M39 PolarHBondContact O-N 3.26Å; M39-G43 PolarHBondContact O-N 3.24Å
40	T	76.7	Confident	81.6	Confident	18 Å²	18	70.3 Å²	70.3	11%	0.11	37%	0.367	C	S	.	.	H	α-helix	trans	-69	-41.8	179.1	-56	0	0	0	0	111.2	I36 D38 L44 Q167 I168	I36-T40 VanDerWaalsContact O-CB 3.25Å; I36-T40 WeakPolarHBondContact O-CB 3.43Å; I36-T40 PolarHBondContact O-N 2.8Å; I36-T40 PolarHBondContact O-OG1 2.98Å; D38-T40 VanDerWaalsContact C-N 3.3Å; D38-T40 PolarHBondContact O-N 3.42Å; T40-L44 HydrophobicContact CG2-CD1 4.14Å; T40-L44 WeakPolarHBondContact O-CG 3.41Å; T40-L44 PolarHBondContact O-N 3.48Å; T40-L44 VanDerWaalsContact O-N 3.09Å; T40-Q167 HydrophobicContact CG2-CB 4.27Å; T40-Q167 HydrophobicContact CG2-CG 4.23Å; T40-I168 HydrophobicContact CG2-CG1 4.15Å
41	R	77.3	Confident	82.1	Confident	104 Å²	104	66.6 Å²	66.6	39%	0.392	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-49.1	177.2	177.8	-177.3	170	178.8	-1.7	111.4	S37 D38 L44 A45	S37-R41 WeakPolarHBondContact O-CB 3.5Å; S37-R41 PolarHBondContact O-N 3.04Å; S37-R41 VanDerWaalsContact O-N 3.11Å; D38-R41 PolarHBondContact O-N 3.08Å; R41-L44 PolarHBondContact O-N 2.81Å; R41-A45 WeakPolarHBondContact O-CB 3.32Å; R41-A45 PolarHBondContact O-N 2.92Å
42	D	82.3	Confident	82.6	Confident	93 Å²	93	61.8 Å²	61.8	50%	0.497	32%	0.324	S	S	.	.	H	α-helix	trans	-66.1	-40	-179	-70.9	-13.1	0	0	0	111.6	D38 L44 A45 N46	D38-D42 PolarHBondContact O-N 2.85Å; D42-L44 VanDerWaalsContact C-N 3.34Å; D42-L44 PolarHBondContact O-N 2.8Å; D42-A45 PolarHBondContact O-N 3.09Å; D42-N46 WeakPolarHBondContact O-CB 3.37Å; D42-N46 PolarHBondContact O-N 3.24Å; D42-N46 PolarHBondContact O-ND2 3.09Å
43	G	83.4	Confident	83.4	Confident	36 Å²	36	61.3 Å²	61.3	37%	0.371	32%	0.321	S	S	.	.	H	α-helix	trans	-59.9	-41.3	175	0	0	0	0	0	113.1	M39 K47	M39-G43 PolarHBondContact O-N 3.24Å; G43-K47 PolarHBondContact O-N 2.94Å
44	L	83.1	Confident	84.3	Confident	27 Å²	27	61.7 Å²	61.7	14%	0.141	33%	0.332	C	S	.	.	H	α-helix	trans	-73.1	-37.8	176.4	-72.1	170.7	0	0	0	112.4	T40 R41 D42 N46 K47 A48 L138 L159 V164	T40-L44 HydrophobicContact CG2-CD1 4.14Å; T40-L44 WeakPolarHBondContact O-CG 3.41Å; T40-L44 PolarHBondContact O-N 3.48Å; T40-L44 VanDerWaalsContact O-N 3.09Å; R41-L44 PolarHBondContact O-N 2.81Å; D42-L44 VanDerWaalsContact C-N 3.34Å; D42-L44 PolarHBondContact O-N 2.8Å; L44-N46 PolarHBondContact O-N 3.39Å; L44-K47 PolarHBondContact O-N 2.75Å; L44-A48 PolarHBondContact O-N 3.04Å; L44-L138 HydrophobicContact CB-CD2 4.38Å; L44-L159 HydrophobicContact CB-CD1 4.4Å; L44-V164 HydrophobicContact CD1-CB 4.05Å; L44-V164 HydrophobicContact CD1-CG1 4.11Å; L44-V164 HydrophobicContact CD1-CG2 3.67Å
45	A	86.7	Confident	85.1	Confident	5 Å²	5	58.9 Å²	58.9	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-58.5	-46.7	173.5	0	0	0	0	0	111.6	R41 D42 K47 A48 L49 V127 L138	R41-A45 WeakPolarHBondContact O-CB 3.32Å; R41-A45 PolarHBondContact O-N 2.92Å; D42-A45 PolarHBondContact O-N 3.09Å; A45-K47 VanDerWaalsContact C-N 3.34Å; A45-K47 PolarHBondContact O-N 3.16Å; A45-A48 PolarHBondContact O-N 2.95Å; A45-L49 PolarHBondContact O-N 3.41Å; A45-V127 HydrophobicContact CB-CG1 3.93Å; A45-L138 HydrophobicContact CB-CD2 3.96Å
46	N	88.7	Confident	85.9	Confident	100 Å²	100	54 Å²	54	54%	0.535	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-37.9	178.3	-74	-31.8	0	0	0	112.6	D42 L44 L49 A50	D42-N46 WeakPolarHBondContact O-CB 3.37Å; D42-N46 PolarHBondContact O-N 3.24Å; D42-N46 PolarHBondContact O-ND2 3.09Å; L44-N46 PolarHBondContact O-N 3.39Å; N46-L49 PolarHBondContact O-N 3.35Å; N46-A50 PolarHBondContact O-N 3.28Å
47	K	87.3	Confident	86.6	Confident	137 Å²	137	57.3 Å²	57.3	60%	0.596	31%	0.307	S	S	*	.	H	α-helix	trans	-63.3	-44.9	173.4	-76.3	-179.3	-178.9	179.8	0	111.9	G43 L44 A45 A50 V51	G43-K47 PolarHBondContact O-N 2.94Å; L44-K47 PolarHBondContact O-N 2.75Å; A45-K47 VanDerWaalsContact C-N 3.34Å; A45-K47 PolarHBondContact O-N 3.16Å; K47-A50 PolarHBondContact O-N 3.33Å; K47-V51 PolarHBondContact O-N 3.07Å
48	A	89.3	Confident	87.6	Confident	2 Å²	2	56 Å²	56	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-65.8	-38.9	176.5	0	0	0	0	0	112.5	L44 A45 A50 V51 A52 V140 I157 L159	L44-A48 PolarHBondContact O-N 3.04Å; A45-A48 PolarHBondContact O-N 2.95Å; A48-A50 VanDerWaalsContact C-N 3.34Å; A48-A50 PolarHBondContact O-N 3.34Å; A48-V51 PolarHBondContact O-N 3.46Å; A48-A52 WeakPolarHBondContact O-CB 3.45Å; A48-A52 PolarHBondContact O-N 3.13Å; A48-V140 HydrophobicContact CB-CB 4.16Å; A48-V140 HydrophobicContact CB-CG2 3.57Å; A48-I157 HydrophobicContact CB-CG2 4.29Å; A48-L159 HydrophobicContact CB-CD1 3.51Å; A48-L159 HydrophobicContact CB-CG 4.22Å
49	L	92.3	Very high	88.4	Confident	14 Å²	14	55.4 Å²	55.4	7%	0.073	30%	0.298	C	S	.	.	H	α-helix	trans	-57.5	-44.9	171.6	-85.7	168.1	0	0	0	111.6	A45 N46 V51 A52 R53 E125 V127 V140	A45-L49 PolarHBondContact O-N 3.41Å; N46-L49 PolarHBondContact O-N 3.35Å; L49-V51 VanDerWaalsContact C-N 3.34Å; L49-V51 PolarHBondContact O-N 3.46Å; L49-A52 PolarHBondContact O-N 2.79Å; L49-R53 WeakPolarHBondContact O-CB 3.31Å; L49-R53 VanDerWaalsContact O-CG 3.27Å; L49-R53 WeakPolarHBondContact O-CG 3.48Å; L49-R53 PolarHBondContact O-N 3.49Å; L49-E125 HydrophobicContact CD2-CB 4.31Å; L49-V127 HydrophobicContact CD1-CG2 3.96Å; L49-V127 HydrophobicContact CG-CG2 4.29Å; L49-V140 HydrophobicContact CB-CG1 4.1Å; L49-V140 HydrophobicContact CD2-CG1 3.21Å; L49-V140 HydrophobicContact CG-CG1 3.35Å
50	A	93	Very high	89.1	Confident	51 Å²	51	54.6 Å²	54.6	42%	0.421	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-42.6	178.1	0	0	0	0	0	112.4	N46 K47 A48 T54	N46-A50 PolarHBondContact O-N 3.28Å; K47-A50 PolarHBondContact O-N 3.33Å; A48-A50 VanDerWaalsContact C-N 3.34Å; A48-A50 PolarHBondContact O-N 3.34Å; A50-T54 WeakPolarHBondContact O-CB 3.4Å; A50-T54 PolarHBondContact O-N 3.29Å; A50-T54 PolarHBondContact O-OG1 2.84Å
51	V	93.2	Very high	89.9	Confident	27 Å²	27	53.8 Å²	53.8	16%	0.164	29%	0.288	C	S	.	.	H	α-helix	trans	-67.7	-40.9	175.7	-178.8	0	0	0	0	111.2	K47 A48 L49 T54 L55 V81 L87 I157	K47-V51 PolarHBondContact O-N 3.07Å; A48-V51 PolarHBondContact O-N 3.46Å; L49-V51 VanDerWaalsContact C-N 3.34Å; L49-V51 PolarHBondContact O-N 3.46Å; V51-T54 PolarHBondContact O-N 3.37Å; V51-L55 HydrophobicContact CG1-CD1 4.41Å; V51-L55 PolarHBondContact O-N 3.35Å; V51-V81 HydrophobicContact CG1-CG1 3.71Å; V51-L87 HydrophobicContact CG1-CD1 4.05Å; V51-I157 HydrophobicContact CB-CD1 3.87Å; V51-I157 HydrophobicContact CG1-CD1 3.66Å
52	A	93.5	Very high	90.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.8	-45.4	179.2	0	0	0	0	0	111.9	A48 L49 L55 A56 V140 T142 V155 I157	A48-A52 WeakPolarHBondContact O-CB 3.45Å; A48-A52 PolarHBondContact O-N 3.13Å; L49-A52 PolarHBondContact O-N 2.79Å; A52-L55 PolarHBondContact O-N 2.94Å; A52-A56 WeakPolarHBondContact O-CB 3.48Å; A52-A56 PolarHBondContact O-N 2.92Å; A52-V140 HydrophobicContact CB-CG1 4.4Å; A52-T142 WeakPolarHBondContact CB-OG1 3.41Å; A52-V155 HydrophobicContact CB-CG1 4.36Å; A52-I157 HydrophobicContact CB-CD1 3.71Å; A52-I157 HydrophobicContact CB-CG1 4.08Å
53	R	94.4	Very high	91	Very high	116 Å²	116	53.1 Å²	53.1	44%	0.438	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-46.5	173.1	-70.1	170.3	-177.2	171	0.6	111.9	L49 L55 A56 D57 E125 T142	L49-R53 WeakPolarHBondContact O-CB 3.31Å; L49-R53 VanDerWaalsContact O-CG 3.27Å; L49-R53 WeakPolarHBondContact O-CG 3.48Å; L49-R53 PolarHBondContact O-N 3.49Å; R53-L55 VanDerWaalsContact C-N 3.29Å; R53-L55 PolarHBondContact O-N 2.89Å; R53-A56 PolarHBondContact O-N 3.3Å; R53-A56 VanDerWaalsContact O-N 3.13Å; R53-D57 PolarHBondContact O-N 2.97Å; R53-E125 VanDerWaalsContact CG-OE1 3.28Å; R53-E125 WeakPolarHBondContact CG-OE1 3.34Å; R53-E125 IonicContact CZ-OE1 2.86Å; R53-E125 IonicContact CZ-OE2 3.7Å; R53-E125 IonicContact NE-OE1 3.15Å; R53-E125 PolarHBondContact NE-OE1 2.91Å; R53-E125 IonicContact NE-OE2 2.74Å; R53-E125 PolarHBondContact NE-OE2 2.69Å; R53-E125 IonicContact NH2-OE1 3.31Å; R53-E125 IonicContact NH2-OE2 2.97Å; R53-E125 PolarHBondContact NH2-OE2 2.91Å; R53-T142 HydrophobicContact CG-CG2 3.88Å
54	T	93.9	Very high	91.3	Very high	103 Å²	103	51.5 Å²	51.5	63%	0.632	27%	0.267	S	S	*	.	H	α-helix	trans	-59.9	-39.6	177.8	-53.9	0	0	0	0	112.1	A50 V51 S58	A50-T54 WeakPolarHBondContact O-CB 3.4Å; A50-T54 PolarHBondContact O-N 3.29Å; A50-T54 PolarHBondContact O-OG1 2.84Å; V51-T54 PolarHBondContact O-N 3.37Å; T54-S58 PolarHBondContact O-N 2.93Å
55	L	93.6	Very high	91.7	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-71.7	-37.5	175.2	-78.9	176.5	0	0	0	112.9	V51 A52 R53 D57 S58 I61 I77 V81 I90 V155 I157	V51-L55 HydrophobicContact CG1-CD1 4.41Å; V51-L55 PolarHBondContact O-N 3.35Å; A52-L55 PolarHBondContact O-N 2.94Å; R53-L55 VanDerWaalsContact C-N 3.29Å; R53-L55 PolarHBondContact O-N 2.89Å; L55-D57 PolarHBondContact O-N 3.35Å; L55-S58 WeakPolarHBondContact O-CB 3.43Å; L55-S58 PolarHBondContact O-N 2.89Å; L55-I61 WeakPolarHBondContact O-CG1 3.46Å; L55-I77 HydrophobicContact CD2-CG2 4.07Å; L55-V81 HydrophobicContact CD1-CG1 4.12Å; L55-V81 HydrophobicContact CD2-CG1 4.49Å; L55-V81 HydrophobicContact CD2-CG2 4.04Å; L55-V81 HydrophobicContact CG-CG1 4.44Å; L55-I90 HydrophobicContact CD1-CD1 3.9Å; L55-I90 HydrophobicContact CD1-CG2 3.6Å; L55-V155 HydrophobicContact CB-CG1 4.19Å; L55-V155 HydrophobicContact CB-CG2 4.2Å; L55-V155 HydrophobicContact CD1-CG1 4.17Å; L55-I157 HydrophobicContact CD1-CD1 4.32Å
56	A	93.5	Very high	91.7	Very high	2 Å²	2	58.2 Å²	58.2	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-29.5	177.2	0	0	0	0	0	112.3	A52 R53 R62 T142 I144 V155	A52-A56 WeakPolarHBondContact O-CB 3.48Å; A52-A56 PolarHBondContact O-N 2.92Å; R53-A56 PolarHBondContact O-N 3.3Å; R53-A56 VanDerWaalsContact O-N 3.13Å; A56-R62 PolarHBondContact O-NE 3.38Å; A56-T142 HydrophobicContact CB-CG2 3.92Å; A56-I144 HydrophobicContact CB-CG1 4Å; A56-V155 HydrophobicContact CB-CG2 4.04Å
57	D	92.5	Very high	91.7	Very high	101 Å²	101	59 Å²	59	54%	0.54	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.2	177.1	-69.2	-28.4	0	0	0	114.6	R53 L55 P59 R62	R53-D57 PolarHBondContact O-N 2.97Å; L55-D57 PolarHBondContact O-N 3.35Å; D57-P59 WeakPolarHBondContact O-CD 3.44Å; D57-R62 IonicContact OD1-NH2 3.99Å; D57-R62 PolarHBondContact OD1-NH2 3.24Å
58	S	92.8	Very high	91.7	Very high	19 Å²	19	59.3 Å²	59.3	13%	0.133	30%	0.297	C	S	.	.			trans	-68.4	124.2	177.8	159.2	0	0	0	0	111.3	T54 L55 E60 I61 R62	T54-S58 PolarHBondContact O-N 2.93Å; L55-S58 WeakPolarHBondContact O-CB 3.43Å; L55-S58 PolarHBondContact O-N 2.89Å; S58-E60 PolarHBondContact O-N 3.47Å; S58-E60 PolarHBondContact OG-N 3Å; S58-E60 PolarHBondContact OG-OE2 2.91Å; S58-I61 PolarHBondContact O-N 3.41Å; S58-I61 PolarHBondContact OG-N 3.23Å; S58-R62 PolarHBondContact O-N 2.96Å
59	P	91.8	Very high	91.5	Very high	74 Å²	74	60.2 Å²	60.2	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-56.7	-35.8	176	-25.7	34.7	0	0	0	113.1	D57 I61 R62 Q63	D57-P59 WeakPolarHBondContact O-CD 3.44Å; P59-I61 PolarHBondContact O-N 2.84Å; P59-R62 PolarHBondContact O-N 3.43Å; P59-Q63 WeakPolarHBondContact O-CB 3.49Å; P59-Q63 WeakPolarHBondContact O-CG 3.32Å; P59-Q63 PolarHBondContact O-N 3.07Å
60	E	91.9	Very high	91	Very high	109 Å²	109	68 Å²	68	51%	0.509	34%	0.339	S	S	.	.	H	α-helix	trans	-65.5	-38	-179.7	-59.3	75.8	-166.2	0	0	112	S58 G64 I77	S58-E60 PolarHBondContact O-N 3.47Å; S58-E60 PolarHBondContact OG-N 3Å; S58-E60 PolarHBondContact OG-OE2 2.91Å; E60-G64 PolarHBondContact O-N 2.82Å; E60-I77 HydrophobicContact CB-CD1 3.52Å; E60-I77 HydrophobicContact CG-CD1 4.33Å
61	I	92.8	Very high	90.6	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-68.5	-45	175.2	-61.8	-60.4	0	0	0	110.4	L55 S58 P59 Q63 G64 L65 I74 I77 V92 I144	L55-I61 WeakPolarHBondContact O-CG1 3.46Å; S58-I61 PolarHBondContact O-N 3.41Å; S58-I61 PolarHBondContact OG-N 3.23Å; P59-I61 PolarHBondContact O-N 2.84Å; I61-Q63 PolarHBondContact O-N 3.24Å; I61-G64 PolarHBondContact O-N 3.49Å; I61-L65 HydrophobicContact CG2-CD1 4.49Å; I61-L65 PolarHBondContact O-N 3.3Å; I61-I74 HydrophobicContact CD1-CB 4.26Å; I61-I74 HydrophobicContact CD1-CG1 3.93Å; I61-I74 HydrophobicContact CD1-CG2 3.88Å; I61-I74 HydrophobicContact CG2-CD1 4.46Å; I61-I77 HydrophobicContact CD1-CB 4.23Å; I61-I77 HydrophobicContact CD1-CD1 4.19Å; I61-I77 HydrophobicContact CD1-CG2 4.03Å; I61-V92 HydrophobicContact CG2-CG1 4.02Å; I61-V92 HydrophobicContact CG2-CG2 4.48Å; I61-I144 HydrophobicContact CG2-CD1 4.07Å
62	R	92.2	Very high	90.3	Very high	62 Å²	62	71.2 Å²	71.2	23%	0.234	35%	0.345	C	S	.	.	H	α-helix	trans	-61.4	-44.6	179	-64.9	178.9	-174.8	-170.6	-1.9	111.8	A56 D57 S58 P59 I144 Y145 I152	A56-R62 PolarHBondContact O-NE 3.38Å; D57-R62 IonicContact OD1-NH2 3.99Å; D57-R62 PolarHBondContact OD1-NH2 3.24Å; S58-R62 PolarHBondContact O-N 2.96Å; P59-R62 PolarHBondContact O-N 3.43Å; R62-I144 HydrophobicContact CG-CG2 4.07Å; R62-Y145 VanDerWaalsContact CD-O 3.3Å; R62-Y145 WeakPolarHBondContact CD-O 3.27Å; R62-Y145 VanDerWaalsContact CZ-O 3.27Å; R62-Y145 PolarHBondContact NE-O 3.31Å; R62-I152 HydrophobicContact CB-CD1 4.18Å; R62-I152 HydrophobicContact CG-CD1 4.3Å
63	Q	90.2	Very high	90.1	Very high	121 Å²	121	73.4 Å²	73.4	57%	0.565	37%	0.367	S	S	*	.	H	α-helix	trans	-69.1	-37.3	175.3	-69.6	176.4	12.5	0	0	112.2	P59 I61 L65 Q66	P59-Q63 WeakPolarHBondContact O-CB 3.49Å; P59-Q63 WeakPolarHBondContact O-CG 3.32Å; P59-Q63 PolarHBondContact O-N 3.07Å; I61-Q63 PolarHBondContact O-N 3.24Å; Q63-L65 VanDerWaalsContact C-N 3.31Å; Q63-L65 PolarHBondContact O-N 2.85Å; Q63-Q66 WeakPolarHBondContact O-CB 3.48Å; Q63-Q66 PolarHBondContact O-N 2.81Å
64	G	90.6	Very high	90.1	Very high	2 Å²	2	67.9 Å²	67.9	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-34.9	178.7	0	0	0	0	0	113.4	E60 I61 Q66 K67 S72	E60-G64 PolarHBondContact O-N 2.82Å; I61-G64 PolarHBondContact O-N 3.49Å; G64-Q66 PolarHBondContact O-N 3.04Å; G64-K67 PolarHBondContact O-N 2.88Å; G64-K67 VanDerWaalsContact O-N 3.15Å; G64-S72 VanDerWaalsContact CA-O 3.28Å; G64-S72 WeakPolarHBondContact CA-O 3.45Å; G64-S72 WeakPolarHBondContact O-CB 3.3Å
65	L	91	Very high	90	Very high	15 Å²	15	65.3 Å²	65.3	8%	0.079	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-19.2	177.7	-80.1	171.8	0	0	0	113.5	I61 Q63 K67 I74 V92 D94 Y100 I144 I152	I61-L65 HydrophobicContact CG2-CD1 4.49Å; I61-L65 PolarHBondContact O-N 3.3Å; Q63-L65 VanDerWaalsContact C-N 3.31Å; Q63-L65 PolarHBondContact O-N 2.85Å; L65-K67 VanDerWaalsContact C-N 3.28Å; L65-I74 HydrophobicContact CD2-CD1 4.11Å; L65-I74 HydrophobicContact CG-CD1 3.86Å; L65-V92 HydrophobicContact CD1-CG1 4.33Å; L65-V92 HydrophobicContact CD2-CG1 4.02Å; L65-V92 HydrophobicContact CG-CG1 4.32Å; L65-D94 HydrophobicContact CD2-CB 4.47Å; L65-Y100 HydrophobicContact CD2-CD1 4.09Å; L65-Y100 HydrophobicContact CD2-CD2 3.77Å; L65-Y100 HydrophobicContact CD2-CE1 4.16Å; L65-Y100 HydrophobicContact CD2-CE2 3.9Å; L65-Y100 HydrophobicContact CD2-CG 3.88Å; L65-Y100 PolarHBondContact O-OH 3.38Å; L65-I144 HydrophobicContact CD1-CB 4.46Å; L65-I144 HydrophobicContact CD1-CD1 3.73Å; L65-I144 HydrophobicContact CD1-CG2 4.09Å; L65-I152 HydrophobicContact CB-CD1 4.44Å; L65-I152 HydrophobicContact CD1-CD1 3.98Å; L65-I152 HydrophobicContact CD1-CG1 4.04Å
66	Q	87.2	Confident	90	Very high	159 Å²	159	68.3 Å²	68.3	74%	0.743	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-12.8	175.6	-60.3	178.9	-1.2	0	0	112.9	Q63 G64	Q63-Q66 WeakPolarHBondContact O-CB 3.48Å; Q63-Q66 PolarHBondContact O-N 2.81Å; G64-Q66 PolarHBondContact O-N 3.04Å
67	K	88.8	Confident	90	Very high	117 Å²	117	70.6 Å²	70.6	51%	0.509	37%	0.365	S	S	.	.	S	Bend	trans	-99.6	172	178.6	-62	178.8	-177.3	175	0	110.5	G64 L65 E71 Y100	G64-K67 PolarHBondContact O-N 2.88Å; G64-K67 VanDerWaalsContact O-N 3.15Å; L65-K67 VanDerWaalsContact C-N 3.28Å; K67-E71 HydrophobicContact CB-CB 4.46Å; K67-E71 WeakPolarHBondContact CD-O 3.22Å; K67-Y100 WeakPolarHBondContact O-CE1 3.34Å; K67-Y100 PolarHBondContact O-OH 2.82Å
68	K	87	Confident	90	Very high	142 Å²	142	66 Å²	66	62%	0.617	34%	0.34	S	S	*	.			trans	-66.7	150.7	169.3	-71	-177.9	-179.9	175.3	0	110.2	Q70 E71 S72	K68-Q70 PolarHBondContact O-N 2.89Å; K68-E71 PolarHBondContact O-N 3.14Å; K68-S72 PolarHBondContact O-N 3Å; K68-S72 VanDerWaalsContact O-N 3.11Å
69	P	85	Confident	90	Very high	21 Å²	21	67.1 Å²	67.1	14%	0.136	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-48.8	-39.1	-178.2	-31.2	35.1	0	0	0	114.6	E71 S72 L98 Y100 I108	P69-E71 VanDerWaalsContact C-N 3.34Å; P69-E71 PolarHBondContact O-N 3.22Å; P69-S72 PolarHBondContact O-OG 3.39Å; P69-L98 HydrophobicContact CG-CD2 3.87Å; P69-Y100 HydrophobicContact CB-CD1 4.26Å; P69-Y100 HydrophobicContact CB-CE1 4.48Å; P69-Y100 HydrophobicContact CB-CG 4.41Å; P69-Y100 HydrophobicContact CG-CD1 4.32Å; P69-Y100 HydrophobicContact CG-CD2 4.3Å; P69-Y100 HydrophobicContact CG-CE1 4.15Å; P69-Y100 HydrophobicContact CG-CE2 4.06Å; P69-Y100 HydrophobicContact CG-CG 4.41Å; P69-I108 HydrophobicContact CB-CG2 3.88Å
70	Q	81.6	Confident	90.1	Very high	178 Å²	178	66.5 Å²	66.5	83%	0.832	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-70.3	-25.1	-178.8	-66.6	142.1	-1.7	0	0	113.9	K68	K68-Q70 PolarHBondContact O-N 2.89Å
71	E	84.5	Confident	90.1	Very high	136 Å²	136	62.9 Å²	62.9	64%	0.636	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-108.7	2.4	-176.5	-65.1	174.1	-173.3	0	0	112.5	K67 K68 P69	K67-E71 HydrophobicContact CB-CB 4.46Å; K67-E71 WeakPolarHBondContact CD-O 3.22Å; K68-E71 PolarHBondContact O-N 3.14Å; P69-E71 VanDerWaalsContact C-N 3.34Å; P69-E71 PolarHBondContact O-N 3.22Å
72	S	87.7	Confident	90.2	Very high	10 Å²	10	65.4 Å²	65.4	7%	0.07	34%	0.339	C	S	.	.	S	Bend	trans	-74	-25	-171.1	66.3	0	0	0	0	114.7	G64 K68 P69 I74	G64-S72 VanDerWaalsContact CA-O 3.28Å; G64-S72 WeakPolarHBondContact CA-O 3.45Å; G64-S72 WeakPolarHBondContact O-CB 3.3Å; K68-S72 PolarHBondContact O-N 3Å; K68-S72 VanDerWaalsContact O-N 3.11Å; P69-S72 PolarHBondContact O-OG 3.39Å; S72-I74 PolarHBondContact O-N 2.91Å; S72-I74 VanDerWaalsContact O-N 3.12Å; S72-I74 PolarHBondContact OG-N 3.45Å
73	G	89.5	Confident	90.1	Very high	45 Å²	45	69 Å²	69	46%	0.464	36%	0.357	S	S	.	.	S	Bend	trans	71.4	-9.9	-170.3	0	0	0	0	0	114.8	Q75 A76	G73-Q75 VanDerWaalsContact C-N 3.32Å; G73-Q75 PolarHBondContact O-N 3.35Å; G73-A76 PolarHBondContact O-N 3.02Å
74	I	93.4	Very high	90.2	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-61.5	-38.3	-174.9	-69.3	173.5	0	0	0	111.9	I61 L65 S72 A76 I77 A78 V92 Y100	I61-I74 HydrophobicContact CD1-CB 4.26Å; I61-I74 HydrophobicContact CD1-CG1 3.93Å; I61-I74 HydrophobicContact CD1-CG2 3.88Å; I61-I74 HydrophobicContact CG2-CD1 4.46Å; L65-I74 HydrophobicContact CD2-CD1 4.11Å; L65-I74 HydrophobicContact CG-CD1 3.86Å; S72-I74 PolarHBondContact O-N 2.91Å; S72-I74 VanDerWaalsContact O-N 3.12Å; S72-I74 PolarHBondContact OG-N 3.45Å; I74-A76 VanDerWaalsContact C-N 3.28Å; I74-A76 PolarHBondContact O-N 3.35Å; I74-I77 PolarHBondContact O-N 2.88Å; I74-A78 VanDerWaalsContact O-CB 3.28Å; I74-A78 WeakPolarHBondContact O-CB 3.29Å; I74-A78 PolarHBondContact O-N 2.88Å; I74-V92 HydrophobicContact CD1-CG1 4.27Å; I74-V92 HydrophobicContact CG2-CB 3.66Å; I74-V92 HydrophobicContact CG2-CG1 4.13Å; I74-V92 HydrophobicContact CG2-CG2 3.64Å; I74-Y100 HydrophobicContact CD1-CD1 3.79Å; I74-Y100 HydrophobicContact CD1-CG 4.19Å
75	Q	93.4	Very high	90.1	Very high	49 Å²	49	77.2 Å²	77.2	23%	0.229	39%	0.387	C	S	.	.	H	α-helix	trans	-57.1	-39.9	178.3	178.1	63.1	10.7	0	0	112.6	G73 E79 H102 I108	G73-Q75 VanDerWaalsContact C-N 3.32Å; G73-Q75 PolarHBondContact O-N 3.35Å; Q75-E79 VanDerWaalsContact O-CB 3.23Å; Q75-E79 WeakPolarHBondContact O-CB 3.39Å; Q75-E79 PolarHBondContact O-N 2.92Å; Q75-H102 PolarHBondContact NE2-O 3.26Å; Q75-H102 PolarHBondContact OE1-O 3.13Å; Q75-I108 HydrophobicContact CB-CD1 4.32Å; Q75-I108 HydrophobicContact CG-CD1 3.86Å
76	A	92.3	Very high	89.8	Confident	73 Å²	73	80.6 Å²	80.6	60%	0.603	41%	0.406	S	S	*	.	H	α-helix	trans	-68.8	-42	-179.3	0	0	0	0	0	111.6	G73 I74 A80	G73-A76 PolarHBondContact O-N 3.02Å; I74-A76 VanDerWaalsContact C-N 3.28Å; I74-A76 PolarHBondContact O-N 3.35Å; A76-A80 WeakPolarHBondContact O-CB 3.39Å; A76-A80 PolarHBondContact O-N 3.27Å
77	I	93.3	Very high	89.9	Confident	50 Å²	50	73.4 Å²	73.4	26%	0.256	37%	0.372	S	S	.	.	H	α-helix	trans	-66.4	-49.8	177.8	-61.7	166.6	0	0	0	110.1	L55 E60 I61 I74 E79 A80 V81	L55-I77 HydrophobicContact CD2-CG2 4.07Å; E60-I77 HydrophobicContact CB-CD1 3.52Å; E60-I77 HydrophobicContact CG-CD1 4.33Å; I61-I77 HydrophobicContact CD1-CB 4.23Å; I61-I77 HydrophobicContact CD1-CD1 4.19Å; I61-I77 HydrophobicContact CD1-CG2 4.03Å; I74-I77 PolarHBondContact O-N 2.88Å; I77-E79 VanDerWaalsContact C-N 3.3Å; I77-E79 PolarHBondContact O-N 2.86Å; I77-A80 PolarHBondContact O-N 2.9Å; I77-V81 HydrophobicContact CG2-CG2 4.42Å; I77-V81 WeakPolarHBondContact O-CG2 3.22Å; I77-V81 PolarHBondContact O-N 3.46Å
78	A	93.8	Very high	89.8	Confident	3 Å²	3	69.5 Å²	69.5	3%	0.025	36%	0.357	C	S	.	.	H	α-helix	trans	-57.6	-43.8	179	0	0	0	0	0	111.3	I74 R82 I90 S101	I74-A78 VanDerWaalsContact O-CB 3.28Å; I74-A78 WeakPolarHBondContact O-CB 3.29Å; I74-A78 PolarHBondContact O-N 2.88Å; A78-R82 WeakPolarHBondContact O-CB 3.39Å; A78-R82 PolarHBondContact O-N 3.45Å; A78-I90 HydrophobicContact CB-CB 4.15Å; A78-I90 HydrophobicContact CB-CG2 3.93Å; A78-S101 VanDerWaalsContact CB-CB 3.45Å; A78-S101 WeakPolarHBondContact CB-OG 3.44Å
79	E	92.4	Very high	90	Very high	43 Å²	43	63.4 Å²	63.4	20%	0.201	33%	0.33	C	S	.	.	H	α-helix	trans	-70.8	-36.4	-179.6	-169.6	61.6	-167.4	0	0	112.8	Q75 I77 R82 K83	Q75-E79 VanDerWaalsContact O-CB 3.23Å; Q75-E79 WeakPolarHBondContact O-CB 3.39Å; Q75-E79 PolarHBondContact O-N 2.92Å; I77-E79 VanDerWaalsContact C-N 3.3Å; I77-E79 PolarHBondContact O-N 2.86Å; E79-R82 VanDerWaalsContact CD-NE 3.35Å; E79-R82 PolarHBondContact O-N 3.11Å; E79-R82 IonicContact OE1-CZ 2.65Å; E79-R82 IonicContact OE1-NE 3.38Å; E79-R82 PolarHBondContact OE1-NE 2.99Å; E79-R82 IonicContact OE1-NH2 3.71Å; E79-R82 PolarHBondContact OE1-NH2 2.84Å; E79-R82 IonicContact OE2-CZ 3.18Å; E79-R82 IonicContact OE2-NE 3.65Å; E79-R82 PolarHBondContact OE2-NE 3.44Å; E79-R82 IonicContact OE2-NH2 2.7Å; E79-K83 WeakPolarHBondContact O-CG 3.19Å; E79-K83 PolarHBondContact O-N 3.43Å; E79-K83 VanDerWaalsContact OE1-CE 3.28Å; E79-K83 WeakPolarHBondContact OE1-CE 3.22Å
80	A	93.1	Very high	90.5	Very high	61 Å²	61	62.6 Å²	62.6	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-64.8	-46.4	175	0	0	0	0	0	111.7	A76 I77 R82 R84	A76-A80 WeakPolarHBondContact O-CB 3.39Å; A76-A80 PolarHBondContact O-N 3.27Å; I77-A80 PolarHBondContact O-N 2.9Å; A80-R82 VanDerWaalsContact C-N 3.35Å; A80-R84 WeakPolarHBondContact O-CB 3.33Å; A80-R84 PolarHBondContact O-N 2.84Å
81	V	93.5	Very high	91.1	Very high	34 Å²	34	54.2 Å²	54.2	21%	0.206	29%	0.286	C	S	.	.	H	α-helix	trans	-68.1	-37.5	177.6	178.7	0	0	0	0	110.8	V51 L55 I77 R84 N85 I90	V51-V81 HydrophobicContact CG1-CG1 3.71Å; L55-V81 HydrophobicContact CD1-CG1 4.12Å; L55-V81 HydrophobicContact CD2-CG1 4.49Å; L55-V81 HydrophobicContact CD2-CG2 4.04Å; L55-V81 HydrophobicContact CG-CG1 4.44Å; I77-V81 HydrophobicContact CG2-CG2 4.42Å; I77-V81 WeakPolarHBondContact O-CG2 3.22Å; I77-V81 PolarHBondContact O-N 3.46Å; V81-R84 PolarHBondContact O-N 3.25Å; V81-N85 WeakPolarHBondContact CG1-ND2 3.47Å; V81-N85 WeakPolarHBondContact O-CB 3.43Å; V81-N85 PolarHBondContact O-N 3.43Å; V81-N85 PolarHBondContact O-ND2 3.34Å; V81-I90 HydrophobicContact CB-CD1 3.81Å; V81-I90 HydrophobicContact CG1-CD1 3.63Å
82	R	93.4	Very high	91.6	Very high	52 Å²	52	47.7 Å²	47.7	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-49.8	176.6	-173.3	-170.7	76	77.9	-3.5	111.5	A78 E79 A80 D86 L87 I90	A78-R82 WeakPolarHBondContact O-CB 3.39Å; A78-R82 PolarHBondContact O-N 3.45Å; E79-R82 VanDerWaalsContact CD-NE 3.35Å; E79-R82 PolarHBondContact O-N 3.11Å; E79-R82 IonicContact OE1-CZ 2.65Å; E79-R82 IonicContact OE1-NE 3.38Å; E79-R82 PolarHBondContact OE1-NE 2.99Å; E79-R82 IonicContact OE1-NH2 3.71Å; E79-R82 PolarHBondContact OE1-NH2 2.84Å; E79-R82 IonicContact OE2-CZ 3.18Å; E79-R82 IonicContact OE2-NE 3.65Å; E79-R82 PolarHBondContact OE2-NE 3.44Å; E79-R82 IonicContact OE2-NH2 2.7Å; A80-R82 VanDerWaalsContact C-N 3.35Å; R82-D86 WeakPolarHBondContact O-CA 3.43Å; R82-D86 PolarHBondContact O-N 3.15Å; R82-D86 VanDerWaalsContact O-N 3.07Å; R82-L87 HydrophobicContact CG-CB 4.09Å; R82-L87 WeakPolarHBondContact CG-O 3.49Å; R82-L87 PolarHBondContact NH1-O 3.34Å; R82-L87 PolarHBondContact O-N 3.46Å; R82-I90 HydrophobicContact CB-CD1 3.95Å; R82-I90 HydrophobicContact CB-CG1 3.94Å; R82-I90 HydrophobicContact CG-CG1 4.33Å
83	K	91.2	Very high	91.9	Very high	137 Å²	137	47.2 Å²	47.2	60%	0.596	25%	0.252	S	S	*	.	H	α-helix	trans	-67.9	-37	178.9	-73.5	-178.5	180	177.7	0	112.5	E79	E79-K83 WeakPolarHBondContact O-CG 3.19Å; E79-K83 PolarHBondContact O-N 3.43Å; E79-K83 VanDerWaalsContact OE1-CE 3.28Å; E79-K83 WeakPolarHBondContact OE1-CE 3.22Å
84	R	91.6	Very high	92.1	Very high	221 Å²	221	45.9 Å²	45.9	83%	0.834	23%	0.234	S	C	*	.	H	α-helix	trans	-72	-31.5	-178.2	-171.3	172.4	-176.9	177.4	0.8	113.6	A80 V81	A80-R84 WeakPolarHBondContact O-CB 3.33Å; A80-R84 PolarHBondContact O-N 2.84Å; V81-R84 PolarHBondContact O-N 3.25Å
85	N	88.5	Confident	92	Very high	75 Å²	75	49.3 Å²	49.3	40%	0.401	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	8.3	-179.2	-63.7	-83.2	0	0	0	112.9	V81 L87	V81-N85 WeakPolarHBondContact CG1-ND2 3.47Å; V81-N85 WeakPolarHBondContact O-CB 3.43Å; V81-N85 PolarHBondContact O-N 3.43Å; V81-N85 PolarHBondContact O-ND2 3.34Å; N85-L87 VanDerWaalsContact C-N 3.34Å; N85-L87 HydrophobicContact CB-CD1 3.89Å; N85-L87 HydrophobicContact CB-CG 3.89Å; N85-L87 PolarHBondContact O-N 3.38Å
86	D	85	Confident	91.8	Very high	86 Å²	86	53.8 Å²	53.8	46%	0.46	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	47.9	-177	-69.7	-28.9	0	0	0	115	R82 R163	R82-D86 WeakPolarHBondContact O-CA 3.43Å; R82-D86 PolarHBondContact O-N 3.15Å; R82-D86 VanDerWaalsContact O-N 3.07Å; D86-R163 VanDerWaalsContact CB-NH2 3.34Å; D86-R163 VanDerWaalsContact CG-NH1 3.3Å; D86-R163 VanDerWaalsContact CG-NH2 3.33Å; D86-R163 IonicContact OD1-NH2 3.69Å; D86-R163 IonicContact OD2-CZ 2.79Å; D86-R163 IonicContact OD2-NH1 3.52Å; D86-R163 PolarHBondContact OD2-NH1 2.96Å; D86-R163 IonicContact OD2-NH2 3.67Å; D86-R163 PolarHBondContact OD2-NH2 3.13Å
87	L	88.2	Confident	91.6	Very high	9 Å²	9	51.4 Å²	51.4	5%	0.047	25%	0.251	C	S	.	.			trans	-88.4	144.4	179.6	-59.6	169.4	0	0	0	110.1	V51 R82 N85 F89 I90 I157 L159	V51-L87 HydrophobicContact CG1-CD1 4.05Å; R82-L87 HydrophobicContact CG-CB 4.09Å; R82-L87 WeakPolarHBondContact CG-O 3.49Å; R82-L87 PolarHBondContact NH1-O 3.34Å; R82-L87 PolarHBondContact O-N 3.46Å; N85-L87 VanDerWaalsContact C-N 3.34Å; N85-L87 HydrophobicContact CB-CD1 3.89Å; N85-L87 HydrophobicContact CB-CG 3.89Å; N85-L87 PolarHBondContact O-N 3.38Å; L87-F89 VanDerWaalsContact C-N 3.35Å; L87-I90 HydrophobicContact CB-CG1 4.28Å; L87-I90 HydrophobicContact CD1-CD1 3.59Å; L87-I90 HydrophobicContact CD1-CG1 3.85Å; L87-I157 HydrophobicContact CB-CG2 4.3Å; L87-I157 HydrophobicContact CD1-CD1 4.16Å; L87-I157 HydrophobicContact CD1-CG2 3.63Å; L87-I157 HydrophobicContact CD2-CG2 3.72Å; L87-I157 HydrophobicContact CG-CG2 4.07Å; L87-L159 HydrophobicContact CD2-CD2 3.44Å; L87-L159 VanDerWaalsContact CD2-CD2 3.44Å; L87-L159 HydrophobicContact CD2-CG 3.91Å
88	L	88	Confident	91.6	Very high	34 Å²	34	51.3 Å²	51.3	18%	0.178	25%	0.251	C	S	.	.	S	Bend	trans	-64	-44.1	177.1	-177.6	68.8	0	0	0	110.2	L134 A135 A137 G158 E160	L88-L134 HydrophobicContact CD1-CB 4.32Å; L88-L134 HydrophobicContact CD2-CB 4Å; L88-L134 HydrophobicContact CG-CB 4.19Å; L88-L134 HydrophobicContact CG-CD1 4.31Å; L88-A135 HydrophobicContact CD2-CB 3.97Å; L88-A137 HydrophobicContact CD2-CB 3.8Å; L88-G158 WeakPolarHBondContact CA-O 3.44Å; L88-G158 VanDerWaalsContact CB-O 3.29Å; L88-G158 WeakPolarHBondContact CB-O 3.34Å; L88-G158 PolarHBondContact N-O 3.39Å; L88-E160 HydrophobicContact CB-CB 4.49Å; L88-E160 HydrophobicContact CD1-CB 4.46Å; L88-E160 HydrophobicContact CD1-CG 4.44Å
89	F	91.2	Very high	91.6	Very high	15 Å²	15	51.7 Å²	51.7	7%	0.066	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	154.1	172.8	65.8	-97.5	0	0	0	111.6	L87 V91 P103 L134 A137 R139 A156 I157 G158	L87-F89 VanDerWaalsContact C-N 3.35Å; F89-V91 HydrophobicContact CB-CG2 4.39Å; F89-V91 HydrophobicContact CD2-CB 4.18Å; F89-V91 HydrophobicContact CD2-CG2 3.61Å; F89-V91 HydrophobicContact CE2-CG2 4.28Å; F89-V91 HydrophobicContact CG-CG2 4.33Å; F89-P103 HydrophobicContact CB-CG 3.5Å; F89-L134 HydrophobicContact CB-CD1 3.97Å; F89-L134 HydrophobicContact CD1-CD1 3.99Å; F89-L134 HydrophobicContact CG-CD1 4.37Å; F89-A137 HydrophobicContact CE1-CB 4.48Å; F89-R139 HydrophobicContact CZ-CG 4.03Å; F89-A156 HydrophobicContact CE2-CB 4.28Å; F89-I157 WeakPolarHBondContact O-CA 3.22Å; F89-G158 PolarHBondContact N-O 2.86Å; F89-G158 PolarHBondContact O-N 2.92Å
90	I	94.1	Very high	91.7	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	116.3	163	-59	-174.7	0	0	0	106.7	L55 A78 V81 R82 L87 S101 V155 I157	L55-I90 HydrophobicContact CD1-CD1 3.9Å; L55-I90 HydrophobicContact CD1-CG2 3.6Å; A78-I90 HydrophobicContact CB-CB 4.15Å; A78-I90 HydrophobicContact CB-CG2 3.93Å; V81-I90 HydrophobicContact CB-CD1 3.81Å; V81-I90 HydrophobicContact CG1-CD1 3.63Å; R82-I90 HydrophobicContact CB-CD1 3.95Å; R82-I90 HydrophobicContact CB-CG1 3.94Å; R82-I90 HydrophobicContact CG-CG1 4.33Å; L87-I90 HydrophobicContact CB-CG1 4.28Å; L87-I90 HydrophobicContact CD1-CD1 3.59Å; L87-I90 HydrophobicContact CD1-CG1 3.85Å; I90-S101 PolarHBondContact O-OG 2.64Å; I90-V155 HydrophobicContact CG2-CG1 4.38Å; I90-I157 HydrophobicContact CG1-CG1 4.26Å; I90-I157 HydrophobicContact CG2-CG1 4.43Å
91	V	94.3	Very high	91.7	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113.1	-176.2	172.7	0	0	0	0	108.3	F89 T93 R99 S101 H102 F112 A156	F89-V91 HydrophobicContact CB-CG2 4.39Å; F89-V91 HydrophobicContact CD2-CB 4.18Å; F89-V91 HydrophobicContact CD2-CG2 3.61Å; F89-V91 HydrophobicContact CE2-CG2 4.28Å; F89-V91 HydrophobicContact CG-CG2 4.33Å; V91-T93 HydrophobicContact CG1-CG2 3.89Å; V91-R99 HydrophobicContact CG1-CB 4.35Å; V91-R99 HydrophobicContact CG1-CG 3.74Å; V91-S101 WeakPolarHBondContact CA-O 3.37Å; V91-S101 WeakPolarHBondContact CA-OG 3.45Å; V91-S101 WeakPolarHBondContact CG1-O 3.47Å; V91-S101 WeakPolarHBondContact CG2-O 3.39Å; V91-H102 HydrophobicContact CG2-CB 4.44Å; V91-F112 HydrophobicContact CB-CE2 4.39Å; V91-F112 HydrophobicContact CG1-CD2 3.79Å; V91-F112 HydrophobicContact CG1-CE2 4.04Å; V91-A156 HydrophobicContact CB-CB 4.34Å; V91-A156 PolarHBondContact N-O 3.19Å; V91-A156 PolarHBondContact O-N 3.3Å
92	V	95.2	Very high	91.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	136.7	171	-179.5	0	0	0	0	108.3	I61 L65 I74 Y100 S101 I144 V155	I61-V92 HydrophobicContact CG2-CG1 4.02Å; I61-V92 HydrophobicContact CG2-CG2 4.48Å; L65-V92 HydrophobicContact CD1-CG1 4.33Å; L65-V92 HydrophobicContact CD2-CG1 4.02Å; L65-V92 HydrophobicContact CG-CG1 4.32Å; I74-V92 HydrophobicContact CD1-CG1 4.27Å; I74-V92 HydrophobicContact CG2-CB 3.66Å; I74-V92 HydrophobicContact CG2-CG1 4.13Å; I74-V92 HydrophobicContact CG2-CG2 3.64Å; V92-Y100 PolarHBondContact O-N 3.42Å; V92-S101 PolarHBondContact N-OG 3.12Å; V92-I144 HydrophobicContact CG1-CD1 3.76Å; V92-V155 HydrophobicContact CG2-CG2 4.4Å
93	T	94.1	Very high	91.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154	179.3	59	0	0	0	0	111.5	V91 L98 R99 F112 I117 G153 V154	V91-T93 HydrophobicContact CG1-CG2 3.89Å; T93-L98 WeakPolarHBondContact CA-O 3.35Å; T93-R99 HydrophobicContact CG2-CG 4.13Å; T93-F112 HydrophobicContact CG2-CB 4.09Å; T93-F112 HydrophobicContact CG2-CD2 4.21Å; T93-I117 HydrophobicContact CG2-CD1 4.24Å; T93-G153 CarbonylContact O-C 3.46Å; T93-G153 WeakPolarHBondContact O-CA 3.32Å; T93-V154 PolarHBondContact N-O 3.47Å; T93-V154 PolarHBondContact O-N 2.97Å; T93-V154 PolarHBondContact OG1-O 3.01Å
94	D	93.5	Very high	91.2	Very high	17 Å²	17	42.6 Å²	42.6	9%	0.091	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-178	166.2	65.8	15.3	0	0	0	111.9	L65 Q96 S97 L98 Y100	L65-D94 HydrophobicContact CD2-CB 4.47Å; D94-Q96 PolarHBondContact O-N 3Å; D94-Q96 VanDerWaalsContact OD1-C 3.25Å; D94-Q96 VanDerWaalsContact OD1-CA 3.29Å; D94-Q96 WeakPolarHBondContact OD1-CA 3.31Å; D94-Q96 WeakPolarHBondContact OD1-CB 3.33Å; D94-Q96 PolarHBondContact OD1-N 3.27Å; D94-Q96 PolarHBondContact OD2-OE1 3.35Å; D94-S97 PolarHBondContact O-N 3.13Å; D94-S97 PolarHBondContact OD1-N 3.05Å; D94-L98 PolarHBondContact N-O 3.42Å; D94-L98 VanDerWaalsContact OD1-CB 3.31Å; D94-L98 WeakPolarHBondContact OD1-CB 3.42Å; D94-L98 PolarHBondContact OD1-N 3.48Å; D94-L98 VanDerWaalsContact OD2-CB 3.23Å; D94-L98 WeakPolarHBondContact OD2-CB 3.35Å; D94-Y100 HydrophobicContact CB-CE2 3.88Å
95	M	92.8	Very high	90.9	Very high	71 Å²	71	35.3 Å²	35.3	35%	0.35	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-15.9	176.4	-69	-56.6	-64.5	0	0	114.1	S97 L121 Q151	M95-S97 VanDerWaalsContact C-N 3.27Å; M95-L121 HydrophobicContact CE-CD2 4.4Å; M95-L121 HydrophobicContact SD-CD2 4.27Å; M95-Q151 HydrophobicContact CE-CG 4.43Å; M95-Q151 HydrophobicContact SD-CB 4.1Å; M95-Q151 HydrophobicContact SD-CG 3.62Å
96	Q	89.3	Confident	90.9	Very high	144 Å²	144	40.1 Å²	40.1	67%	0.673	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	9.6	173.1	-65.6	73.7	34.7	0	0	112	D94 L98	D94-Q96 PolarHBondContact O-N 3Å; D94-Q96 VanDerWaalsContact OD1-C 3.25Å; D94-Q96 VanDerWaalsContact OD1-CA 3.29Å; D94-Q96 WeakPolarHBondContact OD1-CA 3.31Å; D94-Q96 WeakPolarHBondContact OD1-CB 3.33Å; D94-Q96 PolarHBondContact OD1-N 3.27Å; D94-Q96 PolarHBondContact OD2-OE1 3.35Å; Q96-L98 PolarHBondContact O-N 3.22Å
97	S	88.1	Confident	91	Very high	23 Å²	23	37.9 Å²	37.9	16%	0.161	20%	0.196	C	C	.	.			trans	62.8	17.9	-175.4	-56.4	0	0	0	0	114.2	D94 M95 P111 F112	D94-S97 PolarHBondContact O-N 3.13Å; D94-S97 PolarHBondContact OD1-N 3.05Å; M95-S97 VanDerWaalsContact C-N 3.27Å; S97-P111 CarbonylContact O-C 3.44Å; S97-P111 VanDerWaalsContact O-CA 3.32Å; S97-P111 WeakPolarHBondContact O-CA 3.27Å; S97-F112 PolarHBondContact O-N 2.96Å
98	L	92.4	Very high	91	Very high	48 Å²	48	39.4 Å²	39.4	25%	0.251	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-74	128.2	177.6	-160.7	74.7	0	0	0	110	P69 T93 D94 Q96 Y100 G109	P69-L98 HydrophobicContact CG-CD2 3.87Å; T93-L98 WeakPolarHBondContact CA-O 3.35Å; D94-L98 PolarHBondContact N-O 3.42Å; D94-L98 VanDerWaalsContact OD1-CB 3.31Å; D94-L98 WeakPolarHBondContact OD1-CB 3.42Å; D94-L98 PolarHBondContact OD1-N 3.48Å; D94-L98 VanDerWaalsContact OD2-CB 3.23Å; D94-L98 WeakPolarHBondContact OD2-CB 3.35Å; Q96-L98 PolarHBondContact O-N 3.22Å; L98-Y100 WeakPolarHBondContact O-CD2 3.46Å; L98-Y100 PolarHBondContact O-N 2.85Å; L98-G109 WeakPolarHBondContact CD1-O 3.24Å
99	R	93.5	Very high	91	Very high	11 Å²	11	39.4 Å²	39.4	4%	0.042	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-77.2	124.4	-177.6	-66.5	175.2	175.4	140.8	-1.1	112.7	V91 T93 I108 G109 Q110 P111	V91-R99 HydrophobicContact CG1-CB 4.35Å; V91-R99 HydrophobicContact CG1-CG 3.74Å; T93-R99 HydrophobicContact CG2-CG 4.13Å; R99-I108 WeakPolarHBondContact O-CG2 3.45Å; R99-G109 PolarHBondContact O-N 3Å; R99-Q110 WeakPolarHBondContact CB-O 3.21Å; R99-Q110 VanDerWaalsContact CG-O 3.3Å; R99-Q110 WeakPolarHBondContact CG-O 3.29Å; R99-Q110 PolarHBondContact N-O 2.7Å; R99-P111 PolarHBondContact NH1-O 2.81Å
100	Y	94.4	Very high	90.9	Very high	16 Å²	16	43.3 Å²	43.3	6%	0.063	23%	0.23	C	C	.	.	S	Bend	trans	-94.7	-22	171	-81	-111	0	0	0	113	L65 K67 P69 I74 V92 D94 L98	L65-Y100 HydrophobicContact CD2-CD1 4.09Å; L65-Y100 HydrophobicContact CD2-CD2 3.77Å; L65-Y100 HydrophobicContact CD2-CE1 4.16Å; L65-Y100 HydrophobicContact CD2-CE2 3.9Å; L65-Y100 HydrophobicContact CD2-CG 3.88Å; L65-Y100 PolarHBondContact O-OH 3.38Å; K67-Y100 WeakPolarHBondContact O-CE1 3.34Å; K67-Y100 PolarHBondContact O-OH 2.82Å; P69-Y100 HydrophobicContact CB-CD1 4.26Å; P69-Y100 HydrophobicContact CB-CE1 4.48Å; P69-Y100 HydrophobicContact CB-CG 4.41Å; P69-Y100 HydrophobicContact CG-CD1 4.32Å; P69-Y100 HydrophobicContact CG-CD2 4.3Å; P69-Y100 HydrophobicContact CG-CE1 4.15Å; P69-Y100 HydrophobicContact CG-CE2 4.06Å; P69-Y100 HydrophobicContact CG-CG 4.41Å; I74-Y100 HydrophobicContact CD1-CD1 3.79Å; I74-Y100 HydrophobicContact CD1-CG 4.19Å; V92-Y100 PolarHBondContact O-N 3.42Å; D94-Y100 HydrophobicContact CB-CE2 3.88Å; L98-Y100 WeakPolarHBondContact O-CD2 3.46Å; L98-Y100 PolarHBondContact O-N 2.85Å
101	S	93.5	Very high	90.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.			trans	-137.2	149.6	169.2	65.1	0	0	0	0	112.8	A78 I90 V91 V92	A78-S101 VanDerWaalsContact CB-CB 3.45Å; A78-S101 WeakPolarHBondContact CB-OG 3.44Å; I90-S101 PolarHBondContact O-OG 2.64Å; V91-S101 WeakPolarHBondContact CA-O 3.37Å; V91-S101 WeakPolarHBondContact CA-OG 3.45Å; V91-S101 WeakPolarHBondContact CG1-O 3.47Å; V91-S101 WeakPolarHBondContact CG2-O 3.39Å; V92-S101 PolarHBondContact N-OG 3.12Å
102	H	91.4	Very high	90.3	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.046	26%	0.262	C	S	.	.			trans	-163.9	145.8	171.1	-165.8	-90	0	0	0	110	Q75 V91 E104 R107 I108	Q75-H102 PolarHBondContact NE2-O 3.26Å; Q75-H102 PolarHBondContact OE1-O 3.13Å; V91-H102 HydrophobicContact CG2-CB 4.44Å; H102-E104 VanDerWaalsContact C-N 3.3Å; H102-E104 WeakPolarHBondContact ND1-CB 3.27Å; H102-E104 PolarHBondContact ND1-N 3.43Å; H102-E104 PolarHBondContact ND1-O 3.01Å; H102-E104 PolarHBondContact O-N 2.91Å; H102-R107 HydrophobicContact CB-CB 4.3Å; H102-I108 HydrophobicContact CB-CG1 4.22Å
103	P	89.1	Confident	89.7	Confident	40 Å²	40	55.8 Å²	55.8	26%	0.26	29%	0.294	S	S	.	.	S	Bend	trans	-58.7	-40.3	175.7	-24.6	33	0	0	0	113.1	F89 A105 L134	F89-P103 HydrophobicContact CB-CG 3.5Å; P103-A105 PolarHBondContact O-N 3.35Å; P103-L134 HydrophobicContact CG-CD1 4.21Å
104	E	88.1	Confident	89	Confident	69 Å²	69	56.7 Å²	56.7	32%	0.322	30%	0.303	S	S	.	.	S	Bend	trans	-84.8	104.6	168.9	-60.9	168.7	-148.7	0	0	109.9	H102 Q106 R107 L134	H102-E104 VanDerWaalsContact C-N 3.3Å; H102-E104 WeakPolarHBondContact ND1-CB 3.27Å; H102-E104 PolarHBondContact ND1-N 3.43Å; H102-E104 PolarHBondContact ND1-O 3.01Å; H102-E104 PolarHBondContact O-N 2.91Å; E104-Q106 PolarHBondContact O-N 2.95Å; E104-Q106 VanDerWaalsContact O-N 3.09Å; E104-R107 HydrophobicContact CB-CG 4.3Å; E104-R107 PolarHBondContact O-N 3.2Å; E104-R107 VanDerWaalsContact O-N 3.07Å; E104-R107 IonicContact OE1-NH2 3.55Å; E104-R107 IonicContact OE2-CZ 3.31Å; E104-R107 IonicContact OE2-NE 2.77Å; E104-R107 PolarHBondContact OE2-NE 3.42Å; E104-R107 IonicContact OE2-NH2 2.93Å; E104-R107 PolarHBondContact OE2-NH2 3.41Å; E104-L134 WeakPolarHBondContact OE1-CD2 3.33Å
105	A	85.1	Confident	88.5	Confident	69 Å²	69	62.1 Å²	62.1	57%	0.57	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-56.4	-28.6	-175.7	0	0	0	0	0	114.2	P103 R107 I108	P103-A105 PolarHBondContact O-N 3.35Å; A105-R107 PolarHBondContact O-N 2.99Å; A105-R107 VanDerWaalsContact O-N 3.1Å; A105-I108 HydrophobicContact CB-CD1 4.42Å; A105-I108 WeakPolarHBondContact O-CG1 3.45Å; A105-I108 PolarHBondContact O-N 3.28Å
106	Q	87.1	Confident	88.2	Confident	176 Å²	176	60 Å²	60	82%	0.822	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-63	-15.4	178.9	-62.2	177.3	7.3	0	0	113.8	E104 Q110	E104-Q106 PolarHBondContact O-N 2.95Å; E104-Q106 VanDerWaalsContact O-N 3.09Å; Q106-Q110 PolarHBondContact O-NE2 3.16Å
107	R	87.4	Confident	88.2	Confident	38 Å²	38	53.3 Å²	53.3	14%	0.143	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-98.4	-5.1	-178.8	-57.8	-162.2	-167.3	-160.6	1.6	114.3	H102 E104 A105 G109 Q110	H102-R107 HydrophobicContact CB-CB 4.3Å; E104-R107 HydrophobicContact CB-CG 4.3Å; E104-R107 PolarHBondContact O-N 3.2Å; E104-R107 VanDerWaalsContact O-N 3.07Å; E104-R107 IonicContact OE1-NH2 3.55Å; E104-R107 IonicContact OE2-CZ 3.31Å; E104-R107 IonicContact OE2-NE 2.77Å; E104-R107 PolarHBondContact OE2-NE 3.42Å; E104-R107 IonicContact OE2-NH2 2.93Å; E104-R107 PolarHBondContact OE2-NH2 3.41Å; A105-R107 PolarHBondContact O-N 2.99Å; A105-R107 VanDerWaalsContact O-N 3.1Å; R107-G109 PolarHBondContact O-N 3.01Å; R107-Q110 WeakPolarHBondContact O-CB 3.16Å; R107-Q110 PolarHBondContact O-N 3.19Å; R107-Q110 VanDerWaalsContact O-N 3.14Å
108	I	89	Confident	88.2	Confident	42 Å²	42	56.8 Å²	56.8	22%	0.215	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	131.9	174.2	-58.2	172.1	0	0	0	107.4	P69 Q75 R99 H102 A105	P69-I108 HydrophobicContact CB-CG2 3.88Å; Q75-I108 HydrophobicContact CB-CD1 4.32Å; Q75-I108 HydrophobicContact CG-CD1 3.86Å; R99-I108 WeakPolarHBondContact O-CG2 3.45Å; H102-I108 HydrophobicContact CB-CG1 4.22Å; A105-I108 HydrophobicContact CB-CD1 4.42Å; A105-I108 WeakPolarHBondContact O-CG1 3.45Å; A105-I108 PolarHBondContact O-N 3.28Å
109	G	86.9	Confident	88	Confident	34 Å²	34	59.8 Å²	59.8	35%	0.351	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	5.4	-172.4	0	0	0	0	0	114.8	L98 R99 R107	L98-G109 WeakPolarHBondContact CD1-O 3.24Å; R99-G109 PolarHBondContact O-N 3Å; R107-G109 PolarHBondContact O-N 3.01Å
110	Q	89.6	Confident	87.9	Confident	97 Å²	97	59.2 Å²	59.2	45%	0.453	32%	0.316	S	S	.	.	S	Bend	trans	-101.4	152.4	170.4	-61.6	-178.2	1.1	0	0	110.7	R99 Q106 R107	R99-Q110 WeakPolarHBondContact CB-O 3.21Å; R99-Q110 VanDerWaalsContact CG-O 3.3Å; R99-Q110 WeakPolarHBondContact CG-O 3.29Å; R99-Q110 PolarHBondContact N-O 2.7Å; Q106-Q110 PolarHBondContact O-NE2 3.16Å; R107-Q110 WeakPolarHBondContact O-CB 3.16Å; R107-Q110 PolarHBondContact O-N 3.19Å; R107-Q110 VanDerWaalsContact O-N 3.14Å
111	P	89.1	Confident	87.7	Confident	90 Å²	90	59.7 Å²	59.7	58%	0.584	32%	0.32	S	S	*	.	B	Isolated β-bridge	trans	-60.1	145.5	174.7	-24.3	34.1	0	0	0	113.3	S97 R99 K113	S97-P111 CarbonylContact O-C 3.44Å; S97-P111 VanDerWaalsContact O-CA 3.32Å; S97-P111 WeakPolarHBondContact O-CA 3.27Å; R99-P111 PolarHBondContact NH1-O 2.81Å; P111-K113 PolarHBondContact O-N 3.35Å
112	F	87.7	Confident	87.6	Confident	23 Å²	23	66.1 Å²	66.1	10%	0.101	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-68.8	125.5	171.8	-168.5	-84.8	0	0	0	110.3	V91 T93 S97 I117 F141 A156	V91-F112 HydrophobicContact CB-CE2 4.39Å; V91-F112 HydrophobicContact CG1-CD2 3.79Å; V91-F112 HydrophobicContact CG1-CE2 4.04Å; T93-F112 HydrophobicContact CG2-CB 4.09Å; T93-F112 HydrophobicContact CG2-CD2 4.21Å; S97-F112 PolarHBondContact O-N 2.96Å; F112-I117 HydrophobicContact CB-CD1 4.1Å; F112-I117 HydrophobicContact CD1-CB 4.11Å; F112-I117 HydrophobicContact CD1-CD1 3.98Å; F112-I117 HydrophobicContact CD1-CG2 4.1Å; F112-I117 HydrophobicContact CD2-CD1 4.46Å; F112-I117 HydrophobicContact CE1-CB 4.27Å; F112-I117 HydrophobicContact CG-CD1 3.93Å; F112-F141 HydrophobicContact CE1-CE1 4.03Å; F112-F141 HydrophobicContact CE1-CZ 4.42Å; F112-F141 AromaticContact CZ-CE1 3.82Å; F112-F141 HydrophobicContact CZ-CE1 3.82Å; F112-F141 HydrophobicContact CZ-CZ 4.25Å; F112-A156 HydrophobicContact CE2-CB 4.08Å; F112-A156 HydrophobicContact CZ-CB 4.38Å
113	K	80.6	Confident	87.5	Confident	153 Å²	153	66.7 Å²	66.7	67%	0.665	36%	0.363	S	S	*	.			trans	-98	113.1	177.3	-165.7	-178.7	-174.7	177.3	0	110.3	P111 F133	P111-K113 PolarHBondContact O-N 3.35Å; K113-F133 HydrophobicContact CB-CE2 4.33Å; K113-F133 HydrophobicContact CD-CE2 3.67Å; K113-F133 HydrophobicContact CD-CZ 4.08Å
114	G	80.1	Confident	87.6	Confident	20 Å²	20	70.7 Å²	70.7	21%	0.206	38%	0.378	C	S	.	.			trans	145.3	133.5	173.3	0	0	0	0	0	112	D116 I117	G114-D116 PolarHBondContact O-N 3Å; G114-I117 WeakPolarHBondContact O-CG2 3.3Å
115	D	83.6	Confident	87.8	Confident	131 Å²	131	70.9 Å²	70.9	70%	0.701	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-73.4	-14.5	-173.9	-53.8	-30.5	0	0	0	113	I117 L118	D115-I117 PolarHBondContact O-N 2.89Å; D115-I117 VanDerWaalsContact O-N 3.09Å; D115-L118 HydrophobicContact CB-CD1 4.03Å; D115-L118 WeakPolarHBondContact O-CB 3.27Å; D115-L118 VanDerWaalsContact O-CG 3.3Å; D115-L118 WeakPolarHBondContact O-CG 3.25Å; D115-L118 PolarHBondContact O-N 2.85Å; D115-L118 VanDerWaalsContact O-N 3.07Å
116	D	85.6	Confident	88.1	Confident	26 Å²	26	68.6 Å²	68.6	14%	0.139	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-59.7	-23	-179.9	-42.9	-33.5	0	0	0	113.2	G114 L118 N126 A128 N130 R139 F141	G114-D116 PolarHBondContact O-N 3Å; D116-L118 VanDerWaalsContact C-N 3.34Å; D116-N126 PolarHBondContact O-ND2 3.33Å; D116-A128 HydrophobicContact CB-CB 3.89Å; D116-N130 VanDerWaalsContact CG-ND2 3.3Å; D116-N130 PolarHBondContact OD1-ND2 3.36Å; D116-N130 WeakPolarHBondContact OD2-CB 3.47Å; D116-N130 PolarHBondContact OD2-ND2 3.45Å; D116-R139 IonicContact OD2-CZ 2.67Å; D116-R139 IonicContact OD2-NH1 3.4Å; D116-R139 PolarHBondContact OD2-NH1 2.85Å; D116-F141 HydrophobicContact CB-CD2 4.29Å; D116-F141 HydrophobicContact CB-CE2 3.41Å; D116-F141 VanDerWaalsContact CB-CE2 3.41Å; D116-F141 HydrophobicContact CB-CZ 3.57Å
117	I	89.1	Confident	88.2	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.021	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-76.2	-21.4	179.9	-160.5	172.7	0	0	0	112.6	T93 F112 G114 D115 K119 A120 L121 F141 V154	T93-I117 HydrophobicContact CG2-CD1 4.24Å; F112-I117 HydrophobicContact CB-CD1 4.1Å; F112-I117 HydrophobicContact CD1-CB 4.11Å; F112-I117 HydrophobicContact CD1-CD1 3.98Å; F112-I117 HydrophobicContact CD1-CG2 4.1Å; F112-I117 HydrophobicContact CD2-CD1 4.46Å; F112-I117 HydrophobicContact CE1-CB 4.27Å; F112-I117 HydrophobicContact CG-CD1 3.93Å; G114-I117 WeakPolarHBondContact O-CG2 3.3Å; D115-I117 PolarHBondContact O-N 2.89Å; D115-I117 VanDerWaalsContact O-N 3.09Å; I117-K119 VanDerWaalsContact C-N 3.3Å; I117-K119 PolarHBondContact O-N 2.82Å; I117-A120 PolarHBondContact O-N 2.91Å; I117-L121 HydrophobicContact CG1-CD1 4.35Å; I117-L121 HydrophobicContact CG1-CG 4.23Å; I117-L121 HydrophobicContact CG2-CD1 3.96Å; I117-L121 PolarHBondContact O-N 2.74Å; I117-F141 HydrophobicContact CB-CD1 4.16Å; I117-F141 HydrophobicContact CB-CE1 4.04Å; I117-F141 HydrophobicContact CG1-CD1 4.02Å; I117-F141 HydrophobicContact CG1-CE1 4.27Å; I117-V154 HydrophobicContact CD1-CB 4.36Å; I117-V154 HydrophobicContact CD1-CG1 4.4Å; I117-V154 HydrophobicContact CG1-CB 4.34Å; I117-V154 HydrophobicContact CG1-CG1 4.06Å; I117-V154 HydrophobicContact CG1-CG2 4.47Å
118	L	89	Confident	88.2	Confident	96 Å²	96	61.8 Å²	61.8	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-38.6	-172.5	-67.4	172.1	0	0	0	112.8	D115 D116 L121 N122	D115-L118 HydrophobicContact CB-CD1 4.03Å; D115-L118 WeakPolarHBondContact O-CB 3.27Å; D115-L118 VanDerWaalsContact O-CG 3.3Å; D115-L118 WeakPolarHBondContact O-CG 3.25Å; D115-L118 PolarHBondContact O-N 2.85Å; D115-L118 VanDerWaalsContact O-N 3.07Å; D116-L118 VanDerWaalsContact C-N 3.34Å; L118-L121 PolarHBondContact O-N 2.82Å; L118-N122 PolarHBondContact O-N 2.89Å; L118-N122 PolarHBondContact O-ND2 2.86Å
119	K	89	Confident	87.8	Confident	110 Å²	110	62.6 Å²	62.6	48%	0.478	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-42.5	175.6	-69.1	-170.7	-176.7	-179.9	0	111.9	I117 N122 G123 E124 N126	I117-K119 VanDerWaalsContact C-N 3.3Å; I117-K119 PolarHBondContact O-N 2.82Å; K119-N122 CarbonylContact O-C 3.58Å; K119-N122 WeakPolarHBondContact O-CA 3.09Å; K119-N122 WeakPolarHBondContact O-CB 3.37Å; K119-N122 PolarHBondContact O-N 3.4Å; K119-N122 VanDerWaalsContact O-N 3.08Å; K119-G123 PolarHBondContact O-N 3.21Å; K119-E124 CarbonylContact C-O 3.58Å; K119-E124 PolarHBondContact O-N 2.84Å; K119-N126 HydrophobicContact CB-CB 3.95Å; K119-N126 HydrophobicContact CD-CB 4.22Å
120	A	91.3	Very high	87.1	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-70.1	-31.8	177.3	0	0	0	0	0	112.9	I117 N122 G123 E124 F141 Q151 V154	I117-A120 PolarHBondContact O-N 2.91Å; A120-N122 PolarHBondContact O-N 3.4Å; A120-G123 PolarHBondContact O-N 3.39Å; A120-G123 VanDerWaalsContact O-N 3.1Å; A120-E124 WeakPolarHBondContact CA-O 3.41Å; A120-E124 PolarHBondContact N-O 3.3Å; A120-E124 VanDerWaalsContact N-O 3.15Å; A120-F141 HydrophobicContact CB-CB 3.54Å; A120-Q151 PolarHBondContact O-NE2 3.45Å; A120-V154 HydrophobicContact CB-CB 4.43Å; A120-V154 HydrophobicContact CB-CG1 3.6Å; A120-V154 HydrophobicContact CB-CG2 3.87Å
121	L	89.9	Confident	85.8	Confident	25 Å²	25	68.6 Å²	68.6	13%	0.131	35%	0.349	C	S	.	.	H	α-helix	trans	-67.4	-19.9	170.5	-69.6	168.5	0	0	0	113.1	M95 I117 L118 G123 Q151 V154	M95-L121 HydrophobicContact CE-CD2 4.4Å; M95-L121 HydrophobicContact SD-CD2 4.27Å; I117-L121 HydrophobicContact CG1-CD1 4.35Å; I117-L121 HydrophobicContact CG1-CG 4.23Å; I117-L121 HydrophobicContact CG2-CD1 3.96Å; I117-L121 PolarHBondContact O-N 2.74Å; L118-L121 PolarHBondContact O-N 2.82Å; L121-G123 VanDerWaalsContact C-N 3.35Å; L121-Q151 PolarHBondContact O-OE1 3.24Å; L121-V154 HydrophobicContact CD2-CG2 3.83Å; L121-V154 HydrophobicContact CG-CG2 4.18Å
122	N	90.9	Very high	84.4	Confident	135 Å²	135	65.6 Å²	65.6	72%	0.722	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	9.1	172.1	-67.1	-22.4	0	0	0	113.1	L118 K119 A120	L118-N122 PolarHBondContact O-N 2.89Å; L118-N122 PolarHBondContact O-ND2 2.86Å; K119-N122 CarbonylContact O-C 3.58Å; K119-N122 WeakPolarHBondContact O-CA 3.09Å; K119-N122 WeakPolarHBondContact O-CB 3.37Å; K119-N122 PolarHBondContact O-N 3.4Å; K119-N122 VanDerWaalsContact O-N 3.08Å; A120-N122 PolarHBondContact O-N 3.4Å
123	G	89.6	Confident	83	Confident	22 Å²	22	70.5 Å²	70.5	23%	0.227	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	2.8	178.7	0	0	0	0	0	115.5	K119 A120 L121 Y145	K119-G123 PolarHBondContact O-N 3.21Å; A120-G123 PolarHBondContact O-N 3.39Å; A120-G123 VanDerWaalsContact O-N 3.1Å; L121-G123 VanDerWaalsContact C-N 3.35Å; G123-Y145 WeakPolarHBondContact CA-OH 3.3Å; G123-Y145 PolarHBondContact O-OH 2.97Å
124	E	90.7	Very high	82.1	Confident	125 Å²	125	66.3 Å²	66.3	58%	0.584	34%	0.341	S	S	*	.			trans	-102.5	129.2	-179.5	-65.3	-178.1	-179.8	0	0	112.4	K119 A120	K119-E124 CarbonylContact C-O 3.58Å; K119-E124 PolarHBondContact O-N 2.84Å; A120-E124 WeakPolarHBondContact CA-O 3.41Å; A120-E124 PolarHBondContact N-O 3.3Å; A120-E124 VanDerWaalsContact N-O 3.15Å
125	E	92.4	Very high	81.2	Confident	72 Å²	72	66.8 Å²	66.8	34%	0.336	34%	0.342	S	S	.	.			trans	-62.2	142.6	171.2	-64.5	-172.9	141.8	0	0	111.5	L49 R53 F141 T142	L49-E125 HydrophobicContact CD2-CB 4.31Å; R53-E125 VanDerWaalsContact CG-OE1 3.28Å; R53-E125 WeakPolarHBondContact CG-OE1 3.34Å; R53-E125 IonicContact CZ-OE1 2.86Å; R53-E125 IonicContact CZ-OE2 3.7Å; R53-E125 IonicContact NE-OE1 3.15Å; R53-E125 PolarHBondContact NE-OE1 2.91Å; R53-E125 IonicContact NE-OE2 2.74Å; R53-E125 PolarHBondContact NE-OE2 2.69Å; R53-E125 IonicContact NH2-OE1 3.31Å; R53-E125 IonicContact NH2-OE2 2.97Å; R53-E125 PolarHBondContact NH2-OE2 2.91Å; E125-F141 VanDerWaalsContact CA-O 3.31Å; E125-F141 WeakPolarHBondContact CA-O 3.45Å; E125-T142 HydrophobicContact CG-CG2 4.44Å; E125-T142 WeakPolarHBondContact OE1-CG2 3.16Å; E125-T142 PolarHBondContact OE1-OG1 3Å
126	N	92.1	Very high	80.7	Confident	21 Å²	21	65.4 Å²	65.4	11%	0.112	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.7	-179	-172.3	38.7	0	0	0	111.7	D116 K119 V140 F141	D116-N126 PolarHBondContact O-ND2 3.33Å; K119-N126 HydrophobicContact CB-CB 3.95Å; K119-N126 HydrophobicContact CD-CB 4.22Å; N126-V140 WeakPolarHBondContact O-CA 3.49Å; N126-F141 HydrophobicContact CB-CB 4.39Å; N126-F141 HydrophobicContact CB-CD2 4.28Å; N126-F141 PolarHBondContact N-O 3.16Å; N126-F141 VanDerWaalsContact N-O 3.1Å; N126-F141 PolarHBondContact O-N 3.3Å
127	V	89.7	Confident	80.5	Confident	56 Å²	56	64.2 Å²	64.2	34%	0.339	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	116.9	172.5	-177.6	0	0	0	0	108	A45 L49 L138 R139 V140	A45-V127 HydrophobicContact CB-CG1 3.93Å; L49-V127 HydrophobicContact CD1-CG2 3.96Å; L49-V127 HydrophobicContact CG-CG2 4.29Å; V127-L138 HydrophobicContact CG1-CD1 3.68Å; V127-L138 HydrophobicContact CG1-CG 4.48Å; V127-R139 WeakPolarHBondContact CA-O 3.43Å; V127-V140 HydrophobicContact CG1-CG2 4.43Å; V127-V140 HydrophobicContact CG2-CG2 4.29Å
128	A	86	Confident	80.4	Confident	15 Å²	15	64 Å²	64	12%	0.124	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	143.9	-177.4	0	0	0	0	0	110.9	D116 R139	D116-A128 HydrophobicContact CB-CB 3.89Å; A128-R139 PolarHBondContact N-O 3.36Å; A128-R139 PolarHBondContact O-N 2.99Å
129	I	80.5	Confident	80.5	Confident	59 Å²	59	60 Å²	60	30%	0.303	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	115.2	165.1	-62.8	-179.3	0	0	0	106.7	Q136 L138 L161	I129-Q136 HydrophobicContact CG2-CG 4.17Å; I129-L138 HydrophobicContact CD1-CD1 4.47Å; I129-L138 HydrophobicContact CG1-CD1 3.84Å; I129-L161 HydrophobicContact CD1-CD1 4.32Å
130	N	73.7	Confident	80.7	Confident	52 Å²	52	54.7 Å²	54.7	28%	0.278	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	142.6	-178.6	-169.7	-31.3	0	0	0	110.1	D116 G132 A137 R139	D116-N130 VanDerWaalsContact CG-ND2 3.3Å; D116-N130 PolarHBondContact OD1-ND2 3.36Å; D116-N130 WeakPolarHBondContact OD2-CB 3.47Å; D116-N130 PolarHBondContact OD2-ND2 3.45Å; N130-G132 PolarHBondContact O-N 2.88Å; N130-A137 PolarHBondContact N-O 2.89Å; N130-A137 PolarHBondContact O-N 2.8Å; N130-R139 PolarHBondContact O-NH2 2.68Å; N130-R139 VanDerWaalsContact O-NH2 3.09Å; N130-R139 PolarHBondContact OD1-NH2 3.26Å
131	R	60.8	Low	80.8	Confident	205 Å²	205	54.7 Å²	54.7	77%	0.774	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	110.1	176.8	-168.7	172.6	-179	172.7	0.6	109.2	R139	R131-R139 PolarHBondContact O-NH2 2.84Å; R131-R139 VanDerWaalsContact O-NH2 3.16Å
132	G	59.6	Low	81.1	Confident	27 Å²	27	53.8 Å²	53.8	28%	0.278	28%	0.275	S	S	.	.			trans	-88.7	-176	179.2	0	0	0	0	0	111.6	N130 L134 A135	N130-G132 PolarHBondContact O-N 2.88Å; G132-L134 VanDerWaalsContact C-N 3.27Å; G132-A135 PolarHBondContact N-O 3.46Å
133	F	58.7	Low	81.3	Confident	127 Å²	127	47.9 Å²	47.9	56%	0.557	24%	0.244	S	C	*	.	S	Bend	trans	-66.1	-31.7	167.2	-83.9	-86	0	0	0	112.8	K113	K113-F133 HydrophobicContact CB-CE2 4.33Å; K113-F133 HydrophobicContact CD-CE2 3.67Å; K113-F133 HydrophobicContact CD-CZ 4.08Å
134	L	60.9	Low	81.6	Confident	65 Å²	65	46.9 Å²	46.9	34%	0.34	23%	0.233	S	C	.	.	S	Bend	trans	-83.2	-55.7	-177.7	-69.3	167.3	0	0	0	111.8	L88 F89 P103 E104 G132	L88-L134 HydrophobicContact CD1-CB 4.32Å; L88-L134 HydrophobicContact CD2-CB 4Å; L88-L134 HydrophobicContact CG-CB 4.19Å; L88-L134 HydrophobicContact CG-CD1 4.31Å; F89-L134 HydrophobicContact CB-CD1 3.97Å; F89-L134 HydrophobicContact CD1-CD1 3.99Å; F89-L134 HydrophobicContact CG-CD1 4.37Å; P103-L134 HydrophobicContact CG-CD1 4.21Å; E104-L134 WeakPolarHBondContact OE1-CD2 3.33Å; G132-L134 VanDerWaalsContact C-N 3.27Å
135	A	62.2	Low	81.7	Confident	29 Å²	29	44.7 Å²	44.7	24%	0.24	22%	0.22	C	C	.	.			trans	-164	175.8	178.1	0	0	0	0	0	110.6	L88 G132 A137 E160	L88-A135 HydrophobicContact CD2-CB 3.97Å; G132-A135 PolarHBondContact N-O 3.46Å; A135-A137 PolarHBondContact O-N 3.03Å; A135-E160 HydrophobicContact CB-CG 4.24Å
136	Q	73.3	Confident	81.6	Confident	103 Å²	103	42.6 Å²	42.6	48%	0.481	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	120	162.2	-164.5	170.9	6.6	0	0	108.3	I129 L161	I129-Q136 HydrophobicContact CG2-CG 4.17Å; Q136-L161 HydrophobicContact CG-CD2 4.06Å; Q136-L161 WeakPolarHBondContact O-CB 3.49Å; Q136-L161 PolarHBondContact O-N 3.43Å; Q136-L161 VanDerWaalsContact O-N 3.12Å
137	A	81.8	Confident	81.2	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144.1	-171.5	0	0	0	0	0	110.6	L88 F89 N130 A135 R139 L159	L88-A137 HydrophobicContact CD2-CB 3.8Å; F89-A137 HydrophobicContact CE1-CB 4.48Å; N130-A137 PolarHBondContact N-O 2.89Å; N130-A137 PolarHBondContact O-N 2.8Å; A135-A137 PolarHBondContact O-N 3.03Å; A137-R139 HydrophobicContact CB-CG 4.28Å; A137-R139 PolarHBondContact O-N 3.42Å; A137-L159 CarbonylContact C-O 3.47Å; A137-L159 WeakPolarHBondContact CA-O 3.43Å; A137-L159 VanDerWaalsContact CB-O 3.22Å; A137-L159 WeakPolarHBondContact CB-O 2.9Å
138	L	87.1	Confident	81.1	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	113	160.4	178.5	70.7	0	0	0	106.7	L44 A45 V127 I129 L159	L44-L138 HydrophobicContact CB-CD2 4.38Å; A45-L138 HydrophobicContact CB-CD2 3.96Å; V127-L138 HydrophobicContact CG1-CD1 3.68Å; V127-L138 HydrophobicContact CG1-CG 4.48Å; I129-L138 HydrophobicContact CD1-CD1 4.47Å; I129-L138 HydrophobicContact CG1-CD1 3.84Å; L138-L159 HydrophobicContact CB-CB 4.29Å; L138-L159 HydrophobicContact CD2-CD1 4.09Å; L138-L159 PolarHBondContact N-O 2.8Å; L138-L159 PolarHBondContact O-N 3.48Å
139	R	90.1	Very high	81.2	Confident	10 Å²	10	61.1 Å²	61.1	4%	0.038	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	136.5	-177.4	-57.3	-176.2	-168.9	160.8	3.4	110.1	F89 D116 V127 A128 N130 R131 A137 F141 I157	F89-R139 HydrophobicContact CZ-CG 4.03Å; D116-R139 IonicContact OD2-CZ 2.67Å; D116-R139 IonicContact OD2-NH1 3.4Å; D116-R139 PolarHBondContact OD2-NH1 2.85Å; V127-R139 WeakPolarHBondContact CA-O 3.43Å; A128-R139 PolarHBondContact N-O 3.36Å; A128-R139 PolarHBondContact O-N 2.99Å; N130-R139 PolarHBondContact O-NH2 2.68Å; N130-R139 VanDerWaalsContact O-NH2 3.09Å; N130-R139 PolarHBondContact OD1-NH2 3.26Å; R131-R139 PolarHBondContact O-NH2 2.84Å; R131-R139 VanDerWaalsContact O-NH2 3.16Å; A137-R139 HydrophobicContact CB-CG 4.28Å; A137-R139 PolarHBondContact O-N 3.42Å; R139-F141 HydrophobicContact CB-CD2 4.44Å; R139-F141 HydrophobicContact CB-CE2 3.53Å; R139-F141 HydrophobicContact CB-CZ 3.83Å; R139-I157 CarbonylContact C-O 3.56Å; R139-I157 VanDerWaalsContact CA-O 3.27Å; R139-I157 WeakPolarHBondContact CA-O 3.45Å
140	V	92.9	Very high	81.7	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	135.7	177.8	-179.5	0	0	0	0	108.5	A48 L49 A52 N126 V127 A156 I157	A48-V140 HydrophobicContact CB-CB 4.16Å; A48-V140 HydrophobicContact CB-CG2 3.57Å; L49-V140 HydrophobicContact CB-CG1 4.1Å; L49-V140 HydrophobicContact CD2-CG1 3.21Å; L49-V140 HydrophobicContact CG-CG1 3.35Å; A52-V140 HydrophobicContact CB-CG1 4.4Å; N126-V140 WeakPolarHBondContact O-CA 3.49Å; V127-V140 HydrophobicContact CG1-CG2 4.43Å; V127-V140 HydrophobicContact CG2-CG2 4.29Å; V140-A156 CarbonylContact O-C 3.59Å; V140-A156 WeakPolarHBondContact O-CA 3.47Å; V140-I157 PolarHBondContact N-O 2.95Å; V140-I157 PolarHBondContact O-N 2.88Å
141	F	94.5	Very high	82.6	Confident	0 Å²	0	64 Å²	64	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.5	-177.8	-56.7	-93.6	0	0	0	109.9	F112 D116 I117 A120 E125 N126 R139 V154 V155 A156	F112-F141 HydrophobicContact CE1-CE1 4.03Å; F112-F141 HydrophobicContact CE1-CZ 4.42Å; F112-F141 AromaticContact CZ-CE1 3.82Å; F112-F141 HydrophobicContact CZ-CE1 3.82Å; F112-F141 HydrophobicContact CZ-CZ 4.25Å; D116-F141 HydrophobicContact CB-CD2 4.29Å; D116-F141 HydrophobicContact CB-CE2 3.41Å; D116-F141 VanDerWaalsContact CB-CE2 3.41Å; D116-F141 HydrophobicContact CB-CZ 3.57Å; I117-F141 HydrophobicContact CB-CD1 4.16Å; I117-F141 HydrophobicContact CB-CE1 4.04Å; I117-F141 HydrophobicContact CG1-CD1 4.02Å; I117-F141 HydrophobicContact CG1-CE1 4.27Å; A120-F141 HydrophobicContact CB-CB 3.54Å; E125-F141 VanDerWaalsContact CA-O 3.31Å; E125-F141 WeakPolarHBondContact CA-O 3.45Å; N126-F141 HydrophobicContact CB-CB 4.39Å; N126-F141 HydrophobicContact CB-CD2 4.28Å; N126-F141 PolarHBondContact N-O 3.16Å; N126-F141 VanDerWaalsContact N-O 3.1Å; N126-F141 PolarHBondContact O-N 3.3Å; R139-F141 HydrophobicContact CB-CD2 4.44Å; R139-F141 HydrophobicContact CB-CE2 3.53Å; R139-F141 HydrophobicContact CB-CZ 3.83Å; F141-V154 HydrophobicContact CB-CG1 4.13Å; F141-V154 HydrophobicContact CD1-CG1 4.28Å; F141-V155 WeakPolarHBondContact CA-O 3.46Å; F141-A156 HydrophobicContact CD1-CB 3.57Å; F141-A156 HydrophobicContact CE1-CB 3.54Å
142	T	95.5	Very high	84.2	Confident	6 Å²	6	56 Å²	56	4%	0.037	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128.2	177.3	-62.7	0	0	0	0	109.9	A52 R53 A56 E125 V154 V155	A52-T142 WeakPolarHBondContact CB-OG1 3.41Å; R53-T142 HydrophobicContact CG-CG2 3.88Å; A56-T142 HydrophobicContact CB-CG2 3.92Å; E125-T142 HydrophobicContact CG-CG2 4.44Å; E125-T142 WeakPolarHBondContact OE1-CG2 3.16Å; E125-T142 PolarHBondContact OE1-OG1 3Å; T142-V154 WeakPolarHBondContact O-CA 3.44Å; T142-V155 PolarHBondContact N-O 3.02Å; T142-V155 PolarHBondContact O-N 3.32Å
143	P	95.9	Very high	85.8	Confident	11 Å²	11	54.7 Å²	54.7	7%	0.071	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	148.4	177	28.5	-35.8	0	0	0	111.9	Y145 Q151	P143-Y145 HydrophobicContact CB-CE2 3.8Å; P143-Y145 HydrophobicContact CG-CE2 3.63Å; P143-Q151 HydrophobicContact CB-CG 4.24Å
144	I	95.3	Very high	87.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.8	176.8	-53.2	170.1	0	0	0	107.9	A56 I61 R62 L65 V92 Q151 I152 G153 V155	A56-I144 HydrophobicContact CB-CG1 4Å; I61-I144 HydrophobicContact CG2-CD1 4.07Å; R62-I144 HydrophobicContact CG-CG2 4.07Å; L65-I144 HydrophobicContact CD1-CB 4.46Å; L65-I144 HydrophobicContact CD1-CD1 3.73Å; L65-I144 HydrophobicContact CD1-CG2 4.09Å; V92-I144 HydrophobicContact CG1-CD1 3.76Å; I144-Q151 CarbonylContact O-C 3.55Å; I144-Q151 WeakPolarHBondContact O-CA 3.47Å; I144-Q151 WeakPolarHBondContact O-CG 3.32Å; I144-I152 HydrophobicContact CB-CG1 4.18Å; I144-I152 HydrophobicContact CG2-CD1 3.94Å; I144-I152 HydrophobicContact CG2-CG1 3.75Å; I144-I152 WeakPolarHBondContact O-CG1 3.28Å; I144-I152 PolarHBondContact O-N 3.4Å; I144-G153 PolarHBondContact N-O 3.34Å; I144-G153 PolarHBondContact O-N 2.83Å; I144-V155 HydrophobicContact CD1-CG2 3.58Å; I144-V155 HydrophobicContact CG1-CG2 3.71Å
145	Y	93.4	Very high	89.2	Confident	79 Å²	79	45.6 Å²	45.6	31%	0.31	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	145.1	178.2	-62	-84.3	0	0	0	111.1	R62 G123 P143 K150 Q151	R62-Y145 VanDerWaalsContact CD-O 3.3Å; R62-Y145 WeakPolarHBondContact CD-O 3.27Å; R62-Y145 VanDerWaalsContact CZ-O 3.27Å; R62-Y145 PolarHBondContact NE-O 3.31Å; G123-Y145 WeakPolarHBondContact CA-OH 3.3Å; G123-Y145 PolarHBondContact O-OH 2.97Å; P143-Y145 HydrophobicContact CB-CE2 3.8Å; P143-Y145 HydrophobicContact CG-CE2 3.63Å; Y145-K150 CarbonylContact C-O 3.56Å; Y145-K150 WeakPolarHBondContact CA-O 3.49Å; Y145-Q151 HydrophobicContact CD1-CB 4.01Å; Y145-Q151 HydrophobicContact CE1-CB 3.88Å; Y145-Q151 HydrophobicContact CE1-CG 4.35Å
146	D	89	Confident	90.7	Very high	29 Å²	29	44.2 Å²	44.2	16%	0.155	21%	0.208	C	C	.	.			trans	-79.6	-177.8	170	72.2	8.3	0	0	0	112.2	N148 H149 K150 I152	D146-N148 PolarHBondContact O-N 3.41Å; D146-N148 VanDerWaalsContact OD1-C 3.27Å; D146-N148 VanDerWaalsContact OD1-CA 3.3Å; D146-N148 WeakPolarHBondContact OD1-CA 3.47Å; D146-N148 WeakPolarHBondContact OD1-CB 3.27Å; D146-N148 PolarHBondContact OD1-N 3.5Å; D146-H149 PolarHBondContact O-N 3.42Å; D146-H149 VanDerWaalsContact O-N 3.09Å; D146-H149 PolarHBondContact OD1-N 3.07Å; D146-H149 VanDerWaalsContact OD1-N 3.11Å; D146-K150 PolarHBondContact N-O 3.04Å; D146-K150 WeakPolarHBondContact OD1-CB 3.36Å; D146-K150 PolarHBondContact OD1-N 2.97Å; D146-I152 HydrophobicContact CB-CD1 4.25Å; D146-I152 HydrophobicContact CB-CG2 3.88Å
147	E	85.3	Confident	91.7	Very high	177 Å²	177	39.3 Å²	39.3	83%	0.827	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.5	177.8	-64	-170.6	165.1	0	0	113.3	H149	E147-H149 VanDerWaalsContact C-N 3.32Å
148	N	86.2	Confident	92	Very high	143 Å²	143	39.3 Å²	39.3	77%	0.765	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	12.6	177.6	-61.1	-48.4	0	0	0	112.8	D146 K150	D146-N148 PolarHBondContact O-N 3.41Å; D146-N148 VanDerWaalsContact OD1-C 3.27Å; D146-N148 VanDerWaalsContact OD1-CA 3.3Å; D146-N148 WeakPolarHBondContact OD1-CA 3.47Å; D146-N148 WeakPolarHBondContact OD1-CB 3.27Å; D146-N148 PolarHBondContact OD1-N 3.5Å; N148-K150 PolarHBondContact O-N 3Å
149	H	88.3	Confident	91.9	Very high	160 Å²	160	40.2 Å²	40.2	74%	0.741	19%	0.19	S	C	*	.	S	Bend	trans	59.8	23.4	-175.7	-73	17.2	0	0	0	114.1	D146 E147	D146-H149 PolarHBondContact O-N 3.42Å; D146-H149 VanDerWaalsContact O-N 3.09Å; D146-H149 PolarHBondContact OD1-N 3.07Å; D146-H149 VanDerWaalsContact OD1-N 3.11Å; E147-H149 VanDerWaalsContact C-N 3.32Å
150	K	91.2	Very high	91.5	Very high	144 Å²	144	43.4 Å²	43.4	63%	0.626	21%	0.206	S	C	*	.			trans	-87.3	130.4	170.7	-172.1	179.2	178.7	-179.4	0	109.1	Y145 D146 N148 I152	Y145-K150 CarbonylContact C-O 3.56Å; Y145-K150 WeakPolarHBondContact CA-O 3.49Å; D146-K150 PolarHBondContact N-O 3.04Å; D146-K150 WeakPolarHBondContact OD1-CB 3.36Å; D146-K150 PolarHBondContact OD1-N 2.97Å; N148-K150 PolarHBondContact O-N 3Å; K150-I152 PolarHBondContact O-N 3.49Å
151	Q	93.5	Very high	90.5	Very high	29 Å²	29	45.5 Å²	45.5	14%	0.136	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	126.9	175.3	-167	-179.4	-18.1	0	0	110.2	M95 A120 L121 P143 I144 Y145 G153	M95-Q151 HydrophobicContact CE-CG 4.43Å; M95-Q151 HydrophobicContact SD-CB 4.1Å; M95-Q151 HydrophobicContact SD-CG 3.62Å; A120-Q151 PolarHBondContact O-NE2 3.45Å; L121-Q151 PolarHBondContact O-OE1 3.24Å; P143-Q151 HydrophobicContact CB-CG 4.24Å; I144-Q151 CarbonylContact O-C 3.55Å; I144-Q151 WeakPolarHBondContact O-CA 3.47Å; I144-Q151 WeakPolarHBondContact O-CG 3.32Å; Y145-Q151 HydrophobicContact CD1-CB 4.01Å; Y145-Q151 HydrophobicContact CE1-CB 3.88Å; Y145-Q151 HydrophobicContact CE1-CG 4.35Å; Q151-G153 PolarHBondContact NE2-O 3.45Å
152	I	93.4	Very high	89.2	Confident	36 Å²	36	47.8 Å²	47.8	19%	0.185	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-11.2	-177.8	56.1	169.8	0	0	0	113.1	R62 L65 I144 D146 K150	R62-I152 HydrophobicContact CB-CD1 4.18Å; R62-I152 HydrophobicContact CG-CD1 4.3Å; L65-I152 HydrophobicContact CB-CD1 4.44Å; L65-I152 HydrophobicContact CD1-CD1 3.98Å; L65-I152 HydrophobicContact CD1-CG1 4.04Å; I144-I152 HydrophobicContact CB-CG1 4.18Å; I144-I152 HydrophobicContact CG2-CD1 3.94Å; I144-I152 HydrophobicContact CG2-CG1 3.75Å; I144-I152 WeakPolarHBondContact O-CG1 3.28Å; I144-I152 PolarHBondContact O-N 3.4Å; D146-I152 HydrophobicContact CB-CD1 4.25Å; D146-I152 HydrophobicContact CB-CG2 3.88Å; K150-I152 PolarHBondContact O-N 3.49Å
153	G	93.5	Very high	87.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-168.8	-178.3	0	0	0	0	0	114.2	T93 I144 Q151	T93-G153 CarbonylContact O-C 3.46Å; T93-G153 WeakPolarHBondContact O-CA 3.32Å; I144-G153 PolarHBondContact N-O 3.34Å; I144-G153 PolarHBondContact O-N 2.83Å; Q151-G153 PolarHBondContact NE2-O 3.45Å
154	V	95.6	Very high	86.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	135.8	177.3	176.9	0	0	0	0	109.9	T93 I117 A120 L121 F141 T142	T93-V154 PolarHBondContact N-O 3.47Å; T93-V154 PolarHBondContact O-N 2.97Å; T93-V154 PolarHBondContact OG1-O 3.01Å; I117-V154 HydrophobicContact CD1-CB 4.36Å; I117-V154 HydrophobicContact CD1-CG1 4.4Å; I117-V154 HydrophobicContact CG1-CB 4.34Å; I117-V154 HydrophobicContact CG1-CG1 4.06Å; I117-V154 HydrophobicContact CG1-CG2 4.47Å; A120-V154 HydrophobicContact CB-CB 4.43Å; A120-V154 HydrophobicContact CB-CG1 3.6Å; A120-V154 HydrophobicContact CB-CG2 3.87Å; L121-V154 HydrophobicContact CD2-CG2 3.83Å; L121-V154 HydrophobicContact CG-CG2 4.18Å; F141-V154 HydrophobicContact CB-CG1 4.13Å; F141-V154 HydrophobicContact CD1-CG1 4.28Å; T142-V154 WeakPolarHBondContact O-CA 3.44Å
155	V	95.5	Very high	84.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.7	165.9	-175.3	0	0	0	0	108.8	A52 L55 A56 I90 V92 F141 T142 I144 I157	A52-V155 HydrophobicContact CB-CG1 4.36Å; L55-V155 HydrophobicContact CB-CG1 4.19Å; L55-V155 HydrophobicContact CB-CG2 4.2Å; L55-V155 HydrophobicContact CD1-CG1 4.17Å; A56-V155 HydrophobicContact CB-CG2 4.04Å; I90-V155 HydrophobicContact CG2-CG1 4.38Å; V92-V155 HydrophobicContact CG2-CG2 4.4Å; F141-V155 WeakPolarHBondContact CA-O 3.46Å; T142-V155 PolarHBondContact N-O 3.02Å; T142-V155 PolarHBondContact O-N 3.32Å; I144-V155 HydrophobicContact CD1-CG2 3.58Å; I144-V155 HydrophobicContact CG1-CG2 3.71Å; V155-I157 HydrophobicContact CG1-CD1 4.44Å; V155-I157 HydrophobicContact CG1-CG1 4.02Å
156	A	93.9	Very high	83.6	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.2	173.2	0	0	0	0	0	110.2	F89 V91 F112 V140 F141	F89-A156 HydrophobicContact CE2-CB 4.28Å; V91-A156 HydrophobicContact CB-CB 4.34Å; V91-A156 PolarHBondContact N-O 3.19Å; V91-A156 PolarHBondContact O-N 3.3Å; F112-A156 HydrophobicContact CE2-CB 4.08Å; F112-A156 HydrophobicContact CZ-CB 4.38Å; V140-A156 CarbonylContact O-C 3.59Å; V140-A156 WeakPolarHBondContact O-CA 3.47Å; F141-A156 HydrophobicContact CD1-CB 3.57Å; F141-A156 HydrophobicContact CE1-CB 3.54Å
157	I	93.1	Very high	82.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.6	176.2	-61.3	-171	0	0	0	109.5	A48 V51 A52 L55 L87 F89 I90 R139 V140 V155	A48-I157 HydrophobicContact CB-CG2 4.29Å; V51-I157 HydrophobicContact CB-CD1 3.87Å; V51-I157 HydrophobicContact CG1-CD1 3.66Å; A52-I157 HydrophobicContact CB-CD1 3.71Å; A52-I157 HydrophobicContact CB-CG1 4.08Å; L55-I157 HydrophobicContact CD1-CD1 4.32Å; L87-I157 HydrophobicContact CB-CG2 4.3Å; L87-I157 HydrophobicContact CD1-CD1 4.16Å; L87-I157 HydrophobicContact CD1-CG2 3.63Å; L87-I157 HydrophobicContact CD2-CG2 3.72Å; L87-I157 HydrophobicContact CG-CG2 4.07Å; F89-I157 WeakPolarHBondContact O-CA 3.22Å; I90-I157 HydrophobicContact CG1-CG1 4.26Å; I90-I157 HydrophobicContact CG2-CG1 4.43Å; R139-I157 CarbonylContact C-O 3.56Å; R139-I157 VanDerWaalsContact CA-O 3.27Å; R139-I157 WeakPolarHBondContact CA-O 3.45Å; V140-I157 PolarHBondContact N-O 2.95Å; V140-I157 PolarHBondContact O-N 2.88Å; V155-I157 HydrophobicContact CG1-CD1 4.44Å; V155-I157 HydrophobicContact CG1-CG1 4.02Å
158	G	89.5	Confident	81.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.5	172.2	0	0	0	0	0	112.2	L88 F89	L88-G158 WeakPolarHBondContact CA-O 3.44Å; L88-G158 VanDerWaalsContact CB-O 3.29Å; L88-G158 WeakPolarHBondContact CB-O 3.34Å; L88-G158 PolarHBondContact N-O 3.39Å; F89-G158 PolarHBondContact N-O 2.86Å; F89-G158 PolarHBondContact O-N 2.92Å
159	L	85.2	Confident	80.8	Confident	21 Å²	21	51.2 Å²	51.2	11%	0.11	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.2	166.3	-75.4	159.4	0	0	0	109.2	L44 A48 L87 A137 L138 L161	L44-L159 HydrophobicContact CB-CD1 4.4Å; A48-L159 HydrophobicContact CB-CD1 3.51Å; A48-L159 HydrophobicContact CB-CG 4.22Å; L87-L159 HydrophobicContact CD2-CD2 3.44Å; L87-L159 VanDerWaalsContact CD2-CD2 3.44Å; L87-L159 HydrophobicContact CD2-CG 3.91Å; A137-L159 CarbonylContact C-O 3.47Å; A137-L159 WeakPolarHBondContact CA-O 3.43Å; A137-L159 VanDerWaalsContact CB-O 3.22Å; A137-L159 WeakPolarHBondContact CB-O 2.9Å; L138-L159 HydrophobicContact CB-CB 4.29Å; L138-L159 HydrophobicContact CD2-CD1 4.09Å; L138-L159 PolarHBondContact N-O 2.8Å; L138-L159 PolarHBondContact O-N 3.48Å; L159-L161 PolarHBondContact O-N 3.01Å
160	E	80.7	Confident	79.9	Confident	77 Å²	77	48.9 Å²	48.9	36%	0.36	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	129.7	176.8	-157.5	-174.3	149.3	0	0	110.8	L88 A135 S162 R163	L88-E160 HydrophobicContact CB-CB 4.49Å; L88-E160 HydrophobicContact CD1-CB 4.46Å; L88-E160 HydrophobicContact CD1-CG 4.44Å; A135-E160 HydrophobicContact CB-CG 4.24Å; E160-S162 VanDerWaalsContact CG-OG 3.25Å; E160-S162 WeakPolarHBondContact CG-OG 3.41Å; E160-S162 PolarHBondContact O-N 3.21Å; E160-S162 PolarHBondContact OE1-OG 3.16Å; E160-R163 PolarHBondContact O-N 2.88Å
161	L	71.5	Confident	78.9	Confident	43 Å²	43	43.8 Å²	43.8	23%	0.225	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-25.9	-178.1	-162.1	74.1	0	0	0	112.1	I129 Q136 L159 R163 V164 T165	I129-L161 HydrophobicContact CD1-CD1 4.32Å; Q136-L161 HydrophobicContact CG-CD2 4.06Å; Q136-L161 WeakPolarHBondContact O-CB 3.49Å; Q136-L161 PolarHBondContact O-N 3.43Å; Q136-L161 VanDerWaalsContact O-N 3.12Å; L159-L161 PolarHBondContact O-N 3.01Å; L161-R163 VanDerWaalsContact C-N 3.27Å; L161-R163 PolarHBondContact O-N 2.9Å; L161-V164 HydrophobicContact CD1-CB 4.49Å; L161-V164 HydrophobicContact CD1-CG2 4.29Å; L161-V164 VanDerWaalsContact O-CB 3.32Å; L161-V164 WeakPolarHBondContact O-CB 3.39Å; L161-V164 PolarHBondContact O-N 3.22Å; L161-V164 VanDerWaalsContact O-N 3.08Å; L161-T165 PolarHBondContact O-N 3.28Å
162	S	67.8	Low	77.8	Confident	49 Å²	49	48.2 Å²	48.2	34%	0.343	24%	0.24	S	C	.	.	H	α-helix	trans	-58.7	-36.6	176.8	60.3	0	0	0	0	112.4	E160 T165 Q166	E160-S162 VanDerWaalsContact CG-OG 3.25Å; E160-S162 WeakPolarHBondContact CG-OG 3.41Å; E160-S162 PolarHBondContact O-N 3.21Å; E160-S162 PolarHBondContact OE1-OG 3.16Å; S162-T165 VanDerWaalsContact CA-OG1 3.3Å; S162-T165 WeakPolarHBondContact CA-OG1 3.36Å; S162-T165 PolarHBondContact O-N 3.35Å; S162-T165 PolarHBondContact O-OG1 2.85Å; S162-Q166 WeakPolarHBondContact O-CB 3.26Å; S162-Q166 PolarHBondContact O-N 2.88Å
163	R	64	Low	76.8	Confident	112 Å²	112	54 Å²	54	42%	0.423	26%	0.26	S	S	.	.	H	α-helix	trans	-67.2	-37.3	174.7	-70.8	-169.4	174.7	-138.1	0	112.6	D86 E160 L161 T165 Q166 Q167	D86-R163 VanDerWaalsContact CB-NH2 3.34Å; D86-R163 VanDerWaalsContact CG-NH1 3.3Å; D86-R163 VanDerWaalsContact CG-NH2 3.33Å; D86-R163 IonicContact OD1-NH2 3.69Å; D86-R163 IonicContact OD2-CZ 2.79Å; D86-R163 IonicContact OD2-NH1 3.52Å; D86-R163 PolarHBondContact OD2-NH1 2.96Å; D86-R163 IonicContact OD2-NH2 3.67Å; D86-R163 PolarHBondContact OD2-NH2 3.13Å; E160-R163 PolarHBondContact O-N 2.88Å; L161-R163 VanDerWaalsContact C-N 3.27Å; L161-R163 PolarHBondContact O-N 2.9Å; R163-T165 VanDerWaalsContact C-N 3.32Å; R163-Q166 PolarHBondContact O-N 3.14Å; R163-Q167 PolarHBondContact O-N 3.46Å
164	V	63.5	Low	75.8	Confident	9 Å²	9	58.1 Å²	58.1	6%	0.055	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-45.8	172.2	-173.3	0	0	0	0	109.4	L44 L161 Q166 Q167 I168	L44-V164 HydrophobicContact CD1-CB 4.05Å; L44-V164 HydrophobicContact CD1-CG1 4.11Å; L44-V164 HydrophobicContact CD1-CG2 3.67Å; L161-V164 HydrophobicContact CD1-CB 4.49Å; L161-V164 HydrophobicContact CD1-CG2 4.29Å; L161-V164 VanDerWaalsContact O-CB 3.32Å; L161-V164 WeakPolarHBondContact O-CB 3.39Å; L161-V164 PolarHBondContact O-N 3.22Å; L161-V164 VanDerWaalsContact O-N 3.08Å; V164-Q166 PolarHBondContact O-N 2.96Å; V164-Q167 PolarHBondContact O-N 3.48Å; V164-I168 HydrophobicContact CG1-CD1 4.14Å; V164-I168 VanDerWaalsContact O-CG1 3.3Å; V164-I168 WeakPolarHBondContact O-CG1 3.38Å; V164-I168 PolarHBondContact O-N 3.35Å; V164-I168 VanDerWaalsContact O-N 3.16Å
165	T	66.8	Low	74.9	Confident	79 Å²	79	58.8 Å²	58.8	49%	0.485	29%	0.292	S	S	.	.	H	α-helix	trans	-68.1	-32.3	179.8	58.7	0	0	0	0	113.5	L161 S162 R163 I168 N169	L161-T165 PolarHBondContact O-N 3.28Å; S162-T165 VanDerWaalsContact CA-OG1 3.3Å; S162-T165 WeakPolarHBondContact CA-OG1 3.36Å; S162-T165 PolarHBondContact O-N 3.35Å; S162-T165 PolarHBondContact O-OG1 2.85Å; R163-T165 VanDerWaalsContact C-N 3.32Å; T165-I168 PolarHBondContact O-N 3.24Å; T165-N169 WeakPolarHBondContact O-CB 3.45Å; T165-N169 PolarHBondContact O-N 3.28Å
166	Q	67.5	Low	74.1	Confident	124 Å²	124	62.2 Å²	62.2	58%	0.579	31%	0.309	S	S	*	.	H	α-helix	trans	-69	-43.7	178.5	-168.7	170	0.2	0	0	111.4	S162 R163 V164 I168 N169 D170	S162-Q166 WeakPolarHBondContact O-CB 3.26Å; S162-Q166 PolarHBondContact O-N 2.88Å; R163-Q166 PolarHBondContact O-N 3.14Å; V164-Q166 PolarHBondContact O-N 2.96Å; Q166-I168 VanDerWaalsContact C-N 3.31Å; Q166-I168 PolarHBondContact O-N 2.91Å; Q166-N169 WeakPolarHBondContact O-CA 3.46Å; Q166-N169 WeakPolarHBondContact O-CB 3.39Å; Q166-N169 PolarHBondContact O-N 3.1Å; Q166-D170 PolarHBondContact O-N 2.71Å
167	Q	64	Low	73.5	Confident	94 Å²	94	70.4 Å²	70.4	44%	0.439	34%	0.34	S	S	.	.	H	α-helix	trans	-66.8	-33	177.1	-168.1	169.2	-13.1	0	0	112.6	T40 R163 V164 S171	T40-Q167 HydrophobicContact CG2-CB 4.27Å; T40-Q167 HydrophobicContact CG2-CG 4.23Å; R163-Q167 PolarHBondContact O-N 3.46Å; V164-Q167 PolarHBondContact O-N 3.48Å; Q167-S171 PolarHBondContact O-N 2.96Å; Q167-S171 PolarHBondContact O-OG 3.29Å
168	I	67.9	Low	72.8	Confident	26 Å²	26	73.7 Å²	73.7	13%	0.133	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-44.5	168.8	-67.9	167.3	0	0	0	109.9	T40 V164 T165 Q166 D170 S171 R172	T40-I168 HydrophobicContact CG2-CG1 4.15Å; V164-I168 HydrophobicContact CG1-CD1 4.14Å; V164-I168 VanDerWaalsContact O-CG1 3.3Å; V164-I168 WeakPolarHBondContact O-CG1 3.38Å; V164-I168 PolarHBondContact O-N 3.35Å; V164-I168 VanDerWaalsContact O-N 3.16Å; T165-I168 PolarHBondContact O-N 3.24Å; Q166-I168 VanDerWaalsContact C-N 3.31Å; Q166-I168 PolarHBondContact O-N 2.91Å; I168-D170 PolarHBondContact O-N 3.38Å; I168-S171 WeakPolarHBondContact O-CB 3.5Å; I168-S171 PolarHBondContact O-N 3.37Å; I168-R172 WeakPolarHBondContact O-CG 3.35Å; I168-R172 PolarHBondContact O-N 2.94Å; I168-R172 VanDerWaalsContact O-N 3.16Å
169	N	70.4	Confident	72.5	Confident	72 Å²	72	75.7 Å²	75.7	39%	0.385	38%	0.375	S	S	.	.	H	α-helix	trans	-65.7	-36.6	-176.6	-156.4	54.2	0	0	0	113.1	T165 Q166 S171 R172	T165-N169 WeakPolarHBondContact O-CB 3.45Å; T165-N169 PolarHBondContact O-N 3.28Å; Q166-N169 WeakPolarHBondContact O-CA 3.46Å; Q166-N169 WeakPolarHBondContact O-CB 3.39Å; Q166-N169 PolarHBondContact O-N 3.1Å; N169-S171 VanDerWaalsContact C-N 3.28Å; N169-S171 PolarHBondContact O-N 2.84Å; N169-R172 WeakPolarHBondContact O-CB 3.34Å; N169-R172 PolarHBondContact O-N 3.45Å; N169-R172 VanDerWaalsContact O-N 3.13Å; N169-R172 VanDerWaalsContact OD1-CD 3.3Å; N169-R172 WeakPolarHBondContact OD1-CD 3.31Å; N169-R172 PolarHBondContact OD1-NH1 3.41Å; N169-R172 VanDerWaalsContact OD1-NH1 3.12Å
170	D	69.9	Low	72.5	Confident	111 Å²	111	78.9 Å²	78.9	59%	0.594	39%	0.392	S	S	*	.	H	α-helix	trans	-63.7	-36.7	174.5	-68.7	-18.2	0	0	0	111.5	Q166 I168 R172	Q166-D170 PolarHBondContact O-N 2.71Å; I168-D170 PolarHBondContact O-N 3.38Å; D170-R172 VanDerWaalsContact C-N 3.3Å; D170-R172 PolarHBondContact O-N 2.94Å
171	S	69.1	Low	72.8	Confident	38 Å²	38	81.9 Å²	81.9	27%	0.266	40%	0.404	S	S	.	.	H	α-helix	trans	-70.2	-24.4	175.5	-57.2	0	0	0	0	113.1	I36 Q167 I168 N169 W173 S174 I175	I36-S171 VanDerWaalsContact CD1-CB 3.47Å; Q167-S171 PolarHBondContact O-N 2.96Å; Q167-S171 PolarHBondContact O-OG 3.29Å; I168-S171 WeakPolarHBondContact O-CB 3.5Å; I168-S171 PolarHBondContact O-N 3.37Å; N169-S171 VanDerWaalsContact C-N 3.28Å; N169-S171 PolarHBondContact O-N 2.84Å; S171-W173 VanDerWaalsContact C-N 3.33Å; S171-W173 PolarHBondContact O-N 2.95Å; S171-S174 PolarHBondContact O-N 3.34Å; S171-I175 PolarHBondContact O-N 3.46Å
172	R	71.1	Confident	73.5	Confident	122 Å²	122	80.8 Å²	80.8	46%	0.46	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-35.7	-179.8	-68.3	171.5	84.6	-172.5	7.5	112.8	I168 N169 D170 S174 I175 I176	I168-R172 WeakPolarHBondContact O-CG 3.35Å; I168-R172 PolarHBondContact O-N 2.94Å; I168-R172 VanDerWaalsContact O-N 3.16Å; N169-R172 WeakPolarHBondContact O-CB 3.34Å; N169-R172 PolarHBondContact O-N 3.45Å; N169-R172 VanDerWaalsContact O-N 3.13Å; N169-R172 VanDerWaalsContact OD1-CD 3.3Å; N169-R172 WeakPolarHBondContact OD1-CD 3.31Å; N169-R172 PolarHBondContact OD1-NH1 3.41Å; N169-R172 VanDerWaalsContact OD1-NH1 3.12Å; D170-R172 VanDerWaalsContact C-N 3.3Å; D170-R172 PolarHBondContact O-N 2.94Å; R172-S174 VanDerWaalsContact C-N 3.31Å; R172-S174 PolarHBondContact O-N 3.32Å; R172-I175 PolarHBondContact O-N 3.06Å; R172-I176 WeakPolarHBondContact O-CG1 3.46Å; R172-I176 PolarHBondContact O-N 3.4Å; R172-I176 VanDerWaalsContact O-N 3.1Å
173	W	73.1	Confident	74.3	Confident	157 Å²	157	83.1 Å²	83.1	60%	0.595	41%	0.41	S	S	*	.	H	α-helix	trans	-64.3	-37.4	179.1	-85.6	108.2	0	0	0	112.2	S171 I175 I176 W177	S171-W173 VanDerWaalsContact C-N 3.33Å; S171-W173 PolarHBondContact O-N 2.95Å; W173-I175 VanDerWaalsContact C-N 3.32Å; W173-I175 PolarHBondContact O-N 3.34Å; W173-I176 PolarHBondContact O-N 3.05Å; W173-W177 PolarHBondContact O-N 3.39Å; W173-W177 VanDerWaalsContact O-N 3.1Å
174	S	72.4	Confident	75.5	Confident	87 Å²	87	82.5 Å²	82.5	61%	0.608	42%	0.415	S	S	*	.	H	α-helix	trans	-61.9	-41.3	175.9	-174.3	0	0	0	0	111.8	S171 R172 W177 S178	S171-S174 PolarHBondContact O-N 3.34Å; R172-S174 VanDerWaalsContact C-N 3.31Å; R172-S174 PolarHBondContact O-N 3.32Å; S174-W177 PolarHBondContact O-N 2.97Å; S174-S178 PolarHBondContact O-N 3.43Å
175	I	75.3	Confident	76.7	Confident	13 Å²	13	85.7 Å²	85.7	7%	0.067	43%	0.434	C	S	.	.	H	α-helix	trans	-65.2	-45.7	178.7	-58.4	170.4	0	0	0	110.7	H29 Y32 S171 R172 W173 W177 S178 V179	H29-I175 WeakPolarHBondContact ND1-CG2 3.45Å; Y32-I175 HydrophobicContact CD1-CD1 3.92Å; Y32-I175 HydrophobicContact CD1-CG1 4.15Å; S171-I175 PolarHBondContact O-N 3.46Å; R172-I175 PolarHBondContact O-N 3.06Å; W173-I175 VanDerWaalsContact C-N 3.32Å; W173-I175 PolarHBondContact O-N 3.34Å; I175-W177 VanDerWaalsContact C-N 3.31Å; I175-W177 PolarHBondContact O-N 3.08Å; I175-S178 PolarHBondContact O-N 3.43Å; I175-S178 VanDerWaalsContact O-N 3.15Å; I175-S178 PolarHBondContact O-OG 2.84Å; I175-V179 WeakPolarHBondContact O-CG2 2.91Å; I175-V179 PolarHBondContact O-N 3Å
176	I	79.2	Confident	77.6	Confident	72 Å²	72	82.7 Å²	82.7	37%	0.369	42%	0.419	S	S	.	.	H	α-helix	trans	-58.8	-44.7	178.7	-67.5	168.6	0	0	0	110.7	R172 W173 S178 V179 L180	R172-I176 WeakPolarHBondContact O-CG1 3.46Å; R172-I176 PolarHBondContact O-N 3.4Å; R172-I176 VanDerWaalsContact O-N 3.1Å; W173-I176 PolarHBondContact O-N 3.05Å; I176-S178 VanDerWaalsContact C-N 3.34Å; I176-S178 PolarHBondContact O-N 2.99Å; I176-V179 PolarHBondContact O-N 2.81Å; I176-L180 HydrophobicContact CG2-CD1 3.92Å; I176-L180 HydrophobicContact CG2-CG 4.37Å; I176-L180 WeakPolarHBondContact O-CG 3.28Å; I176-L180 PolarHBondContact O-N 2.85Å
177	W	82.2	Confident	78.6	Confident	172 Å²	172	81.1 Å²	81.1	65%	0.652	41%	0.414	S	S	*	.	H	α-helix	trans	-62.5	-39	176.7	-80.1	114.9	0	0	0	113	W173 S174 I175 L180 F181	W173-W177 PolarHBondContact O-N 3.39Å; W173-W177 VanDerWaalsContact O-N 3.1Å; S174-W177 PolarHBondContact O-N 2.97Å; I175-W177 VanDerWaalsContact C-N 3.31Å; I175-W177 PolarHBondContact O-N 3.08Å; W177-L180 HydrophobicContact CE3-CD1 4.36Å; W177-L180 PolarHBondContact O-N 3.06Å; W177-F181 VanDerWaalsContact O-CB 3.29Å; W177-F181 WeakPolarHBondContact O-CB 3.4Å; W177-F181 PolarHBondContact O-N 2.88Å
178	S	78.5	Confident	79.8	Confident	69 Å²	69	80.9 Å²	80.9	48%	0.483	42%	0.415	S	S	.	.	H	α-helix	trans	-64.5	-39.5	176.4	74.2	0	0	0	0	112.8	S174 I175 I176 F181 G182	S174-S178 PolarHBondContact O-N 3.43Å; I175-S178 PolarHBondContact O-N 3.43Å; I175-S178 VanDerWaalsContact O-N 3.15Å; I175-S178 PolarHBondContact O-OG 2.84Å; I176-S178 VanDerWaalsContact C-N 3.34Å; I176-S178 PolarHBondContact O-N 2.99Å; S178-F181 PolarHBondContact O-N 3.36Å; S178-G182 PolarHBondContact O-N 2.69Å
179	V	82.6	Confident	80.8	Confident	42 Å²	42	81.4 Å²	81.4	26%	0.255	43%	0.427	S	S	.	.	H	α-helix	trans	-68.2	-45.6	177	172.4	0	0	0	0	110.7	L25 I175 I176 F181 G182 M183	L25-V179 HydrophobicContact CB-CG1 4.32Å; L25-V179 HydrophobicContact CD1-CG1 4.35Å; I175-V179 WeakPolarHBondContact O-CG2 2.91Å; I175-V179 PolarHBondContact O-N 3Å; I176-V179 PolarHBondContact O-N 2.81Å; V179-F181 VanDerWaalsContact C-N 3.32Å; V179-F181 PolarHBondContact O-N 2.71Å; V179-G182 PolarHBondContact O-N 2.78Å; V179-M183 WeakPolarHBondContact O-CB 3.47Å; V179-M183 PolarHBondContact O-N 3.05Å
180	L	85.8	Confident	81.6	Confident	89 Å²	89	78.2 Å²	78.2	47%	0.466	41%	0.41	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176.1	-73.5	173.1	0	0	0	111.5	I176 W177 M183 L184	I176-L180 HydrophobicContact CG2-CD1 3.92Å; I176-L180 HydrophobicContact CG2-CG 4.37Å; I176-L180 WeakPolarHBondContact O-CG 3.28Å; I176-L180 PolarHBondContact O-N 2.85Å; W177-L180 HydrophobicContact CE3-CD1 4.36Å; W177-L180 PolarHBondContact O-N 3.06Å; L180-M183 PolarHBondContact O-N 2.86Å; L180-L184 WeakPolarHBondContact O-CB 3.49Å; L180-L184 PolarHBondContact O-N 3.14Å
181	F	87.1	Confident	82.5	Confident	139 Å²	139	75.6 Å²	75.6	61%	0.61	40%	0.4	S	S	*	.	H	α-helix	trans	-63.7	-45.4	176.1	-175.2	-99.1	0	0	0	111.9	W177 S178 V179 M183 L184 V185	W177-F181 VanDerWaalsContact O-CB 3.29Å; W177-F181 WeakPolarHBondContact O-CB 3.4Å; W177-F181 PolarHBondContact O-N 2.88Å; S178-F181 PolarHBondContact O-N 3.36Å; V179-F181 VanDerWaalsContact C-N 3.32Å; V179-F181 PolarHBondContact O-N 2.71Å; F181-M183 VanDerWaalsContact C-N 3.33Å; F181-M183 PolarHBondContact O-N 3.35Å; F181-L184 WeakPolarHBondContact O-CB 3.29Å; F181-L184 PolarHBondContact O-N 2.98Å; F181-V185 HydrophobicContact CD1-CG2 4.28Å; F181-V185 HydrophobicContact CE1-CG2 3.89Å; F181-V185 HydrophobicContact CZ-CG2 4.02Å; F181-V185 WeakPolarHBondContact O-CG2 3.4Å; F181-V185 PolarHBondContact O-N 3.21Å
182	G	84.9	Confident	83.5	Confident	21 Å²	21	78.6 Å²	78.6	22%	0.216	41%	0.412	C	S	.	.	H	α-helix	trans	-59.7	-42	174.9	0	0	0	0	0	112.7	S178 V179 V185 G186	S178-G182 PolarHBondContact O-N 2.69Å; V179-G182 PolarHBondContact O-N 2.78Å; G182-V185 PolarHBondContact O-N 3.02Å; G182-G186 PolarHBondContact O-N 3.01Å
183	M	86	Confident	84.3	Confident	97 Å²	97	76.7 Å²	76.7	48%	0.478	41%	0.41	S	S	.	.	H	α-helix	trans	-62.6	-42.3	176.2	-166.1	176.6	-174.7	0	0	112	L25 V179 L180 F181 G186 L187	L25-M183 HydrophobicContact CD1-CB 4.4Å; V179-M183 WeakPolarHBondContact O-CB 3.47Å; V179-M183 PolarHBondContact O-N 3.05Å; L180-M183 PolarHBondContact O-N 2.86Å; F181-M183 VanDerWaalsContact C-N 3.33Å; F181-M183 PolarHBondContact O-N 3.35Å; M183-G186 PolarHBondContact O-N 2.93Å; M183-L187 WeakPolarHBondContact O-CB 3.22Å; M183-L187 PolarHBondContact O-N 3.36Å
184	L	88.9	Confident	85	Confident	100 Å²	100	70 Å²	70	52%	0.524	39%	0.386	S	S	.	.	H	α-helix	trans	-61.6	-49.6	176.2	-173.3	106.8	0	0	0	111.6	L180 F181 G186 L187 I188	L180-L184 WeakPolarHBondContact O-CB 3.49Å; L180-L184 PolarHBondContact O-N 3.14Å; F181-L184 WeakPolarHBondContact O-CB 3.29Å; F181-L184 PolarHBondContact O-N 2.98Å; L184-G186 VanDerWaalsContact C-N 3.34Å; L184-G186 PolarHBondContact O-N 2.75Å; L184-L187 PolarHBondContact O-N 2.94Å; L184-I188 HydrophobicContact CD2-CD1 4.02Å; L184-I188 HydrophobicContact CG-CD1 4.14Å; L184-I188 WeakPolarHBondContact O-CG1 3.37Å; L184-I188 PolarHBondContact O-N 3.47Å
185	V	88	Confident	85.7	Confident	76 Å²	76	73.5 Å²	73.5	46%	0.461	39%	0.391	S	S	.	.	H	α-helix	trans	-61.6	-43.2	178.7	173.8	0	0	0	0	111	F181 G182 L187 I188 G189	F181-V185 HydrophobicContact CD1-CG2 4.28Å; F181-V185 HydrophobicContact CE1-CG2 3.89Å; F181-V185 HydrophobicContact CZ-CG2 4.02Å; F181-V185 WeakPolarHBondContact O-CG2 3.4Å; F181-V185 PolarHBondContact O-N 3.21Å; G182-V185 PolarHBondContact O-N 3.02Å; V185-L187 PolarHBondContact O-N 3.31Å; V185-I188 PolarHBondContact O-N 3.3Å; V185-G189 PolarHBondContact O-N 2.86Å
186	G	86.7	Confident	86.4	Confident	15 Å²	15	76.5 Å²	76.5	16%	0.155	41%	0.409	C	S	.	.	H	α-helix	trans	-60.4	-42.5	175.9	0	0	0	0	0	112.9	G182 M183 L184 G189 T190	G182-G186 PolarHBondContact O-N 3.01Å; M183-G186 PolarHBondContact O-N 2.93Å; L184-G186 VanDerWaalsContact C-N 3.34Å; L184-G186 PolarHBondContact O-N 2.75Å; G186-G189 PolarHBondContact O-N 3.22Å; G186-T190 WeakPolarHBondContact O-CB 3.48Å; G186-T190 PolarHBondContact O-N 3.47Å; G186-T190 PolarHBondContact O-OG1 3.39Å
187	L	87.5	Confident	86.8	Confident	91 Å²	91	75.6 Å²	75.6	48%	0.476	41%	0.405	S	S	.	.	H	α-helix	trans	-64.1	-42.6	176.9	-162.6	103.9	0	0	0	111.7	M183 L184 V185 T190 C191	M183-L187 WeakPolarHBondContact O-CB 3.22Å; M183-L187 PolarHBondContact O-N 3.36Å; L184-L187 PolarHBondContact O-N 2.94Å; V185-L187 PolarHBondContact O-N 3.31Å; L187-T190 PolarHBondContact O-N 3Å; L187-C191 WeakPolarHBondContact O-CB 3.28Å; L187-C191 PolarHBondContact O-N 3.11Å; L187-C191 PolarHBondContact O-SG 3.21Å; L187-C191 VanDerWaalsContact O-SG 3.39Å
188	I	89.4	Confident	86.9	Confident	89 Å²	89	71.9 Å²	71.9	46%	0.456	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-49.1	176.7	-67.5	165.8	0	0	0	110.7	L184 V185 T190 C191 I192	L184-I188 HydrophobicContact CD2-CD1 4.02Å; L184-I188 HydrophobicContact CG-CD1 4.14Å; L184-I188 WeakPolarHBondContact O-CG1 3.37Å; L184-I188 PolarHBondContact O-N 3.47Å; V185-I188 PolarHBondContact O-N 3.3Å; I188-T190 VanDerWaalsContact C-N 3.32Å; I188-T190 PolarHBondContact O-N 3.43Å; I188-C191 WeakPolarHBondContact O-CB 3.43Å; I188-C191 PolarHBondContact O-N 3.29Å; I188-I192 HydrophobicContact CG2-CD1 3.97Å; I188-I192 WeakPolarHBondContact O-CG1 3.37Å; I188-I192 PolarHBondContact O-N 3.05Å
189	G	88.3	Confident	87.3	Confident	38 Å²	38	77 Å²	77	39%	0.392	41%	0.407	S	S	.	.	H	α-helix	trans	-59.8	-42.5	178.3	0	0	0	0	0	112.5	V185 G186 I192 L193	V185-G189 PolarHBondContact O-N 2.86Å; G186-G189 PolarHBondContact O-N 3.22Å; G189-I192 PolarHBondContact O-N 2.86Å; G189-L193 PolarHBondContact O-N 3.28Å
190	T	88.3	Confident	87.4	Confident	5 Å²	5	80.5 Å²	80.5	3%	0.031	42%	0.423	C	S	.	.	H	α-helix	trans	-62.9	-43	176.1	-55.9	0	0	0	0	111.8	I14 V17 G186 L187 I188 I192 L193 V194	I14-T190 HydrophobicContact CB-CG2 4.15Å; I14-T190 HydrophobicContact CG1-CG2 3.66Å; V17-T190 HydrophobicContact CB-CG2 4.13Å; V17-T190 HydrophobicContact CG1-CG2 4.38Å; V17-T190 WeakPolarHBondContact CG1-OG1 3.49Å; G186-T190 WeakPolarHBondContact O-CB 3.48Å; G186-T190 PolarHBondContact O-N 3.47Å; G186-T190 PolarHBondContact O-OG1 3.39Å; L187-T190 PolarHBondContact O-N 3Å; I188-T190 VanDerWaalsContact C-N 3.32Å; I188-T190 PolarHBondContact O-N 3.43Å; T190-I192 VanDerWaalsContact C-N 3.33Å; T190-I192 PolarHBondContact O-N 3.1Å; T190-L193 PolarHBondContact O-N 3.13Å; T190-V194 WeakPolarHBondContact O-CG2 3.45Å; T190-V194 PolarHBondContact O-N 3.12Å
191	C	87.6	Confident	87.4	Confident	56 Å²	56	77.8 Å²	77.8	38%	0.378	41%	0.409	S	S	.	.	H	α-helix	trans	-61.4	-39.8	174.8	-80.3	0	0	0	0	112.5	L187 I188 K195	L187-C191 WeakPolarHBondContact O-CB 3.28Å; L187-C191 PolarHBondContact O-N 3.11Å; L187-C191 PolarHBondContact O-SG 3.21Å; L187-C191 VanDerWaalsContact O-SG 3.39Å; I188-C191 WeakPolarHBondContact O-CB 3.43Å; I188-C191 PolarHBondContact O-N 3.29Å; C191-K195 WeakPolarHBondContact O-CG 3.23Å; C191-K195 PolarHBondContact O-N 3.04Å; C191-K195 VanDerWaalsContact O-N 3.13Å
192	I	90	Very high	87.2	Confident	100 Å²	100	80.2 Å²	80.2	51%	0.513	42%	0.42	S	S	.	.	H	α-helix	trans	-64.6	-47	175.4	-67.6	163.7	0	0	0	110.5	I188 G189 T190 V194 K195 V196	I188-I192 HydrophobicContact CG2-CD1 3.97Å; I188-I192 WeakPolarHBondContact O-CG1 3.37Å; I188-I192 PolarHBondContact O-N 3.05Å; G189-I192 PolarHBondContact O-N 2.86Å; T190-I192 VanDerWaalsContact C-N 3.33Å; T190-I192 PolarHBondContact O-N 3.1Å; I192-V194 VanDerWaalsContact C-N 3.34Å; I192-V194 PolarHBondContact O-N 2.69Å; I192-K195 WeakPolarHBondContact O-CB 3.32Å; I192-K195 PolarHBondContact O-N 2.95Å; I192-K195 VanDerWaalsContact O-N 3.1Å; I192-V196 HydrophobicContact CG2-CG2 4.42Å; I192-V196 WeakPolarHBondContact O-CG2 3.37Å; I192-V196 PolarHBondContact O-N 3.05Å
193	L	88.4	Confident	87	Confident	83 Å²	83	81.6 Å²	81.6	44%	0.435	43%	0.434	S	S	.	.	H	α-helix	trans	-56.1	-47	178.1	-179.3	67.3	0	0	0	111.7	V13 G189 T190 K195 V196 L197	V13-L193 HydrophobicContact CG1-CD2 4.07Å; G189-L193 PolarHBondContact O-N 3.28Å; T190-L193 PolarHBondContact O-N 3.13Å; L193-K195 VanDerWaalsContact C-N 3.32Å; L193-K195 PolarHBondContact O-N 3.32Å; L193-V196 PolarHBondContact O-N 3.5Å; L193-L197 HydrophobicContact CD1-CD1 4.46Å; L193-L197 HydrophobicContact CG-CD1 4.13Å; L193-L197 PolarHBondContact O-N 3.07Å
194	V	87.3	Confident	86.9	Confident	15 Å²	15	79.8 Å²	79.8	9%	0.091	43%	0.426	C	S	.	.	H	α-helix	trans	-61.8	-39.5	177.2	169.8	0	0	0	0	111.7	S10 V13 I14 T190 I192 K198	S10-V194 VanDerWaalsContact CB-CG1 3.44Å; V13-V194 HydrophobicContact CB-CG2 4.38Å; V13-V194 HydrophobicContact CG1-CG2 4.21Å; I14-V194 HydrophobicContact CD1-CG2 4.38Å; I14-V194 HydrophobicContact CG1-CG2 4.07Å; T190-V194 WeakPolarHBondContact O-CG2 3.45Å; T190-V194 PolarHBondContact O-N 3.12Å; I192-V194 VanDerWaalsContact C-N 3.34Å; I192-V194 PolarHBondContact O-N 2.69Å; V194-K198 WeakPolarHBondContact O-CB 3.37Å; V194-K198 WeakPolarHBondContact O-CG 3.41Å; V194-K198 PolarHBondContact O-N 3.06Å
195	K	87.6	Confident	86.6	Confident	162 Å²	162	75.8 Å²	75.8	70%	0.704	40%	0.404	S	S	*	.	H	α-helix	trans	-64.2	-42.3	176	-77.5	-178.8	178.3	-179	0	112	C191 I192 L193 K198 K199	C191-K195 WeakPolarHBondContact O-CG 3.23Å; C191-K195 PolarHBondContact O-N 3.04Å; C191-K195 VanDerWaalsContact O-N 3.13Å; I192-K195 WeakPolarHBondContact O-CB 3.32Å; I192-K195 PolarHBondContact O-N 2.95Å; I192-K195 VanDerWaalsContact O-N 3.1Å; L193-K195 VanDerWaalsContact C-N 3.32Å; L193-K195 PolarHBondContact O-N 3.32Å; K195-K198 PolarHBondContact O-N 3.06Å; K195-K199 PolarHBondContact O-N 3.36Å
196	V	89.4	Confident	86.3	Confident	75 Å²	75	75.1 Å²	75.1	46%	0.455	40%	0.402	S	S	.	.	H	α-helix	trans	-64.7	-47.2	177.4	173.6	0	0	0	0	110.8	I192 L193 K198 K199 I200	I192-V196 HydrophobicContact CG2-CG2 4.42Å; I192-V196 WeakPolarHBondContact O-CG2 3.37Å; I192-V196 PolarHBondContact O-N 3.05Å; L193-V196 PolarHBondContact O-N 3.5Å; V196-K198 VanDerWaalsContact C-N 3.34Å; V196-K198 PolarHBondContact O-N 2.94Å; V196-K199 WeakPolarHBondContact O-CB 3.47Å; V196-K199 PolarHBondContact O-N 3.11Å; V196-I200 HydrophobicContact CG1-CD1 4.04Å; V196-I200 WeakPolarHBondContact O-CG1 3.37Å; V196-I200 PolarHBondContact O-N 3.05Å
197	L	87.4	Confident	86.1	Confident	54 Å²	54	79.2 Å²	79.2	28%	0.283	41%	0.413	S	S	.	.	H	α-helix	trans	-57.9	-45.9	176.1	-79.8	164.7	0	0	0	111.6	L193 K199 I200 L201	L193-L197 HydrophobicContact CD1-CD1 4.46Å; L193-L197 HydrophobicContact CG-CD1 4.13Å; L193-L197 PolarHBondContact O-N 3.07Å; L197-K199 VanDerWaalsContact C-N 3.28Å; L197-K199 PolarHBondContact O-N 2.92Å; L197-I200 PolarHBondContact O-N 2.76Å; L197-L201 VanDerWaalsContact O-CD1 3.28Å; L197-L201 WeakPolarHBondContact O-CD1 3.41Å; L197-L201 PolarHBondContact O-N 2.67Å
198	K	85.1	Confident	86	Confident	94 Å²	94	77.6 Å²	77.6	41%	0.409	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-37	175	-79.9	-168.9	174.7	-167.9	0	112.5	V194 K195 V196 F202 G203	V194-K198 WeakPolarHBondContact O-CB 3.37Å; V194-K198 WeakPolarHBondContact O-CG 3.41Å; V194-K198 PolarHBondContact O-N 3.06Å; K195-K198 PolarHBondContact O-N 3.06Å; V196-K198 VanDerWaalsContact C-N 3.34Å; V196-K198 PolarHBondContact O-N 2.94Å; K198-F202 PolarHBondContact O-N 2.88Å; K198-G203 WeakPolarHBondContact O-CA 3.34Å; K198-G203 PolarHBondContact O-N 2.91Å
199	K	87.2	Confident	85.7	Confident	177 Å²	177	76.7 Å²	76.7	77%	0.77	40%	0.399	S	S	*	.	H	α-helix	trans	-65.4	-42.2	177	-171.5	178.1	178.9	-178.1	0	111.9	K195 V196 L197 F202	K195-K199 PolarHBondContact O-N 3.36Å; V196-K199 WeakPolarHBondContact O-CB 3.47Å; V196-K199 PolarHBondContact O-N 3.11Å; L197-K199 VanDerWaalsContact C-N 3.28Å; L197-K199 PolarHBondContact O-N 2.92Å; K199-F202 PolarHBondContact O-N 2.86Å
200	I	85.5	Confident	85.6	Confident	115 Å²	115	77.6 Å²	77.6	59%	0.59	40%	0.399	S	S	*	.	H	α-helix	trans	-67.2	-40.8	178.1	-64.7	167.9	0	0	0	111	V196 L197 F202	V196-I200 HydrophobicContact CG1-CD1 4.04Å; V196-I200 WeakPolarHBondContact O-CG1 3.37Å; V196-I200 PolarHBondContact O-N 3.05Å; L197-I200 PolarHBondContact O-N 2.76Å; I200-F202 WeakPolarHBondContact O-CD2 3.12Å; I200-F202 PolarHBondContact O-N 2.96Å
201	L	85.4	Confident	85.5	Confident	32 Å²	32	80.1 Å²	80.1	17%	0.168	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	13.9	176.2	-84.9	84.3	0	0	0	113.4	L197 G203 L204 P206 I209	L197-L201 VanDerWaalsContact O-CD1 3.28Å; L197-L201 WeakPolarHBondContact O-CD1 3.41Å; L197-L201 PolarHBondContact O-N 2.67Å; L201-G203 PolarHBondContact O-N 3.36Å; L201-G203 VanDerWaalsContact O-N 3.11Å; L201-L204 VanDerWaalsContact CB-O 3.29Å; L201-L204 WeakPolarHBondContact CB-O 3.48Å; L201-L204 WeakPolarHBondContact CD2-O 3.28Å; L201-L204 VanDerWaalsContact O-CB 3.31Å; L201-L204 WeakPolarHBondContact O-CB 3.48Å; L201-L204 PolarHBondContact O-N 2.98Å; L201-P206 HydrophobicContact CD2-CG 3.84Å; L201-I209 HydrophobicContact CB-CD1 4.05Å; L201-I209 HydrophobicContact CD2-CD1 3.6Å; L201-I209 HydrophobicContact CG-CD1 3.7Å
202	F	82.1	Confident	85.5	Confident	189 Å²	189	80.5 Å²	80.5	83%	0.829	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	30.9	-179.3	-60.6	-86.5	0	0	0	114.2	K198 K199 I200 L204	K198-F202 PolarHBondContact O-N 2.88Å; K199-F202 PolarHBondContact O-N 2.86Å; I200-F202 WeakPolarHBondContact O-CD2 3.12Å; I200-F202 PolarHBondContact O-N 2.96Å; F202-L204 PolarHBondContact O-N 2.75Å
203	G	81.8	Confident	85.4	Confident	50 Å²	50	82.2 Å²	82.2	52%	0.515	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-6.8	-177.2	0	0	0	0	0	114.6	K198 L201	K198-G203 WeakPolarHBondContact O-CA 3.34Å; K198-G203 PolarHBondContact O-N 2.91Å; L201-G203 PolarHBondContact O-N 3.36Å; L201-G203 VanDerWaalsContact O-N 3.11Å
204	L	83.2	Confident	85.3	Confident	59 Å²	59	83.9 Å²	83.9	31%	0.309	42%	0.422	S	S	.	.			trans	-82.2	148	-177.8	-61	167.7	0	0	0	111.3	L201 F202 E208 I209 L212	L201-L204 VanDerWaalsContact CB-O 3.29Å; L201-L204 WeakPolarHBondContact CB-O 3.48Å; L201-L204 WeakPolarHBondContact CD2-O 3.28Å; L201-L204 VanDerWaalsContact O-CB 3.31Å; L201-L204 WeakPolarHBondContact O-CB 3.48Å; L201-L204 PolarHBondContact O-N 2.98Å; F202-L204 PolarHBondContact O-N 2.75Å; L204-E208 WeakPolarHBondContact CA-OE2 3.4Å; L204-E208 HydrophobicContact CB-CB 4.29Å; L204-E208 HydrophobicContact CD2-CB 4.22Å; L204-I209 HydrophobicContact CB-CD1 4.32Å; L204-I209 HydrophobicContact CB-CG1 3.76Å; L204-I209 HydrophobicContact CD1-CG1 4.07Å; L204-L212 HydrophobicContact CD1-CD1 3.67Å; L204-L212 HydrophobicContact CD2-CD1 4.05Å
205	E	83.4	Confident	85.3	Confident	16 Å²	16	88.3 Å²	88.3	8%	0.075	44%	0.442	C	S	.	.			trans	-81.8	152.4	168	-62.5	-167.6	-164.9	0	0	110.4	K8 Y207 E208 I209	K8-E205 VanDerWaalsContact CA-OE2 3.3Å; K8-E205 WeakPolarHBondContact CA-OE2 3.34Å; K8-E205 WeakPolarHBondContact CD-OE1 3.29Å; K8-E205 WeakPolarHBondContact CE-OE1 3.44Å; K8-E205 WeakPolarHBondContact CG-OE1 3.38Å; K8-E205 WeakPolarHBondContact CG-OE2 3.03Å; K8-E205 IonicContact NZ-OE1 3.3Å; E205-Y207 HydrophobicContact CB-CD1 3.7Å; E205-Y207 HydrophobicContact CB-CE1 3.54Å; E205-Y207 HydrophobicContact CG-CE1 4.21Å; E205-Y207 PolarHBondContact O-N 3.33Å; E205-Y207 VanDerWaalsContact O-N 3.1Å; E205-Y207 VanDerWaalsContact OE2-CE1 3.29Å; E205-Y207 WeakPolarHBondContact OE2-CE1 3.49Å; E205-E208 HydrophobicContact CB-CG 4.17Å; E205-E208 PolarHBondContact N-OE2 3.11Å; E205-E208 WeakPolarHBondContact O-CA 3.08Å; E205-E208 VanDerWaalsContact O-CB 3.32Å; E205-E208 WeakPolarHBondContact O-CB 3.46Å; E205-E208 PolarHBondContact O-N 3.3Å; E205-I209 PolarHBondContact O-N 3.12Å; E205-I209 VanDerWaalsContact O-N 3.1Å
206	P	80.2	Confident	85.4	Confident	63 Å²	63	88.7 Å²	88.7	41%	0.409	44%	0.439	S	S	.	.	H	α-helix	trans	-53.7	-36.2	-176.9	-27.7	33.6	0	0	0	114.3	L9 L201 E208 I209 S210	L9-P206 HydrophobicContact CB-CG 4.42Å; L9-P206 HydrophobicContact CD1-CG 4.47Å; L9-P206 HydrophobicContact CD2-CG 4.06Å; L201-P206 HydrophobicContact CD2-CG 3.84Å; P206-E208 VanDerWaalsContact C-N 3.31Å; P206-E208 PolarHBondContact O-N 2.75Å; P206-I209 PolarHBondContact O-N 3.45Å; P206-S210 PolarHBondContact O-N 3.45Å; P206-S210 VanDerWaalsContact O-N 3.08Å
207	Y	82.6	Confident	85.2	Confident	100 Å²	100	89.9 Å²	89.9	39%	0.392	44%	0.439	S	S	.	.	H	α-helix	trans	-68.2	-31.6	176.3	80.7	-96.7	0	0	0	112.2	P6 E205 S210 T211	P6-Y207 HydrophobicContact CG-CD1 3.99Å; P6-Y207 HydrophobicContact CG-CG 4.17Å; E205-Y207 HydrophobicContact CB-CD1 3.7Å; E205-Y207 HydrophobicContact CB-CE1 3.54Å; E205-Y207 HydrophobicContact CG-CE1 4.21Å; E205-Y207 PolarHBondContact O-N 3.33Å; E205-Y207 VanDerWaalsContact O-N 3.1Å; E205-Y207 VanDerWaalsContact OE2-CE1 3.29Å; E205-Y207 WeakPolarHBondContact OE2-CE1 3.49Å; Y207-S210 PolarHBondContact O-N 3.39Å; Y207-T211 WeakPolarHBondContact O-CB 3.5Å; Y207-T211 PolarHBondContact O-N 3.47Å; Y207-T211 PolarHBondContact O-OG1 3.11Å
208	E	85.3	Confident	85.3	Confident	58 Å²	58	90.2 Å²	90.2	27%	0.271	45%	0.45	S	S	.	.	H	α-helix	trans	-71	-40.2	177.4	-60.9	176.5	153	0	0	110.1	L204 E205 P206 T211 L212	L204-E208 WeakPolarHBondContact CA-OE2 3.4Å; L204-E208 HydrophobicContact CB-CB 4.29Å; L204-E208 HydrophobicContact CD2-CB 4.22Å; E205-E208 HydrophobicContact CB-CG 4.17Å; E205-E208 PolarHBondContact N-OE2 3.11Å; E205-E208 WeakPolarHBondContact O-CA 3.08Å; E205-E208 VanDerWaalsContact O-CB 3.32Å; E205-E208 WeakPolarHBondContact O-CB 3.46Å; E205-E208 PolarHBondContact O-N 3.3Å; P206-E208 VanDerWaalsContact C-N 3.31Å; P206-E208 PolarHBondContact O-N 2.75Å; E208-T211 PolarHBondContact O-N 2.9Å; E208-L212 WeakPolarHBondContact O-CB 3.41Å; E208-L212 VanDerWaalsContact O-CG 3.3Å; E208-L212 WeakPolarHBondContact O-CG 3.41Å; E208-L212 PolarHBondContact O-N 2.77Å
209	I	84.4	Confident	85.4	Confident	70 Å²	70	91.2 Å²	91.2	36%	0.359	46%	0.457	S	S	.	.	H	α-helix	trans	-60.8	-47	173.5	-61	176.2	0	0	0	110.3	L201 L204 E205 P206 T211 L212 F213	L201-I209 HydrophobicContact CB-CD1 4.05Å; L201-I209 HydrophobicContact CD2-CD1 3.6Å; L201-I209 HydrophobicContact CG-CD1 3.7Å; L204-I209 HydrophobicContact CB-CD1 4.32Å; L204-I209 HydrophobicContact CB-CG1 3.76Å; L204-I209 HydrophobicContact CD1-CG1 4.07Å; E205-I209 PolarHBondContact O-N 3.12Å; E205-I209 VanDerWaalsContact O-N 3.1Å; P206-I209 PolarHBondContact O-N 3.45Å; I209-T211 VanDerWaalsContact C-N 3.32Å; I209-T211 PolarHBondContact O-N 3.24Å; I209-L212 PolarHBondContact O-N 3.22Å; I209-F213 VanDerWaalsContact O-CB 3.25Å; I209-F213 WeakPolarHBondContact O-CB 3.07Å; I209-F213 PolarHBondContact O-N 3.21Å
210	S	85.2	Confident	85.4	Confident	57 Å²	57	85.4 Å²	85.4	40%	0.399	44%	0.435	S	S	.	.	H	α-helix	trans	-59.1	-44.6	175.8	-165.3	0	0	0	0	111.5	P206 Y207 F213 E214	P206-S210 PolarHBondContact O-N 3.45Å; P206-S210 VanDerWaalsContact O-N 3.08Å; Y207-S210 PolarHBondContact O-N 3.39Å; S210-F213 PolarHBondContact O-N 3.05Å; S210-E214 WeakPolarHBondContact O-CB 3.31Å; S210-E214 WeakPolarHBondContact O-CG 3.24Å; S210-E214 PolarHBondContact O-N 2.74Å
211	T	86.2	Confident	85.5	Confident	57 Å²	57	82.9 Å²	82.9	35%	0.35	42%	0.42	S	S	.	.	H	α-helix	trans	-65.8	-43.9	179.9	-53.8	0	0	0	0	111.4	Y207 E208 I209 F213 E214 Q215	Y207-T211 WeakPolarHBondContact O-CB 3.5Å; Y207-T211 PolarHBondContact O-N 3.47Å; Y207-T211 PolarHBondContact O-OG1 3.11Å; E208-T211 PolarHBondContact O-N 2.9Å; I209-T211 VanDerWaalsContact C-N 3.32Å; I209-T211 PolarHBondContact O-N 3.24Å; T211-F213 VanDerWaalsContact C-N 3.31Å; T211-F213 PolarHBondContact O-N 2.93Å; T211-E214 PolarHBondContact O-N 3.15Å; T211-Q215 HydrophobicContact CG2-CG 4.43Å; T211-Q215 WeakPolarHBondContact O-CB 3.24Å; T211-Q215 VanDerWaalsContact O-CG 3.24Å; T211-Q215 WeakPolarHBondContact O-CG 3.47Å; T211-Q215 PolarHBondContact O-N 3.45Å
212	L	88.6	Confident	85.6	Confident	64 Å²	64	85.7 Å²	85.7	34%	0.335	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-37.5	176.6	-76.5	168.2	0	0	0	111.7	L204 E208 I209 R216	L204-L212 HydrophobicContact CD1-CD1 3.67Å; L204-L212 HydrophobicContact CD2-CD1 4.05Å; E208-L212 WeakPolarHBondContact O-CB 3.41Å; E208-L212 VanDerWaalsContact O-CG 3.3Å; E208-L212 WeakPolarHBondContact O-CG 3.41Å; E208-L212 PolarHBondContact O-N 2.77Å; I209-L212 PolarHBondContact O-N 3.22Å; L212-R216 WeakPolarHBondContact O-CB 3.39Å; L212-R216 VanDerWaalsContact O-CG 3.26Å; L212-R216 WeakPolarHBondContact O-CG 3.26Å; L212-R216 PolarHBondContact O-N 2.9Å
213	F	86.5	Confident	85.9	Confident	136 Å²	136	79.9 Å²	79.9	60%	0.596	42%	0.42	S	S	*	.	H	α-helix	trans	-64.6	-50.9	174.8	-178.5	-94.4	0	0	0	111	I209 S210 T211 Q215 R216 Q217	I209-F213 VanDerWaalsContact O-CB 3.25Å; I209-F213 WeakPolarHBondContact O-CB 3.07Å; I209-F213 PolarHBondContact O-N 3.21Å; S210-F213 PolarHBondContact O-N 3.05Å; T211-F213 VanDerWaalsContact C-N 3.31Å; T211-F213 PolarHBondContact O-N 2.93Å; F213-Q215 VanDerWaalsContact C-N 3.34Å; F213-Q215 PolarHBondContact O-N 2.58Å; F213-R216 PolarHBondContact O-N 2.97Å; F213-Q217 WeakPolarHBondContact O-CB 3.34Å; F213-Q217 PolarHBondContact O-N 2.8Å
214	E	86.6	Confident	86.2	Confident	119 Å²	119	87.1 Å²	87.1	56%	0.556	44%	0.437	S	S	*	.	H	α-helix	trans	-57.7	-44.3	175.4	-76.3	173.5	-161.7	0	0	111.9	S210 T211 Q217 A218	S210-E214 WeakPolarHBondContact O-CB 3.31Å; S210-E214 WeakPolarHBondContact O-CG 3.24Å; S210-E214 PolarHBondContact O-N 2.74Å; T211-E214 PolarHBondContact O-N 3.15Å; E214-Q217 PolarHBondContact O-N 2.88Å; E214-A218 WeakPolarHBondContact O-CB 3.17Å; E214-A218 PolarHBondContact O-N 3.39Å
215	Q	88.1	Confident	86.6	Confident	108 Å²	108	87.7 Å²	87.7	51%	0.505	44%	0.438	S	S	.	.	H	α-helix	trans	-63.3	-44.4	177.2	-77.6	177.6	-17	0	0	112.3	T211 F213 Q217 A218 M219	T211-Q215 HydrophobicContact CG2-CG 4.43Å; T211-Q215 WeakPolarHBondContact O-CB 3.24Å; T211-Q215 VanDerWaalsContact O-CG 3.24Å; T211-Q215 WeakPolarHBondContact O-CG 3.47Å; T211-Q215 PolarHBondContact O-N 3.45Å; F213-Q215 VanDerWaalsContact C-N 3.34Å; F213-Q215 PolarHBondContact O-N 2.58Å; Q215-Q217 VanDerWaalsContact C-N 3.34Å; Q215-A218 PolarHBondContact O-N 3.03Å; Q215-M219 WeakPolarHBondContact O-CG 3.45Å; Q215-M219 PolarHBondContact O-N 3.31Å
216	R	89	Confident	87	Confident	169 Å²	169	86.9 Å²	86.9	64%	0.638	43%	0.434	S	S	*	.	H	α-helix	trans	-62.9	-41.8	176.6	-76.7	175.9	-179.7	-173.6	0.6	111.7	L212 F213 M219 L220	L212-R216 WeakPolarHBondContact O-CB 3.39Å; L212-R216 VanDerWaalsContact O-CG 3.26Å; L212-R216 WeakPolarHBondContact O-CG 3.26Å; L212-R216 PolarHBondContact O-N 2.9Å; F213-R216 PolarHBondContact O-N 2.97Å; R216-M219 HydrophobicContact CB-CE 4.46Å; R216-M219 HydrophobicContact CG-CE 4.02Å; R216-M219 PolarHBondContact O-N 3.37Å; R216-L220 WeakPolarHBondContact O-CG 3.47Å; R216-L220 PolarHBondContact O-N 3.13Å
217	Q	86.1	Confident	87.6	Confident	100 Å²	100	84.3 Å²	84.3	47%	0.467	42%	0.417	S	S	.	.	H	α-helix	trans	-64.7	-44.2	176.5	-171.8	167.5	-1.4	0	0	111.5	F213 E214 Q215 M219 L220 Q221	F213-Q217 WeakPolarHBondContact O-CB 3.34Å; F213-Q217 PolarHBondContact O-N 2.8Å; E214-Q217 PolarHBondContact O-N 2.88Å; Q215-Q217 VanDerWaalsContact C-N 3.34Å; Q217-M219 VanDerWaalsContact C-N 3.33Å; Q217-M219 PolarHBondContact O-N 2.81Å; Q217-L220 PolarHBondContact O-N 3.28Å; Q217-Q221 WeakPolarHBondContact O-CG 3.44Å; Q217-Q221 PolarHBondContact O-N 2.99Å
218	A	88.4	Confident	88	Confident	61 Å²	61	79.7 Å²	79.7	50%	0.504	40%	0.399	S	S	.	.	H	α-helix	trans	-62.9	-37.2	175.6	0	0	0	0	0	112.8	E214 Q215 Q221 S222	E214-A218 WeakPolarHBondContact O-CB 3.17Å; E214-A218 PolarHBondContact O-N 3.39Å; Q215-A218 PolarHBondContact O-N 3.03Å; A218-Q221 PolarHBondContact O-N 3.22Å; A218-S222 PolarHBondContact O-N 3.17Å; A218-S222 VanDerWaalsContact O-N 3.13Å; A218-S222 PolarHBondContact O-OG 3.04Å
219	M	88.2	Confident	88.3	Confident	115 Å²	115	77.6 Å²	77.6	57%	0.567	39%	0.392	S	S	*	.	H	α-helix	trans	-64.7	-42.2	173.8	-75.4	-173.3	-65.1	0	0	112.1	Q215 R216 Q217 Q221 S222 I223	Q215-M219 WeakPolarHBondContact O-CG 3.45Å; Q215-M219 PolarHBondContact O-N 3.31Å; R216-M219 HydrophobicContact CB-CE 4.46Å; R216-M219 HydrophobicContact CG-CE 4.02Å; R216-M219 PolarHBondContact O-N 3.37Å; Q217-M219 VanDerWaalsContact C-N 3.33Å; Q217-M219 PolarHBondContact O-N 2.81Å; M219-Q221 VanDerWaalsContact C-N 3.32Å; M219-Q221 PolarHBondContact O-N 3.21Å; M219-S222 PolarHBondContact O-N 2.87Å; M219-S222 PolarHBondContact O-OG 3.23Å; M219-S222 VanDerWaalsContact O-OG 3.07Å; M219-I223 WeakPolarHBondContact O-CG1 3.48Å
220	L	87.5	Confident	88.7	Confident	56 Å²	56	74.5 Å²	74.5	29%	0.293	38%	0.376	S	S	.	.	H	α-helix	trans	-65.3	-37.4	177.3	-71.8	171.2	0	0	0	112.2	R216 Q217 S222 I223 L238 N240	R216-L220 WeakPolarHBondContact O-CG 3.47Å; R216-L220 PolarHBondContact O-N 3.13Å; Q217-L220 PolarHBondContact O-N 3.28Å; L220-S222 VanDerWaalsContact C-N 3.35Å; L220-I223 HydrophobicContact CD2-CD1 4.37Å; L220-L238 HydrophobicContact CD1-CD1 3.56Å; L220-L238 HydrophobicContact CD1-CD2 4.1Å; L220-N240 WeakPolarHBondContact O-CB 3.37Å; L220-N240 PolarHBondContact O-ND2 3.41Å; L220-N240 VanDerWaalsContact O-ND2 3.16Å
221	Q	86.9	Confident	89	Confident	61 Å²	61	73.9 Å²	73.9	29%	0.285	37%	0.368	S	S	.	.	H	α-helix	trans	-73.6	-21.6	178.7	-65.1	-65.2	37.5	0	0	114.3	Q217 A218 M219 D241	Q217-Q221 WeakPolarHBondContact O-CG 3.44Å; Q217-Q221 PolarHBondContact O-N 2.99Å; A218-Q221 PolarHBondContact O-N 3.22Å; M219-Q221 VanDerWaalsContact C-N 3.32Å; M219-Q221 PolarHBondContact O-N 3.21Å; Q221-D241 VanDerWaalsContact CD-OD1 3.3Å; Q221-D241 VanDerWaalsContact NE2-CG 3.33Å; Q221-D241 PolarHBondContact NE2-OD1 2.91Å; Q221-D241 PolarHBondContact NE2-OD2 3.06Å; Q221-D241 PolarHBondContact OE1-OD1 3.49Å; Q221-D241 PolarHBondContact OE1-OD2 3.04Å
222	S	86.5	Confident	89.1	Confident	92 Å²	92	76.3 Å²	76.3	64%	0.643	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-7.4	178.8	68.8	0	0	0	0	114.3	A218 M219 L220	A218-S222 PolarHBondContact O-N 3.17Å; A218-S222 VanDerWaalsContact O-N 3.13Å; A218-S222 PolarHBondContact O-OG 3.04Å; M219-S222 PolarHBondContact O-N 2.87Å; M219-S222 PolarHBondContact O-OG 3.23Å; M219-S222 VanDerWaalsContact O-OG 3.07Å; L220-S222 VanDerWaalsContact C-N 3.35Å
223	I	89.8	Confident	89	Confident	67 Å²	67	83.2 Å²	83.2	34%	0.344	40%	0.401	S	S	.	.			trans	-73	129.3	178.1	-66.1	166.1	0	0	0	109.5	M219 L220 E225 V227 N240 A242	M219-I223 WeakPolarHBondContact O-CG1 3.48Å; L220-I223 HydrophobicContact CD2-CD1 4.37Å; I223-E225 VanDerWaalsContact C-N 3.29Å; I223-E225 HydrophobicContact CG2-CB 3.85Å; I223-E225 HydrophobicContact CG2-CG 4.49Å; I223-E225 PolarHBondContact O-N 3.03Å; I223-V227 HydrophobicContact CG2-CG2 4.29Å; I223-N240 PolarHBondContact O-ND2 3.23Å; I223-A242 WeakPolarHBondContact O-CB 3.49Å
224	K	86.8	Confident	88.9	Confident	201 Å²	201	77.8 Å²	77.8	87%	0.874	38%	0.384	S	S	*	.	S	Bend	trans	-72.5	-21.1	177.5	-69.6	-171.2	175.4	-173.4	0	114
225	E	91.4	Very high	89	Confident	71 Å²	71	75.7 Å²	75.7	33%	0.332	37%	0.374	S	S	.	.	S	Bend	trans	-78.8	144.2	174.2	-59.9	-176.1	175	0	0	109.5	I223 V227 N240 A242 R314	I223-E225 VanDerWaalsContact C-N 3.29Å; I223-E225 HydrophobicContact CG2-CB 3.85Å; I223-E225 HydrophobicContact CG2-CG 4.49Å; I223-E225 PolarHBondContact O-N 3.03Å; E225-V227 PolarHBondContact O-N 3.36Å; E225-N240 PolarHBondContact O-ND2 3.21Å; E225-A242 WeakPolarHBondContact O-CB 3.47Å; E225-R314 HydrophobicContact CG-CB 4.26Å; E225-R314 HydrophobicContact CG-CG 4.5Å
226	G	91.8	Very high	89	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	132.2	170.1	0	0	0	0	0	109.7	T312 F313	G226-T312 CarbonylContact O-C 3.58Å; G226-T312 WeakPolarHBondContact O-CA 3.25Å; G226-F313 PolarHBondContact N-O 2.92Å; G226-F313 WeakPolarHBondContact O-CD1 3.24Å; G226-F313 PolarHBondContact O-N 3.29Å
227	V	93.4	Very high	88.9	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.055	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	124.3	177.4	-175.8	0	0	0	0	109	I223 E225 I239 N240 I310 S311 T312	I223-V227 HydrophobicContact CG2-CG2 4.29Å; E225-V227 PolarHBondContact O-N 3.36Å; V227-I239 WeakPolarHBondContact O-CA 3.23Å; V227-N240 HydrophobicContact CB-CB 4.37Å; V227-N240 PolarHBondContact N-OD1 3.2Å; V227-N240 PolarHBondContact O-N 3.44Å; V227-N240 VanDerWaalsContact O-N 3.08Å; V227-N240 PolarHBondContact O-OD1 2.83Å; V227-I310 HydrophobicContact CG1-CG2 3.92Å; V227-S311 WeakPolarHBondContact CA-O 3.47Å; V227-T312 HydrophobicContact CG2-CG2 4.21Å
228	V	91.6	Very high	89.1	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.9	172.9	173.4	0	0	0	0	108.2	V230 V236 L238 I239 A243 W265 I310 S311 F313	V228-V230 HydrophobicContact CG1-CG1 4.49Å; V228-V236 HydrophobicContact CG1-CG1 4.11Å; V228-V236 HydrophobicContact CG1-CG2 3.89Å; V228-L238 CarbonylContact C-O 3.57Å; V228-L238 WeakPolarHBondContact CA-O 3.49Å; V228-I239 HydrophobicContact CG2-CD1 4.19Å; V228-I239 HydrophobicContact CG2-CG1 4Å; V228-A243 HydrophobicContact CG2-CB 4.18Å; V228-W265 HydrophobicContact CB-CD2 4.4Å; V228-W265 HydrophobicContact CB-CZ2 4.19Å; V228-W265 HydrophobicContact CG1-CD2 4.06Å; V228-W265 HydrophobicContact CG1-CG 4.05Å; V228-W265 HydrophobicContact CG2-CD2 4.35Å; V228-W265 HydrophobicContact CG2-CE3 4.4Å; V228-W265 HydrophobicContact CG2-CH2 4.48Å; V228-W265 HydrophobicContact CG2-CZ2 4.42Å; V228-W265 HydrophobicContact CG2-CZ3 4.47Å; V228-I310 WeakPolarHBondContact O-CA 3.44Å; V228-S311 PolarHBondContact N-O 2.79Å; V228-S311 PolarHBondContact O-N 3.36Å; V228-F313 HydrophobicContact CG2-CE1 3.87Å; V228-F313 HydrophobicContact CG2-CZ 4.49Å
229	A	92.2	Very high	89.1	Confident	14 Å²	14	62.9 Å²	62.9	12%	0.116	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.6	173.9	0	0	0	0	0	110.2	V236 T237 L238 A309 I310	A229-V236 CarbonylContact O-C 3.21Å; A229-V236 WeakPolarHBondContact O-CA 3.41Å; A229-T237 PolarHBondContact O-N 3.39Å; A229-T237 PolarHBondContact O-OG1 2.98Å; A229-L238 HydrophobicContact CB-CB 3.98Å; A229-L238 PolarHBondContact N-O 3.16Å; A229-L238 PolarHBondContact O-N 3.12Å; A229-A309 CarbonylContact C-O 3.37Å; A229-A309 WeakPolarHBondContact CA-O 3.36Å; A229-I310 HydrophobicContact CB-CG1 3.88Å
230	V	91.6	Very high	89.2	Confident	6 Å²	6	57.5 Å²	57.5	4%	0.036	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	153.7	176.8	-58.4	0	0	0	0	111.4	V228 E235 V236 V271 L275 G308 A309	V228-V230 HydrophobicContact CG1-CG1 4.49Å; V230-E235 CarbonylContact C-O 3.38Å; V230-E235 WeakPolarHBondContact CA-O 3.35Å; V230-E235 WeakPolarHBondContact CB-O 3.37Å; V230-V236 HydrophobicContact CG1-CG2 4.01Å; V230-V271 HydrophobicContact CG2-CB 4.47Å; V230-V271 HydrophobicContact CG2-CG1 3.67Å; V230-L275 HydrophobicContact CG2-CD1 4.43Å; V230-G308 CarbonylContact O-C 3.58Å; V230-G308 WeakPolarHBondContact O-CA 3.36Å; V230-A309 HydrophobicContact CG2-CB 3.94Å; V230-A309 PolarHBondContact N-O 3.26Å; V230-A309 PolarHBondContact O-N 3.2Å
231	D	91	Very high	89.3	Confident	43 Å²	43	58.1 Å²	58.1	23%	0.23	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-172.7	172.3	69.6	8.1	0	0	0	112.8	R233 G234 E235 T237	D231-R233 PolarHBondContact O-N 2.98Å; D231-R233 WeakPolarHBondContact OD1-CA 3.33Å; D231-R233 WeakPolarHBondContact OD1-CB 3.44Å; D231-R233 PolarHBondContact OD1-N 3.05Å; D231-G234 PolarHBondContact O-N 2.91Å; D231-G234 PolarHBondContact OD1-N 2.78Å; D231-E235 PolarHBondContact N-O 2.86Å; D231-E235 PolarHBondContact OD1-N 3.41Å; D231-T237 HydrophobicContact CB-CG2 3.82Å
232	D	89.2	Confident	89.4	Confident	108 Å²	108	55.9 Å²	55.9	58%	0.578	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-10.5	177.7	65.9	-27	0	0	0	113.9	I307	D232-I307 PolarHBondContact N-O 2.8Å
233	R	86	Confident	89.6	Confident	209 Å²	209	51.5 Å²	51.5	79%	0.789	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-2.9	175.9	-57.8	177.9	-177.1	-167.4	-1	112.8	D231 E235	D231-R233 PolarHBondContact O-N 2.98Å; D231-R233 WeakPolarHBondContact OD1-CA 3.33Å; D231-R233 WeakPolarHBondContact OD1-CB 3.44Å; D231-R233 PolarHBondContact OD1-N 3.05Å; R233-E235 HydrophobicContact CB-CG 4.47Å
234	G	85.2	Confident	89.4	Confident	23 Å²	23	50.4 Å²	50.4	24%	0.237	25%	0.251	C	S	.	.	S	Bend	trans	82.6	10.8	-176.4	0	0	0	0	0	114.1	D231	D231-G234 PolarHBondContact O-N 2.91Å; D231-G234 PolarHBondContact OD1-N 2.78Å
235	E	87.5	Confident	89.3	Confident	74 Å²	74	47.8 Å²	47.8	35%	0.346	24%	0.242	S	C	.	.			trans	-82.1	133.8	177.5	-68.1	-70.4	163.6	0	0	110.8	V230 D231 R233 T237 S262	V230-E235 CarbonylContact C-O 3.38Å; V230-E235 WeakPolarHBondContact CA-O 3.35Å; V230-E235 WeakPolarHBondContact CB-O 3.37Å; D231-E235 PolarHBondContact N-O 2.86Å; D231-E235 PolarHBondContact OD1-N 3.41Å; R233-E235 HydrophobicContact CB-CG 4.47Å; E235-T237 PolarHBondContact O-N 3.27Å; E235-S262 WeakPolarHBondContact CA-OG 3.11Å; E235-S262 WeakPolarHBondContact OE2-CB 3.43Å; E235-S262 PolarHBondContact OE2-OG 3.46Å
236	V	88.4	Confident	89	Confident	8 Å²	8	45.9 Å²	45.9	5%	0.048	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	119.2	179.8	175.8	0	0	0	0	109.8	V228 A229 V230 L258 S262 W265	V228-V236 HydrophobicContact CG1-CG1 4.11Å; V228-V236 HydrophobicContact CG1-CG2 3.89Å; A229-V236 CarbonylContact O-C 3.21Å; A229-V236 WeakPolarHBondContact O-CA 3.41Å; V230-V236 HydrophobicContact CG1-CG2 4.01Å; V236-L258 HydrophobicContact CB-CB 4.42Å; V236-L258 HydrophobicContact CG1-CD2 4.27Å; V236-L258 WeakPolarHBondContact O-CB 3.23Å; V236-L258 WeakPolarHBondContact O-CD1 3.27Å; V236-S262 PolarHBondContact N-OG 2.95Å; V236-W265 HydrophobicContact CG2-CB 4.26Å
237	T	88.4	Confident	88.5	Confident	81 Å²	81	47.8 Å²	47.8	50%	0.497	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-25.1	177.2	56.8	0	0	0	0	112.5	A229 D231 E235	A229-T237 PolarHBondContact O-N 3.39Å; A229-T237 PolarHBondContact O-OG1 2.98Å; D231-T237 HydrophobicContact CB-CG2 3.82Å; E235-T237 PolarHBondContact O-N 3.27Å
238	L	88.7	Confident	87.7	Confident	60 Å²	60	52.6 Å²	52.6	31%	0.314	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	140.2	-179.3	-173.7	143.4	0	0	0	111.2	L220 V228 A229	L220-L238 HydrophobicContact CD1-CD1 3.56Å; L220-L238 HydrophobicContact CD1-CD2 4.1Å; V228-L238 CarbonylContact C-O 3.57Å; V228-L238 WeakPolarHBondContact CA-O 3.49Å; A229-L238 HydrophobicContact CB-CB 3.98Å; A229-L238 PolarHBondContact N-O 3.16Å; A229-L238 PolarHBondContact O-N 3.12Å
239	I	88.4	Confident	86.7	Confident	21 Å²	21	54.7 Å²	54.7	11%	0.108	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	131.1	169.9	-174.6	170.8	0	0	0	108.6	V227 V228 A243 Q244 L247 L258 L261	V227-I239 WeakPolarHBondContact O-CA 3.23Å; V228-I239 HydrophobicContact CG2-CD1 4.19Å; V228-I239 HydrophobicContact CG2-CG1 4Å; I239-A243 HydrophobicContact CD1-CB 3.99Å; I239-A243 HydrophobicContact CG1-CB 3.53Å; I239-Q244 HydrophobicContact CD1-CG 3.93Å; I239-Q244 HydrophobicContact CG1-CG 4.08Å; I239-Q244 HydrophobicContact CG2-CG 4.43Å; I239-L247 HydrophobicContact CD1-CD1 4.38Å; I239-L258 HydrophobicContact CG2-CD2 4.21Å; I239-L261 HydrophobicContact CD1-CD1 4.24Å; I239-L261 HydrophobicContact CG2-CD1 4.24Å
240	N	90.9	Very high	85.3	Confident	1 Å²	1	65 Å²	65	1%	0.005	31%	0.313	C	S	.	.			trans	-87.6	169.1	176.1	79.8	-21	0	0	0	112.5	L220 I223 E225 V227 A242 A243 Q244	L220-N240 WeakPolarHBondContact O-CB 3.37Å; L220-N240 PolarHBondContact O-ND2 3.41Å; L220-N240 VanDerWaalsContact O-ND2 3.16Å; I223-N240 PolarHBondContact O-ND2 3.23Å; E225-N240 PolarHBondContact O-ND2 3.21Å; V227-N240 HydrophobicContact CB-CB 4.37Å; V227-N240 PolarHBondContact N-OD1 3.2Å; V227-N240 PolarHBondContact O-N 3.44Å; V227-N240 VanDerWaalsContact O-N 3.08Å; V227-N240 PolarHBondContact O-OD1 2.83Å; N240-A242 VanDerWaalsContact C-N 3.35Å; N240-A242 PolarHBondContact O-N 2.88Å; N240-A243 WeakPolarHBondContact O-CB 3.4Å; N240-A243 PolarHBondContact O-N 3.37Å; N240-A243 WeakPolarHBondContact OD1-CB 3.13Å; N240-A243 PolarHBondContact OD1-N 2.58Å; N240-Q244 PolarHBondContact O-N 2.96Å; N240-Q244 VanDerWaalsContact O-N 3.11Å
241	D	89.7	Confident	83.8	Confident	70 Å²	70	72.1 Å²	72.1	37%	0.374	34%	0.343	S	S	.	.	H	α-helix	trans	-65	-39.1	-175.3	-64.4	-17.8	0	0	0	111	Q221 A243 Q244 E245	Q221-D241 VanDerWaalsContact CD-OD1 3.3Å; Q221-D241 VanDerWaalsContact NE2-CG 3.33Å; Q221-D241 PolarHBondContact NE2-OD1 2.91Å; Q221-D241 PolarHBondContact NE2-OD2 3.06Å; Q221-D241 PolarHBondContact OE1-OD1 3.49Å; Q221-D241 PolarHBondContact OE1-OD2 3.04Å; D241-A243 VanDerWaalsContact C-N 3.32Å; D241-A243 PolarHBondContact O-N 2.9Å; D241-Q244 WeakPolarHBondContact O-CB 3.43Å; D241-Q244 PolarHBondContact O-N 2.95Å; D241-Q244 VanDerWaalsContact O-N 3.15Å; D241-E245 PolarHBondContact O-N 3.37Å
242	A	89.9	Confident	82.1	Confident	13 Å²	13	73 Å²	73	11%	0.107	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-38.1	174.7	0	0	0	0	0	112.5	I223 E225 N240 E245 L246	I223-A242 WeakPolarHBondContact O-CB 3.49Å; E225-A242 WeakPolarHBondContact O-CB 3.47Å; N240-A242 VanDerWaalsContact C-N 3.35Å; N240-A242 PolarHBondContact O-N 2.88Å; A242-E245 PolarHBondContact O-N 2.93Å; A242-L246 WeakPolarHBondContact O-CB 3.48Å; A242-L246 VanDerWaalsContact O-CG 3.26Å; A242-L246 WeakPolarHBondContact O-CG 3.49Å; A242-L246 PolarHBondContact O-N 3.36Å
243	A	89.7	Confident	80.3	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-66	-40.7	174.1	0	0	0	0	0	111.6	V228 I239 N240 D241 L246 L247 F313	V228-A243 HydrophobicContact CG2-CB 4.18Å; I239-A243 HydrophobicContact CD1-CB 3.99Å; I239-A243 HydrophobicContact CG1-CB 3.53Å; N240-A243 WeakPolarHBondContact O-CB 3.4Å; N240-A243 PolarHBondContact O-N 3.37Å; N240-A243 WeakPolarHBondContact OD1-CB 3.13Å; N240-A243 PolarHBondContact OD1-N 2.58Å; D241-A243 VanDerWaalsContact C-N 3.32Å; D241-A243 PolarHBondContact O-N 2.9Å; A243-L246 PolarHBondContact O-N 3.09Å; A243-L247 VanDerWaalsContact O-CB 3.27Å; A243-L247 WeakPolarHBondContact O-CB 3.26Å; A243-L247 VanDerWaalsContact O-CG 3.23Å; A243-L247 WeakPolarHBondContact O-CG 3.48Å; A243-L247 PolarHBondContact O-N 2.9Å; A243-F313 HydrophobicContact CB-CE1 3.94Å; A243-F313 HydrophobicContact CB-CE2 4.41Å; A243-F313 HydrophobicContact CB-CZ 3.47Å; A243-F313 VanDerWaalsContact CB-CZ 3.47Å
244	Q	86.6	Confident	78.5	Confident	45 Å²	45	74.5 Å²	74.5	21%	0.21	37%	0.37	C	S	.	.	H	α-helix	trans	-61	-44.9	175.8	-68.5	179.8	26.6	0	0	111.6	I239 N240 D241 N248 Y249	I239-Q244 HydrophobicContact CD1-CG 3.93Å; I239-Q244 HydrophobicContact CG1-CG 4.08Å; I239-Q244 HydrophobicContact CG2-CG 4.43Å; N240-Q244 PolarHBondContact O-N 2.96Å; N240-Q244 VanDerWaalsContact O-N 3.11Å; D241-Q244 WeakPolarHBondContact O-CB 3.43Å; D241-Q244 PolarHBondContact O-N 2.95Å; D241-Q244 VanDerWaalsContact O-N 3.15Å; Q244-N248 CarbonylContact O-C 3.6Å; Q244-N248 WeakPolarHBondContact O-CA 3.44Å; Q244-N248 PolarHBondContact O-N 2.9Å; Q244-Y249 WeakPolarHBondContact CB-O 3.32Å; Q244-Y249 HydrophobicContact CG-CD1 4.35Å; Q244-Y249 PolarHBondContact O-N 2.85Å
245	E	84.5	Confident	77	Confident	146 Å²	146	75.8 Å²	75.8	68%	0.682	37%	0.372	S	S	*	.	H	α-helix	trans	-65.1	-43.5	176.6	-72.1	-176.2	176.2	0	0	112.8	D241 A242 L247 N248	D241-E245 PolarHBondContact O-N 3.37Å; A242-E245 PolarHBondContact O-N 2.93Å; E245-L247 VanDerWaalsContact C-N 3.34Å; E245-L247 PolarHBondContact O-N 3.22Å; E245-N248 PolarHBondContact O-N 3.42Å; E245-N248 PolarHBondContact O-OD1 3.36Å
246	L	84.7	Confident	75.3	Confident	30 Å²	30	81.4 Å²	81.4	16%	0.157	40%	0.398	C	S	.	.	H	α-helix	trans	-67.5	-35.8	-179.8	-75.6	173.8	0	0	0	112.3	A242 A243 R291 F313 D315	A242-L246 WeakPolarHBondContact O-CB 3.48Å; A242-L246 VanDerWaalsContact O-CG 3.26Å; A242-L246 WeakPolarHBondContact O-CG 3.49Å; A242-L246 PolarHBondContact O-N 3.36Å; A243-L246 PolarHBondContact O-N 3.09Å; L246-R291 PolarHBondContact O-NH1 2.9Å; L246-F313 HydrophobicContact CB-CD2 4.36Å; L246-F313 HydrophobicContact CB-CE2 3.66Å; L246-F313 HydrophobicContact CD1-CD2 3.8Å; L246-F313 HydrophobicContact CD1-CE2 3.74Å; L246-F313 HydrophobicContact CG-CE2 4.37Å; L246-D315 HydrophobicContact CD2-CB 4.02Å
247	L	81.2	Confident	73.8	Confident	41 Å²	41	88.3 Å²	88.3	22%	0.215	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.3	178.9	-61.7	173.8	0	0	0	113.5	I239 A243 E245 Y249 W265 I288 F313	I239-L247 HydrophobicContact CD1-CD1 4.38Å; A243-L247 VanDerWaalsContact O-CB 3.27Å; A243-L247 WeakPolarHBondContact O-CB 3.26Å; A243-L247 VanDerWaalsContact O-CG 3.23Å; A243-L247 WeakPolarHBondContact O-CG 3.48Å; A243-L247 PolarHBondContact O-N 2.9Å; E245-L247 VanDerWaalsContact C-N 3.34Å; E245-L247 PolarHBondContact O-N 3.22Å; L247-Y249 PolarHBondContact O-N 3.06Å; L247-W265 HydrophobicContact CD1-CE3 4.01Å; L247-W265 HydrophobicContact CD1-CZ3 3.87Å; L247-W265 HydrophobicContact CD2-CZ3 4.05Å; L247-I288 HydrophobicContact CD2-CD1 3.96Å; L247-F313 HydrophobicContact CD1-CZ 3.82Å; L247-F313 HydrophobicContact CD2-CE2 4.26Å; L247-F313 HydrophobicContact CD2-CZ 4.26Å; L247-F313 HydrophobicContact CG-CE2 4.1Å; L247-F313 HydrophobicContact CG-CZ 3.86Å
248	N	76.2	Confident	72.6	Confident	109 Å²	109	87.6 Å²	87.6	58%	0.583	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	30.5	-169.7	-87.4	8.3	0	0	0	113.1	Q244 E245 R250	Q244-N248 CarbonylContact O-C 3.6Å; Q244-N248 WeakPolarHBondContact O-CA 3.44Å; Q244-N248 PolarHBondContact O-N 2.9Å; E245-N248 PolarHBondContact O-N 3.42Å; E245-N248 PolarHBondContact O-OD1 3.36Å; N248-R250 PolarHBondContact O-N 2.85Å
249	Y	71.4	Confident	71.4	Confident	46 Å²	46	86.8 Å²	86.8	18%	0.18	42%	0.42	C	S	.	.			trans	-86.2	113	176.2	-177.6	-98	0	0	0	109.6	Q244 L247 K251 L261	Q244-Y249 WeakPolarHBondContact CB-O 3.32Å; Q244-Y249 HydrophobicContact CG-CD1 4.35Å; Q244-Y249 PolarHBondContact O-N 2.85Å; L247-Y249 PolarHBondContact O-N 3.06Å; Y249-K251 HydrophobicContact CE1-CB 4.36Å; Y249-L261 HydrophobicContact CD1-CD1 3.92Å; Y249-L261 HydrophobicContact CD1-CD2 3.93Å; Y249-L261 HydrophobicContact CD1-CG 4.26Å; Y249-L261 HydrophobicContact CD2-CD2 3.34Å; Y249-L261 HydrophobicContact CD2-CG 4.01Å; Y249-L261 HydrophobicContact CE1-CD1 3.45Å; Y249-L261 VanDerWaalsContact CE1-CD1 3.45Å; Y249-L261 HydrophobicContact CE1-CD2 4.04Å; Y249-L261 HydrophobicContact CE1-CG 3.86Å; Y249-L261 HydrophobicContact CE2-CD1 4.14Å; Y249-L261 HydrophobicContact CE2-CD2 3.45Å; Y249-L261 VanDerWaalsContact CE2-CD2 3.45Å; Y249-L261 HydrophobicContact CE2-CG 3.57Å; Y249-L261 HydrophobicContact CG-CD1 4.43Å; Y249-L261 HydrophobicContact CG-CD2 3.57Å; Y249-L261 HydrophobicContact CG-CG 4.31Å; Y249-L261 VanDerWaalsContact CZ-CG 3.46Å
250	R	62.6	Low	70.3	Confident	230 Å²	230	88.7 Å²	88.7	87%	0.868	43%	0.432	S	S	*	.			trans	-98.7	120.3	167.4	-82.8	-176.3	176.1	170.2	-0	108.6	N248 S252	N248-R250 PolarHBondContact O-N 2.85Å; R250-S252 PolarHBondContact O-N 2.79Å
251	K	60	Low	69.3	Low	156 Å²	156	89.2 Å²	89.2	68%	0.678	44%	0.435	S	S	*	.			trans	-56.3	105.1	171.4	-166.6	175	-175.4	177.2	0	109.3	Y249	Y249-K251 HydrophobicContact CE1-CB 4.36Å
252	S	54.9	Low	68.5	Low	62 Å²	62	86.1 Å²	86.1	43%	0.434	42%	0.419	S	S	.	.			trans	-70.5	147.4	170.3	-168.9	0	0	0	0	108.9	R250 D254 D255	R250-S252 PolarHBondContact O-N 2.79Å; S252-D254 PolarHBondContact O-N 2.83Å; S252-D255 PolarHBondContact O-N 2.98Å; S252-D255 VanDerWaalsContact O-N 3.11Å
253	Q	51.8	Low	67.4	Low	200 Å²	200	91.3 Å²	91.3	94%	0.935	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.9	177.5	-81.8	-176.3	-19.3	0	0	112.8
254	D	47.8	Very low	66.5	Low	149 Å²	149	94.5 Å²	94.5	80%	0.797	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-6.6	-179.8	-64.3	-38.4	0	0	0	114.5	S252 E256	S252-D254 PolarHBondContact O-N 2.83Å; D254-E256 PolarHBondContact O-N 2.79Å
255	D	54.6	Low	66.1	Low	50 Å²	50	92.9 Å²	92.9	27%	0.267	46%	0.455	S	S	.	.			trans	-84.4	68.3	174.9	-87.7	-49.4	0	0	0	110.1	S252 K257 T260	S252-D255 PolarHBondContact O-N 2.98Å; S252-D255 VanDerWaalsContact O-N 3.11Å; D255-K257 PolarHBondContact O-N 2.87Å; D255-T260 PolarHBondContact OD1-OG1 3.4Å
256	E	52	Low	65.5	Low	192 Å²	192	89.3 Å²	89.3	90%	0.897	45%	0.446	S	S	*	.			trans	-70	-8.6	174.5	-137.1	-177.4	-165.8	0	0	112.3	D254	D254-E256 PolarHBondContact O-N 2.79Å
257	K	55	Low	64.8	Low	152 Å²	152	95.9 Å²	95.9	66%	0.661	48%	0.476	S	S	*	.			trans	-124	119.6	179.7	-65.1	-177.9	-179.4	176.6	0	111.2	D255 S259 T260	D255-K257 PolarHBondContact O-N 2.87Å; K257-S259 VanDerWaalsContact CB-OG 3.26Å; K257-S259 WeakPolarHBondContact CB-OG 3.33Å; K257-S259 PolarHBondContact O-N 2.82Å; K257-T260 PolarHBondContact O-OG1 2.86Å
258	L	64.4	Low	64.4	Low	67 Å²	67	95.9 Å²	95.9	35%	0.351	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-2.8	165.7	-68.1	160.5	0	0	0	113.5	V236 I239 T260 L261 S262	V236-L258 HydrophobicContact CB-CB 4.42Å; V236-L258 HydrophobicContact CG1-CD2 4.27Å; V236-L258 WeakPolarHBondContact O-CB 3.23Å; V236-L258 WeakPolarHBondContact O-CD1 3.27Å; I239-L258 HydrophobicContact CG2-CD2 4.21Å; L258-T260 PolarHBondContact O-N 3.43Å; L258-L261 HydrophobicContact CD2-CD1 3.9Å; L258-L261 WeakPolarHBondContact O-CB 3.48Å; L258-L261 PolarHBondContact O-N 3.01Å; L258-S262 PolarHBondContact O-N 2.96Å; L258-S262 PolarHBondContact O-OG 3.11Å; L258-S262 VanDerWaalsContact O-OG 3.09Å
259	S	63.1	Low	64.6	Low	43 Å²	43	90.8 Å²	90.8	30%	0.301	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-33.1	179.4	56.8	0	0	0	0	114	K257 L261 S262 H263	K257-S259 VanDerWaalsContact CB-OG 3.26Å; K257-S259 WeakPolarHBondContact CB-OG 3.33Å; K257-S259 PolarHBondContact O-N 2.82Å; S259-L261 VanDerWaalsContact C-N 3.3Å; S259-S262 WeakPolarHBondContact O-CB 3.41Å; S259-S262 PolarHBondContact O-N 2.83Å; S259-H263 PolarHBondContact O-CD2 3.19Å; S259-H263 PolarHBondContact O-N 2.85Å
260	T	65.2	Low	65	Low	61 Å²	61	93 Å²	93	37%	0.374	47%	0.465	S	S	.	.	H	α-helix	trans	-65.9	-37.6	175.2	44.8	0	0	0	0	111.2	D255 K257 L258 S264	D255-T260 PolarHBondContact OD1-OG1 3.4Å; K257-T260 PolarHBondContact O-OG1 2.86Å; L258-T260 PolarHBondContact O-N 3.43Å; T260-S264 PolarHBondContact O-N 3.11Å; T260-S264 PolarHBondContact O-OG 2.91Å; T260-S264 VanDerWaalsContact O-OG 3.11Å
261	L	70.8	Confident	66	Low	12 Å²	12	82.5 Å²	82.5	6%	0.063	43%	0.427	C	S	.	.	H	α-helix	trans	-66.8	-39.7	170.2	-80.4	172.8	0	0	0	112.4	I239 Y249 L258 S259 H263 S264 W265	I239-L261 HydrophobicContact CD1-CD1 4.24Å; I239-L261 HydrophobicContact CG2-CD1 4.24Å; Y249-L261 HydrophobicContact CD1-CD1 3.92Å; Y249-L261 HydrophobicContact CD1-CD2 3.93Å; Y249-L261 HydrophobicContact CD1-CG 4.26Å; Y249-L261 HydrophobicContact CD2-CD2 3.34Å; Y249-L261 HydrophobicContact CD2-CG 4.01Å; Y249-L261 HydrophobicContact CE1-CD1 3.45Å; Y249-L261 VanDerWaalsContact CE1-CD1 3.45Å; Y249-L261 HydrophobicContact CE1-CD2 4.04Å; Y249-L261 HydrophobicContact CE1-CG 3.86Å; Y249-L261 HydrophobicContact CE2-CD1 4.14Å; Y249-L261 HydrophobicContact CE2-CD2 3.45Å; Y249-L261 VanDerWaalsContact CE2-CD2 3.45Å; Y249-L261 HydrophobicContact CE2-CG 3.57Å; Y249-L261 HydrophobicContact CG-CD1 4.43Å; Y249-L261 HydrophobicContact CG-CD2 3.57Å; Y249-L261 HydrophobicContact CG-CG 4.31Å; Y249-L261 VanDerWaalsContact CZ-CG 3.46Å; L258-L261 HydrophobicContact CD2-CD1 3.9Å; L258-L261 WeakPolarHBondContact O-CB 3.48Å; L258-L261 PolarHBondContact O-N 3.01Å; S259-L261 VanDerWaalsContact C-N 3.3Å; L261-H263 VanDerWaalsContact C-N 3.32Å; L261-H263 PolarHBondContact O-N 3.15Å; L261-S264 PolarHBondContact O-N 3.4Å; L261-W265 VanDerWaalsContact O-CB 3.24Å; L261-W265 WeakPolarHBondContact O-CB 3.13Å; L261-W265 PolarHBondContact O-N 3.07Å
262	S	71.2	Confident	66.9	Low	5 Å²	5	78.7 Å²	78.7	4%	0.035	42%	0.42	C	S	.	.	H	α-helix	trans	-55.8	-46.7	177.1	-53.5	0	0	0	0	112	E235 V236 L258 S259 W265 S266	E235-S262 WeakPolarHBondContact CA-OG 3.11Å; E235-S262 WeakPolarHBondContact OE2-CB 3.43Å; E235-S262 PolarHBondContact OE2-OG 3.46Å; V236-S262 PolarHBondContact N-OG 2.95Å; L258-S262 PolarHBondContact O-N 2.96Å; L258-S262 PolarHBondContact O-OG 3.11Å; L258-S262 VanDerWaalsContact O-OG 3.09Å; S259-S262 WeakPolarHBondContact O-CB 3.41Å; S259-S262 PolarHBondContact O-N 2.83Å; S262-W265 PolarHBondContact O-N 3.24Å; S262-S266 VanDerWaalsContact O-CB 3.31Å; S262-S266 WeakPolarHBondContact O-CB 3.37Å; S262-S266 PolarHBondContact O-N 3.5Å; S262-S266 PolarHBondContact O-OG 2.92Å
263	H	68.7	Low	68.1	Low	122 Å²	122	79.4 Å²	79.4	57%	0.565	42%	0.416	S	S	*	.	H	α-helix	trans	-63.3	-44.9	176.9	-74.4	-51.6	0	0	0	112.5	S259 L261 S266 Q267	S259-H263 PolarHBondContact O-CD2 3.19Å; S259-H263 PolarHBondContact O-N 2.85Å; L261-H263 VanDerWaalsContact C-N 3.32Å; L261-H263 PolarHBondContact O-N 3.15Å; H263-S266 PolarHBondContact O-N 3.42Å; H263-S266 PolarHBondContact O-OG 3.45Å; H263-Q267 WeakPolarHBondContact O-CG 3.26Å; H263-Q267 PolarHBondContact O-N 2.86Å
264	S	71	Confident	69.9	Low	67 Å²	67	69.9 Å²	69.9	47%	0.469	37%	0.372	S	S	.	.	H	α-helix	trans	-66.6	-40.4	-179.7	-55.9	0	0	0	0	111.5	T260 L261 Q267 V268	T260-S264 PolarHBondContact O-N 3.11Å; T260-S264 PolarHBondContact O-OG 2.91Å; T260-S264 VanDerWaalsContact O-OG 3.11Å; L261-S264 PolarHBondContact O-N 3.4Å; S264-Q267 PolarHBondContact O-N 3.29Å; S264-V268 WeakPolarHBondContact O-CG2 3.48Å; S264-V268 PolarHBondContact O-N 3.19Å
265	W	77.2	Confident	71.8	Confident	10 Å²	10	64.3 Å²	64.3	4%	0.038	34%	0.342	C	S	.	.	H	α-helix	trans	-67.9	-41.2	178.4	-170.4	-110.8	0	0	0	111.9	V228 V236 L247 L261 S262 Q267 V268 V269 S311 F313	V228-W265 HydrophobicContact CB-CD2 4.4Å; V228-W265 HydrophobicContact CB-CZ2 4.19Å; V228-W265 HydrophobicContact CG1-CD2 4.06Å; V228-W265 HydrophobicContact CG1-CG 4.05Å; V228-W265 HydrophobicContact CG2-CD2 4.35Å; V228-W265 HydrophobicContact CG2-CE3 4.4Å; V228-W265 HydrophobicContact CG2-CH2 4.48Å; V228-W265 HydrophobicContact CG2-CZ2 4.42Å; V228-W265 HydrophobicContact CG2-CZ3 4.47Å; V236-W265 HydrophobicContact CG2-CB 4.26Å; L247-W265 HydrophobicContact CD1-CE3 4.01Å; L247-W265 HydrophobicContact CD1-CZ3 3.87Å; L247-W265 HydrophobicContact CD2-CZ3 4.05Å; L261-W265 VanDerWaalsContact O-CB 3.24Å; L261-W265 WeakPolarHBondContact O-CB 3.13Å; L261-W265 PolarHBondContact O-N 3.07Å; S262-W265 PolarHBondContact O-N 3.24Å; W265-Q267 PolarHBondContact O-N 2.79Å; W265-V268 HydrophobicContact CE3-CB 4.44Å; W265-V268 HydrophobicContact CZ3-CG1 4.27Å; W265-V268 PolarHBondContact O-N 3.08Å; W265-V269 HydrophobicContact CH2-CG2 3.73Å; W265-V269 HydrophobicContact CZ2-CB 4.1Å; W265-V269 HydrophobicContact CZ2-CG2 3.45Å; W265-V269 VanDerWaalsContact CZ2-CG2 3.45Å; W265-V269 HydrophobicContact CZ3-CG2 4.37Å; W265-V269 PolarHBondContact O-N 2.89Å; W265-S311 VanDerWaalsContact CZ2-CB 3.49Å; W265-F313 AromaticContact CH2-CD1 3.54Å; W265-F313 HydrophobicContact CH2-CD1 3.54Å; W265-F313 AromaticContact CH2-CE1 3.48Å; W265-F313 HydrophobicContact CH2-CE1 3.48Å; W265-F313 VanDerWaalsContact CH2-CE1 3.48Å; W265-F313 HydrophobicContact CH2-CG 4.35Å; W265-F313 HydrophobicContact CH2-CZ 4.23Å; W265-F313 HydrophobicContact CZ2-CD1 4.29Å; W265-F313 HydrophobicContact CZ2-CE1 4.3Å; W265-F313 HydrophobicContact CZ3-CD1 4.32Å; W265-F313 AromaticContact CZ3-CE1 3.87Å; W265-F313 HydrophobicContact CZ3-CE1 3.87Å; W265-F313 HydrophobicContact CZ3-CZ 4.21Å
266	S	71.4	Confident	73.3	Confident	71 Å²	71	72.7 Å²	72.7	50%	0.497	37%	0.37	S	S	.	.	H	α-helix	trans	-62.2	-23.5	175.6	69.5	0	0	0	0	113.7	S262 H263	S262-S266 VanDerWaalsContact O-CB 3.31Å; S262-S266 WeakPolarHBondContact O-CB 3.37Å; S262-S266 PolarHBondContact O-N 3.5Å; S262-S266 PolarHBondContact O-OG 2.92Å; H263-S266 PolarHBondContact O-N 3.42Å; H263-S266 PolarHBondContact O-OG 3.45Å
267	Q	71.1	Confident	74.9	Confident	168 Å²	168	67.6 Å²	67.6	79%	0.785	35%	0.349	S	S	*	.	H	α-helix	trans	-80.5	-23.8	172.5	-69.4	177.8	-2.1	0	0	113	H263 S264 W265	H263-Q267 WeakPolarHBondContact O-CG 3.26Å; H263-Q267 PolarHBondContact O-N 2.86Å; S264-Q267 PolarHBondContact O-N 3.29Å; W265-Q267 PolarHBondContact O-N 2.79Å
268	V	73	Confident	76.4	Confident	42 Å²	42	60.6 Å²	60.6	26%	0.255	32%	0.32	S	S	.	.	H	α-helix	trans	-89.9	-43.6	-179.1	177.5	0	0	0	0	110.9	S264 W265 I286 I288	S264-V268 WeakPolarHBondContact O-CG2 3.48Å; S264-V268 PolarHBondContact O-N 3.19Å; W265-V268 HydrophobicContact CE3-CB 4.44Å; W265-V268 HydrophobicContact CZ3-CG1 4.27Å; W265-V268 PolarHBondContact O-N 3.08Å; V268-I286 HydrophobicContact CG1-CG2 4.36Å; V268-I286 WeakPolarHBondContact O-CD1 3.26Å; V268-I288 HydrophobicContact CG1-CD1 3.44Å; V268-I288 VanDerWaalsContact CG1-CD1 3.44Å; V268-I288 HydrophobicContact CG1-CG1 4.29Å; V268-I288 HydrophobicContact CG2-CD1 4.24Å
269	V	79	Confident	77.6	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.012	32%	0.32	C	S	.	.	S	Bend	trans	-130.7	122.7	-177.1	-175.3	0	0	0	0	109.2	W265 V271 I286 I295	W265-V269 HydrophobicContact CH2-CG2 3.73Å; W265-V269 HydrophobicContact CZ2-CB 4.1Å; W265-V269 HydrophobicContact CZ2-CG2 3.45Å; W265-V269 VanDerWaalsContact CZ2-CG2 3.45Å; W265-V269 HydrophobicContact CZ3-CG2 4.37Å; W265-V269 PolarHBondContact O-N 2.89Å; V269-V271 HydrophobicContact CB-CG2 4.37Å; V269-V271 HydrophobicContact CG1-CG2 4.11Å; V269-V271 PolarHBondContact O-N 3.49Å; V269-I286 HydrophobicContact CG2-CD1 4.32Å; V269-I295 HydrophobicContact CG1-CG2 4.5Å; V269-I295 HydrophobicContact CG2-CD1 3.6Å; V269-I295 HydrophobicContact CG2-CG2 4.08Å
270	D	79.7	Confident	79	Confident	91 Å²	91	61 Å²	61	49%	0.487	32%	0.324	S	S	.	.			trans	-78.1	92.4	172.3	-171.4	5.4	0	0	0	110.5	S272	D270-S272 WeakPolarHBondContact OD1-CB 3.22Å; D270-S272 PolarHBondContact OD1-N 3.49Å; D270-S272 PolarHBondContact OD1-OG 3.13Å
271	V	83.9	Confident	80.2	Confident	10 Å²	10	62.2 Å²	62.2	6%	0.061	32%	0.322	C	S	.	.			trans	-79.3	-11.5	178.3	-162	0	0	0	0	111.8	V230 V269 E273 V274 L275 T297 A309	V230-V271 HydrophobicContact CG2-CB 4.47Å; V230-V271 HydrophobicContact CG2-CG1 3.67Å; V269-V271 HydrophobicContact CB-CG2 4.37Å; V269-V271 HydrophobicContact CG1-CG2 4.11Å; V269-V271 PolarHBondContact O-N 3.49Å; V271-E273 VanDerWaalsContact C-N 3.34Å; V271-E273 PolarHBondContact O-N 2.82Å; V271-V274 PolarHBondContact O-N 3.5Å; V271-L275 HydrophobicContact CG1-CD1 4.25Å; V271-L275 HydrophobicContact CG1-CG 4.13Å; V271-L275 WeakPolarHBondContact O-CG 3.2Å; V271-L275 PolarHBondContact O-N 2.93Å; V271-T297 HydrophobicContact CG1-CG2 3.99Å; V271-A309 HydrophobicContact CG1-CB 3.54Å
272	S	79.2	Confident	81.1	Confident	76 Å²	76	69.9 Å²	69.9	53%	0.531	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-38.9	-172.5	-40.4	0	0	0	0	112.2	D270 R276	D270-S272 WeakPolarHBondContact OD1-CB 3.22Å; D270-S272 PolarHBondContact OD1-N 3.49Å; D270-S272 PolarHBondContact OD1-OG 3.13Å; S272-R276 VanDerWaalsContact O-CB 3.24Å; S272-R276 WeakPolarHBondContact O-CB 3.41Å; S272-R276 PolarHBondContact O-N 3.46Å
273	E	80.8	Confident	81.9	Confident	77 Å²	77	74.5 Å²	74.5	36%	0.36	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-48.3	176.6	-65.8	-168.1	163.9	0	0	110.8	V271 L275 R276 D277 R281	V271-E273 VanDerWaalsContact C-N 3.34Å; V271-E273 PolarHBondContact O-N 2.82Å; E273-L275 VanDerWaalsContact C-N 3.33Å; E273-L275 PolarHBondContact O-N 2.98Å; E273-R276 PolarHBondContact O-N 3.16Å; E273-D277 VanDerWaalsContact O-CG 3.3Å; E273-D277 PolarHBondContact O-N 2.82Å; E273-R281 IonicContact OE2-CZ 3.49Å; E273-R281 IonicContact OE2-NH1 2.81Å; E273-R281 PolarHBondContact OE2-NH1 3.03Å; E273-R281 IonicContact OE2-NH2 3.61Å; E273-R281 PolarHBondContact OE2-NH2 3.13Å
274	V	88.3	Confident	82.9	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-39.2	-179.2	-178.3	0	0	0	0	112.1	V271 R276 G278 T279 R281 T297 P299 A309	V271-V274 PolarHBondContact O-N 3.5Å; V274-R276 VanDerWaalsContact C-N 3.34Å; V274-G278 VanDerWaalsContact O-CA 3.23Å; V274-G278 WeakPolarHBondContact O-CA 3.44Å; V274-G278 PolarHBondContact O-N 3.23Å; V274-T279 WeakPolarHBondContact CG2-O 3.31Å; V274-R281 HydrophobicContact CG2-CB 4.3Å; V274-R281 HydrophobicContact CG2-CG 3.71Å; V274-T297 HydrophobicContact CB-CG2 4.2Å; V274-T297 HydrophobicContact CG1-CG2 4.17Å; V274-T297 HydrophobicContact CG2-CG2 3.85Å; V274-P299 HydrophobicContact CG1-CB 4.03Å; V274-P299 HydrophobicContact CG1-CG 4.34Å; V274-A309 HydrophobicContact CG1-CB 4.22Å
275	L	89	Confident	83.7	Confident	32 Å²	32	74.4 Å²	74.4	17%	0.168	37%	0.367	C	S	.	.	H	α-helix	trans	-68.6	-33.6	176	-68.9	172.9	0	0	0	112.1	V230 V271 E273 I306 G308 A309	V230-L275 HydrophobicContact CG2-CD1 4.43Å; V271-L275 HydrophobicContact CG1-CD1 4.25Å; V271-L275 HydrophobicContact CG1-CG 4.13Å; V271-L275 WeakPolarHBondContact O-CG 3.2Å; V271-L275 PolarHBondContact O-N 2.93Å; E273-L275 VanDerWaalsContact C-N 3.33Å; E273-L275 PolarHBondContact O-N 2.98Å; L275-I306 HydrophobicContact CD2-CG2 4.32Å; L275-G308 VanDerWaalsContact CD2-C 3.44Å; L275-A309 HydrophobicContact CD2-CB 3.96Å; L275-A309 HydrophobicContact CG-CB 4.5Å
276	R	85.7	Confident	84.2	Confident	227 Å²	227	76 Å²	76	86%	0.857	38%	0.375	S	S	*	.	H	α-helix	trans	-80.4	-48.6	-176	178.3	-178.5	159.1	-163	-7.2	113.3	S272 E273 V274	S272-R276 VanDerWaalsContact O-CB 3.24Å; S272-R276 WeakPolarHBondContact O-CB 3.41Å; S272-R276 PolarHBondContact O-N 3.46Å; E273-R276 PolarHBondContact O-N 3.16Å; V274-R276 VanDerWaalsContact C-N 3.34Å
277	D	85.6	Confident	84.7	Confident	85 Å²	85	76.8 Å²	76.8	46%	0.455	38%	0.377	S	S	.	.	H	α-helix	trans	-104.1	-12	-173.5	69.4	14.3	0	0	0	113.6	E273 T279	E273-D277 VanDerWaalsContact O-CG 3.3Å; E273-D277 PolarHBondContact O-N 2.82Å; D277-T279 HydrophobicContact CB-CG2 4.25Å; D277-T279 PolarHBondContact O-N 3.49Å; D277-T279 WeakPolarHBondContact OD1-CA 3.23Å; D277-T279 VanDerWaalsContact OD1-CB 3.26Å; D277-T279 WeakPolarHBondContact OD1-CB 3.48Å; D277-T279 WeakPolarHBondContact OD1-CG2 3.33Å; D277-T279 PolarHBondContact OD1-N 3.46Å; D277-T279 PolarHBondContact OD1-OG1 3.37Å; D277-T279 PolarHBondContact OD2-OG1 2.88Å; D277-T279 VanDerWaalsContact OD2-OG1 3.05Å
278	G	86.7	Confident	85.1	Confident	5 Å²	5	70.8 Å²	70.8	5%	0.052	35%	0.35	C	S	.	.			trans	68.3	18.6	-178.7	0	0	0	0	0	114	V274 P299 R301	V274-G278 VanDerWaalsContact O-CA 3.23Å; V274-G278 WeakPolarHBondContact O-CA 3.44Å; V274-G278 PolarHBondContact O-N 3.23Å; G278-P299 WeakPolarHBondContact O-CG 3.2Å; G278-R301 PolarHBondContact O-NH2 3.24Å; G278-R301 VanDerWaalsContact O-NH2 3.12Å
279	T	89.7	Confident	85.2	Confident	59 Å²	59	76.1 Å²	76.1	36%	0.362	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-87.5	128.6	175.8	68.7	0	0	0	0	109.7	V274 D277	V274-T279 WeakPolarHBondContact CG2-O 3.31Å; D277-T279 HydrophobicContact CB-CG2 4.25Å; D277-T279 PolarHBondContact O-N 3.49Å; D277-T279 WeakPolarHBondContact OD1-CA 3.23Å; D277-T279 VanDerWaalsContact OD1-CB 3.26Å; D277-T279 WeakPolarHBondContact OD1-CB 3.48Å; D277-T279 WeakPolarHBondContact OD1-CG2 3.33Å; D277-T279 PolarHBondContact OD1-N 3.46Å; D277-T279 PolarHBondContact OD1-OG1 3.37Å; D277-T279 PolarHBondContact OD2-OG1 2.88Å; D277-T279 VanDerWaalsContact OD2-OG1 3.05Å
280	P	91.2	Very high	85.1	Confident	58 Å²	58	83.1 Å²	83.1	38%	0.377	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-73.5	134.8	176.7	29	-32.7	0	0	0	110.7	T297 V298	P280-T297 CarbonylContact C-O 3.59Å; P280-T297 WeakPolarHBondContact CA-O 3.43Å; P280-V298 HydrophobicContact CB-CG1 4.05Å
281	R	90.7	Very high	85.3	Confident	88 Å²	88	83.3 Å²	83.3	33%	0.332	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.5	168.5	-65	-65.8	-104.8	-116.2	-15.6	109	E273 V274 E284 N296 T297	E273-R281 IonicContact OE2-CZ 3.49Å; E273-R281 IonicContact OE2-NH1 2.81Å; E273-R281 PolarHBondContact OE2-NH1 3.03Å; E273-R281 IonicContact OE2-NH2 3.61Å; E273-R281 PolarHBondContact OE2-NH2 3.13Å; V274-R281 HydrophobicContact CG2-CB 4.3Å; V274-R281 HydrophobicContact CG2-CG 3.71Å; R281-E284 IonicContact CZ-OE1 3.74Å; R281-E284 IonicContact NE-OE1 2.71Å; R281-E284 PolarHBondContact NE-OE1 3.43Å; R281-E284 IonicContact NH2-OE1 3.86Å; R281-N296 CarbonylContact O-C 3.48Å; R281-N296 WeakPolarHBondContact O-CA 3.39Å; R281-T297 PolarHBondContact N-O 3.41Å; R281-T297 PolarHBondContact O-N 3.25Å
282	R	89.7	Confident	85.5	Confident	172 Å²	172	83.3 Å²	83.3	65%	0.649	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	142	-172.6	-64.8	-175.4	-179.7	179.9	0	111	E284 N296	R282-E284 VanDerWaalsContact C-N 3.25Å; R282-E284 PolarHBondContact O-N 3.47Å; R282-N296 WeakPolarHBondContact CA-OD1 3.43Å; R282-N296 WeakPolarHBondContact CB-OD1 3.43Å
283	D	88.4	Confident	86	Confident	102 Å²	102	79.8 Å²	79.8	55%	0.545	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.2	38.7	171.9	-56.8	-41.7	0	0	0	113.5	L294 I295 N296	D283-L294 HydrophobicContact CB-CD1 3.95Å; D283-L294 HydrophobicContact CB-CD2 4.47Å; D283-L294 HydrophobicContact CB-CG 4.38Å; D283-L294 WeakPolarHBondContact O-CD1 3.48Å; D283-I295 PolarHBondContact N-O 3.44Å; D283-N296 PolarHBondContact N-OD1 3.42Å; D283-N296 PolarHBondContact OD1-ND2 3.38Å; D283-N296 PolarHBondContact OD1-OD1 2.87Å
284	E	89.3	Confident	86.5	Confident	59 Å²	59	77.6 Å²	77.6	28%	0.276	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	126.4	173.7	-71.8	-176.4	152.1	0	0	109.9	R281 R282 L294 I295	R281-E284 IonicContact CZ-OE1 3.74Å; R281-E284 IonicContact NE-OE1 2.71Å; R281-E284 PolarHBondContact NE-OE1 3.43Å; R281-E284 IonicContact NH2-OE1 3.86Å; R282-E284 VanDerWaalsContact C-N 3.25Å; R282-E284 PolarHBondContact O-N 3.47Å; E284-L294 WeakPolarHBondContact O-CA 3.16Å; E284-I295 PolarHBondContact N-O 2.85Å; E284-I295 PolarHBondContact O-N 3.07Å
285	E	89	Confident	86.7	Confident	129 Å²	129	77.6 Å²	77.6	60%	0.603	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	121.2	177.9	-71.3	-171.5	-172.6	0	0	111.1	L292 L293 L294	E285-L292 HydrophobicContact CB-CD1 4.13Å; E285-L293 WeakPolarHBondContact CA-O 3.39Å; E285-L294 HydrophobicContact CG-CD1 3.71Å
286	I	85.7	Confident	86.9	Confident	42 Å²	42	78 Å²	78	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.3	176.8	-54.2	-164.3	0	0	0	109.1	V268 V269 I288 L293 I295	V268-I286 HydrophobicContact CG1-CG2 4.36Å; V268-I286 WeakPolarHBondContact O-CD1 3.26Å; V269-I286 HydrophobicContact CG2-CD1 4.32Å; I286-I288 HydrophobicContact CG2-CG1 4.06Å; I286-L293 PolarHBondContact N-O 3.48Å; I286-L293 PolarHBondContact O-N 2.94Å; I286-I295 HydrophobicContact CB-CD1 4Å; I286-I295 HydrophobicContact CD1-CD1 3.64Å; I286-I295 HydrophobicContact CG1-CD1 3.85Å; I286-I295 HydrophobicContact CG1-CG1 4.47Å
287	T	83.4	Confident	87.3	Confident	89 Å²	89	67.3 Å²	67.3	55%	0.546	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.5	174.5	-54.3	0	0	0	0	109.1	R291	T287-R291 CarbonylContact C-O 3.49Å; T287-R291 WeakPolarHBondContact CA-O 3.47Å
288	I	78.6	Confident	87.7	Confident	41 Å²	41	66.1 Å²	66.1	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	112.8	175	-54.8	-175.3	0	0	0	107.7	L247 V268 I286 D290 R291 L293	L247-I288 HydrophobicContact CD2-CD1 3.96Å; V268-I288 HydrophobicContact CG1-CD1 3.44Å; V268-I288 VanDerWaalsContact CG1-CD1 3.44Å; V268-I288 HydrophobicContact CG1-CG1 4.29Å; V268-I288 HydrophobicContact CG2-CD1 4.24Å; I286-I288 HydrophobicContact CG2-CG1 4.06Å; I288-D290 PolarHBondContact O-N 3.03Å; I288-D290 VanDerWaalsContact O-N 3.12Å; I288-R291 PolarHBondContact N-O 3.36Å; I288-R291 PolarHBondContact O-N 3.44Å; I288-L293 HydrophobicContact CB-CD1 4.45Å; I288-L293 HydrophobicContact CD1-CD1 3.54Å; I288-L293 HydrophobicContact CG1-CD1 4.05Å
289	K	76.2	Confident	88.1	Confident	155 Å²	155	67.1 Å²	67.1	67%	0.674	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	-110.4	-170	-56.3	174.1	-178.6	175.2	0	109.8
290	D	76.6	Confident	88.3	Confident	148 Å²	148	66.5 Å²	66.5	79%	0.791	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	11.5	-178.9	-51.8	-49.6	0	0	0	113	I288	I288-D290 PolarHBondContact O-N 3.03Å; I288-D290 VanDerWaalsContact O-N 3.12Å
291	R	83	Confident	88.3	Confident	95 Å²	95	70.9 Å²	70.9	36%	0.358	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.7	-179.1	-64	-176.4	-177.4	172.2	-2.7	111.1	L246 T287 I288 L293 T317	L246-R291 PolarHBondContact O-NH1 2.9Å; T287-R291 CarbonylContact C-O 3.49Å; T287-R291 WeakPolarHBondContact CA-O 3.47Å; I288-R291 PolarHBondContact N-O 3.36Å; I288-R291 PolarHBondContact O-N 3.44Å; R291-L293 HydrophobicContact CB-CD2 4.4Å; R291-T317 WeakPolarHBondContact CA-OG1 3.29Å
292	L	88.1	Confident	88.2	Confident	11 Å²	11	69.3 Å²	69.3	6%	0.058	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.4	167.9	-174.8	72.9	0	0	0	109	E285 K316 T317 R320	E285-L292 HydrophobicContact CB-CD1 4.13Å; L292-K316 HydrophobicContact CD2-CB 4.09Å; L292-K316 HydrophobicContact CG-CB 4.48Å; L292-K316 PolarHBondContact O-N 3.39Å; L292-T317 PolarHBondContact N-OG1 3.28Å; L292-R320 HydrophobicContact CD2-CB 3.99Å; L292-R320 HydrophobicContact CD2-CG 4.44Å
293	L	90.3	Very high	88	Confident	2 Å²	2	69 Å²	69	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	131.1	175.4	-57.2	-176.9	0	0	0	109.7	E285 I286 I288 R291 I295 F313 R314 D315	E285-L293 WeakPolarHBondContact CA-O 3.39Å; I286-L293 PolarHBondContact N-O 3.48Å; I286-L293 PolarHBondContact O-N 2.94Å; I288-L293 HydrophobicContact CB-CD1 4.45Å; I288-L293 HydrophobicContact CD1-CD1 3.54Å; I288-L293 HydrophobicContact CG1-CD1 4.05Å; R291-L293 HydrophobicContact CB-CD2 4.4Å; L293-I295 HydrophobicContact CB-CG1 4.27Å; L293-F313 HydrophobicContact CD1-CD2 3.92Å; L293-F313 HydrophobicContact CD1-CE2 4.34Å; L293-R314 WeakPolarHBondContact CA-O 3.38Å; L293-D315 HydrophobicContact CD2-CB 4.19Å
294	L	92.3	Very high	87.9	Confident	31 Å²	31	67.1 Å²	67.1	16%	0.162	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.6	168.8	-170.8	73.9	0	0	0	108.4	D283 E284 E285 F313 R314 K316	D283-L294 HydrophobicContact CB-CD1 3.95Å; D283-L294 HydrophobicContact CB-CD2 4.47Å; D283-L294 HydrophobicContact CB-CG 4.38Å; D283-L294 WeakPolarHBondContact O-CD1 3.48Å; E284-L294 WeakPolarHBondContact O-CA 3.16Å; E285-L294 HydrophobicContact CG-CD1 3.71Å; L294-F313 CarbonylContact O-C 3.54Å; L294-F313 WeakPolarHBondContact O-CA 3.26Å; L294-R314 PolarHBondContact N-O 3.5Å; L294-R314 PolarHBondContact O-N 3.11Å; L294-K316 HydrophobicContact CB-CG 3.8Å; L294-K316 HydrophobicContact CD2-CG 4.5Å
295	I	92.5	Very high	88	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.8	-169.3	-50	-171.2	0	0	0	110.4	V269 D283 E284 I286 L293 T312 F313	V269-I295 HydrophobicContact CG1-CG2 4.5Å; V269-I295 HydrophobicContact CG2-CD1 3.6Å; V269-I295 HydrophobicContact CG2-CG2 4.08Å; D283-I295 PolarHBondContact N-O 3.44Å; E284-I295 PolarHBondContact N-O 2.85Å; E284-I295 PolarHBondContact O-N 3.07Å; I286-I295 HydrophobicContact CB-CD1 4Å; I286-I295 HydrophobicContact CD1-CD1 3.64Å; I286-I295 HydrophobicContact CG1-CD1 3.85Å; I286-I295 HydrophobicContact CG1-CG1 4.47Å; L293-I295 HydrophobicContact CB-CG1 4.27Å; I295-T312 CarbonylContact C-O 3.46Å; I295-T312 WeakPolarHBondContact CA-O 3.46Å; I295-F313 HydrophobicContact CB-CB 4.32Å; I295-F313 HydrophobicContact CD1-CB 4.48Å; I295-F313 HydrophobicContact CG1-CB 3.78Å; I295-F313 HydrophobicContact CG2-CB 4.4Å
296	N	93.1	Very high	88.1	Confident	40 Å²	40	64.7 Å²	64.7	21%	0.214	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.1	174.5	-77.1	-61.9	0	0	0	109.1	R281 R282 D283 S311 T312	R281-N296 CarbonylContact O-C 3.48Å; R281-N296 WeakPolarHBondContact O-CA 3.39Å; R282-N296 WeakPolarHBondContact CA-OD1 3.43Å; R282-N296 WeakPolarHBondContact CB-OD1 3.43Å; D283-N296 PolarHBondContact N-OD1 3.42Å; D283-N296 PolarHBondContact OD1-ND2 3.38Å; D283-N296 PolarHBondContact OD1-OD1 2.87Å; N296-S311 CarbonylContact O-C 3.57Å; N296-S311 VanDerWaalsContact O-CA 3.26Å; N296-S311 WeakPolarHBondContact O-CA 3.36Å; N296-T312 PolarHBondContact N-O 3.37Å; N296-T312 PolarHBondContact O-N 3.19Å
297	T	93.8	Very high	88.4	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.012	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.8	178.7	-57.2	0	0	0	0	110.4	V271 V274 P280 R281 A309 I310 S311	V271-T297 HydrophobicContact CG1-CG2 3.99Å; V274-T297 HydrophobicContact CB-CG2 4.2Å; V274-T297 HydrophobicContact CG1-CG2 4.17Å; V274-T297 HydrophobicContact CG2-CG2 3.85Å; P280-T297 CarbonylContact C-O 3.59Å; P280-T297 WeakPolarHBondContact CA-O 3.43Å; R281-T297 PolarHBondContact N-O 3.41Å; R281-T297 PolarHBondContact O-N 3.25Å; T297-A309 HydrophobicContact CG2-CB 4.17Å; T297-I310 WeakPolarHBondContact CA-O 3.34Å; T297-S311 WeakPolarHBondContact CG2-OG 3.42Å; T297-S311 PolarHBondContact OG1-OG 3.49Å
298	V	93.8	Very high	88.9	Confident	60 Å²	60	62.6 Å²	62.6	36%	0.364	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140	-177.2	-63.6	0	0	0	0	111.4	P280 A309 I310	P280-V298 HydrophobicContact CB-CG1 4.05Å; V298-A309 CarbonylContact O-C 3.51Å; V298-A309 VanDerWaalsContact O-CA 3.31Å; V298-A309 WeakPolarHBondContact O-CA 3.39Å; V298-I310 HydrophobicContact CG2-CB 4.3Å; V298-I310 PolarHBondContact N-O 3.42Å; V298-I310 PolarHBondContact O-N 3.06Å
299	P	94.7	Very high	89.6	Confident	26 Å²	26	60.7 Å²	60.7	17%	0.169	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	138.6	178.3	30.5	-34.7	0	0	0	111.3	V274 G278 I306	V274-P299 HydrophobicContact CG1-CB 4.03Å; V274-P299 HydrophobicContact CG1-CG 4.34Å; G278-P299 WeakPolarHBondContact O-CG 3.2Å; P299-I306 HydrophobicContact CB-CD1 4.48Å; P299-I306 HydrophobicContact CB-CG1 4.4Å; P299-I306 HydrophobicContact CB-CG2 4.18Å
300	V	93.9	Very high	90.4	Very high	46 Å²	46	56 Å²	56	28%	0.279	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.2	173.2	-176.3	0	0	0	0	108.8	I306 I307 G308 I310	V300-I306 WeakPolarHBondContact O-CA 3.32Å; V300-I307 HydrophobicContact CB-CG1 4.22Å; V300-I307 HydrophobicContact CG1-CD1 3.96Å; V300-I307 HydrophobicContact CG1-CG1 3.86Å; V300-I307 WeakPolarHBondContact O-CG1 3.34Å; V300-I307 PolarHBondContact O-N 2.95Å; V300-G308 PolarHBondContact N-O 3.24Å; V300-I310 HydrophobicContact CG2-CB 4.35Å; V300-I310 HydrophobicContact CG2-CD1 3.49Å; V300-I310 VanDerWaalsContact CG2-CD1 3.49Å; V300-I310 HydrophobicContact CG2-CG1 3.51Å
301	R	92.2	Very high	91.3	Very high	150 Å²	150	49 Å²	49	57%	0.566	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.7	-178.5	-59.3	-176.6	-174.4	-165.4	1.1	111.7	G278 V305 I306	G278-R301 PolarHBondContact O-NH2 3.24Å; G278-R301 VanDerWaalsContact O-NH2 3.12Å; R301-V305 CarbonylContact C-O 3.55Å; R301-V305 VanDerWaalsContact CA-O 3.23Å; R301-V305 WeakPolarHBondContact CA-O 3.48Å; R301-I306 HydrophobicContact CG-CG1 4.08Å
302	S	88.6	Confident	91.8	Very high	56 Å²	56	46.1 Å²	46.1	39%	0.392	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.2	169.3	-175.6	0	0	0	0	109	G304 V305	S302-G304 PolarHBondContact O-N 3.33Å; S302-G304 VanDerWaalsContact O-N 3.13Å; S302-V305 PolarHBondContact N-O 2.86Å; S302-V305 PolarHBondContact O-N 2.96Å
303	N	85.4	Confident	92	Very high	166 Å²	166	45.7 Å²	45.7	89%	0.888	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	34.6	-174.8	-60.8	-28.9	0	0	0	114.1	V305	N303-V305 VanDerWaalsContact C-N 3.29Å; N303-V305 PolarHBondContact O-N 2.81Å
304	G	86.6	Confident	92	Very high	61 Å²	61	51.8 Å²	51.8	63%	0.629	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	-11.1	-179.1	0	0	0	0	0	115.3	S302	S302-G304 PolarHBondContact O-N 3.33Å; S302-G304 VanDerWaalsContact O-N 3.13Å
305	V	90.3	Very high	92	Very high	95 Å²	95	52.9 Å²	52.9	58%	0.576	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	133.9	177	-176.9	0	0	0	0	109.6	R301 S302 N303 I307	R301-V305 CarbonylContact C-O 3.55Å; R301-V305 VanDerWaalsContact CA-O 3.23Å; R301-V305 WeakPolarHBondContact CA-O 3.48Å; S302-V305 PolarHBondContact N-O 2.86Å; S302-V305 PolarHBondContact O-N 2.96Å; N303-V305 VanDerWaalsContact C-N 3.29Å; N303-V305 PolarHBondContact O-N 2.81Å; V305-I307 PolarHBondContact O-N 3.04Å
306	I	91.5	Very high	91.9	Very high	43 Å²	43	55.6 Å²	55.6	22%	0.221	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	121.4	172.9	-60.1	167.8	0	0	0	107.7	L275 P299 V300 R301 G308	L275-I306 HydrophobicContact CD2-CG2 4.32Å; P299-I306 HydrophobicContact CB-CD1 4.48Å; P299-I306 HydrophobicContact CB-CG1 4.4Å; P299-I306 HydrophobicContact CB-CG2 4.18Å; V300-I306 WeakPolarHBondContact O-CA 3.32Å; R301-I306 HydrophobicContact CG-CG1 4.08Å; I306-G308 WeakPolarHBondContact CG2-O 3.39Å
307	I	92.1	Very high	91.6	Very high	86 Å²	86	54.7 Å²	54.7	44%	0.441	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	2.8	-179.4	57.6	162.4	0	0	0	112.4	D232 V300 V305	D232-I307 PolarHBondContact N-O 2.8Å; V300-I307 HydrophobicContact CB-CG1 4.22Å; V300-I307 HydrophobicContact CG1-CD1 3.96Å; V300-I307 HydrophobicContact CG1-CG1 3.86Å; V300-I307 WeakPolarHBondContact O-CG1 3.34Å; V300-I307 PolarHBondContact O-N 2.95Å; V305-I307 PolarHBondContact O-N 3.04Å
308	G	92.7	Very high	91.2	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.2	-168.5	-175.4	0	0	0	0	0	112.5	V230 L275 V300 I306	V230-G308 CarbonylContact O-C 3.58Å; V230-G308 WeakPolarHBondContact O-CA 3.36Å; L275-G308 VanDerWaalsContact CD2-C 3.44Å; V300-G308 PolarHBondContact N-O 3.24Å; I306-G308 WeakPolarHBondContact CG2-O 3.39Å
309	A	94.1	Very high	90.9	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.008	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	153.1	175.8	0	0	0	0	0	111.1	A229 V230 V271 V274 L275 T297 V298	A229-A309 CarbonylContact C-O 3.37Å; A229-A309 WeakPolarHBondContact CA-O 3.36Å; V230-A309 HydrophobicContact CG2-CB 3.94Å; V230-A309 PolarHBondContact N-O 3.26Å; V230-A309 PolarHBondContact O-N 3.2Å; V271-A309 HydrophobicContact CG1-CB 3.54Å; V274-A309 HydrophobicContact CG1-CB 4.22Å; L275-A309 HydrophobicContact CD2-CB 3.96Å; L275-A309 HydrophobicContact CG-CB 4.5Å; T297-A309 HydrophobicContact CG2-CB 4.17Å; V298-A309 CarbonylContact O-C 3.51Å; V298-A309 VanDerWaalsContact O-CA 3.31Å; V298-A309 WeakPolarHBondContact O-CA 3.39Å
310	I	94	Very high	90.4	Very high	56 Å²	56	65.5 Å²	65.5	29%	0.287	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.7	173.3	-68.2	166.6	0	0	0	107.7	V227 V228 A229 T297 V298 V300 T312	V227-I310 HydrophobicContact CG1-CG2 3.92Å; V228-I310 WeakPolarHBondContact O-CA 3.44Å; A229-I310 HydrophobicContact CB-CG1 3.88Å; T297-I310 WeakPolarHBondContact CA-O 3.34Å; V298-I310 HydrophobicContact CG2-CB 4.3Å; V298-I310 PolarHBondContact N-O 3.42Å; V298-I310 PolarHBondContact O-N 3.06Å; V300-I310 HydrophobicContact CG2-CB 4.35Å; V300-I310 HydrophobicContact CG2-CD1 3.49Å; V300-I310 VanDerWaalsContact CG2-CD1 3.49Å; V300-I310 HydrophobicContact CG2-CG1 3.51Å; I310-T312 HydrophobicContact CG2-CG2 4.14Å
311	S	93.8	Very high	89.8	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.007	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.9	169.8	-59.5	0	0	0	0	109.7	V227 V228 W265 N296 T297	V227-S311 WeakPolarHBondContact CA-O 3.47Å; V228-S311 PolarHBondContact N-O 2.79Å; V228-S311 PolarHBondContact O-N 3.36Å; W265-S311 VanDerWaalsContact CZ2-CB 3.49Å; N296-S311 CarbonylContact O-C 3.57Å; N296-S311 VanDerWaalsContact O-CA 3.26Å; N296-S311 WeakPolarHBondContact O-CA 3.36Å; T297-S311 WeakPolarHBondContact CG2-OG 3.42Å; T297-S311 PolarHBondContact OG1-OG 3.49Å
312	T	94.1	Very high	89.3	Confident	35 Å²	35	65.7 Å²	65.7	22%	0.215	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	142.6	167.9	69.9	0	0	0	0	109.7	G226 V227 I295 N296 I310	G226-T312 CarbonylContact O-C 3.58Å; G226-T312 WeakPolarHBondContact O-CA 3.25Å; V227-T312 HydrophobicContact CG2-CG2 4.21Å; I295-T312 CarbonylContact C-O 3.46Å; I295-T312 WeakPolarHBondContact CA-O 3.46Å; N296-T312 PolarHBondContact N-O 3.37Å; N296-T312 PolarHBondContact O-N 3.19Å; I310-T312 HydrophobicContact CG2-CG2 4.14Å
313	F	92.4	Very high	88.9	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.009	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	144.8	179.9	56.5	-86.1	0	0	0	112.7	G226 V228 A243 L246 L247 W265 L293 L294 I295	G226-F313 PolarHBondContact N-O 2.92Å; G226-F313 WeakPolarHBondContact O-CD1 3.24Å; G226-F313 PolarHBondContact O-N 3.29Å; V228-F313 HydrophobicContact CG2-CE1 3.87Å; V228-F313 HydrophobicContact CG2-CZ 4.49Å; A243-F313 HydrophobicContact CB-CE1 3.94Å; A243-F313 HydrophobicContact CB-CE2 4.41Å; A243-F313 HydrophobicContact CB-CZ 3.47Å; A243-F313 VanDerWaalsContact CB-CZ 3.47Å; L246-F313 HydrophobicContact CB-CD2 4.36Å; L246-F313 HydrophobicContact CB-CE2 3.66Å; L246-F313 HydrophobicContact CD1-CD2 3.8Å; L246-F313 HydrophobicContact CD1-CE2 3.74Å; L246-F313 HydrophobicContact CG-CE2 4.37Å; L247-F313 HydrophobicContact CD1-CZ 3.82Å; L247-F313 HydrophobicContact CD2-CE2 4.26Å; L247-F313 HydrophobicContact CD2-CZ 4.26Å; L247-F313 HydrophobicContact CG-CE2 4.1Å; L247-F313 HydrophobicContact CG-CZ 3.86Å; W265-F313 AromaticContact CH2-CD1 3.54Å; W265-F313 HydrophobicContact CH2-CD1 3.54Å; W265-F313 AromaticContact CH2-CE1 3.48Å; W265-F313 HydrophobicContact CH2-CE1 3.48Å; W265-F313 VanDerWaalsContact CH2-CE1 3.48Å; W265-F313 HydrophobicContact CH2-CG 4.35Å; W265-F313 HydrophobicContact CH2-CZ 4.23Å; W265-F313 HydrophobicContact CZ2-CD1 4.29Å; W265-F313 HydrophobicContact CZ2-CE1 4.3Å; W265-F313 HydrophobicContact CZ3-CD1 4.32Å; W265-F313 AromaticContact CZ3-CE1 3.87Å; W265-F313 HydrophobicContact CZ3-CE1 3.87Å; W265-F313 HydrophobicContact CZ3-CZ 4.21Å; L293-F313 HydrophobicContact CD1-CD2 3.92Å; L293-F313 HydrophobicContact CD1-CE2 4.34Å; L294-F313 CarbonylContact O-C 3.54Å; L294-F313 WeakPolarHBondContact O-CA 3.26Å; I295-F313 HydrophobicContact CB-CB 4.32Å; I295-F313 HydrophobicContact CD1-CB 4.48Å; I295-F313 HydrophobicContact CG1-CB 3.78Å; I295-F313 HydrophobicContact CG2-CB 4.4Å
314	R	91.3	Very high	88.5	Confident	129 Å²	129	66.1 Å²	66.1	49%	0.487	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	137.7	-175.7	-176.9	175.4	172.7	-177.8	1.2	111	E225 L293 L294 K316	E225-R314 HydrophobicContact CG-CB 4.26Å; E225-R314 HydrophobicContact CG-CG 4.5Å; L293-R314 WeakPolarHBondContact CA-O 3.38Å; L294-R314 PolarHBondContact N-O 3.5Å; L294-R314 PolarHBondContact O-N 3.11Å; R314-K316 PolarHBondContact O-N 3.08Å
315	D	90.9	Very high	87.9	Confident	54 Å²	54	69.9 Å²	69.9	29%	0.289	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	123.5	172.6	-165.6	-21.6	0	0	0	111.2	L246 L293 T317	L246-D315 HydrophobicContact CD2-CB 4.02Å; L293-D315 HydrophobicContact CD2-CB 4.19Å; D315-T317 WeakPolarHBondContact OD1-CB 3.28Å; D315-T317 PolarHBondContact OD1-N 3.1Å; D315-T317 PolarHBondContact OD1-OG1 2.82Å
316	K	90.3	Very high	87.3	Confident	57 Å²	57	70 Å²	70	25%	0.248	33%	0.33	C	S	.	.			trans	-118	9.6	179	-70.2	-65.4	-171.5	163.7	0	112.8	L292 L294 R314 E318 V319 R320	L292-K316 HydrophobicContact CD2-CB 4.09Å; L292-K316 HydrophobicContact CG-CB 4.48Å; L292-K316 PolarHBondContact O-N 3.39Å; L294-K316 HydrophobicContact CB-CG 3.8Å; L294-K316 HydrophobicContact CD2-CG 4.5Å; R314-K316 PolarHBondContact O-N 3.08Å; K316-E318 VanDerWaalsContact C-N 3.33Å; K316-E318 PolarHBondContact O-N 2.72Å; K316-V319 HydrophobicContact CD-CB 4.43Å; K316-V319 HydrophobicContact CD-CG2 4.08Å; K316-V319 WeakPolarHBondContact O-CB 3.32Å; K316-V319 PolarHBondContact O-N 2.92Å; K316-R320 PolarHBondContact O-N 3.1Å
317	T	87.4	Confident	86.2	Confident	21 Å²	21	72.5 Å²	72.5	13%	0.129	34%	0.344	C	S	.	.	H	α-helix	trans	-54.5	-47.9	-177.3	-50.5	0	0	0	0	111.9	R291 L292 D315 V319 R320 K321	R291-T317 WeakPolarHBondContact CA-OG1 3.29Å; L292-T317 PolarHBondContact N-OG1 3.28Å; D315-T317 WeakPolarHBondContact OD1-CB 3.28Å; D315-T317 PolarHBondContact OD1-N 3.1Å; D315-T317 PolarHBondContact OD1-OG1 2.82Å; T317-V319 VanDerWaalsContact C-N 3.32Å; T317-V319 PolarHBondContact O-N 3.42Å; T317-R320 PolarHBondContact O-N 2.83Å; T317-K321 WeakPolarHBondContact O-CG 3.34Å; T317-K321 PolarHBondContact O-N 3.49Å
318	E	86.4	Confident	85.2	Confident	131 Å²	131	70.4 Å²	70.4	61%	0.612	34%	0.343	S	S	*	.	H	α-helix	trans	-65.3	-33.2	178.9	-67.6	-59.3	119.9	0	0	113	K316 K321 L322	K316-E318 VanDerWaalsContact C-N 3.33Å; K316-E318 PolarHBondContact O-N 2.72Å; E318-K321 IonicContact OE1-NZ 3.05Å; E318-K321 PolarHBondContact OE1-NZ 3.26Å; E318-L322 PolarHBondContact O-N 3.42Å; E318-L322 VanDerWaalsContact O-N 3.13Å
319	V	87.4	Confident	84.1	Confident	71 Å²	71	75.6 Å²	75.6	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-69.1	-43	176.7	-178.8	0	0	0	0	110.4	K316 T317 L322 M323	K316-V319 HydrophobicContact CD-CB 4.43Å; K316-V319 HydrophobicContact CD-CG2 4.08Å; K316-V319 WeakPolarHBondContact O-CB 3.32Å; K316-V319 PolarHBondContact O-N 2.92Å; T317-V319 VanDerWaalsContact C-N 3.32Å; T317-V319 PolarHBondContact O-N 3.42Å; V319-L322 PolarHBondContact O-N 3.31Å; V319-M323 PolarHBondContact O-N 3.35Å
320	R	83.1	Confident	83	Confident	114 Å²	114	79.4 Å²	79.4	43%	0.43	39%	0.393	S	S	.	.	H	α-helix	trans	-63.2	-43.4	177	179.7	167.3	175.7	170.9	1.1	112.1	L292 K316 T317 L322 M323 Q324	L292-R320 HydrophobicContact CD2-CB 3.99Å; L292-R320 HydrophobicContact CD2-CG 4.44Å; K316-R320 PolarHBondContact O-N 3.1Å; T317-R320 PolarHBondContact O-N 2.83Å; R320-L322 VanDerWaalsContact C-N 3.27Å; R320-L322 PolarHBondContact O-N 2.93Å; R320-M323 PolarHBondContact O-N 2.94Å; R320-Q324 WeakPolarHBondContact O-CG 3.41Å; R320-Q324 PolarHBondContact O-N 3.46Å
321	K	81.4	Confident	81.6	Confident	100 Å²	100	82 Å²	82	44%	0.435	41%	0.407	S	S	.	.	H	α-helix	trans	-57.4	-41.5	173.9	-71.9	176.5	-177.2	170	0	111.6	T317 E318 Q324 R325	T317-K321 WeakPolarHBondContact O-CG 3.34Å; T317-K321 PolarHBondContact O-N 3.49Å; E318-K321 IonicContact OE1-NZ 3.05Å; E318-K321 PolarHBondContact OE1-NZ 3.26Å; K321-Q324 PolarHBondContact O-N 2.74Å; K321-R325 WeakPolarHBondContact O-CG 3.3Å; K321-R325 PolarHBondContact O-N 3.1Å; K321-R325 VanDerWaalsContact O-N 3.13Å
322	L	82.1	Confident	80.4	Confident	99 Å²	99	89.1 Å²	89.1	52%	0.518	44%	0.435	S	S	.	.	H	α-helix	trans	-67.2	-40	177.4	-172.8	64.3	0	0	0	112.6	E318 V319 R320 R325 L326	E318-L322 PolarHBondContact O-N 3.42Å; E318-L322 VanDerWaalsContact O-N 3.13Å; V319-L322 PolarHBondContact O-N 3.31Å; R320-L322 VanDerWaalsContact C-N 3.27Å; R320-L322 PolarHBondContact O-N 2.93Å; L322-R325 WeakPolarHBondContact O-CB 3.31Å; L322-R325 PolarHBondContact O-N 3.13Å; L322-L326 PolarHBondContact O-N 3.35Å
323	M	80.2	Confident	79.1	Confident	115 Å²	115	89.8 Å²	89.8	57%	0.567	44%	0.444	S	S	*	.	H	α-helix	trans	-61.9	-44.6	175.2	-71.9	-177.9	69	0	0	111.6	V319 R320 R325 L326 D327	V319-M323 PolarHBondContact O-N 3.35Å; R320-M323 PolarHBondContact O-N 2.94Å; M323-R325 VanDerWaalsContact C-N 3.28Å; M323-R325 PolarHBondContact O-N 3.1Å; M323-L326 WeakPolarHBondContact O-CB 3.49Å; M323-L326 PolarHBondContact O-N 3.02Å; M323-D327 PolarHBondContact O-N 2.97Å
324	Q	76.4	Confident	77.8	Confident	116 Å²	116	93.3 Å²	93.3	54%	0.542	46%	0.463	S	S	.	.	H	α-helix	trans	-59.7	-37.7	175.8	-73.1	175.7	-41	0	0	112.5	R320 K321 D327 G328	R320-Q324 WeakPolarHBondContact O-CG 3.41Å; R320-Q324 PolarHBondContact O-N 3.46Å; K321-Q324 PolarHBondContact O-N 2.74Å; Q324-D327 PolarHBondContact O-N 2.97Å; Q324-G328 PolarHBondContact O-N 3.24Å; Q324-G328 VanDerWaalsContact O-N 3.1Å
325	R	74.2	Confident	76.5	Confident	140 Å²	140	89.9 Å²	89.9	53%	0.528	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-40.6	173	-74	176.8	172.3	164	-1.3	112.6	K321 L322 M323 G328 L329 E421	K321-R325 WeakPolarHBondContact O-CG 3.3Å; K321-R325 PolarHBondContact O-N 3.1Å; K321-R325 VanDerWaalsContact O-N 3.13Å; L322-R325 WeakPolarHBondContact O-CB 3.31Å; L322-R325 PolarHBondContact O-N 3.13Å; M323-R325 VanDerWaalsContact C-N 3.28Å; M323-R325 PolarHBondContact O-N 3.1Å; R325-G328 PolarHBondContact O-N 3Å; R325-L329 WeakPolarHBondContact O-CG 3.42Å; R325-L329 PolarHBondContact O-N 3.33Å; R325-L329 VanDerWaalsContact O-N 3.11Å; R325-E421 IonicContact CZ-OE2 3.84Å; R325-E421 VanDerWaalsContact CZ-OE2 3.31Å; R325-E421 IonicContact NE-OE2 3.74Å; R325-E421 PolarHBondContact NE-OE2 3.31Å; R325-E421 VanDerWaalsContact NE-OE2 3.15Å; R325-E421 IonicContact NH2-OE1 2.78Å; R325-E421 IonicContact NH2-OE2 2.86Å; R325-E421 PolarHBondContact NH2-OE2 3.42Å
326	L	77.5	Confident	75.4	Confident	97 Å²	97	91.4 Å²	91.4	51%	0.508	47%	0.47	S	S	.	.	H	α-helix	trans	-65.6	-43.9	177.2	-72.6	170	0	0	0	111.6	L322 M323 G328 L329 V330	L322-L326 PolarHBondContact O-N 3.35Å; M323-L326 WeakPolarHBondContact O-CB 3.49Å; M323-L326 PolarHBondContact O-N 3.02Å; L326-G328 VanDerWaalsContact C-N 3.28Å; L326-G328 PolarHBondContact O-N 3.38Å; L326-L329 PolarHBondContact O-N 2.9Å; L326-L329 VanDerWaalsContact O-N 3.11Å; L326-V330 WeakPolarHBondContact O-CG2 3.4Å; L326-V330 PolarHBondContact O-N 3.45Å
327	D	68.2	Low	74.5	Confident	97 Å²	97	95.9 Å²	95.9	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-59.8	-41	176.4	-67.6	-26.3	0	0	0	111.2	M323 Q324 L329 V330 N331	M323-D327 PolarHBondContact O-N 2.97Å; Q324-D327 PolarHBondContact O-N 2.97Å; D327-L329 PolarHBondContact O-N 2.95Å; D327-V330 PolarHBondContact O-N 3.45Å; D327-N331 PolarHBondContact O-N 3.42Å; D327-N331 PolarHBondContact O-ND2 3.06Å
328	G	70.4	Confident	73.4	Confident	42 Å²	42	101.9 Å²	101.9	43%	0.433	51%	0.512	S	S	.	.	H	α-helix	trans	-59	-42.6	173	0	0	0	0	0	113.5	Q324 R325 L326 Y332	Q324-G328 PolarHBondContact O-N 3.24Å; Q324-G328 VanDerWaalsContact O-N 3.1Å; R325-G328 PolarHBondContact O-N 3Å; L326-G328 VanDerWaalsContact C-N 3.28Å; L326-G328 PolarHBondContact O-N 3.38Å; G328-Y332 PolarHBondContact O-N 3.45Å; G328-Y332 VanDerWaalsContact O-N 3.12Å
329	L	71.3	Confident	72.4	Confident	110 Å²	110	99.7 Å²	99.7	58%	0.576	50%	0.498	S	S	*	.	H	α-helix	trans	-68.7	-36.5	176.9	-73	172.5	0	0	0	112.9	R325 L326 D327 Y332 A333	R325-L329 WeakPolarHBondContact O-CG 3.42Å; R325-L329 PolarHBondContact O-N 3.33Å; R325-L329 VanDerWaalsContact O-N 3.11Å; L326-L329 PolarHBondContact O-N 2.9Å; L326-L329 VanDerWaalsContact O-N 3.11Å; D327-L329 PolarHBondContact O-N 2.95Å; L329-Y332 PolarHBondContact O-N 3.33Å; L329-A333 PolarHBondContact O-N 3.36Å
330	V	69.9	Low	71.5	Confident	80 Å²	80	99.7 Å²	99.7	49%	0.485	50%	0.501	S	S	.	.	H	α-helix	trans	-63	-48.1	175.8	172.1	0	0	0	0	110.1	L326 D327 Y332 A333 D334	L326-V330 WeakPolarHBondContact O-CG2 3.4Å; L326-V330 PolarHBondContact O-N 3.45Å; D327-V330 PolarHBondContact O-N 3.45Å; V330-Y332 VanDerWaalsContact C-N 3.29Å; V330-Y332 PolarHBondContact O-N 3.5Å; V330-A333 WeakPolarHBondContact O-CB 3.32Å; V330-A333 PolarHBondContact O-N 2.94Å; V330-A333 VanDerWaalsContact O-N 3.08Å; V330-D334 PolarHBondContact O-N 2.99Å
331	N	65.4	Low	70.9	Confident	110 Å²	110	100 Å²	100	59%	0.588	51%	0.507	S	S	*	.	H	α-helix	trans	-60	-39.5	177.3	-70.2	-22.4	0	0	0	112.2	D327 D334 A335	D327-N331 PolarHBondContact O-N 3.42Å; D327-N331 PolarHBondContact O-ND2 3.06Å; N331-D334 PolarHBondContact O-N 3.22Å; N331-A335 PolarHBondContact O-N 2.95Å
332	Y	67.7	Low	70.4	Confident	152 Å²	152	98.8 Å²	98.8	60%	0.596	50%	0.503	S	S	*	.	H	α-helix	trans	-62.9	-42.1	174.2	177.5	-107.2	0	0	0	112.4	G328 L329 V330 A335 L336	G328-Y332 PolarHBondContact O-N 3.45Å; G328-Y332 VanDerWaalsContact O-N 3.12Å; L329-Y332 PolarHBondContact O-N 3.33Å; V330-Y332 VanDerWaalsContact C-N 3.29Å; V330-Y332 PolarHBondContact O-N 3.5Å; Y332-A335 PolarHBondContact O-N 2.94Å; Y332-L336 HydrophobicContact CD1-CD1 3.9Å; Y332-L336 HydrophobicContact CE1-CD1 3.4Å; Y332-L336 HydrophobicContact CE1-CG 4.26Å; Y332-L336 HydrophobicContact CE2-CD1 4.47Å; Y332-L336 PolarHBondContact O-N 3.44Å
333	A	67	Low	70.1	Confident	49 Å²	49	99.9 Å²	99.9	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-37.4	177	0	0	0	0	0	112.5	L329 V330 L336 R337	L329-A333 PolarHBondContact O-N 3.36Å; V330-A333 WeakPolarHBondContact O-CB 3.32Å; V330-A333 PolarHBondContact O-N 2.94Å; V330-A333 VanDerWaalsContact O-N 3.08Å; A333-L336 PolarHBondContact O-N 3.44Å; A333-R337 PolarHBondContact O-N 3.48Å
334	D	65.8	Low	70	Confident	76 Å²	76	98.7 Å²	98.7	41%	0.406	50%	0.498	S	S	.	.	H	α-helix	trans	-68.3	-41.1	176	-76.2	-25.3	0	0	0	112.2	V330 N331 L336 R337 E338	V330-D334 PolarHBondContact O-N 2.99Å; N331-D334 PolarHBondContact O-N 3.22Å; D334-L336 VanDerWaalsContact C-N 3.33Å; D334-L336 PolarHBondContact O-N 3.47Å; D334-R337 WeakPolarHBondContact O-CB 3.42Å; D334-R337 PolarHBondContact O-N 2.89Å; D334-R337 IonicContact OD1-NH1 3.23Å; D334-R337 PolarHBondContact OD1-NH1 3.48Å; D334-E338 PolarHBondContact O-N 2.91Å
335	A	64.4	Low	70.2	Confident	56 Å²	56	98 Å²	98	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-40.4	173	0	0	0	0	0	112.4	N331 Y332 R337 E338 R339	N331-A335 PolarHBondContact O-N 2.95Å; Y332-A335 PolarHBondContact O-N 2.94Å; A335-R337 VanDerWaalsContact C-N 3.31Å; A335-R337 PolarHBondContact O-N 3.42Å; A335-E338 PolarHBondContact O-N 2.95Å; A335-R339 WeakPolarHBondContact O-CB 3.41Å; A335-R339 PolarHBondContact O-N 2.96Å
336	L	67	Low	70.6	Confident	87 Å²	87	93.5 Å²	93.5	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-62.5	-36.8	172.9	-78.8	171.2	0	0	0	112.5	Y332 A333 D334 S340	Y332-L336 HydrophobicContact CD1-CD1 3.9Å; Y332-L336 HydrophobicContact CE1-CD1 3.4Å; Y332-L336 HydrophobicContact CE1-CG 4.26Å; Y332-L336 HydrophobicContact CE2-CD1 4.47Å; Y332-L336 PolarHBondContact O-N 3.44Å; A333-L336 PolarHBondContact O-N 3.44Å; D334-L336 VanDerWaalsContact C-N 3.33Å; D334-L336 PolarHBondContact O-N 3.47Å; L336-S340 PolarHBondContact O-N 2.92Å; L336-S340 PolarHBondContact O-OG 2.66Å
337	R	71.2	Confident	70.8	Confident	151 Å²	151	92.3 Å²	92.3	57%	0.57	48%	0.476	S	S	*	.	H	α-helix	trans	-68	-44.4	177.8	-177.8	-179.2	-74.1	126.2	-3.2	111.5	A333 D334 A335 R339 S340 H341	A333-R337 PolarHBondContact O-N 3.48Å; D334-R337 WeakPolarHBondContact O-CB 3.42Å; D334-R337 PolarHBondContact O-N 2.89Å; D334-R337 IonicContact OD1-NH1 3.23Å; D334-R337 PolarHBondContact OD1-NH1 3.48Å; A335-R337 VanDerWaalsContact C-N 3.31Å; A335-R337 PolarHBondContact O-N 3.42Å; R337-R339 VanDerWaalsContact C-N 3.34Å; R337-R339 PolarHBondContact O-N 3.42Å; R337-S340 WeakPolarHBondContact O-CB 3.44Å; R337-S340 PolarHBondContact O-N 3.42Å; R337-H341 PolarHBondContact O-N 2.96Å
338	E	65.2	Low	71.5	Confident	147 Å²	147	93.2 Å²	93.2	69%	0.687	48%	0.477	S	S	*	.	H	α-helix	trans	-60	-44.7	174.8	-174.1	175.7	-167.7	0	0	111.3	D334 A335 S340 H341 E342	D334-E338 PolarHBondContact O-N 2.91Å; A335-E338 PolarHBondContact O-N 2.95Å; E338-S340 VanDerWaalsContact C-N 3.25Å; E338-S340 PolarHBondContact O-N 2.7Å; E338-H341 WeakPolarHBondContact O-CA 3.45Å; E338-H341 WeakPolarHBondContact O-CB 3.46Å; E338-H341 PolarHBondContact O-N 3.46Å; E338-E342 PolarHBondContact O-N 3.46Å
339	R	64.5	Low	72.2	Confident	85 Å²	85	94.1 Å²	94.1	32%	0.321	47%	0.474	S	S	.	.	H	α-helix	trans	-61.4	-35.5	176	-169.5	58.2	166.8	-167.9	-8.4	112.6	A335 R337 E342 F343	A335-R339 WeakPolarHBondContact O-CB 3.41Å; A335-R339 PolarHBondContact O-N 2.96Å; R337-R339 VanDerWaalsContact C-N 3.34Å; R337-R339 PolarHBondContact O-N 3.42Å; R339-E342 WeakPolarHBondContact CD-OE2 3.32Å; R339-E342 IonicContact CZ-OE2 3.42Å; R339-E342 IonicContact NE-OE2 2.64Å; R339-E342 IonicContact NH1-OE1 3.72Å; R339-E342 PolarHBondContact NH1-OE1 3.49Å; R339-E342 IonicContact NH1-OE2 2.79Å; R339-E342 PolarHBondContact NH1-OE2 2.94Å; R339-E342 PolarHBondContact O-N 3.06Å; R339-F343 WeakPolarHBondContact O-CB 3.29Å; R339-F343 PolarHBondContact O-N 2.85Å
340	S	69.3	Low	72.9	Confident	70 Å²	70	91.5 Å²	91.5	49%	0.49	46%	0.46	S	S	.	.	H	α-helix	trans	-65	-40.2	173.4	-58.9	0	0	0	0	111.5	L336 R337 E338 F343 M344	L336-S340 PolarHBondContact O-N 2.92Å; L336-S340 PolarHBondContact O-OG 2.66Å; R337-S340 WeakPolarHBondContact O-CB 3.44Å; R337-S340 PolarHBondContact O-N 3.42Å; E338-S340 VanDerWaalsContact C-N 3.25Å; E338-S340 PolarHBondContact O-N 2.7Å; S340-F343 PolarHBondContact O-N 3.3Å; S340-M344 VanDerWaalsContact O-CG 3.31Å; S340-M344 WeakPolarHBondContact O-CG 3.42Å; S340-M344 PolarHBondContact O-N 3.01Å
341	H	70.9	Confident	73.2	Confident	122 Å²	122	91.9 Å²	91.9	57%	0.565	46%	0.459	S	S	*	.	H	α-helix	trans	-62.9	-46.4	173.9	-92.4	-71.9	0	0	0	112.4	R337 E338 F343 M344 N345	R337-H341 PolarHBondContact O-N 2.96Å; E338-H341 WeakPolarHBondContact O-CA 3.45Å; E338-H341 WeakPolarHBondContact O-CB 3.46Å; E338-H341 PolarHBondContact O-N 3.46Å; H341-F343 VanDerWaalsContact C-N 3.3Å; H341-F343 PolarHBondContact O-N 3.26Å; H341-M344 PolarHBondContact O-N 3.45Å; H341-N345 PolarHBondContact O-N 3.03Å
342	E	70.8	Confident	74.1	Confident	73 Å²	73	88.1 Å²	88.1	34%	0.341	45%	0.446	S	S	.	.	H	α-helix	trans	-59.4	-43.3	176.2	-166.1	-158.5	149.7	0	0	111.1	E338 R339 N345 K346	E338-E342 PolarHBondContact O-N 3.46Å; R339-E342 WeakPolarHBondContact CD-OE2 3.32Å; R339-E342 IonicContact CZ-OE2 3.42Å; R339-E342 IonicContact NE-OE2 2.64Å; R339-E342 IonicContact NH1-OE1 3.72Å; R339-E342 PolarHBondContact NH1-OE1 3.49Å; R339-E342 IonicContact NH1-OE2 2.79Å; R339-E342 PolarHBondContact NH1-OE2 2.94Å; R339-E342 PolarHBondContact O-N 3.06Å; E342-N345 PolarHBondContact O-N 2.98Å; E342-K346 WeakPolarHBondContact O-CG 3.3Å; E342-K346 PolarHBondContact O-N 3.46Å; E342-K346 WeakPolarHBondContact OE1-CE 3.45Å; E342-K346 IonicContact OE1-NZ 2.7Å; E342-K346 PolarHBondContact OE1-NZ 2.96Å
343	F	76	Confident	75.1	Confident	122 Å²	122	82.1 Å²	82.1	54%	0.535	42%	0.424	S	S	.	.	H	α-helix	trans	-61.3	-44.2	175.3	-176.9	-103.6	0	0	0	112.2	R339 S340 H341 N345 K346 L347	R339-F343 WeakPolarHBondContact O-CB 3.29Å; R339-F343 PolarHBondContact O-N 2.85Å; S340-F343 PolarHBondContact O-N 3.3Å; H341-F343 VanDerWaalsContact C-N 3.3Å; H341-F343 PolarHBondContact O-N 3.26Å; F343-N345 VanDerWaalsContact C-N 3.32Å; F343-N345 PolarHBondContact O-N 3.38Å; F343-K346 WeakPolarHBondContact O-CB 3.42Å; F343-K346 PolarHBondContact O-N 3.06Å; F343-L347 HydrophobicContact CD1-CD1 4.07Å; F343-L347 HydrophobicContact CD1-CG 4.44Å; F343-L347 HydrophobicContact CE1-CD1 3.58Å; F343-L347 HydrophobicContact CE1-CG 4.08Å; F343-L347 HydrophobicContact CZ-CD1 4.18Å; F343-L347 HydrophobicContact CZ-CD2 4.37Å; F343-L347 HydrophobicContact CZ-CG 4.3Å; F343-L347 PolarHBondContact O-N 3.5Å
344	M	76.6	Confident	75.9	Confident	90 Å²	90	83.8 Å²	83.8	44%	0.443	43%	0.426	S	S	.	.	H	α-helix	trans	-62.1	-38.4	175.4	-72.5	-57	-63.7	0	0	112.3	S340 H341 K346 L347 H348	S340-M344 VanDerWaalsContact O-CG 3.31Å; S340-M344 WeakPolarHBondContact O-CG 3.42Å; S340-M344 PolarHBondContact O-N 3.01Å; H341-M344 PolarHBondContact O-N 3.45Å; M344-K346 VanDerWaalsContact C-N 3.34Å; M344-L347 PolarHBondContact O-N 3.39Å; M344-L347 HydrophobicContact SD-CD1 4.14Å; M344-H348 PolarHBondContact O-N 3.01Å; M344-H348 PolarHBondContact O-ND1 3.39Å
345	N	81.4	Confident	76.8	Confident	101 Å²	101	87.2 Å²	87.2	54%	0.54	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-42.3	175	-70.6	-14.4	0	0	0	111	H341 E342 F343 L347 H348 V349	H341-N345 PolarHBondContact O-N 3.03Å; E342-N345 PolarHBondContact O-N 2.98Å; F343-N345 VanDerWaalsContact C-N 3.32Å; F343-N345 PolarHBondContact O-N 3.38Å; N345-L347 VanDerWaalsContact C-N 3.33Å; N345-L347 PolarHBondContact O-N 3.06Å; N345-H348 PolarHBondContact O-N 2.98Å; N345-H348 VanDerWaalsContact O-N 3.16Å; N345-V349 WeakPolarHBondContact O-CG2 3.41Å; N345-V349 PolarHBondContact O-N 3.39Å
346	K	82	Confident	78	Confident	46 Å²	46	90.6 Å²	90.6	20%	0.2	45%	0.449	C	S	.	.	H	α-helix	trans	-60.3	-41.7	174.9	-67	171.3	-178.8	175.8	0	111.7	E342 F343 M344 V349 I350 Y365 T369	E342-K346 WeakPolarHBondContact O-CG 3.3Å; E342-K346 PolarHBondContact O-N 3.46Å; E342-K346 WeakPolarHBondContact OE1-CE 3.45Å; E342-K346 IonicContact OE1-NZ 2.7Å; E342-K346 PolarHBondContact OE1-NZ 2.96Å; F343-K346 WeakPolarHBondContact O-CB 3.42Å; F343-K346 PolarHBondContact O-N 3.06Å; M344-K346 VanDerWaalsContact C-N 3.34Å; K346-V349 PolarHBondContact O-N 2.95Å; K346-I350 WeakPolarHBondContact O-CG1 3.48Å; K346-I350 PolarHBondContact O-N 3.35Å; K346-Y365 WeakPolarHBondContact CG-OH 3.45Å; K346-T369 HydrophobicContact CD-CG2 4.05Å
347	L	83.1	Confident	79.1	Confident	72 Å²	72	93.6 Å²	93.6	38%	0.377	46%	0.458	S	S	.	.	H	α-helix	trans	-64.1	-38.7	174.5	-70.1	-178.9	0	0	0	112.8	F343 M344 N345 I350 L351	F343-L347 HydrophobicContact CD1-CD1 4.07Å; F343-L347 HydrophobicContact CD1-CG 4.44Å; F343-L347 HydrophobicContact CE1-CD1 3.58Å; F343-L347 HydrophobicContact CE1-CG 4.08Å; F343-L347 HydrophobicContact CZ-CD1 4.18Å; F343-L347 HydrophobicContact CZ-CD2 4.37Å; F343-L347 HydrophobicContact CZ-CG 4.3Å; F343-L347 PolarHBondContact O-N 3.5Å; M344-L347 PolarHBondContact O-N 3.39Å; M344-L347 HydrophobicContact SD-CD1 4.14Å; N345-L347 VanDerWaalsContact C-N 3.33Å; N345-L347 PolarHBondContact O-N 3.06Å; L347-I350 HydrophobicContact CD2-CD1 4.45Å; L347-I350 WeakPolarHBondContact O-CB 3.04Å; L347-I350 PolarHBondContact O-N 2.89Å; L347-L351 WeakPolarHBondContact O-CB 3.29Å; L347-L351 PolarHBondContact O-N 3Å
348	H	81.5	Confident	79.9	Confident	116 Å²	116	88 Å²	88	54%	0.537	44%	0.442	S	S	.	.	H	α-helix	trans	-64.7	-39.3	175.3	-79.4	86	0	0	0	112.2	M344 N345 L351 G352	M344-H348 PolarHBondContact O-N 3.01Å; M344-H348 PolarHBondContact O-ND1 3.39Å; N345-H348 PolarHBondContact O-N 2.98Å; N345-H348 VanDerWaalsContact O-N 3.16Å; H348-L351 PolarHBondContact O-N 2.86Å; H348-G352 PolarHBondContact O-N 2.92Å
349	V	85.3	Confident	81	Confident	61 Å²	61	87.8 Å²	87.8	37%	0.37	44%	0.436	S	S	.	.	H	α-helix	trans	-63.4	-45.9	174.3	175.2	0	0	0	0	110.6	N345 K346 L351 G352 L353 Y365	N345-V349 WeakPolarHBondContact O-CG2 3.41Å; N345-V349 PolarHBondContact O-N 3.39Å; K346-V349 PolarHBondContact O-N 2.95Å; V349-L351 VanDerWaalsContact C-N 3.33Å; V349-L351 PolarHBondContact O-N 3.4Å; V349-G352 PolarHBondContact O-N 3.5Å; V349-L353 HydrophobicContact CG1-CD1 3.91Å; V349-L353 HydrophobicContact CG1-CG 4.33Å; V349-L353 WeakPolarHBondContact O-CG 3.41Å; V349-L353 PolarHBondContact O-N 3.24Å; V349-Y365 HydrophobicContact CB-CE1 4.13Å; V349-Y365 HydrophobicContact CG1-CD1 4.18Å; V349-Y365 HydrophobicContact CG1-CD2 4.14Å; V349-Y365 HydrophobicContact CG1-CE1 3.89Å; V349-Y365 HydrophobicContact CG1-CE2 3.84Å; V349-Y365 HydrophobicContact CG1-CG 4.29Å
350	I	85.3	Confident	82	Confident	55 Å²	55	91.3 Å²	91.3	28%	0.282	45%	0.453	S	S	.	.	H	α-helix	trans	-55.8	-47.8	174.6	-73.7	167.9	0	0	0	110.7	K346 L347 L354 L362 Y365 I366	K346-I350 WeakPolarHBondContact O-CG1 3.48Å; K346-I350 PolarHBondContact O-N 3.35Å; L347-I350 HydrophobicContact CD2-CD1 4.45Å; L347-I350 WeakPolarHBondContact O-CB 3.04Å; L347-I350 PolarHBondContact O-N 2.89Å; I350-L354 WeakPolarHBondContact O-CB 3.14Å; I350-L354 PolarHBondContact O-N 3.44Å; I350-L362 HydrophobicContact CB-CD1 4.2Å; I350-L362 HydrophobicContact CG1-CD1 4.17Å; I350-L362 HydrophobicContact CG2-CD1 3.96Å; I350-Y365 HydrophobicContact CG1-CD1 4.03Å; I350-Y365 HydrophobicContact CG1-CE1 4.06Å; I350-I366 HydrophobicContact CD1-CG1 4.36Å; I350-I366 HydrophobicContact CG1-CG1 4.38Å
351	L	78.2	Confident	82.7	Confident	88 Å²	88	93.1 Å²	93.1	46%	0.461	45%	0.454	S	S	.	.	H	α-helix	trans	-64.6	-40.9	178.5	-176.3	64	0	0	0	112.3	L347 H348 V349 L354 H355	L347-L351 WeakPolarHBondContact O-CB 3.29Å; L347-L351 PolarHBondContact O-N 3Å; H348-L351 PolarHBondContact O-N 2.86Å; V349-L351 VanDerWaalsContact C-N 3.33Å; V349-L351 PolarHBondContact O-N 3.4Å; L351-L354 PolarHBondContact O-N 3.29Å; L351-H355 PolarHBondContact O-N 2.88Å
352	G	83.5	Confident	83.4	Confident	31 Å²	31	88.3 Å²	88.3	32%	0.32	43%	0.433	S	S	.	.	H	α-helix	trans	-62.9	-47.4	177.1	0	0	0	0	0	112.4	H348 V349 L354 H355 L356	H348-G352 PolarHBondContact O-N 2.92Å; V349-G352 PolarHBondContact O-N 3.5Å; G352-L354 VanDerWaalsContact C-N 3.3Å; G352-L354 PolarHBondContact O-N 3.45Å; G352-H355 PolarHBondContact O-N 3.37Å; G352-L356 WeakPolarHBondContact O-CG 3.46Å; G352-L356 PolarHBondContact O-N 3.43Å
353	L	88.9	Confident	83.8	Confident	26 Å²	26	90.6 Å²	90.6	14%	0.136	44%	0.443	C	S	.	.	H	α-helix	trans	-63.7	-36.8	176.5	-68.3	172.9	0	0	0	111.8	V349 L356 K357 S358 Q361 L362 Y365	V349-L353 HydrophobicContact CG1-CD1 3.91Å; V349-L353 HydrophobicContact CG1-CG 4.33Å; V349-L353 WeakPolarHBondContact O-CG 3.41Å; V349-L353 PolarHBondContact O-N 3.24Å; L353-L356 PolarHBondContact O-N 2.92Å; L353-K357 PolarHBondContact O-N 2.68Å; L353-S358 PolarHBondContact O-N 3.04Å; L353-Q361 HydrophobicContact CD2-CB 3.96Å; L353-L362 HydrophobicContact CB-CB 4.03Å; L353-L362 HydrophobicContact CB-CD1 4.22Å; L353-L362 HydrophobicContact CD1-CB 4.46Å; L353-L362 HydrophobicContact CD1-CD1 4.49Å; L353-Y365 HydrophobicContact CD1-CG 4.32Å
354	L	82.6	Confident	84.1	Confident	84 Å²	84	89 Å²	89	44%	0.44	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-46	174.8	-169	73.4	0	0	0	111.8	I350 L351 G352 L356 K357 Y359 L362	I350-L354 WeakPolarHBondContact O-CB 3.14Å; I350-L354 PolarHBondContact O-N 3.44Å; L351-L354 PolarHBondContact O-N 3.29Å; G352-L354 VanDerWaalsContact C-N 3.3Å; G352-L354 PolarHBondContact O-N 3.45Å; L354-L356 PolarHBondContact O-N 3.24Å; L354-K357 PolarHBondContact O-N 3.47Å; L354-Y359 HydrophobicContact CD1-CE1 4.45Å; L354-L362 HydrophobicContact CB-CD2 4.47Å; L354-L362 HydrophobicContact CD1-CD2 3.9Å
355	H	84.7	Confident	84.5	Confident	148 Å²	148	87.8 Å²	87.8	69%	0.685	43%	0.431	S	S	*	.	H	α-helix	trans	-63.6	-37.8	176.3	-84.3	167.6	0	0	0	113.1	L351 G352 K357	L351-H355 PolarHBondContact O-N 2.88Å; G352-H355 PolarHBondContact O-N 3.37Å; H355-K357 PolarHBondContact O-N 2.9Å
356	L	89.9	Confident	84.5	Confident	127 Å²	127	86.8 Å²	86.8	67%	0.665	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	0.7	175	-65.9	173.6	0	0	0	113	G352 L353 L354 S358	G352-L356 WeakPolarHBondContact O-CG 3.46Å; G352-L356 PolarHBondContact O-N 3.43Å; L353-L356 PolarHBondContact O-N 2.92Å; L354-L356 PolarHBondContact O-N 3.24Å; L356-S358 PolarHBondContact O-N 3.46Å; L356-S358 PolarHBondContact O-OG 2.97Å
357	K	90.2	Very high	84.2	Confident	151 Å²	151	88.8 Å²	88.8	66%	0.657	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	30	-175.9	-58.6	-176.5	-179.9	-179.5	0	112.8	L353 L354 H355 Y359	L353-K357 PolarHBondContact O-N 2.68Å; L354-K357 PolarHBondContact O-N 3.47Å; H355-K357 PolarHBondContact O-N 2.9Å; K357-Y359 HydrophobicContact CB-CE2 3.93Å; K357-Y359 VanDerWaalsContact O-CD2 3.31Å; K357-Y359 WeakPolarHBondContact O-CD2 3.43Å; K357-Y359 PolarHBondContact O-N 3.3Å
358	S	89.1	Confident	83.9	Confident	33 Å²	33	92.1 Å²	92.1	23%	0.231	45%	0.449	C	S	.	.			trans	-88.2	61.6	-178	-66.9	0	0	0	0	109.8	L353 L356 K360 Q361 L362	L353-S358 PolarHBondContact O-N 3.04Å; L356-S358 PolarHBondContact O-N 3.46Å; L356-S358 PolarHBondContact O-OG 2.97Å; S358-K360 VanDerWaalsContact C-N 3.28Å; S358-K360 PolarHBondContact O-N 3.1Å; S358-Q361 VanDerWaalsContact CB-OE1 3.3Å; S358-Q361 PolarHBondContact O-N 3.23Å; S358-Q361 VanDerWaalsContact O-N 3.1Å; S358-L362 PolarHBondContact O-N 3.39Å
359	Y	87.8	Confident	83.4	Confident	143 Å²	143	88.5 Å²	88.5	56%	0.561	44%	0.435	S	S	*	.	H	α-helix	trans	-57.5	-38.1	-169.9	-58.4	-64.2	0	0	0	113.3	L354 K357 L362 E363	L354-Y359 HydrophobicContact CD1-CE1 4.45Å; K357-Y359 HydrophobicContact CB-CE2 3.93Å; K357-Y359 VanDerWaalsContact O-CD2 3.31Å; K357-Y359 WeakPolarHBondContact O-CD2 3.43Å; K357-Y359 PolarHBondContact O-N 3.3Å; Y359-L362 WeakPolarHBondContact O-CB 3.44Å; Y359-L362 PolarHBondContact O-N 3.25Å; Y359-E363 WeakPolarHBondContact O-CB 3.39Å; Y359-E363 PolarHBondContact O-N 3.5Å
360	K	84.7	Confident	82.7	Confident	158 Å²	158	87.7 Å²	87.7	69%	0.687	44%	0.435	S	S	*	.	H	α-helix	trans	-63.2	-45.5	177.2	-169.2	179	-179.4	-179.2	0	112.3	S358 L362 E363 D364	S358-K360 VanDerWaalsContact C-N 3.28Å; S358-K360 PolarHBondContact O-N 3.1Å; K360-L362 VanDerWaalsContact C-N 3.33Å; K360-L362 PolarHBondContact O-N 3.5Å; K360-E363 PolarHBondContact O-N 3.07Å; K360-D364 WeakPolarHBondContact O-CB 3.32Å; K360-D364 PolarHBondContact O-N 3.37Å
361	Q	84.2	Confident	81.6	Confident	109 Å²	109	89.1 Å²	89.1	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-68.2	-35	178	-66.7	165.3	3.1	0	0	111.7	L353 S358 Y365	L353-Q361 HydrophobicContact CD2-CB 3.96Å; S358-Q361 VanDerWaalsContact CB-OE1 3.3Å; S358-Q361 PolarHBondContact O-N 3.23Å; S358-Q361 VanDerWaalsContact O-N 3.1Å; Q361-Y365 WeakPolarHBondContact O-CB 3.31Å; Q361-Y365 PolarHBondContact O-N 3.07Å
362	L	84.8	Confident	80.9	Confident	21 Å²	21	89 Å²	89	11%	0.11	44%	0.443	C	S	.	.	H	α-helix	trans	-63	-47.5	173.7	176	62.1	0	0	0	111.4	I350 L353 L354 S358 Y359 K360 Y365 I366	I350-L362 HydrophobicContact CB-CD1 4.2Å; I350-L362 HydrophobicContact CG1-CD1 4.17Å; I350-L362 HydrophobicContact CG2-CD1 3.96Å; L353-L362 HydrophobicContact CB-CB 4.03Å; L353-L362 HydrophobicContact CB-CD1 4.22Å; L353-L362 HydrophobicContact CD1-CB 4.46Å; L353-L362 HydrophobicContact CD1-CD1 4.49Å; L354-L362 HydrophobicContact CB-CD2 4.47Å; L354-L362 HydrophobicContact CD1-CD2 3.9Å; S358-L362 PolarHBondContact O-N 3.39Å; Y359-L362 WeakPolarHBondContact O-CB 3.44Å; Y359-L362 PolarHBondContact O-N 3.25Å; K360-L362 VanDerWaalsContact C-N 3.33Å; K360-L362 PolarHBondContact O-N 3.5Å; L362-Y365 PolarHBondContact O-N 3.36Å; L362-I366 HydrophobicContact CD1-CD1 3.77Å; L362-I366 HydrophobicContact CD1-CG1 4.18Å; L362-I366 HydrophobicContact CG-CD1 3.98Å; L362-I366 WeakPolarHBondContact O-CG1 3.42Å; L362-I366 PolarHBondContact O-N 3.42Å
363	E	80.5	Confident	79.7	Confident	120 Å²	120	94.2 Å²	94.2	56%	0.561	45%	0.454	S	S	*	.	H	α-helix	trans	-60.1	-49.9	176.4	-175.8	176.8	-175.1	0	0	111.1	Y359 K360 Y365 I366 L367	Y359-E363 WeakPolarHBondContact O-CB 3.39Å; Y359-E363 PolarHBondContact O-N 3.5Å; K360-E363 PolarHBondContact O-N 3.07Å; E363-Y365 VanDerWaalsContact C-N 3.32Å; E363-Y365 PolarHBondContact O-N 2.98Å; E363-I366 PolarHBondContact O-N 3.47Å; E363-L367 HydrophobicContact CG-CD1 3.98Å; E363-L367 WeakPolarHBondContact O-CB 3.15Å; E363-L367 WeakPolarHBondContact O-CG 3.28Å; E363-L367 PolarHBondContact O-N 3.49Å
364	D	82.6	Confident	78	Confident	90 Å²	90	99.9 Å²	99.9	48%	0.481	48%	0.48	S	S	.	.	H	α-helix	trans	-57.9	-43.2	176.5	-69.2	-23.9	0	0	0	111.5	K360 K368	K360-D364 WeakPolarHBondContact O-CB 3.32Å; K360-D364 PolarHBondContact O-N 3.37Å; D364-K368 WeakPolarHBondContact O-CB 3.43Å; D364-K368 PolarHBondContact O-N 2.92Å
365	Y	84.6	Confident	76.8	Confident	64 Å²	64	103.2 Å²	103.2	25%	0.251	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-43.7	179	-175.7	-97.6	0	0	0	112.5	K346 V349 I350 L353 Q361 L362 E363 T369	K346-Y365 WeakPolarHBondContact CG-OH 3.45Å; V349-Y365 HydrophobicContact CB-CE1 4.13Å; V349-Y365 HydrophobicContact CG1-CD1 4.18Å; V349-Y365 HydrophobicContact CG1-CD2 4.14Å; V349-Y365 HydrophobicContact CG1-CE1 3.89Å; V349-Y365 HydrophobicContact CG1-CE2 3.84Å; V349-Y365 HydrophobicContact CG1-CG 4.29Å; I350-Y365 HydrophobicContact CG1-CD1 4.03Å; I350-Y365 HydrophobicContact CG1-CE1 4.06Å; L353-Y365 HydrophobicContact CD1-CG 4.32Å; Q361-Y365 WeakPolarHBondContact O-CB 3.31Å; Q361-Y365 PolarHBondContact O-N 3.07Å; L362-Y365 PolarHBondContact O-N 3.36Å; E363-Y365 VanDerWaalsContact C-N 3.32Å; E363-Y365 PolarHBondContact O-N 2.98Å; Y365-T369 VanDerWaalsContact O-CB 3.22Å; Y365-T369 WeakPolarHBondContact O-CB 3.22Å; Y365-T369 PolarHBondContact O-N 2.98Å; Y365-T369 PolarHBondContact O-OG1 3.02Å
366	I	81.8	Confident	75.7	Confident	80 Å²	80	102.1 Å²	102.1	41%	0.41	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-47.5	177.7	-70.5	171	0	0	0	110.2	I350 L362 E363 T369 A370	I350-I366 HydrophobicContact CD1-CG1 4.36Å; I350-I366 HydrophobicContact CG1-CG1 4.38Å; L362-I366 HydrophobicContact CD1-CD1 3.77Å; L362-I366 HydrophobicContact CD1-CG1 4.18Å; L362-I366 HydrophobicContact CG-CD1 3.98Å; L362-I366 WeakPolarHBondContact O-CG1 3.42Å; L362-I366 PolarHBondContact O-N 3.42Å; E363-I366 PolarHBondContact O-N 3.47Å; I366-T369 PolarHBondContact O-N 3.27Å; I366-A370 VanDerWaalsContact O-CB 3.25Å; I366-A370 WeakPolarHBondContact O-CB 3.48Å; I366-A370 PolarHBondContact O-N 3.46Å
367	L	75.1	Confident	74.3	Confident	88 Å²	88	97.5 Å²	97.5	46%	0.461	46%	0.464	S	S	.	.	H	α-helix	trans	-62.1	-44.7	179	-73.8	172.3	0	0	0	111.6	E363 A370 N371	E363-L367 HydrophobicContact CG-CD1 3.98Å; E363-L367 WeakPolarHBondContact O-CB 3.15Å; E363-L367 WeakPolarHBondContact O-CG 3.28Å; E363-L367 PolarHBondContact O-N 3.49Å; L367-A370 PolarHBondContact O-N 3.01Å; L367-N371 VanDerWaalsContact O-CB 3.3Å; L367-N371 WeakPolarHBondContact O-CB 3.33Å; L367-N371 PolarHBondContact O-N 3.3Å
368	K	76.1	Confident	73.1	Confident	141 Å²	141	92.4 Å²	92.4	61%	0.613	45%	0.454	S	S	*	.	H	α-helix	trans	-62.7	-44.1	175.8	-169.1	177.4	-176.5	-179	0	111.6	D364 A370 N372	D364-K368 WeakPolarHBondContact O-CB 3.43Å; D364-K368 PolarHBondContact O-N 2.92Å; K368-A370 VanDerWaalsContact C-N 3.35Å; K368-A370 PolarHBondContact O-N 3.46Å; K368-N372 VanDerWaalsContact O-CB 3.29Å; K368-N372 WeakPolarHBondContact O-CB 3.25Å; K368-N372 PolarHBondContact O-N 2.91Å; K368-N372 PolarHBondContact O-OD1 3.15Å; K368-N372 VanDerWaalsContact O-OD1 3.13Å
369	T	72.7	Confident	72.2	Confident	41 Å²	41	93.7 Å²	93.7	25%	0.252	46%	0.463	S	S	.	.	H	α-helix	trans	-65.9	-38	178.8	-56.9	0	0	0	0	111.8	K346 Y365 I366 Y373	K346-T369 HydrophobicContact CD-CG2 4.05Å; Y365-T369 VanDerWaalsContact O-CB 3.22Å; Y365-T369 WeakPolarHBondContact O-CB 3.22Å; Y365-T369 PolarHBondContact O-N 2.98Å; Y365-T369 PolarHBondContact O-OG1 3.02Å; I366-T369 PolarHBondContact O-N 3.27Å; T369-Y373 PolarHBondContact O-N 3.04Å
370	A	69.7	Low	71.7	Confident	43 Å²	43	87.1 Å²	87.1	36%	0.355	44%	0.437	S	S	.	.	H	α-helix	trans	-73.2	-44.4	178.7	0	0	0	0	0	112.6	I366 L367 K368 Y373 Q374	I366-A370 VanDerWaalsContact O-CB 3.25Å; I366-A370 WeakPolarHBondContact O-CB 3.48Å; I366-A370 PolarHBondContact O-N 3.46Å; L367-A370 PolarHBondContact O-N 3.01Å; K368-A370 VanDerWaalsContact C-N 3.35Å; K368-A370 PolarHBondContact O-N 3.46Å; A370-Y373 VanDerWaalsContact O-CB 3.27Å; A370-Y373 WeakPolarHBondContact O-CB 3.14Å; A370-Y373 PolarHBondContact O-N 3.44Å; A370-Y373 VanDerWaalsContact O-N 3.13Å; A370-Q374 PolarHBondContact O-N 3.39Å
371	N	62.7	Low	71	Confident	86 Å²	86	83.9 Å²	83.9	46%	0.46	43%	0.427	S	S	.	.	H	α-helix	trans	-67.2	-42.3	179.7	-75.4	-11.1	0	0	0	112	L367 Y373 Q374 E375	L367-N371 VanDerWaalsContact O-CB 3.3Å; L367-N371 WeakPolarHBondContact O-CB 3.33Å; L367-N371 PolarHBondContact O-N 3.3Å; N371-Y373 PolarHBondContact O-N 3.38Å; N371-Q374 PolarHBondContact O-N 3.1Å; N371-E375 PolarHBondContact O-N 3.1Å; N371-E375 VanDerWaalsContact O-N 3.11Å
372	N	62.4	Low	70.7	Confident	84 Å²	84	80.8 Å²	80.8	45%	0.449	42%	0.424	S	S	.	.	H	α-helix	trans	-59.4	-31.4	172.8	-70.8	17.1	0	0	0	111.5	K368 Q374	K368-N372 VanDerWaalsContact O-CB 3.29Å; K368-N372 WeakPolarHBondContact O-CB 3.25Å; K368-N372 PolarHBondContact O-N 2.91Å; K368-N372 PolarHBondContact O-OD1 3.15Å; K368-N372 VanDerWaalsContact O-OD1 3.13Å; N372-Q374 VanDerWaalsContact C-N 3.32Å; N372-Q374 PolarHBondContact O-N 3.37Å
373	Y	57.9	Low	70.7	Confident	142 Å²	142	82 Å²	82	56%	0.557	43%	0.428	S	S	*	.	H	α-helix	trans	-71.4	-24.8	176.7	-153.7	-91.7	0	0	0	113.2	T369 A370 N371 I377	T369-Y373 PolarHBondContact O-N 3.04Å; A370-Y373 VanDerWaalsContact O-CB 3.27Å; A370-Y373 WeakPolarHBondContact O-CB 3.14Å; A370-Y373 PolarHBondContact O-N 3.44Å; A370-Y373 VanDerWaalsContact O-N 3.13Å; N371-Y373 PolarHBondContact O-N 3.38Å; Y373-I377 HydrophobicContact CD1-CD1 4.41Å; Y373-I377 HydrophobicContact CD2-CD1 4.02Å; Y373-I377 HydrophobicContact CE1-CD1 4.4Å; Y373-I377 HydrophobicContact CE2-CD1 4.03Å; Y373-I377 HydrophobicContact CG-CD1 4.22Å; Y373-I377 WeakPolarHBondContact O-CB 3.09Å
374	Q	53.2	Low	71.1	Confident	145 Å²	145	76.3 Å²	76.3	68%	0.678	40%	0.402	S	S	*	.	H	α-helix	trans	-101.2	-34.4	-170.5	-123.4	159.5	-1	0	0	113.8	A370 N371 N372 G378	A370-Q374 PolarHBondContact O-N 3.39Å; N371-Q374 PolarHBondContact O-N 3.1Å; N372-Q374 VanDerWaalsContact C-N 3.32Å; N372-Q374 PolarHBondContact O-N 3.37Å; Q374-G378 PolarHBondContact O-N 3.26Å
375	E	59.4	Low	71.2	Confident	154 Å²	154	78 Å²	78	72%	0.72	41%	0.405	S	S	*	.	H	α-helix	trans	-78.8	-44.1	-178.8	-74.5	-174.6	160.9	0	0	113.4	N371 S379	N371-E375 PolarHBondContact O-N 3.1Å; N371-E375 VanDerWaalsContact O-N 3.11Å; E375-S379 WeakPolarHBondContact O-CB 3.44Å
376	E	59.7	Low	71	Confident	125 Å²	125	75.1 Å²	75.1	58%	0.584	39%	0.394	S	S	*	.	H	α-helix	trans	-80.2	-45.1	-176.6	-72.3	175.8	179.6	0	0	112.5	L380	E376-L380 PolarHBondContact O-N 3.44Å
377	I	61.7	Low	70.6	Confident	30 Å²	30	75.6 Å²	75.6	15%	0.154	40%	0.402	C	S	.	.	H	α-helix	trans	-78.6	-37.4	-175	-59.4	173.9	0	0	0	111.3	Y373 L380 L381 I394	Y373-I377 HydrophobicContact CD1-CD1 4.41Å; Y373-I377 HydrophobicContact CD2-CD1 4.02Å; Y373-I377 HydrophobicContact CE1-CD1 4.4Å; Y373-I377 HydrophobicContact CE2-CD1 4.03Å; Y373-I377 HydrophobicContact CG-CD1 4.22Å; Y373-I377 WeakPolarHBondContact O-CB 3.09Å; I377-L380 PolarHBondContact O-N 2.95Å; I377-L381 HydrophobicContact CG2-CD1 3.76Å; I377-L381 HydrophobicContact CG2-CG 4.23Å; I377-L381 WeakPolarHBondContact O-CG 3.29Å; I377-L381 PolarHBondContact O-N 3.19Å; I377-I394 HydrophobicContact CG1-CD1 4.35Å; I377-I394 HydrophobicContact CG2-CD1 4.25Å
378	G	64.7	Low	70.7	Confident	43 Å²	43	75.7 Å²	75.7	44%	0.443	41%	0.406	S	S	.	.	H	α-helix	trans	-65.7	-42.1	-179.4	0	0	0	0	0	113	Q374 L380 G382	Q374-G378 PolarHBondContact O-N 3.26Å; G378-L380 VanDerWaalsContact C-N 3.35Å; G378-G382 PolarHBondContact O-N 3.3Å; G378-G382 VanDerWaalsContact O-N 3.1Å
379	S	70.8	Confident	71.2	Confident	60 Å²	60	69 Å²	69	42%	0.42	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-44.8	173.4	161.6	0	0	0	0	111.8	E375 G382 K383	E375-S379 WeakPolarHBondContact O-CB 3.44Å; S379-G382 PolarHBondContact O-N 3.47Å; S379-K383 PolarHBondContact O-N 3.42Å
380	L	76	Confident	71.6	Confident	5 Å²	5	67 Å²	67	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-68.7	-46.2	-177.3	-161.7	152.8	0	0	0	111.9	E376 I377 G378 G382 K383 I384 A390 L393 I394 I397 L409	E376-L380 PolarHBondContact O-N 3.44Å; I377-L380 PolarHBondContact O-N 2.95Å; G378-L380 VanDerWaalsContact C-N 3.35Å; L380-G382 PolarHBondContact O-N 2.65Å; L380-K383 PolarHBondContact O-N 3.31Å; L380-K383 VanDerWaalsContact O-N 3.16Å; L380-I384 HydrophobicContact CD2-CB 4.16Å; L380-I384 HydrophobicContact CD2-CG1 4.11Å; L380-I384 HydrophobicContact CG-CG1 4.46Å; L380-I384 WeakPolarHBondContact O-CB 3.33Å; L380-I384 PolarHBondContact O-N 2.77Å; L380-A390 VanDerWaalsContact CD2-CA 3.47Å; L380-A390 HydrophobicContact CD2-CB 3.45Å; L380-A390 VanDerWaalsContact CD2-CB 3.45Å; L380-L393 HydrophobicContact CD1-CB 4.14Å; L380-I394 HydrophobicContact CD1-CG1 3.74Å; L380-I394 HydrophobicContact CD2-CD1 4.49Å; L380-I394 HydrophobicContact CD2-CG1 4.32Å; L380-I397 HydrophobicContact CD1-CD1 3.64Å; L380-L409 HydrophobicContact CG-CD2 4.1Å
381	L	70.1	Confident	71.7	Confident	91 Å²	91	67 Å²	67	48%	0.476	37%	0.369	S	S	.	.	H	α-helix	trans	-65.6	-24.2	175.9	-69.1	173.1	0	0	0	113	I377 A390	I377-L381 HydrophobicContact CG2-CD1 3.76Å; I377-L381 HydrophobicContact CG2-CG 4.23Å; I377-L381 WeakPolarHBondContact O-CG 3.29Å; I377-L381 PolarHBondContact O-N 3.19Å; L381-A390 HydrophobicContact CD2-CB 3.97Å
382	G	78.2	Confident	72.8	Confident	43 Å²	43	64.8 Å²	64.8	44%	0.443	36%	0.355	S	S	.	.	H	α-helix	trans	-65.4	-45.3	171.4	0	0	0	0	0	112.5	G378 S379 L380 K385	G378-G382 PolarHBondContact O-N 3.3Å; G378-G382 VanDerWaalsContact O-N 3.1Å; S379-G382 PolarHBondContact O-N 3.47Å; L380-G382 PolarHBondContact O-N 2.65Å; G382-K385 PolarHBondContact O-NZ 2.94Å
383	K	85.5	Confident	74	Confident	47 Å²	47	60.9 Å²	60.9	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-84.9	-36.2	-174.4	-69.4	175	-177.3	171.2	0	114.1	S379 L380 L409 S413 L415	S379-K383 PolarHBondContact O-N 3.42Å; L380-K383 PolarHBondContact O-N 3.31Å; L380-K383 VanDerWaalsContact O-N 3.16Å; K383-L409 HydrophobicContact CB-CD2 4.42Å; K383-L409 HydrophobicContact CD-CD2 4.15Å; K383-L409 PolarHBondContact NZ-O 2.72Å; K383-S413 VanDerWaalsContact CB-O 3.28Å; K383-S413 WeakPolarHBondContact CB-O 3.46Å; K383-S413 WeakPolarHBondContact CG-O 3.29Å; K383-L415 PolarHBondContact O-N 3.49Å
384	I	88	Confident	75.1	Confident	1 Å²	1	56 Å²	56	1%	0.005	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-112.3	102.9	-174.6	-51.8	-58.2	0	0	0	108.6	L380 I389 A390 L393 L409 L415 L454	L380-I384 HydrophobicContact CD2-CB 4.16Å; L380-I384 HydrophobicContact CD2-CG1 4.11Å; L380-I384 HydrophobicContact CG-CG1 4.46Å; L380-I384 WeakPolarHBondContact O-CB 3.33Å; L380-I384 PolarHBondContact O-N 2.77Å; I384-I389 HydrophobicContact CG2-CB 4.12Å; I384-I389 HydrophobicContact CG2-CG2 4.01Å; I384-A390 HydrophobicContact CB-CB 4.28Å; I384-A390 HydrophobicContact CG2-CB 4.01Å; I384-L393 HydrophobicContact CD1-CD1 4.27Å; I384-L393 HydrophobicContact CG1-CD1 4.04Å; I384-L409 HydrophobicContact CD1-CD2 4.11Å; I384-L409 HydrophobicContact CG1-CD2 3.85Å; I384-L415 HydrophobicContact CD1-CB 3.7Å; I384-L415 HydrophobicContact CD1-CD2 4.38Å; I384-L415 HydrophobicContact CG2-CB 4.44Å; I384-L415 HydrophobicContact CG2-CD2 3.94Å; I384-L454 HydrophobicContact CD1-CB 4.45Å; I384-L454 HydrophobicContact CD1-CD1 3.79Å
385	K	84.4	Confident	76.4	Confident	126 Å²	126	52 Å²	52	55%	0.548	31%	0.305	S	S	.	.			trans	-75.6	-24.8	-176.9	-60.9	-56.1	-177.1	-159.9	0	113.3	G382 P387 L415 D417	G382-K385 PolarHBondContact O-NZ 2.94Å; K385-P387 VanDerWaalsContact O-CD 3.29Å; K385-P387 WeakPolarHBondContact O-CD 3.41Å; K385-L415 WeakPolarHBondContact CB-O 3.35Å; K385-L415 PolarHBondContact N-O 2.97Å; K385-D417 HydrophobicContact CB-CB 4.38Å
386	S	81.8	Confident	77.8	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.014	28%	0.276	C	S	.	.			trans	-77.2	115.4	177.1	-170.5	0	0	0	0	111.3	V388 I389 A390 D417	S386-V388 VanDerWaalsContact C-N 3.27Å; S386-V388 PolarHBondContact O-N 2.97Å; S386-I389 PolarHBondContact O-N 3.11Å; S386-A390 WeakPolarHBondContact O-CB 3.42Å; S386-A390 PolarHBondContact O-N 2.97Å; S386-D417 WeakPolarHBondContact CA-OD1 3.37Å; S386-D417 WeakPolarHBondContact CB-OD1 3.49Å; S386-D417 PolarHBondContact OG-OD1 3.45Å
387	P	72	Confident	79.1	Confident	90 Å²	90	41.5 Å²	41.5	58%	0.584	26%	0.257	S	S	*	.	H	α-helix	trans	-62.5	-33.8	-177.3	-23.3	34.7	0	0	0	113.3	K385 G391	K385-P387 VanDerWaalsContact O-CD 3.29Å; K385-P387 WeakPolarHBondContact O-CD 3.41Å; P387-G391 PolarHBondContact O-N 3.49Å
388	V	77.8	Confident	80.1	Confident	90 Å²	90	43.2 Å²	43.2	55%	0.545	27%	0.266	S	S	.	.	H	α-helix	trans	-66.7	-47.3	-179.2	-172.7	0	0	0	0	110.3	S386 A390 G391 F392 V424 I428	S386-V388 VanDerWaalsContact C-N 3.27Å; S386-V388 PolarHBondContact O-N 2.97Å; V388-A390 VanDerWaalsContact C-N 3.35Å; V388-G391 PolarHBondContact O-N 3.2Å; V388-F392 WeakPolarHBondContact O-CB 3.4Å; V388-F392 PolarHBondContact O-N 3.24Å; V388-V424 HydrophobicContact CB-CG1 4.47Å; V388-I428 HydrophobicContact CG1-CD1 3.55Å
389	I	86	Confident	81.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70.4	-36.5	179.9	-60.7	161.8	0	0	0	110.1	I384 S386 F392 L393 L415 V424 L427 I428 L431 W528	I384-I389 HydrophobicContact CG2-CB 4.12Å; I384-I389 HydrophobicContact CG2-CG2 4.01Å; S386-I389 PolarHBondContact O-N 3.11Å; I389-F392 WeakPolarHBondContact O-CB 3.38Å; I389-F392 PolarHBondContact O-N 3.3Å; I389-L393 HydrophobicContact CG2-CD1 4.15Å; I389-L393 HydrophobicContact CG2-CG 4.42Å; I389-L393 WeakPolarHBondContact O-CG 3.26Å; I389-L393 PolarHBondContact O-N 3.44Å; I389-L415 HydrophobicContact CB-CD2 4.19Å; I389-L415 HydrophobicContact CD1-CD2 3.64Å; I389-L415 HydrophobicContact CG1-CD2 4.48Å; I389-L415 HydrophobicContact CG2-CD2 3.72Å; I389-V424 HydrophobicContact CD1-CG1 4.12Å; I389-V424 HydrophobicContact CD1-CG2 4.34Å; I389-V424 HydrophobicContact CG1-CG1 4.11Å; I389-L427 HydrophobicContact CD1-CD2 3.86Å; I389-L427 HydrophobicContact CG2-CD2 4.31Å; I389-I428 HydrophobicContact CG1-CD1 4.47Å; I389-I428 HydrophobicContact CG1-CG1 4.19Å; I389-L431 HydrophobicContact CG2-CD1 4.47Å; I389-W528 HydrophobicContact CD1-CH2 3.66Å; I389-W528 HydrophobicContact CD1-CZ2 3.9Å
390	A	81.3	Confident	81.9	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-49.4	174.5	0	0	0	0	0	112	L380 L381 I384 S386 V388 F392 L393 I394	L380-A390 VanDerWaalsContact CD2-CA 3.47Å; L380-A390 HydrophobicContact CD2-CB 3.45Å; L380-A390 VanDerWaalsContact CD2-CB 3.45Å; L381-A390 HydrophobicContact CD2-CB 3.97Å; I384-A390 HydrophobicContact CB-CB 4.28Å; I384-A390 HydrophobicContact CG2-CB 4.01Å; S386-A390 WeakPolarHBondContact O-CB 3.42Å; S386-A390 PolarHBondContact O-N 2.97Å; V388-A390 VanDerWaalsContact C-N 3.35Å; A390-F392 VanDerWaalsContact C-N 3.29Å; A390-F392 PolarHBondContact O-N 3.01Å; A390-L393 PolarHBondContact O-N 3.02Å; A390-I394 VanDerWaalsContact O-CG1 3.26Å; A390-I394 WeakPolarHBondContact O-CG1 3.39Å; A390-I394 PolarHBondContact O-N 2.67Å
391	G	72.6	Confident	82.4	Confident	41 Å²	41	47.4 Å²	47.4	42%	0.423	27%	0.269	S	S	.	.	H	α-helix	trans	-60.9	-38.2	175.5	0	0	0	0	0	112.8	P387 V388 I394 S395	P387-G391 PolarHBondContact O-N 3.49Å; V388-G391 PolarHBondContact O-N 3.2Å; G391-I394 PolarHBondContact O-N 3.09Å; G391-S395 PolarHBondContact O-N 3.16Å; G391-S395 VanDerWaalsContact O-N 3.12Å
392	F	85	Confident	83.1	Confident	41 Å²	41	49.2 Å²	49.2	18%	0.18	28%	0.279	C	S	.	.	H	α-helix	trans	-64.5	-44.6	175.2	-179.8	-96.9	0	0	0	113.1	V388 I389 A390 S395 K396 I428 L431 G432	V388-F392 WeakPolarHBondContact O-CB 3.4Å; V388-F392 PolarHBondContact O-N 3.24Å; I389-F392 WeakPolarHBondContact O-CB 3.38Å; I389-F392 PolarHBondContact O-N 3.3Å; A390-F392 VanDerWaalsContact C-N 3.29Å; A390-F392 PolarHBondContact O-N 3.01Å; F392-S395 PolarHBondContact O-N 3.17Å; F392-S395 PolarHBondContact O-OG 3.41Å; F392-K396 HydrophobicContact CE1-CG 4Å; F392-K396 HydrophobicContact CZ-CG 4.02Å; F392-K396 PolarHBondContact O-N 3.42Å; F392-K396 VanDerWaalsContact O-N 3.13Å; F392-I428 HydrophobicContact CD2-CG2 3.81Å; F392-I428 HydrophobicContact CE2-CG2 3.83Å; F392-I428 HydrophobicContact CG-CG1 4.48Å; F392-I428 HydrophobicContact CG-CG2 4.21Å; F392-I428 HydrophobicContact CZ-CG2 4.24Å; F392-L431 HydrophobicContact CE1-CB 3.83Å; F392-G432 VanDerWaalsContact CZ-CA 3.43Å
393	L	87.6	Confident	83.5	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-40	177	-73.7	171	0	0	0	111.6	L380 I384 I389 A390 S395 K396 I397 L409 L431 I435 L454	L380-L393 HydrophobicContact CD1-CB 4.14Å; I384-L393 HydrophobicContact CD1-CD1 4.27Å; I384-L393 HydrophobicContact CG1-CD1 4.04Å; I389-L393 HydrophobicContact CG2-CD1 4.15Å; I389-L393 HydrophobicContact CG2-CG 4.42Å; I389-L393 WeakPolarHBondContact O-CG 3.26Å; I389-L393 PolarHBondContact O-N 3.44Å; A390-L393 PolarHBondContact O-N 3.02Å; L393-S395 VanDerWaalsContact C-N 3.29Å; L393-S395 PolarHBondContact O-N 3.19Å; L393-K396 PolarHBondContact O-N 3.13Å; L393-K396 VanDerWaalsContact O-N 3.15Å; L393-I397 VanDerWaalsContact O-CG1 3.29Å; L393-I397 WeakPolarHBondContact O-CG1 3.44Å; L393-I397 PolarHBondContact O-N 3.43Å; L393-L409 HydrophobicContact CD1-CD1 4.3Å; L393-L431 HydrophobicContact CD2-CD1 4.23Å; L393-I435 HydrophobicContact CD2-CD1 4.34Å; L393-L454 HydrophobicContact CD1-CD1 3.92Å
394	I	81.7	Confident	83.6	Confident	38 Å²	38	49.9 Å²	49.9	20%	0.195	28%	0.283	C	S	.	.	H	α-helix	trans	-57.7	-43.7	175	-69	166	0	0	0	110.8	I377 L380 A390 G391 K396 I397 N398	I377-I394 HydrophobicContact CG1-CD1 4.35Å; I377-I394 HydrophobicContact CG2-CD1 4.25Å; L380-I394 HydrophobicContact CD1-CG1 3.74Å; L380-I394 HydrophobicContact CD2-CD1 4.49Å; L380-I394 HydrophobicContact CD2-CG1 4.32Å; A390-I394 VanDerWaalsContact O-CG1 3.26Å; A390-I394 WeakPolarHBondContact O-CG1 3.39Å; A390-I394 PolarHBondContact O-N 2.67Å; G391-I394 PolarHBondContact O-N 3.09Å; I394-K396 VanDerWaalsContact C-N 3.33Å; I394-K396 PolarHBondContact O-N 3.3Å; I394-I397 PolarHBondContact O-N 3.44Å; I394-N398 PolarHBondContact O-N 3.34Å; I394-N398 PolarHBondContact O-ND2 3.45Å
395	S	80.2	Confident	83.8	Confident	61 Å²	61	50.1 Å²	50.1	43%	0.427	28%	0.284	S	S	.	.	H	α-helix	trans	-65.4	-37.6	178.2	74.7	0	0	0	0	112	G391 F392 L393 N398 R399	G391-S395 PolarHBondContact O-N 3.16Å; G391-S395 VanDerWaalsContact O-N 3.12Å; F392-S395 PolarHBondContact O-N 3.17Å; F392-S395 PolarHBondContact O-OG 3.41Å; L393-S395 VanDerWaalsContact C-N 3.29Å; L393-S395 PolarHBondContact O-N 3.19Å; S395-N398 PolarHBondContact O-N 3.11Å; S395-R399 WeakPolarHBondContact O-CB 3.3Å; S395-R399 PolarHBondContact O-N 3.09Å
396	K	88.3	Confident	84.1	Confident	26 Å²	26	47.7 Å²	47.7	11%	0.113	28%	0.279	C	S	.	.	H	α-helix	trans	-69.6	-34.9	175	-71.8	-64.6	-173.5	169.4	0	113.5	F392 L393 I394 R399 A400 L407 G432 I435 E436	F392-K396 HydrophobicContact CE1-CG 4Å; F392-K396 HydrophobicContact CZ-CG 4.02Å; F392-K396 PolarHBondContact O-N 3.42Å; F392-K396 VanDerWaalsContact O-N 3.13Å; L393-K396 PolarHBondContact O-N 3.13Å; L393-K396 VanDerWaalsContact O-N 3.15Å; I394-K396 VanDerWaalsContact C-N 3.33Å; I394-K396 PolarHBondContact O-N 3.3Å; K396-R399 PolarHBondContact O-N 3.39Å; K396-A400 PolarHBondContact O-N 3.32Å; K396-L407 HydrophobicContact CB-CD2 4.37Å; K396-G432 PolarHBondContact NZ-O 2.85Å; K396-I435 HydrophobicContact CB-CD1 4.19Å; K396-I435 HydrophobicContact CB-CG2 4.24Å; K396-I435 HydrophobicContact CD-CB 4.46Å; K396-I435 HydrophobicContact CD-CG2 3.98Å; K396-I435 HydrophobicContact CG-CD1 4.18Å; K396-I435 HydrophobicContact CG-CG2 4.34Å; K396-E436 IonicContact NZ-OE2 2.82Å; K396-E436 PolarHBondContact NZ-OE2 2.87Å
397	I	88	Confident	84.5	Confident	33 Å²	33	48.1 Å²	48.1	17%	0.169	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-47.9	172.3	-69.2	165.1	0	0	0	110.3	L380 L393 I394 R399 A400 T401 L407	L380-I397 HydrophobicContact CD1-CD1 3.64Å; L393-I397 VanDerWaalsContact O-CG1 3.29Å; L393-I397 WeakPolarHBondContact O-CG1 3.44Å; L393-I397 PolarHBondContact O-N 3.43Å; I394-I397 PolarHBondContact O-N 3.44Å; I397-R399 VanDerWaalsContact C-N 3.33Å; I397-R399 PolarHBondContact O-N 3.22Å; I397-A400 PolarHBondContact O-N 2.92Å; I397-T401 PolarHBondContact O-N 2.98Å; I397-T401 PolarHBondContact O-OG1 3.05Å; I397-L407 HydrophobicContact CB-CD2 4.37Å; I397-L407 HydrophobicContact CG1-CB 4.36Å; I397-L407 HydrophobicContact CG1-CD2 3.43Å; I397-L407 VanDerWaalsContact CG1-CD2 3.43Å; I397-L407 HydrophobicContact CG1-CG 4.46Å
398	N	82	Confident	85.4	Confident	66 Å²	66	47 Å²	47	35%	0.353	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-43.5	176.7	-67.7	-22.3	0	0	0	110.9	I394 S395 A400 T401 D402	I394-N398 PolarHBondContact O-N 3.34Å; I394-N398 PolarHBondContact O-ND2 3.45Å; S395-N398 PolarHBondContact O-N 3.11Å; N398-A400 PolarHBondContact O-N 3.32Å; N398-T401 WeakPolarHBondContact O-CB 3.22Å; N398-T401 PolarHBondContact O-N 3.36Å; N398-T401 VanDerWaalsContact O-N 3.16Å; N398-D402 VanDerWaalsContact O-CG 3.28Å; N398-D402 PolarHBondContact O-N 3.13Å
399	R	86.3	Confident	86	Confident	110 Å²	110	43.8 Å²	43.8	42%	0.415	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-42.3	177.8	-179.6	59.3	173.6	172.6	2.5	113	S395 K396 I397 D402 L403 L439	S395-R399 WeakPolarHBondContact O-CB 3.3Å; S395-R399 PolarHBondContact O-N 3.09Å; K396-R399 PolarHBondContact O-N 3.39Å; I397-R399 VanDerWaalsContact C-N 3.33Å; I397-R399 PolarHBondContact O-N 3.22Å; R399-D402 PolarHBondContact O-N 3.32Å; R399-L403 WeakPolarHBondContact O-CG 3.3Å; R399-L403 PolarHBondContact O-N 2.85Å; R399-L439 HydrophobicContact CG-CD1 4Å
400	A	87.3	Confident	86.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-45.4	175.3	0	0	0	0	0	111	K396 I397 N398 D402 L403 G404 H405 L407 L439	K396-A400 PolarHBondContact O-N 3.32Å; I397-A400 PolarHBondContact O-N 2.92Å; N398-A400 PolarHBondContact O-N 3.32Å; A400-D402 VanDerWaalsContact C-N 3.34Å; A400-D402 PolarHBondContact O-N 2.87Å; A400-L403 CarbonylContact O-C 3.14Å; A400-L403 PolarHBondContact O-N 3.41Å; A400-L403 VanDerWaalsContact O-N 3.09Å; A400-G404 PolarHBondContact O-N 2.88Å; A400-H405 CarbonylContact C-O 3.6Å; A400-H405 HydrophobicContact CB-CB 4.45Å; A400-H405 PolarHBondContact O-N 3.29Å; A400-H405 VanDerWaalsContact O-O 3.04Å; A400-L407 HydrophobicContact CB-CB 3.68Å; A400-L439 HydrophobicContact CB-CD2 3.81Å
401	T	86.3	Confident	86.3	Confident	87 Å²	87	51 Å²	51	53%	0.534	30%	0.296	S	S	.	.	H	α-helix	trans	-59.2	-43.5	177.5	-52.4	0	0	0	0	111.9	I397 N398 L403 G404 H405	I397-T401 PolarHBondContact O-N 2.98Å; I397-T401 PolarHBondContact O-OG1 3.05Å; N398-T401 WeakPolarHBondContact O-CB 3.22Å; N398-T401 PolarHBondContact O-N 3.36Å; N398-T401 VanDerWaalsContact O-N 3.16Å; T401-L403 PolarHBondContact O-N 3.22Å; T401-G404 PolarHBondContact O-N 3.41Å; T401-H405 PolarHBondContact N-O 3.19Å
402	D	84.7	Confident	86.9	Confident	129 Å²	129	55.7 Å²	55.7	69%	0.69	31%	0.307	S	S	*	.	H	α-helix	trans	-62.9	-27.7	177.8	-72.4	-21	0	0	0	112.9	N398 R399 A400	N398-D402 VanDerWaalsContact O-CG 3.28Å; N398-D402 PolarHBondContact O-N 3.13Å; R399-D402 PolarHBondContact O-N 3.32Å; A400-D402 VanDerWaalsContact C-N 3.34Å; A400-D402 PolarHBondContact O-N 2.87Å
403	L	87.3	Confident	87.2	Confident	69 Å²	69	53.7 Å²	53.7	36%	0.361	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.2	176.2	-66.9	172.5	0	0	0	113	R399 A400 T401 L439	R399-L403 WeakPolarHBondContact O-CG 3.3Å; R399-L403 PolarHBondContact O-N 2.85Å; A400-L403 CarbonylContact O-C 3.14Å; A400-L403 PolarHBondContact O-N 3.41Å; A400-L403 VanDerWaalsContact O-N 3.09Å; T401-L403 PolarHBondContact O-N 3.22Å; L403-L439 HydrophobicContact CD1-CB 4.29Å; L403-L439 HydrophobicContact CD1-CD1 4.25Å; L403-L439 HydrophobicContact CD1-CD2 4.19Å; L403-L439 HydrophobicContact CD1-CG 4.49Å
404	G	87.7	Confident	87.3	Confident	35 Å²	35	60 Å²	60	36%	0.361	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	17.5	-178.4	0	0	0	0	0	114.6	A400 T401 P446 G447	A400-G404 PolarHBondContact O-N 2.88Å; T401-G404 PolarHBondContact O-N 3.41Å; G404-P446 WeakPolarHBondContact O-CA 3.49Å; G404-P446 WeakPolarHBondContact O-CB 3.46Å; G404-G447 PolarHBondContact O-N 2.88Å
405	H	91.5	Very high	87.7	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.028	32%	0.319	C	S	.	.			trans	-110.3	164.4	176.7	-54.9	-63.6	0	0	0	111.4	A400 T401 L439 L442 G443 E445 G448	A400-H405 CarbonylContact C-O 3.6Å; A400-H405 HydrophobicContact CB-CB 4.45Å; A400-H405 PolarHBondContact O-N 3.29Å; A400-H405 VanDerWaalsContact O-O 3.04Å; T401-H405 PolarHBondContact N-O 3.19Å; H405-L439 HydrophobicContact CB-CD2 4.24Å; H405-L442 HydrophobicContact CB-CD1 4.24Å; H405-L442 VanDerWaalsContact CE1-CB 3.49Å; H405-L442 WeakPolarHBondContact CE1-CB 3.44Å; H405-G443 PolarHBondContact CE1-O 3.18Å; H405-G443 PolarHBondContact NE2-O 3Å; H405-E445 PolarHBondContact CE1-O 3.38Å; H405-G448 WeakPolarHBondContact CA-O 3.49Å; H405-G448 WeakPolarHBondContact CB-O 3.38Å; H405-G448 PolarHBondContact ND1-N 2.93Å
406	T	90.8	Very high	88.1	Confident	74 Å²	74	56.6 Å²	56.6	45%	0.454	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.4	177.3	-51.1	0	0	0	0	110	I408 G448 E449 I450	T406-I408 HydrophobicContact CG2-CD1 4.03Å; T406-I408 HydrophobicContact CG2-CG1 3.65Å; T406-G448 PolarHBondContact N-O 3.39Å; T406-E449 WeakPolarHBondContact O-CA 3.43Å; T406-I450 PolarHBondContact O-N 3.04Å
407	L	91.3	Very high	87.9	Confident	12 Å²	12	58 Å²	58	6%	0.063	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	114.7	169.8	-171.2	112.6	0	0	0	109.7	K396 I397 A400 I435 I450 V452	K396-L407 HydrophobicContact CB-CD2 4.37Å; I397-L407 HydrophobicContact CB-CD2 4.37Å; I397-L407 HydrophobicContact CG1-CB 4.36Å; I397-L407 HydrophobicContact CG1-CD2 3.43Å; I397-L407 VanDerWaalsContact CG1-CD2 3.43Å; I397-L407 HydrophobicContact CG1-CG 4.46Å; A400-L407 HydrophobicContact CB-CB 3.68Å; L407-I435 HydrophobicContact CD1-CB 4.45Å; L407-I435 HydrophobicContact CD1-CD1 4.17Å; L407-I435 HydrophobicContact CD1-CG1 4.09Å; L407-I435 HydrophobicContact CD1-CG2 3.53Å; L407-I450 CarbonylContact C-O 3.55Å; L407-I450 VanDerWaalsContact CA-O 3.31Å; L407-I450 WeakPolarHBondContact CA-O 3.05Å; L407-I450 HydrophobicContact CD1-CB 3.85Å; L407-I450 HydrophobicContact CD1-CD1 4.28Å; L407-I450 HydrophobicContact CD1-CG2 3.66Å; L407-V452 HydrophobicContact CD1-CG2 4.24Å; L407-V452 HydrophobicContact CG-CG2 4.47Å
408	I	90.1	Very high	87.7	Confident	65 Å²	65	56.9 Å²	56.9	33%	0.333	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.6	-175.9	-52.4	-175.3	0	0	0	109.9	T406 E449 I450 S451 V452	T406-I408 HydrophobicContact CG2-CD1 4.03Å; T406-I408 HydrophobicContact CG2-CG1 3.65Å; I408-E449 HydrophobicContact CD1-CG 4.09Å; I408-E449 WeakPolarHBondContact CD1-OE1 3.44Å; I408-E449 HydrophobicContact CG1-CG 4.47Å; I408-I450 PolarHBondContact N-O 3.07Å; I408-S451 CarbonylContact O-C 3.54Å; I408-S451 WeakPolarHBondContact O-CA 3.38Å; I408-V452 PolarHBondContact O-N 2.82Å
409	L	90.5	Very high	87.4	Confident	23 Å²	23	56.9 Å²	56.9	12%	0.12	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	112.2	167.3	-176.6	70.8	0	0	0	109.4	L380 K383 I384 L393 S413 V452 L454	L380-L409 HydrophobicContact CG-CD2 4.1Å; K383-L409 HydrophobicContact CB-CD2 4.42Å; K383-L409 HydrophobicContact CD-CD2 4.15Å; K383-L409 PolarHBondContact NZ-O 2.72Å; I384-L409 HydrophobicContact CD1-CD2 4.11Å; I384-L409 HydrophobicContact CG1-CD2 3.85Å; L393-L409 HydrophobicContact CD1-CD1 4.3Å; L409-S413 WeakPolarHBondContact CD1-OG 3.5Å; L409-V452 HydrophobicContact CD1-CB 4.37Å; L409-V452 HydrophobicContact CD1-CG1 4.27Å; L409-L454 HydrophobicContact CD1-CD1 4.45Å
410	N	90	Very high	87.4	Confident	52 Å²	52	53 Å²	53	28%	0.278	32%	0.315	S	S	.	.			trans	-55.4	144.8	-175.2	-81.8	-28.5	0	0	0	112.2	E412 S413 V452 T453	N410-E412 PolarHBondContact O-N 3.21Å; N410-S413 VanDerWaalsContact O-CB 3.24Å; N410-S413 WeakPolarHBondContact O-CB 3.43Å; N410-S413 PolarHBondContact O-N 3.48Å; N410-S413 PolarHBondContact O-OG 3.06Å; N410-V452 PolarHBondContact N-O 3.23Å; N410-T453 HydrophobicContact CB-CG2 4.43Å; N410-T453 PolarHBondContact ND2-OG1 3.31Å
411	S	83.3	Confident	87	Confident	100 Å²	100	58.6 Å²	58.6	70%	0.699	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-30.4	-176.4	50.2	0	0	0	0	113.2	S413	S411-S413 PolarHBondContact O-N 2.87Å
412	E	85.2	Confident	86.9	Confident	140 Å²	140	59.9 Å²	59.9	65%	0.654	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-6.3	178.8	-55.6	-170.9	168.8	0	0	113.7	N410 Q414	N410-E412 PolarHBondContact O-N 3.21Å; E412-Q414 PolarHBondContact O-N 3.3Å
413	S	90.6	Very high	87.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.314	C	S	.	.			trans	-64.2	123.2	-178.8	-61.8	0	0	0	0	111.3	K383 L409 N410 S411 L454	K383-S413 VanDerWaalsContact CB-O 3.28Å; K383-S413 WeakPolarHBondContact CB-O 3.46Å; K383-S413 WeakPolarHBondContact CG-O 3.29Å; L409-S413 WeakPolarHBondContact CD1-OG 3.5Å; N410-S413 VanDerWaalsContact O-CB 3.24Å; N410-S413 WeakPolarHBondContact O-CB 3.43Å; N410-S413 PolarHBondContact O-N 3.48Å; N410-S413 PolarHBondContact O-OG 3.06Å; S411-S413 PolarHBondContact O-N 2.87Å; S413-L454 CarbonylContact C-O 3.53Å; S413-L454 WeakPolarHBondContact CA-O 3.45Å; S413-L454 PolarHBondContact OG-N 3.42Å; S413-L454 VanDerWaalsContact OG-N 3.14Å
414	Q	89.8	Confident	87.1	Confident	135 Å²	135	51.8 Å²	51.8	63%	0.631	30%	0.302	S	S	*	.	B	Isolated β-bridge	trans	-138.3	109.5	173.7	-66.1	-171.6	11	0	0	109.2	E412 L454 Y456	E412-Q414 PolarHBondContact O-N 3.3Å; Q414-L454 CarbonylContact C-O 3.52Å; Q414-L454 PolarHBondContact N-O 3.33Å; Q414-Y456 WeakPolarHBondContact O-CB 3.3Å; Q414-Y456 PolarHBondContact O-N 3.07Å; Q414-Y456 VanDerWaalsContact O-N 3.14Å
415	L	90.6	Very high	87	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-119.2	107.7	177.5	-175.8	67.3	0	0	0	110	K383 I384 K385 I389 L427 L454 L461 W528	K383-L415 PolarHBondContact O-N 3.49Å; I384-L415 HydrophobicContact CD1-CB 3.7Å; I384-L415 HydrophobicContact CD1-CD2 4.38Å; I384-L415 HydrophobicContact CG2-CB 4.44Å; I384-L415 HydrophobicContact CG2-CD2 3.94Å; K385-L415 WeakPolarHBondContact CB-O 3.35Å; K385-L415 PolarHBondContact N-O 2.97Å; I389-L415 HydrophobicContact CB-CD2 4.19Å; I389-L415 HydrophobicContact CD1-CD2 3.64Å; I389-L415 HydrophobicContact CG1-CD2 4.48Å; I389-L415 HydrophobicContact CG2-CD2 3.72Å; L415-L427 HydrophobicContact CD1-CD2 4.48Å; L415-L427 HydrophobicContact CD2-CD2 4Å; L415-L454 HydrophobicContact CD2-CD1 4.24Å; L415-L461 HydrophobicContact CD1-CD1 3.51Å; L415-L461 HydrophobicContact CD1-CD2 3.54Å; L415-L461 HydrophobicContact CD1-CG 4.13Å; L415-W528 HydrophobicContact CD1-CD2 4.33Å; L415-W528 HydrophobicContact CD1-CH2 4.47Å; L415-W528 HydrophobicContact CD1-CZ2 3.77Å; L415-W528 HydrophobicContact CD2-CZ2 4.4Å; L415-W528 HydrophobicContact CG-CZ2 4.28Å
416	P	88.7	Confident	86.9	Confident	25 Å²	25	52.9 Å²	52.9	16%	0.162	31%	0.307	C	S	.	.			trans	-68.2	156.6	168.6	32	-35.5	0	0	0	110.2	Y456 W528	P416-Y456 VanDerWaalsContact CD-CB 3.41Å; P416-Y456 HydrophobicContact CG-CD1 3.51Å; P416-Y456 HydrophobicContact CG-CD2 4.03Å; P416-Y456 HydrophobicContact CG-CE1 3.86Å; P416-Y456 HydrophobicContact CG-CE2 4.36Å; P416-Y456 HydrophobicContact CG-CG 3.57Å; P416-W528 PolarHBondContact O-NE1 3.01Å
417	D	84.8	Confident	87	Confident	55 Å²	55	49.4 Å²	49.4	29%	0.294	29%	0.286	S	S	.	.			trans	-67	146.8	171.9	-154.6	10.9	0	0	0	109.6	K385 S386 G530 E531	K385-D417 HydrophobicContact CB-CB 4.38Å; S386-D417 WeakPolarHBondContact CA-OD1 3.37Å; S386-D417 WeakPolarHBondContact CB-OD1 3.49Å; S386-D417 PolarHBondContact OG-OD1 3.45Å; D417-G530 WeakPolarHBondContact O-CA 3.44Å; D417-E531 PolarHBondContact O-N 2.88Å
418	S	82.7	Confident	86.9	Confident	10 Å²	10	50.6 Å²	50.6	7%	0.07	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-112.9	133.9	177	173.4	0	0	0	0	109.8	S420 Q423 W528 D529	S418-S420 PolarHBondContact O-N 3.49Å; S418-S420 WeakPolarHBondContact OG-CB 3.44Å; S418-S420 PolarHBondContact OG-N 3.16Å; S418-Q423 PolarHBondContact OG-OE1 3.47Å; S418-W528 VanDerWaalsContact CB-CE2 3.5Å; S418-D529 WeakPolarHBondContact CA-O 3.47Å
419	G	76.2	Confident	86.7	Confident	65 Å²	65	49.4 Å²	49.4	67%	0.67	29%	0.288	S	S	*	.	S	Bend	trans	-72	-8.4	170.7	0	0	0	0	0	113.5
420	S	85.5	Confident	86.8	Confident	28 Å²	28	48.3 Å²	48.3	20%	0.196	28%	0.282	C	S	.	.			trans	-94.3	108.1	-178.7	-179.3	0	0	0	0	111.3	S418 D422 Q423 V424	S418-S420 PolarHBondContact O-N 3.49Å; S418-S420 WeakPolarHBondContact OG-CB 3.44Å; S418-S420 PolarHBondContact OG-N 3.16Å; S420-D422 PolarHBondContact O-N 3.17Å; S420-Q423 VanDerWaalsContact CB-CD 3.41Å; S420-Q423 PolarHBondContact O-N 2.99Å; S420-Q423 WeakPolarHBondContact OG-CG 3.44Å; S420-Q423 PolarHBondContact OG-N 3.12Å; S420-V424 PolarHBondContact O-N 3.01Å; S420-V424 VanDerWaalsContact O-N 3.14Å
421	E	80.4	Confident	87	Confident	119 Å²	119	45.9 Å²	45.9	56%	0.556	27%	0.269	S	S	*	.	H	α-helix	trans	-55.5	-38.8	173.8	-70.1	-179	-177.7	0	0	111.9	R325 Q423 V424 A425	R325-E421 IonicContact CZ-OE2 3.84Å; R325-E421 VanDerWaalsContact CZ-OE2 3.31Å; R325-E421 IonicContact NE-OE2 3.74Å; R325-E421 PolarHBondContact NE-OE2 3.31Å; R325-E421 VanDerWaalsContact NE-OE2 3.15Å; R325-E421 IonicContact NH2-OE1 2.78Å; R325-E421 IonicContact NH2-OE2 2.86Å; R325-E421 PolarHBondContact NH2-OE2 3.42Å; E421-Q423 VanDerWaalsContact C-N 3.35Å; E421-Q423 PolarHBondContact O-N 3.02Å; E421-V424 PolarHBondContact O-N 3.42Å; E421-A425 VanDerWaalsContact O-CB 3.28Å; E421-A425 WeakPolarHBondContact O-CB 3.46Å; E421-A425 PolarHBondContact O-N 3.1Å
422	D	84	Confident	87.3	Confident	113 Å²	113	41.7 Å²	41.7	60%	0.604	24%	0.242	S	C	*	.	H	α-helix	trans	-65.6	-38.1	-178.6	-68.1	-25.2	0	0	0	111.6	S420 T426 L506	S420-D422 PolarHBondContact O-N 3.17Å; D422-T426 VanDerWaalsContact O-CB 3.22Å; D422-T426 WeakPolarHBondContact O-CB 3.47Å; D422-T426 PolarHBondContact O-N 3.17Å; D422-T426 PolarHBondContact O-OG1 3.26Å; D422-L506 HydrophobicContact CB-CD2 4.17Å
423	Q	89.5	Confident	87.5	Confident	11 Å²	11	37 Å²	37	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-47.1	175.3	-70.6	168.3	3.9	0	0	111.1	S418 S420 E421 T426 L427 L506 P527 W528 D529	S418-Q423 PolarHBondContact OG-OE1 3.47Å; S420-Q423 VanDerWaalsContact CB-CD 3.41Å; S420-Q423 PolarHBondContact O-N 2.99Å; S420-Q423 WeakPolarHBondContact OG-CG 3.44Å; S420-Q423 PolarHBondContact OG-N 3.12Å; E421-Q423 VanDerWaalsContact C-N 3.35Å; E421-Q423 PolarHBondContact O-N 3.02Å; Q423-T426 PolarHBondContact O-N 3.37Å; Q423-L427 WeakPolarHBondContact O-CB 3.22Å; Q423-L427 PolarHBondContact O-N 2.87Å; Q423-L506 HydrophobicContact CG-CD1 4.16Å; Q423-P527 VanDerWaalsContact CD-O 3.25Å; Q423-P527 WeakPolarHBondContact CG-O 3.49Å; Q423-P527 PolarHBondContact NE2-O 2.7Å; Q423-W528 HydrophobicContact CB-CE3 3.8Å; Q423-W528 HydrophobicContact CB-CH2 4.43Å; Q423-W528 HydrophobicContact CB-CZ3 3.71Å; Q423-W528 WeakPolarHBondContact O-CZ3 3.37Å; Q423-D529 PolarHBondContact NE2-OD2 3.45Å
424	V	86.7	Confident	87.6	Confident	18 Å²	18	37 Å²	37	11%	0.109	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-47.2	177.8	174.2	0	0	0	0	111.1	V388 I389 S420 E421 L427 I428 W528	V388-V424 HydrophobicContact CB-CG1 4.47Å; I389-V424 HydrophobicContact CD1-CG1 4.12Å; I389-V424 HydrophobicContact CD1-CG2 4.34Å; I389-V424 HydrophobicContact CG1-CG1 4.11Å; S420-V424 PolarHBondContact O-N 3.01Å; S420-V424 VanDerWaalsContact O-N 3.14Å; E421-V424 PolarHBondContact O-N 3.42Å; V424-L427 PolarHBondContact O-N 3.35Å; V424-I428 HydrophobicContact CG1-CD1 3.8Å; V424-I428 VanDerWaalsContact O-CG1 3.28Å; V424-I428 WeakPolarHBondContact O-CG1 3.3Å; V424-I428 PolarHBondContact O-N 2.81Å; V424-W528 HydrophobicContact CG2-CH2 4.06Å; V424-W528 HydrophobicContact CG2-CZ2 4.37Å
425	A	85.1	Confident	87.8	Confident	50 Å²	50	30.6 Å²	30.6	41%	0.413	19%	0.192	S	C	.	.	H	α-helix	trans	-64.6	-41	178.8	0	0	0	0	0	112.5	E421 I428 T429	E421-A425 VanDerWaalsContact O-CB 3.28Å; E421-A425 WeakPolarHBondContact O-CB 3.46Å; E421-A425 PolarHBondContact O-N 3.1Å; A425-I428 PolarHBondContact O-N 2.73Å; A425-T429 WeakPolarHBondContact O-CB 3.17Å; A425-T429 PolarHBondContact O-N 3.25Å; A425-T429 PolarHBondContact O-OG1 3.08Å
426	T	89.4	Confident	87.7	Confident	14 Å²	14	33.1 Å²	33.1	9%	0.086	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-43.4	176.4	-60.4	0	0	0	0	111	D422 Q423 T429 T430 Q502 V503 L506	D422-T426 VanDerWaalsContact O-CB 3.22Å; D422-T426 WeakPolarHBondContact O-CB 3.47Å; D422-T426 PolarHBondContact O-N 3.17Å; D422-T426 PolarHBondContact O-OG1 3.26Å; Q423-T426 PolarHBondContact O-N 3.37Å; T426-T429 PolarHBondContact O-N 3.1Å; T426-T430 VanDerWaalsContact O-CB 3.22Å; T426-T430 WeakPolarHBondContact O-CB 3.45Å; T426-T430 PolarHBondContact O-N 2.83Å; T426-T430 PolarHBondContact O-OG1 3.23Å; T426-Q502 HydrophobicContact CG2-CB 3.94Å; T426-V503 HydrophobicContact CG2-CG2 4.29Å; T426-L506 VanDerWaalsContact CB-CD1 3.48Å; T426-L506 HydrophobicContact CG2-CD1 3.67Å; T426-L506 HydrophobicContact CG2-CG 4.42Å; T426-L506 WeakPolarHBondContact OG1-CD1 3.31Å
427	L	92.6	Very high	87.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-43.4	176.9	-174.2	68	0	0	0	112	I389 L415 Q423 V424 T429 T430 L431 L454 L461 C463 I526 W528	I389-L427 HydrophobicContact CD1-CD2 3.86Å; I389-L427 HydrophobicContact CG2-CD2 4.31Å; L415-L427 HydrophobicContact CD1-CD2 4.48Å; L415-L427 HydrophobicContact CD2-CD2 4Å; Q423-L427 WeakPolarHBondContact O-CB 3.22Å; Q423-L427 PolarHBondContact O-N 2.87Å; V424-L427 PolarHBondContact O-N 3.35Å; L427-T429 PolarHBondContact O-N 3.15Å; L427-T430 PolarHBondContact O-N 2.87Å; L427-L431 HydrophobicContact CD1-CD1 4.07Å; L427-L431 HydrophobicContact CD1-CG 4.04Å; L427-L431 HydrophobicContact CD2-CD1 4.16Å; L427-L431 HydrophobicContact CG-CD1 3.77Å; L427-L431 HydrophobicContact CG-CG 4.16Å; L427-L431 WeakPolarHBondContact O-CB 3.37Å; L427-L431 WeakPolarHBondContact O-CG 3.47Å; L427-L431 PolarHBondContact O-N 3.05Å; L427-L454 HydrophobicContact CD1-CD2 4.34Å; L427-L461 HydrophobicContact CD1-CD2 3.74Å; L427-L461 HydrophobicContact CD2-CD2 3.49Å; L427-L461 VanDerWaalsContact CD2-CD2 3.49Å; L427-L461 HydrophobicContact CG-CD2 4.17Å; L427-C463 HydrophobicContact CD1-CB 4.2Å; L427-I526 HydrophobicContact CB-CD1 4.09Å; L427-I526 HydrophobicContact CD1-CD1 4.24Å; L427-W528 HydrophobicContact CB-CH2 4.17Å; L427-W528 HydrophobicContact CB-CZ3 3.87Å; L427-W528 HydrophobicContact CD2-CH2 3.79Å; L427-W528 HydrophobicContact CD2-CZ3 3.97Å; L427-W528 HydrophobicContact CG-CZ3 4.49Å
428	I	88.6	Confident	88.1	Confident	38 Å²	38	31.6 Å²	31.6	20%	0.195	19%	0.194	C	C	.	.	H	α-helix	trans	-59.5	-47.1	176.4	-72.4	167.9	0	0	0	110.8	V388 I389 F392 V424 A425 T430 G432	V388-I428 HydrophobicContact CG1-CD1 3.55Å; I389-I428 HydrophobicContact CG1-CD1 4.47Å; I389-I428 HydrophobicContact CG1-CG1 4.19Å; F392-I428 HydrophobicContact CD2-CG2 3.81Å; F392-I428 HydrophobicContact CE2-CG2 3.83Å; F392-I428 HydrophobicContact CG-CG1 4.48Å; F392-I428 HydrophobicContact CG-CG2 4.21Å; F392-I428 HydrophobicContact CZ-CG2 4.24Å; V424-I428 HydrophobicContact CG1-CD1 3.8Å; V424-I428 VanDerWaalsContact O-CG1 3.28Å; V424-I428 WeakPolarHBondContact O-CG1 3.3Å; V424-I428 PolarHBondContact O-N 2.81Å; A425-I428 PolarHBondContact O-N 2.73Å; I428-T430 VanDerWaalsContact C-N 3.31Å; I428-T430 PolarHBondContact O-N 2.78Å; I428-G432 WeakPolarHBondContact O-CA 3.42Å; I428-G432 PolarHBondContact O-N 3.47Å
429	T	87.2	Confident	88.5	Confident	40 Å²	40	31.4 Å²	31.4	25%	0.245	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-39.9	178.5	-53.7	0	0	0	0	110.9	A425 T426 L427 N433 L498	A425-T429 WeakPolarHBondContact O-CB 3.17Å; A425-T429 PolarHBondContact O-N 3.25Å; A425-T429 PolarHBondContact O-OG1 3.08Å; T426-T429 PolarHBondContact O-N 3.1Å; L427-T429 PolarHBondContact O-N 3.15Å; T429-N433 WeakPolarHBondContact CG2-ND2 3.42Å; T429-N433 WeakPolarHBondContact O-CB 3.25Å; T429-N433 PolarHBondContact O-N 3.02Å; T429-N433 PolarHBondContact O-ND2 2.9Å; T429-L498 HydrophobicContact CG2-CD2 4.36Å
430	T	92.4	Very high	89.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.2	-58	179	-58.9	0	0	0	0	111.4	T426 L427 I428 G432 N433 L434 V499 V503 V524	T426-T430 VanDerWaalsContact O-CB 3.22Å; T426-T430 WeakPolarHBondContact O-CB 3.45Å; T426-T430 PolarHBondContact O-N 2.83Å; T426-T430 PolarHBondContact O-OG1 3.23Å; L427-T430 PolarHBondContact O-N 2.87Å; I428-T430 VanDerWaalsContact C-N 3.31Å; I428-T430 PolarHBondContact O-N 2.78Å; T430-G432 PolarHBondContact O-N 2.82Å; T430-N433 PolarHBondContact O-N 2.87Å; T430-L434 HydrophobicContact CG2-CD1 3.76Å; T430-L434 HydrophobicContact CG2-CG 4.24Å; T430-L434 WeakPolarHBondContact O-CB 3.47Å; T430-L434 VanDerWaalsContact O-CG 3.27Å; T430-L434 WeakPolarHBondContact O-CG 3.35Å; T430-L434 PolarHBondContact O-N 2.86Å; T430-V499 HydrophobicContact CG2-CG1 3.59Å; T430-V503 HydrophobicContact CG2-CG2 4.4Å; T430-V524 HydrophobicContact CG2-CB 4.28Å; T430-V524 HydrophobicContact CG2-CG1 3.97Å; T430-V524 HydrophobicContact CG2-CG2 3.69Å
431	L	93.5	Very high	89.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.6	-40.9	175.6	-74.5	172.9	0	0	0	111.4	I389 F392 L393 L427 L434 I435 V452 L454 C463 V465	I389-L431 HydrophobicContact CG2-CD1 4.47Å; F392-L431 HydrophobicContact CE1-CB 3.83Å; L393-L431 HydrophobicContact CD2-CD1 4.23Å; L427-L431 HydrophobicContact CD1-CD1 4.07Å; L427-L431 HydrophobicContact CD1-CG 4.04Å; L427-L431 HydrophobicContact CD2-CD1 4.16Å; L427-L431 HydrophobicContact CG-CD1 3.77Å; L427-L431 HydrophobicContact CG-CG 4.16Å; L427-L431 WeakPolarHBondContact O-CB 3.37Å; L427-L431 WeakPolarHBondContact O-CG 3.47Å; L427-L431 PolarHBondContact O-N 3.05Å; L431-L434 PolarHBondContact O-N 3.4Å; L431-I435 HydrophobicContact CB-CD1 4.27Å; L431-I435 HydrophobicContact CD2-CD1 4.49Å; L431-I435 WeakPolarHBondContact O-CB 3.44Å; L431-I435 WeakPolarHBondContact O-CD1 3.28Å; L431-I435 WeakPolarHBondContact O-CG1 3.39Å; L431-I435 PolarHBondContact O-N 2.9Å; L431-V452 HydrophobicContact CD2-CG1 3.92Å; L431-L454 HydrophobicContact CD1-CD1 4.31Å; L431-L454 HydrophobicContact CD1-CD2 4.37Å; L431-L454 HydrophobicContact CD2-CD2 4.29Å; L431-C463 WeakPolarHBondContact CD2-SG 3.47Å; L431-V465 HydrophobicContact CD2-CG2 4.01Å
432	G	89.6	Confident	89.6	Confident	13 Å²	13	26.9 Å²	26.9	13%	0.134	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-46.4	179.5	0	0	0	0	0	114	F392 K396 I428 T430 E436	F392-G432 VanDerWaalsContact CZ-CA 3.43Å; K396-G432 PolarHBondContact NZ-O 2.85Å; I428-G432 WeakPolarHBondContact O-CA 3.42Å; I428-G432 PolarHBondContact O-N 3.47Å; T430-G432 PolarHBondContact O-N 2.82Å; G432-E436 VanDerWaalsContact O-CB 3.22Å; G432-E436 WeakPolarHBondContact O-CB 3.48Å; G432-E436 PolarHBondContact O-N 3.26Å; G432-E436 VanDerWaalsContact O-N 3.09Å
433	N	89.4	Confident	89.6	Confident	41 Å²	41	22.9 Å²	22.9	22%	0.219	14%	0.142	C	C	.	.	H	α-helix	trans	-70.2	-43.1	176.9	-78.7	-67.3	0	0	0	111.7	T429 T430 E436 N437 V499	T429-N433 WeakPolarHBondContact CG2-ND2 3.42Å; T429-N433 WeakPolarHBondContact O-CB 3.25Å; T429-N433 PolarHBondContact O-N 3.02Å; T429-N433 PolarHBondContact O-ND2 2.9Å; T430-N433 PolarHBondContact O-N 2.87Å; N433-E436 PolarHBondContact O-N 2.86Å; N433-N437 VanDerWaalsContact O-CB 3.32Å; N433-N437 WeakPolarHBondContact O-CB 3.27Å; N433-N437 PolarHBondContact O-N 2.96Å; N433-N437 PolarHBondContact O-ND2 3.08Å; N433-N437 PolarHBondContact O-OD1 2.87Å; N433-V499 HydrophobicContact CB-CG2 3.47Å; N433-V499 VanDerWaalsContact CB-CG2 3.47Å
434	L	93.3	Very high	89.2	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-45.2	-178.5	-65.3	-177.2	0	0	0	112.2	T430 L431 N437 A438 V465 L496 I510 F522 V524	T430-L434 HydrophobicContact CG2-CD1 3.76Å; T430-L434 HydrophobicContact CG2-CG 4.24Å; T430-L434 WeakPolarHBondContact O-CB 3.47Å; T430-L434 VanDerWaalsContact O-CG 3.27Å; T430-L434 WeakPolarHBondContact O-CG 3.35Å; T430-L434 PolarHBondContact O-N 2.86Å; L431-L434 PolarHBondContact O-N 3.4Å; L434-N437 PolarHBondContact O-N 2.85Å; L434-A438 WeakPolarHBondContact O-CB 3.45Å; L434-A438 PolarHBondContact O-N 3.19Å; L434-V465 HydrophobicContact CB-CB 4.12Å; L434-V465 HydrophobicContact CB-CG1 4.16Å; L434-V465 HydrophobicContact CB-CG2 3.95Å; L434-V465 HydrophobicContact CD1-CB 4.33Å; L434-V465 HydrophobicContact CD1-CG2 3.94Å; L434-L496 HydrophobicContact CD2-CD2 3.83Å; L434-I510 HydrophobicContact CD2-CD1 4.44Å; L434-F522 HydrophobicContact CD1-CB 3.84Å; L434-F522 HydrophobicContact CD1-CG 4.41Å; L434-F522 HydrophobicContact CD2-CB 4Å; L434-F522 HydrophobicContact CD2-CD1 3.83Å; L434-F522 HydrophobicContact CD2-CD2 3.89Å; L434-F522 HydrophobicContact CD2-CE1 4.25Å; L434-F522 HydrophobicContact CD2-CE2 4.31Å; L434-F522 HydrophobicContact CD2-CG 3.63Å; L434-F522 HydrophobicContact CD2-CZ 4.47Å; L434-F522 HydrophobicContact CG-CB 4.48Å; L434-V524 HydrophobicContact CD1-CG2 3.82Å
435	I	93.3	Very high	89	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-39.9	176.6	-65	167.4	0	0	0	110.7	L393 K396 L407 L431 A438 L439 V452 V465	L393-I435 HydrophobicContact CD2-CD1 4.34Å; K396-I435 HydrophobicContact CB-CD1 4.19Å; K396-I435 HydrophobicContact CB-CG2 4.24Å; K396-I435 HydrophobicContact CD-CB 4.46Å; K396-I435 HydrophobicContact CD-CG2 3.98Å; K396-I435 HydrophobicContact CG-CD1 4.18Å; K396-I435 HydrophobicContact CG-CG2 4.34Å; L407-I435 HydrophobicContact CD1-CB 4.45Å; L407-I435 HydrophobicContact CD1-CD1 4.17Å; L407-I435 HydrophobicContact CD1-CG1 4.09Å; L407-I435 HydrophobicContact CD1-CG2 3.53Å; L431-I435 HydrophobicContact CB-CD1 4.27Å; L431-I435 HydrophobicContact CD2-CD1 4.49Å; L431-I435 WeakPolarHBondContact O-CB 3.44Å; L431-I435 WeakPolarHBondContact O-CD1 3.28Å; L431-I435 WeakPolarHBondContact O-CG1 3.39Å; L431-I435 PolarHBondContact O-N 2.9Å; I435-A438 PolarHBondContact O-N 3.18Å; I435-L439 HydrophobicContact CG2-CD1 4.03Å; I435-L439 HydrophobicContact CG2-CG 4.36Å; I435-L439 WeakPolarHBondContact O-CB 3.31Å; I435-L439 VanDerWaalsContact O-CG 3.3Å; I435-L439 WeakPolarHBondContact O-CG 3.47Å; I435-L439 PolarHBondContact O-N 3.32Å; I435-V452 HydrophobicContact CD1-CG2 4.15Å; I435-V452 HydrophobicContact CG1-CG2 4.24Å; I435-V465 HydrophobicContact CG1-CG1 4.33Å
436	E	89.7	Confident	88.9	Confident	54 Å²	54	37.5 Å²	37.5	25%	0.252	22%	0.221	S	C	.	.	H	α-helix	trans	-66.1	-40	176.4	-159.8	69.4	-156.7	0	0	111.4	K396 G432 N433 A438 L439 E440	K396-E436 IonicContact NZ-OE2 2.82Å; K396-E436 PolarHBondContact NZ-OE2 2.87Å; G432-E436 VanDerWaalsContact O-CB 3.22Å; G432-E436 WeakPolarHBondContact O-CB 3.48Å; G432-E436 PolarHBondContact O-N 3.26Å; G432-E436 VanDerWaalsContact O-N 3.09Å; N433-E436 PolarHBondContact O-N 2.86Å; E436-A438 VanDerWaalsContact C-N 3.34Å; E436-A438 PolarHBondContact O-N 2.7Å; E436-L439 PolarHBondContact O-N 3.43Å; E436-E440 WeakPolarHBondContact O-CB 3.37Å; E436-E440 WeakPolarHBondContact O-CG 3.3Å; E436-E440 PolarHBondContact O-N 3.25Å
437	N	89.5	Confident	88.6	Confident	48 Å²	48	39.6 Å²	39.6	26%	0.257	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-43.3	174.9	-71.6	-18.3	0	0	0	111.7	N433 L434 E440 A441 L496	N433-N437 VanDerWaalsContact O-CB 3.32Å; N433-N437 WeakPolarHBondContact O-CB 3.27Å; N433-N437 PolarHBondContact O-N 2.96Å; N433-N437 PolarHBondContact O-ND2 3.08Å; N433-N437 PolarHBondContact O-OD1 2.87Å; L434-N437 PolarHBondContact O-N 2.85Å; N437-E440 PolarHBondContact O-N 3.27Å; N437-A441 VanDerWaalsContact O-CB 3.3Å; N437-A441 WeakPolarHBondContact O-CB 3.3Å; N437-A441 PolarHBondContact O-N 3.3Å; N437-L496 WeakPolarHBondContact ND2-CD2 3.4Å; N437-L496 WeakPolarHBondContact ND2-CG 3.08Å
438	A	92.1	Very high	88.5	Confident	1 Å²	1	40 Å²	40	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-61.2	-50	175.2	0	0	0	0	0	111.5	L434 I435 E436 E440 A441 L442 I450 D467	L434-A438 WeakPolarHBondContact O-CB 3.45Å; L434-A438 PolarHBondContact O-N 3.19Å; I435-A438 PolarHBondContact O-N 3.18Å; E436-A438 VanDerWaalsContact C-N 3.34Å; E436-A438 PolarHBondContact O-N 2.7Å; A438-E440 VanDerWaalsContact C-N 3.32Å; A438-E440 PolarHBondContact O-N 2.99Å; A438-A441 WeakPolarHBondContact O-CA 3.42Å; A438-A441 WeakPolarHBondContact O-CB 3.42Å; A438-A441 PolarHBondContact O-N 3.22Å; A438-L442 WeakPolarHBondContact O-CG 3.46Å; A438-L442 PolarHBondContact O-N 2.64Å; A438-I450 HydrophobicContact CB-CD1 3.64Å; A438-I450 HydrophobicContact CB-CG1 3.98Å; A438-I450 HydrophobicContact CB-CG2 4.19Å; A438-D467 HydrophobicContact CB-CB 3.78Å
439	L	90.7	Very high	88.7	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-43	175.8	-72.4	170.8	0	0	0	112.2	R399 A400 L403 H405 I435 E436 A441 I450	R399-L439 HydrophobicContact CG-CD1 4Å; A400-L439 HydrophobicContact CB-CD2 3.81Å; L403-L439 HydrophobicContact CD1-CB 4.29Å; L403-L439 HydrophobicContact CD1-CD1 4.25Å; L403-L439 HydrophobicContact CD1-CD2 4.19Å; L403-L439 HydrophobicContact CD1-CG 4.49Å; H405-L439 HydrophobicContact CB-CD2 4.24Å; I435-L439 HydrophobicContact CG2-CD1 4.03Å; I435-L439 HydrophobicContact CG2-CG 4.36Å; I435-L439 WeakPolarHBondContact O-CB 3.31Å; I435-L439 VanDerWaalsContact O-CG 3.3Å; I435-L439 WeakPolarHBondContact O-CG 3.47Å; I435-L439 PolarHBondContact O-N 3.32Å; E436-L439 PolarHBondContact O-N 3.43Å; L439-A441 VanDerWaalsContact C-N 3.26Å; L439-A441 PolarHBondContact O-N 3.49Å; L439-I450 HydrophobicContact CB-CD1 4.46Å; L439-I450 HydrophobicContact CD2-CD1 3.53Å; L439-I450 HydrophobicContact CG-CD1 3.63Å
440	E	88.2	Confident	89	Confident	59 Å²	59	40.9 Å²	40.9	28%	0.276	25%	0.25	S	C	.	.	H	α-helix	trans	-67.2	-26.6	175.8	-74.8	-166.5	176.7	0	0	112.7	E436 N437 A438 K488 R492	E436-E440 WeakPolarHBondContact O-CB 3.37Å; E436-E440 WeakPolarHBondContact O-CG 3.3Å; E436-E440 PolarHBondContact O-N 3.25Å; N437-E440 PolarHBondContact O-N 3.27Å; A438-E440 VanDerWaalsContact C-N 3.32Å; A438-E440 PolarHBondContact O-N 2.99Å; E440-K488 VanDerWaalsContact C-NZ 3.34Å; E440-K488 PolarHBondContact O-NZ 2.67Å; E440-K488 IonicContact OE2-NZ 3.63Å; E440-R492 IonicContact OE1-CZ 3.84Å; E440-R492 IonicContact OE1-NE 3.67Å; E440-R492 IonicContact OE1-NH2 2.75Å; E440-R492 PolarHBondContact OE1-NH2 3.25Å
441	A	88.1	Confident	89.1	Confident	33 Å²	33	41.7 Å²	41.7	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-79.2	-37.7	179.7	0	0	0	0	0	112.4	N437 A438 L439 G443 P470	N437-A441 VanDerWaalsContact O-CB 3.3Å; N437-A441 WeakPolarHBondContact O-CB 3.3Å; N437-A441 PolarHBondContact O-N 3.3Å; A438-A441 WeakPolarHBondContact O-CA 3.42Å; A438-A441 WeakPolarHBondContact O-CB 3.42Å; A438-A441 PolarHBondContact O-N 3.22Å; L439-A441 VanDerWaalsContact C-N 3.26Å; L439-A441 PolarHBondContact O-N 3.49Å; A441-G443 PolarHBondContact O-N 3.49Å; A441-P470 WeakPolarHBondContact O-CD 3.45Å
442	L	89.2	Confident	89.2	Confident	24 Å²	24	41.8 Å²	41.8	13%	0.126	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-24.9	174.4	-64.1	173.5	0	0	0	112.7	H405 A438 I450 D468	H405-L442 HydrophobicContact CB-CD1 4.24Å; H405-L442 VanDerWaalsContact CE1-CB 3.49Å; H405-L442 WeakPolarHBondContact CE1-CB 3.44Å; A438-L442 WeakPolarHBondContact O-CG 3.46Å; A438-L442 PolarHBondContact O-N 2.64Å; L442-I450 HydrophobicContact CD1-CD1 3.88Å; L442-I450 HydrophobicContact CD1-CG1 3.62Å; L442-D468 WeakPolarHBondContact CD2-OD1 3.36Å
443	G	82.8	Confident	89.5	Confident	29 Å²	29	41.9 Å²	41.9	30%	0.299	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	-160.9	175.2	0	0	0	0	0	112.5	H405 A441	H405-G443 PolarHBondContact CE1-O 3.18Å; H405-G443 PolarHBondContact NE2-O 3Å; A441-G443 PolarHBondContact O-N 3.49Å
444	P	81.1	Confident	89.7	Confident	126 Å²	126	39.9 Å²	39.9	82%	0.818	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-6	-174.4	33.6	-35.4	0	0	0	114.2
445	E	82.7	Confident	89.7	Confident	155 Å²	155	43.1 Å²	43.1	72%	0.724	26%	0.259	S	S	*	.	S	Bend	trans	-78.5	122.4	-178.3	-67.9	-169.3	174.2	0	0	110.1	H405	H405-E445 PolarHBondContact CE1-O 3.38Å
446	P	82.5	Confident	89.6	Confident	105 Å²	105	46.5 Å²	46.5	68%	0.682	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	153.9	-177.9	29.4	-34.9	0	0	0	111.2	G404	G404-P446 WeakPolarHBondContact O-CA 3.49Å; G404-P446 WeakPolarHBondContact O-CB 3.46Å
447	G	85.1	Confident	89.6	Confident	58 Å²	58	51.1 Å²	51.1	60%	0.598	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.2	-5.4	174.1	0	0	0	0	0	115.6	G404	G404-G447 PolarHBondContact O-N 2.88Å
448	G	89.1	Confident	89.4	Confident	10 Å²	10	56.4 Å²	56.4	10%	0.103	31%	0.31	C	S	.	.			trans	-62.9	147.6	170.6	0	0	0	0	0	113.2	H405 T406 D468	H405-G448 WeakPolarHBondContact CA-O 3.49Å; H405-G448 WeakPolarHBondContact CB-O 3.38Å; H405-G448 PolarHBondContact ND1-N 2.93Å; T406-G448 PolarHBondContact N-O 3.39Å; G448-D468 WeakPolarHBondContact CA-OD1 3.27Å
449	E	92.8	Very high	89.3	Confident	95 Å²	95	57.7 Å²	57.7	44%	0.444	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129.8	-176.9	-168.2	177.4	144.9	0	0	111	T406 I408 D468	T406-E449 WeakPolarHBondContact O-CA 3.43Å; I408-E449 HydrophobicContact CD1-CG 4.09Å; I408-E449 WeakPolarHBondContact CD1-OE1 3.44Å; I408-E449 HydrophobicContact CG1-CG 4.47Å; E449-D468 VanDerWaalsContact N-CG 3.31Å; E449-D468 PolarHBondContact N-OD1 3.09Å; E449-D468 PolarHBondContact N-OD2 3.25Å; E449-D468 PolarHBondContact O-N 2.78Å; E449-D468 VanDerWaalsContact O-OD1 3.11Å
450	I	94.5	Very high	89.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	122.3	173.1	-54.6	171.4	0	0	0	107.4	T406 L407 I408 A438 L439 L442 V465 N466 D467	T406-I450 PolarHBondContact O-N 3.04Å; L407-I450 CarbonylContact C-O 3.55Å; L407-I450 VanDerWaalsContact CA-O 3.31Å; L407-I450 WeakPolarHBondContact CA-O 3.05Å; L407-I450 HydrophobicContact CD1-CB 3.85Å; L407-I450 HydrophobicContact CD1-CD1 4.28Å; L407-I450 HydrophobicContact CD1-CG2 3.66Å; I408-I450 PolarHBondContact N-O 3.07Å; A438-I450 HydrophobicContact CB-CD1 3.64Å; A438-I450 HydrophobicContact CB-CG1 3.98Å; A438-I450 HydrophobicContact CB-CG2 4.19Å; L439-I450 HydrophobicContact CB-CD1 4.46Å; L439-I450 HydrophobicContact CD2-CD1 3.53Å; L439-I450 HydrophobicContact CG-CD1 3.63Å; L442-I450 HydrophobicContact CD1-CD1 3.88Å; L442-I450 HydrophobicContact CD1-CG1 3.62Å; I450-V465 HydrophobicContact CG2-CG1 4.11Å; I450-N466 CarbonylContact C-O 3.57Å; I450-N466 VanDerWaalsContact CA-O 3.3Å; I450-N466 WeakPolarHBondContact CA-O 3.35Å; I450-D467 HydrophobicContact CG1-CB 4.36Å
451	S	94.4	Very high	89.7	Confident	18 Å²	18	59.7 Å²	59.7	13%	0.126	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	135.1	173.6	73.3	0	0	0	0	110.7	I408 N466	I408-S451 CarbonylContact O-C 3.54Å; I408-S451 WeakPolarHBondContact O-CA 3.38Å; S451-N466 PolarHBondContact N-O 2.88Å; S451-N466 PolarHBondContact O-N 3.22Å
452	V	95.1	Very high	90	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.6	175.7	-179.9	0	0	0	0	108.7	L407 I408 L409 N410 L431 I435 L454 E464 V465	L407-V452 HydrophobicContact CD1-CG2 4.24Å; L407-V452 HydrophobicContact CG-CG2 4.47Å; I408-V452 PolarHBondContact O-N 2.82Å; L409-V452 HydrophobicContact CD1-CB 4.37Å; L409-V452 HydrophobicContact CD1-CG1 4.27Å; N410-V452 PolarHBondContact N-O 3.23Å; L431-V452 HydrophobicContact CD2-CG1 3.92Å; I435-V452 HydrophobicContact CD1-CG2 4.15Å; I435-V452 HydrophobicContact CG1-CG2 4.24Å; V452-L454 HydrophobicContact CG1-CD2 4.47Å; V452-L454 HydrophobicContact CG1-CG 4.14Å; V452-E464 CarbonylContact C-O 3.6Å; V452-E464 WeakPolarHBondContact CA-O 3.34Å; V452-V465 HydrophobicContact CG2-CG2 4.45Å
453	T	95	Very high	90.3	Very high	15 Å²	15	59.6 Å²	59.6	9%	0.092	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.2	171.6	-47.2	0	0	0	0	109.2	N410 H455 C463 E464	N410-T453 HydrophobicContact CB-CG2 4.43Å; N410-T453 PolarHBondContact ND2-OG1 3.31Å; T453-H455 HydrophobicContact CG2-CB 4.5Å; T453-C463 CarbonylContact O-C 3.57Å; T453-C463 WeakPolarHBondContact O-CA 3.43Å; T453-E464 PolarHBondContact N-O 3.32Å; T453-E464 PolarHBondContact O-N 3.27Å
454	L	94.8	Very high	90.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	101	173.4	-65.5	175.4	0	0	0	109.2	I384 L393 L409 S413 Q414 L415 L427 L431 V452 L461 C463	I384-L454 HydrophobicContact CD1-CB 4.45Å; I384-L454 HydrophobicContact CD1-CD1 3.79Å; L393-L454 HydrophobicContact CD1-CD1 3.92Å; L409-L454 HydrophobicContact CD1-CD1 4.45Å; S413-L454 CarbonylContact C-O 3.53Å; S413-L454 WeakPolarHBondContact CA-O 3.45Å; S413-L454 PolarHBondContact OG-N 3.42Å; S413-L454 VanDerWaalsContact OG-N 3.14Å; Q414-L454 CarbonylContact C-O 3.52Å; Q414-L454 PolarHBondContact N-O 3.33Å; L415-L454 HydrophobicContact CD2-CD1 4.24Å; L427-L454 HydrophobicContact CD1-CD2 4.34Å; L431-L454 HydrophobicContact CD1-CD1 4.31Å; L431-L454 HydrophobicContact CD1-CD2 4.37Å; L431-L454 HydrophobicContact CD2-CD2 4.29Å; V452-L454 HydrophobicContact CG1-CD2 4.47Å; V452-L454 HydrophobicContact CG1-CG 4.14Å; L454-L461 HydrophobicContact CB-CD1 4.44Å; L454-C463 HydrophobicContact CD2-CB 3.77Å
455	H	92.9	Very high	91.7	Very high	69 Å²	69	55.1 Å²	55.1	32%	0.319	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	108.1	-174.7	-176.5	-93.6	0	0	0	111.3	T453 H462	T453-H455 HydrophobicContact CG2-CB 4.5Å; H455-H462 PolarHBondContact N-O 2.93Å; H455-H462 PolarHBondContact O-N 2.95Å
456	Y	91.6	Very high	92.3	Very high	70 Å²	70	49.8 Å²	49.8	28%	0.275	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	126.6	175.1	172.2	-105	0	0	0	112.1	Q414 P416 W460 W528	Q414-Y456 WeakPolarHBondContact O-CB 3.3Å; Q414-Y456 PolarHBondContact O-N 3.07Å; Q414-Y456 VanDerWaalsContact O-N 3.14Å; P416-Y456 VanDerWaalsContact CD-CB 3.41Å; P416-Y456 HydrophobicContact CG-CD1 3.51Å; P416-Y456 HydrophobicContact CG-CD2 4.03Å; P416-Y456 HydrophobicContact CG-CE1 3.86Å; P416-Y456 HydrophobicContact CG-CE2 4.36Å; P416-Y456 HydrophobicContact CG-CG 3.57Å; Y456-W460 WeakPolarHBondContact CA-O 3.3Å; Y456-W460 WeakPolarHBondContact CD2-O 3.47Å; Y456-W528 HydrophobicContact CD2-CB 4Å; Y456-W528 AromaticContact CD2-CD1 3.78Å; Y456-W528 HydrophobicContact CD2-CG 4.19Å; Y456-W528 HydrophobicContact CE2-CB 4.04Å; Y456-W528 AromaticContact CE2-CD1 3.99Å; Y456-W528 HydrophobicContact CE2-CG 4.41Å; Y456-W528 WeakPolarHBondContact CE2-O 3.44Å
457	R	89.2	Confident	92.8	Very high	151 Å²	151	45 Å²	45	57%	0.57	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-148.4	129.4	176.5	-159	-171.9	177.8	174.5	-1.5	111.7	G459 W460	R457-G459 VanDerWaalsContact C-N 3.32Å; R457-G459 PolarHBondContact O-N 3.28Å; R457-W460 PolarHBondContact N-O 2.86Å; R457-W460 PolarHBondContact O-N 3.09Å
458	H	85.5	Confident	93.1	Very high	160 Å²	160	46 Å²	46	74%	0.741	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	41.2	173.4	-56.9	118.9	0	0	0	115.6	W460	H458-W460 VanDerWaalsContact C-N 3.31Å
459	G	89.8	Confident	93	Very high	27 Å²	27	45.8 Å²	45.8	28%	0.278	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	7	179.5	0	0	0	0	0	114.6	R457 W528	R457-G459 VanDerWaalsContact C-N 3.32Å; R457-G459 PolarHBondContact O-N 3.28Å; G459-W528 PolarHBondContact O-N 2.92Å
460	W	92.7	Very high	92.8	Very high	107 Å²	107	45.2 Å²	45.2	41%	0.405	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.9	174.9	-68	85.8	0	0	0	109.9	Y456 R457 H458 Q525 P527	Y456-W460 WeakPolarHBondContact CA-O 3.3Å; Y456-W460 WeakPolarHBondContact CD2-O 3.47Å; R457-W460 PolarHBondContact N-O 2.86Å; R457-W460 PolarHBondContact O-N 3.09Å; H458-W460 VanDerWaalsContact C-N 3.31Å; W460-Q525 HydrophobicContact CE3-CB 4.44Å; W460-P527 HydrophobicContact CE3-CG 4.28Å; W460-P527 HydrophobicContact CH2-CG 3.88Å; W460-P527 HydrophobicContact CZ2-CG 4.47Å; W460-P527 HydrophobicContact CZ3-CG 3.78Å
461	L	94.4	Very high	92.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.3	167.4	176.1	62.4	0	0	0	108.8	L415 L427 L454 Q525 I526 W528	L415-L461 HydrophobicContact CD1-CD1 3.51Å; L415-L461 HydrophobicContact CD1-CD2 3.54Å; L415-L461 HydrophobicContact CD1-CG 4.13Å; L427-L461 HydrophobicContact CD1-CD2 3.74Å; L427-L461 HydrophobicContact CD2-CD2 3.49Å; L427-L461 VanDerWaalsContact CD2-CD2 3.49Å; L427-L461 HydrophobicContact CG-CD2 4.17Å; L454-L461 HydrophobicContact CB-CD1 4.44Å; L461-Q525 WeakPolarHBondContact O-CA 3.06Å; L461-I526 HydrophobicContact CB-CG1 4.08Å; L461-I526 HydrophobicContact CD2-CD1 4.27Å; L461-I526 HydrophobicContact CD2-CG1 4.38Å; L461-I526 PolarHBondContact N-O 3.09Å; L461-I526 PolarHBondContact O-N 3.07Å; L461-I526 VanDerWaalsContact O-N 3.16Å; L461-W528 HydrophobicContact CB-CB 3.71Å; L461-W528 HydrophobicContact CB-CD2 4.12Å; L461-W528 HydrophobicContact CB-CE3 4.16Å; L461-W528 HydrophobicContact CB-CG 3.95Å; L461-W528 HydrophobicContact CD2-CD2 3.91Å; L461-W528 HydrophobicContact CD2-CE3 3.62Å; L461-W528 HydrophobicContact CD2-CH2 4.35Å; L461-W528 HydrophobicContact CD2-CZ3 3.85Å
462	H	95.1	Very high	92.1	Very high	54 Å²	54	46.6 Å²	46.6	25%	0.25	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	117.3	168.7	-59.7	-86.4	0	0	0	108.1	H455 Q525	H455-H462 PolarHBondContact N-O 2.93Å; H455-H462 PolarHBondContact O-N 2.95Å; H462-Q525 PolarHBondContact ND1-NE2 3.21Å
463	C	95.3	Very high	91.8	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	125.3	177.1	170.6	0	0	0	0	108.4	L427 L431 T453 L454 V524	L427-C463 HydrophobicContact CD1-CB 4.2Å; L431-C463 WeakPolarHBondContact CD2-SG 3.47Å; T453-C463 CarbonylContact O-C 3.57Å; T453-C463 WeakPolarHBondContact O-CA 3.43Å; L454-C463 HydrophobicContact CD2-CB 3.77Å; C463-V524 HydrophobicContact CB-CB 4.1Å; C463-V524 PolarHBondContact N-O 3.48Å; C463-V524 PolarHBondContact O-N 2.79Å
464	E	96.2	Very high	91.3	Very high	61 Å²	61	51.9 Å²	51.9	29%	0.285	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.8	175.5	-56.5	177	-178.8	0	0	108.7	V452 T453 Q521 F522 F523	V452-E464 CarbonylContact C-O 3.6Å; V452-E464 WeakPolarHBondContact CA-O 3.34Å; T453-E464 PolarHBondContact N-O 3.32Å; T453-E464 PolarHBondContact O-N 3.27Å; E464-Q521 PolarHBondContact OE2-NE2 3.47Å; E464-F522 WeakPolarHBondContact CA-O 3.32Å; E464-F523 HydrophobicContact CG-CD1 3.83Å; E464-F523 HydrophobicContact CG-CE1 4.15Å
465	V	96.1	Very high	90.9	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	113.6	172.1	-176.9	0	0	0	0	106.8	L431 L434 I435 I450 V452 Q521 F522	L431-V465 HydrophobicContact CD2-CG2 4.01Å; L434-V465 HydrophobicContact CB-CB 4.12Å; L434-V465 HydrophobicContact CB-CG1 4.16Å; L434-V465 HydrophobicContact CB-CG2 3.95Å; L434-V465 HydrophobicContact CD1-CB 4.33Å; L434-V465 HydrophobicContact CD1-CG2 3.94Å; I435-V465 HydrophobicContact CG1-CG1 4.33Å; I450-V465 HydrophobicContact CG2-CG1 4.11Å; V452-V465 HydrophobicContact CG2-CG2 4.45Å; V465-Q521 WeakPolarHBondContact O-CA 3.28Å; V465-F522 PolarHBondContact N-O 2.92Å; V465-F522 PolarHBondContact O-N 3.11Å
466	N	95.3	Very high	90.5	Very high	42 Å²	42	58.6 Å²	58.6	23%	0.225	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.4	-178.8	176	59.1	0	0	0	110	I450 S451 T520 Q521	I450-N466 CarbonylContact C-O 3.57Å; I450-N466 VanDerWaalsContact CA-O 3.3Å; I450-N466 WeakPolarHBondContact CA-O 3.35Å; S451-N466 PolarHBondContact N-O 2.88Å; S451-N466 PolarHBondContact O-N 3.22Å; N466-T520 CarbonylContact C-O 3.57Å; N466-T520 WeakPolarHBondContact CA-O 3.23Å; N466-T520 PolarHBondContact OD1-O 2.95Å; N466-Q521 HydrophobicContact CB-CB 4.31Å; N466-Q521 HydrophobicContact CB-CG 4.06Å
467	D	94.3	Very high	90.1	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.027	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	146.9	171.9	65.1	83.3	0	0	0	111.5	A438 I450 G469 F519 T520	A438-D467 HydrophobicContact CB-CB 3.78Å; I450-D467 HydrophobicContact CG1-CB 4.36Å; D467-G469 PolarHBondContact O-N 3.33Å; D467-G469 WeakPolarHBondContact OD1-CA 3.39Å; D467-G469 PolarHBondContact OD1-N 3.32Å; D467-F519 CarbonylContact O-C 3.5Å; D467-F519 WeakPolarHBondContact O-CA 3.45Å; D467-F519 VanDerWaalsContact O-CB 3.28Å; D467-F519 WeakPolarHBondContact O-CB 3.37Å; D467-T520 PolarHBondContact N-O 3.28Å; D467-T520 PolarHBondContact O-N 2.98Å; D467-T520 WeakPolarHBondContact OD2-CB 3.28Å
468	D	92	Very high	89.7	Confident	78 Å²	78	56.4 Å²	56.4	42%	0.417	31%	0.306	S	S	.	.			trans	-87.1	28.7	172.3	66.6	-13.1	0	0	0	112.6	L442 G448 E449	L442-D468 WeakPolarHBondContact CD2-OD1 3.36Å; G448-D468 WeakPolarHBondContact CA-OD1 3.27Å; E449-D468 VanDerWaalsContact N-CG 3.31Å; E449-D468 PolarHBondContact N-OD1 3.09Å; E449-D468 PolarHBondContact N-OD2 3.25Å; E449-D468 PolarHBondContact O-N 2.78Å; E449-D468 VanDerWaalsContact O-OD1 3.11Å
469	G	86.6	Confident	89.6	Confident	6 Å²	6	53.5 Å²	53.5	6%	0.062	29%	0.293	C	S	.	.	S	Bend	trans	-75.9	-171.8	-178.2	0	0	0	0	0	114.3	D467 G471	D467-G469 PolarHBondContact O-N 3.33Å; D467-G469 WeakPolarHBondContact OD1-CA 3.39Å; D467-G469 PolarHBondContact OD1-N 3.32Å; G469-G471 PolarHBondContact O-N 2.91Å
470	P	87.2	Confident	89.3	Confident	83 Å²	83	53.1 Å²	53.1	54%	0.539	28%	0.284	S	S	.	.	S	Bend	trans	-65.9	-2.3	-174.2	27.7	-36.4	0	0	0	114.8	A441 G517	A441-P470 WeakPolarHBondContact O-CD 3.45Å; P470-G517 PolarHBondContact O-N 3.3Å
471	G	88.4	Confident	88.8	Confident	19 Å²	19	49.3 Å²	49.3	20%	0.196	27%	0.27	C	S	.	.			trans	68.3	178.4	-174.7	0	0	0	0	0	113.9	G469 S514 T520	G469-G471 PolarHBondContact O-N 2.91Å; G471-S514 VanDerWaalsContact CA-OG 3.27Å; G471-S514 WeakPolarHBondContact CA-OG 3.46Å; G471-T520 WeakPolarHBondContact CA-OG1 3.46Å
472	I	87.5	Confident	88	Confident	29 Å²	29	52.7 Å²	52.7	15%	0.149	29%	0.288	C	S	.	.			trans	-114.2	128.6	179.7	-56.2	176.6	0	0	0	108.4	K476 I477 I480 V512 S514 T520 F522	I472-K476 HydrophobicContact CG2-CB 3.94Å; I472-I477 HydrophobicContact CB-CG1 4.27Å; I472-I477 HydrophobicContact CG2-CG1 3.83Å; I472-I480 HydrophobicContact CD1-CD1 3.99Å; I472-I480 HydrophobicContact CD1-CG2 4.37Å; I472-I480 HydrophobicContact CG2-CG2 4.1Å; I472-V512 HydrophobicContact CD1-CG2 4.17Å; I472-S514 PolarHBondContact N-OG 3.3Å; I472-T520 HydrophobicContact CD1-CG2 3.6Å; I472-T520 HydrophobicContact CG1-CG2 4.02Å; I472-F522 HydrophobicContact CD1-CZ 4.41Å
473	A	87.4	Confident	86.7	Confident	34 Å²	34	57.6 Å²	57.6	28%	0.281	31%	0.309	S	S	.	.			trans	-61.9	139.3	176.5	0	0	0	0	0	111.1	D475 K476 I477	A473-D475 WeakPolarHBondContact CB-OD1 3.32Å; A473-D475 PolarHBondContact O-N 3.06Å; A473-D475 VanDerWaalsContact O-N 3.07Å; A473-K476 PolarHBondContact O-N 3.49Å; A473-I477 PolarHBondContact O-N 3.19Å
474	P	85.8	Confident	85.2	Confident	93 Å²	93	60.2 Å²	60.2	60%	0.604	34%	0.336	S	S	*	.	H	α-helix	trans	-56.5	-30.3	-172.9	-27.3	34.9	0	0	0	114.7	K476 P516	P474-K476 PolarHBondContact O-N 3.33Å; P474-P516 HydrophobicContact CG-CG 4.41Å
475	D	85.8	Confident	83.4	Confident	115 Å²	115	60.3 Å²	60.3	62%	0.615	34%	0.341	S	S	*	.	H	α-helix	trans	-70.5	-16.4	177.1	61.1	-56.2	0	0	0	113.9	A473	A473-D475 WeakPolarHBondContact CB-OD1 3.32Å; A473-D475 PolarHBondContact O-N 3.06Å; A473-D475 VanDerWaalsContact O-N 3.07Å
476	K	83.8	Confident	81.8	Confident	95 Å²	95	62.4 Å²	62.4	41%	0.413	36%	0.356	S	S	.	.	H	α-helix	trans	-99.6	-21.5	-179.5	-65.1	-177.2	-179.5	174	0	113.3	I472 A473 P474 D478 H479 I480 T487	I472-K476 HydrophobicContact CG2-CB 3.94Å; A473-K476 PolarHBondContact O-N 3.49Å; P474-K476 PolarHBondContact O-N 3.33Å; K476-D478 VanDerWaalsContact C-N 3.3Å; K476-D478 PolarHBondContact O-N 3.44Å; K476-H479 PolarHBondContact O-N 3.25Å; K476-I480 WeakPolarHBondContact O-CG2 3.3Å; K476-I480 PolarHBondContact O-N 2.82Å; K476-I480 VanDerWaalsContact O-N 3.17Å; K476-T487 HydrophobicContact CD-CG2 4.13Å
477	I	83.7	Confident	79.9	Confident	40 Å²	40	65.5 Å²	65.5	21%	0.205	38%	0.376	C	S	.	.	H	α-helix	trans	-54.3	-44.6	-172.7	-68	179.3	0	0	0	111.6	I472 A473 H479 I480 V512	I472-I477 HydrophobicContact CB-CG1 4.27Å; I472-I477 HydrophobicContact CG2-CG1 3.83Å; A473-I477 PolarHBondContact O-N 3.19Å; I477-H479 PolarHBondContact O-N 2.96Å; I477-I480 WeakPolarHBondContact O-CG1 3.32Å; I477-V512 HydrophobicContact CG2-CG1 3.88Å
478	D	81.1	Confident	78.1	Confident	135 Å²	135	70.2 Å²	70.2	72%	0.722	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-22.2	-178.6	-67.2	-28.1	0	0	0	113.5	K476	K476-D478 VanDerWaalsContact C-N 3.3Å; K476-D478 PolarHBondContact O-N 3.44Å
479	H	82.2	Confident	75.9	Confident	99 Å²	99	68.7 Å²	68.7	46%	0.458	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-8.1	-172.4	-67.9	-59.8	0	0	0	114.3	K476 I477 F481 D482 V485	K476-H479 PolarHBondContact O-N 3.25Å; I477-H479 PolarHBondContact O-N 2.96Å; H479-F481 PolarHBondContact O-N 2.8Å; H479-F481 VanDerWaalsContact O-N 3.08Å; H479-D482 IonicContact CG-OD2 2.87Å; H479-D482 IonicContact ND1-OD2 2.98Å; H479-D482 PolarHBondContact ND1-OD2 3.12Å; H479-D482 WeakPolarHBondContact O-CB 3.45Å; H479-D482 PolarHBondContact O-N 3.43Å; H479-V485 HydrophobicContact CB-CG1 4.45Å; H479-V485 VanDerWaalsContact O-CB 3.32Å; H479-V485 WeakPolarHBondContact O-CB 3.42Å; H479-V485 WeakPolarHBondContact O-CG1 3.48Å; H479-V485 WeakPolarHBondContact O-CG2 3.36Å
480	I	83.8	Confident	73.8	Confident	19 Å²	19	74.5 Å²	74.5	10%	0.097	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-20	-174.7	70.2	179.6	0	0	0	113.9	I472 K476 I477 L496 V512 F522	I472-I480 HydrophobicContact CD1-CD1 3.99Å; I472-I480 HydrophobicContact CD1-CG2 4.37Å; I472-I480 HydrophobicContact CG2-CG2 4.1Å; K476-I480 WeakPolarHBondContact O-CG2 3.3Å; K476-I480 PolarHBondContact O-N 2.82Å; K476-I480 VanDerWaalsContact O-N 3.17Å; I477-I480 WeakPolarHBondContact O-CG1 3.32Å; I480-L496 HydrophobicContact CB-CD1 4.2Å; I480-L496 HydrophobicContact CG1-CD1 4.45Å; I480-L496 WeakPolarHBondContact O-CB 3.48Å; I480-L496 WeakPolarHBondContact O-CD1 3.34Å; I480-V512 HydrophobicContact CD1-CB 4.06Å; I480-V512 HydrophobicContact CD1-CG1 3.47Å; I480-V512 VanDerWaalsContact CD1-CG1 3.47Å; I480-V512 HydrophobicContact CD1-CG2 4.18Å; I480-F522 HydrophobicContact CD1-CE1 3.84Å; I480-F522 HydrophobicContact CD1-CZ 4.14Å
481	F	82.7	Confident	71.9	Confident	26 Å²	26	79.5 Å²	79.5	11%	0.114	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-5.5	178.6	-61.1	-69	0	0	0	113.8	H479 L496 A497 K500 I510 V512 F522	H479-F481 PolarHBondContact O-N 2.8Å; H479-F481 VanDerWaalsContact O-N 3.08Å; F481-L496 HydrophobicContact CD1-CB 4.33Å; F481-L496 HydrophobicContact CE1-CD2 4.39Å; F481-A497 WeakPolarHBondContact O-CB 3.44Å; F481-K500 HydrophobicContact CB-CD 3.49Å; F481-K500 VanDerWaalsContact CB-CD 3.49Å; F481-K500 HydrophobicContact CD1-CB 4.08Å; F481-K500 HydrophobicContact CD1-CD 4.15Å; F481-K500 HydrophobicContact CG-CD 3.86Å; F481-I510 HydrophobicContact CD1-CG2 4.27Å; F481-I510 HydrophobicContact CE1-CB 4.44Å; F481-I510 HydrophobicContact CE1-CD1 3.68Å; F481-I510 HydrophobicContact CE1-CG1 3.76Å; F481-I510 HydrophobicContact CE1-CG2 3.83Å; F481-I510 HydrophobicContact CZ-CD1 4.28Å; F481-I510 HydrophobicContact CZ-CG1 3.9Å; F481-I510 HydrophobicContact CZ-CG2 4.17Å; F481-V512 HydrophobicContact CE2-CG1 4.1Å; F481-V512 HydrophobicContact CZ-CG1 4.31Å; F481-F522 HydrophobicContact CE1-CE1 4.4Å; F481-F522 HydrophobicContact CZ-CD1 4.48Å; F481-F522 HydrophobicContact CZ-CE1 4.27Å
482	D	78.4	Confident	70.3	Confident	71 Å²	71	85 Å²	85	38%	0.38	47%	0.47	S	S	.	.	S	Bend	trans	-74.6	137.8	180	-68.5	-24.6	0	0	0	110.4	H479 G484 V485	H479-D482 IonicContact CG-OD2 2.87Å; H479-D482 IonicContact ND1-OD2 2.98Å; H479-D482 PolarHBondContact ND1-OD2 3.12Å; H479-D482 WeakPolarHBondContact O-CB 3.45Å; H479-D482 PolarHBondContact O-N 3.43Å; D482-G484 PolarHBondContact O-N 2.89Å; D482-V485 HydrophobicContact CB-CB 4.46Å; D482-V485 HydrophobicContact CB-CG2 3.64Å; D482-V485 WeakPolarHBondContact O-CB 3.3Å; D482-V485 PolarHBondContact O-N 2.85Å; D482-V485 VanDerWaalsContact O-N 3.09Å
483	K	67	Low	69	Low	157 Å²	157	84.4 Å²	84.4	68%	0.683	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	126.3	179.8	-78.9	-174.3	179.6	-179.4	0	110.5	V485 A497	K483-V485 VanDerWaalsContact C-N 3.34Å; K483-A497 HydrophobicContact CB-CB 4.37Å; K483-A497 HydrophobicContact CG-CB 3.59Å
484	G	63.6	Low	68	Low	57 Å²	57	87.5 Å²	87.5	59%	0.588	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	1.1	178.4	0	0	0	0	0	114.3	D482 S486 G493	D482-G484 PolarHBondContact O-N 2.89Å; G484-S486 PolarHBondContact O-N 3.31Å; G484-G493 PolarHBondContact N-O 2.85Å
485	V	59.8	Low	67.5	Low	62 Å²	62	84 Å²	84	38%	0.376	47%	0.468	S	S	.	.			trans	-79.4	109.2	171.2	179.2	0	0	0	0	109	H479 D482 K483 G493	H479-V485 HydrophobicContact CB-CG1 4.45Å; H479-V485 VanDerWaalsContact O-CB 3.32Å; H479-V485 WeakPolarHBondContact O-CB 3.42Å; H479-V485 WeakPolarHBondContact O-CG1 3.48Å; H479-V485 WeakPolarHBondContact O-CG2 3.36Å; D482-V485 HydrophobicContact CB-CB 4.46Å; D482-V485 HydrophobicContact CB-CG2 3.64Å; D482-V485 WeakPolarHBondContact O-CB 3.3Å; D482-V485 PolarHBondContact O-N 2.85Å; D482-V485 VanDerWaalsContact O-N 3.09Å; K483-V485 VanDerWaalsContact C-N 3.34Å; V485-G493 WeakPolarHBondContact O-CA 3.33Å
486	S	61.5	Low	67.5	Low	46 Å²	46	80 Å²	80	32%	0.322	45%	0.446	S	S	.	.			trans	-140.9	137.6	170	-176	0	0	0	0	109.5	G484 K488	G484-S486 PolarHBondContact O-N 3.31Å; S486-K488 PolarHBondContact O-N 2.93Å; S486-K488 PolarHBondContact OG-N 3.34Å; S486-K488 VanDerWaalsContact OG-N 3.11Å
487	T	56.2	Low	67.4	Low	107 Å²	107	75.8 Å²	75.8	66%	0.656	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-0.4	169.4	49.9	0	0	0	0	112.8	K476	K476-T487 HydrophobicContact CD-CG2 4.13Å
488	K	54.8	Low	67.4	Low	104 Å²	104	77 Å²	77	45%	0.452	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	17.9	-166.6	-60.3	-176.1	-177.5	175.9	0	115.8	E440 S486	E440-K488 VanDerWaalsContact C-NZ 3.34Å; E440-K488 PolarHBondContact O-NZ 2.67Å; E440-K488 IonicContact OE2-NZ 3.63Å; S486-K488 PolarHBondContact O-N 2.93Å; S486-K488 PolarHBondContact OG-N 3.34Å; S486-K488 VanDerWaalsContact OG-N 3.11Å
489	G	46.7	Very low	67.7	Low	45 Å²	45	70.6 Å²	70.6	46%	0.464	40%	0.401	S	S	.	.			trans	121.2	172.6	168.2	0	0	0	0	0	116.2	E491 R492	G489-E491 PolarHBondContact O-N 3.35Å; G489-R492 PolarHBondContact O-N 2.95Å
490	S	43.1	Very low	68	Low	129 Å²	129	69 Å²	69	90%	0.902	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13	-165.3	56.6	0	0	0	0	116.8
491	E	47.5	Very low	68.1	Low	188 Å²	188	72 Å²	72	88%	0.879	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	3.7	175.5	-69.3	-172.2	161.2	0	0	112.9	G489	G489-E491 PolarHBondContact O-N 3.35Å
492	R	53.8	Low	68.3	Low	133 Å²	133	73 Å²	73	50%	0.502	41%	0.411	S	S	.	.			trans	-115.1	167	179	-70.1	-179.7	126.4	93.2	-4.6	109.6	E440 G489	E440-R492 IonicContact OE1-CZ 3.84Å; E440-R492 IonicContact OE1-NE 3.67Å; E440-R492 IonicContact OE1-NH2 2.75Å; E440-R492 PolarHBondContact OE1-NH2 3.25Å; G489-R492 PolarHBondContact O-N 2.95Å
493	G	59.5	Low	68.9	Low	18 Å²	18	69.6 Å²	69.6	19%	0.186	39%	0.393	C	S	.	.			trans	100.7	16.9	-178.1	0	0	0	0	0	114.8	G484 V485	G484-G493 PolarHBondContact N-O 2.85Å; V485-G493 WeakPolarHBondContact O-CA 3.33Å
494	V	66.9	Low	70.1	Confident	99 Å²	99	67 Å²	67	60%	0.6	38%	0.384	S	S	*	.			trans	-94.1	-26.2	171.4	-159.8	0	0	0	0	111.4	L498	V494-L498 VanDerWaalsContact O-CB 3.27Å; V494-L498 WeakPolarHBondContact O-CB 3.07Å; V494-L498 PolarHBondContact O-N 2.87Å
495	G	76.2	Confident	71.2	Confident	20 Å²	20	70 Å²	70	21%	0.206	39%	0.386	C	S	.	.	H	α-helix	trans	-59.3	-62.9	-171.7	0	0	0	0	0	113.8	A497 L498 V499	G495-A497 VanDerWaalsContact C-N 3.31Å; G495-A497 PolarHBondContact O-N 3.49Å; G495-L498 WeakPolarHBondContact O-CB 2.97Å; G495-L498 PolarHBondContact O-N 3.47Å; G495-L498 VanDerWaalsContact O-N 3.13Å; G495-V499 WeakPolarHBondContact O-CG2 3.22Å; G495-V499 PolarHBondContact O-N 3.05Å
496	L	85.6	Confident	72.6	Confident	29 Å²	29	69.1 Å²	69.1	15%	0.152	38%	0.379	C	S	.	.	H	α-helix	trans	-61.8	-36.8	-179.6	-75.9	170.8	0	0	0	112.9	L434 N437 I480 F481 V499 K500 F522	L434-L496 HydrophobicContact CD2-CD2 3.83Å; N437-L496 WeakPolarHBondContact ND2-CD2 3.4Å; N437-L496 WeakPolarHBondContact ND2-CG 3.08Å; I480-L496 HydrophobicContact CB-CD1 4.2Å; I480-L496 HydrophobicContact CG1-CD1 4.45Å; I480-L496 WeakPolarHBondContact O-CB 3.48Å; I480-L496 WeakPolarHBondContact O-CD1 3.34Å; F481-L496 HydrophobicContact CD1-CB 4.33Å; F481-L496 HydrophobicContact CE1-CD2 4.39Å; L496-V499 PolarHBondContact O-N 3.04Å; L496-K500 WeakPolarHBondContact O-CB 3.49Å; L496-K500 PolarHBondContact O-N 3.02Å; L496-F522 HydrophobicContact CD1-CZ 4.42Å; L496-F522 HydrophobicContact CD2-CE1 3.88Å; L496-F522 HydrophobicContact CD2-CZ 4.1Å
497	A	82.1	Confident	73.9	Confident	7 Å²	7	69.4 Å²	69.4	6%	0.058	39%	0.389	C	S	.	.	H	α-helix	trans	-65.2	-38.5	175.4	0	0	0	0	0	112.1	F481 K483 G495 Q501	F481-A497 WeakPolarHBondContact O-CB 3.44Å; K483-A497 HydrophobicContact CB-CB 4.37Å; K483-A497 HydrophobicContact CG-CB 3.59Å; G495-A497 VanDerWaalsContact C-N 3.31Å; G495-A497 PolarHBondContact O-N 3.49Å; A497-Q501 VanDerWaalsContact O-CB 3.32Å; A497-Q501 WeakPolarHBondContact O-CB 3.25Å; A497-Q501 PolarHBondContact O-N 3.5Å
498	L	82.3	Confident	75.6	Confident	67 Å²	67	64.9 Å²	64.9	35%	0.351	36%	0.364	S	S	.	.	H	α-helix	trans	-67.1	-42.7	174.1	-177.4	68.5	0	0	0	111.2	T429 V494 G495 Q501 Q502	T429-L498 HydrophobicContact CG2-CD2 4.36Å; V494-L498 VanDerWaalsContact O-CB 3.27Å; V494-L498 WeakPolarHBondContact O-CB 3.07Å; V494-L498 PolarHBondContact O-N 2.87Å; G495-L498 WeakPolarHBondContact O-CB 2.97Å; G495-L498 PolarHBondContact O-N 3.47Å; G495-L498 VanDerWaalsContact O-N 3.13Å; L498-Q501 PolarHBondContact O-N 2.96Å; L498-Q502 HydrophobicContact CD1-CG 4.4Å; L498-Q502 HydrophobicContact CG-CG 4.47Å; L498-Q502 WeakPolarHBondContact O-CB 3.5Å; L498-Q502 VanDerWaalsContact O-CG 3.32Å; L498-Q502 WeakPolarHBondContact O-CG 3.29Å; L498-Q502 PolarHBondContact O-N 3.25Å
499	V	88	Confident	77.5	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-59.5	-51.2	175.5	172.2	0	0	0	0	110.4	T430 N433 G495 L496 Q501 Q502 V503 I510	T430-V499 HydrophobicContact CG2-CG1 3.59Å; N433-V499 HydrophobicContact CB-CG2 3.47Å; N433-V499 VanDerWaalsContact CB-CG2 3.47Å; G495-V499 WeakPolarHBondContact O-CG2 3.22Å; G495-V499 PolarHBondContact O-N 3.05Å; L496-V499 PolarHBondContact O-N 3.04Å; V499-Q501 VanDerWaalsContact C-N 3.33Å; V499-Q501 PolarHBondContact O-N 3.02Å; V499-Q502 PolarHBondContact O-N 3.06Å; V499-V503 HydrophobicContact CG1-CG2 4.12Å; V499-V503 WeakPolarHBondContact O-CB 3.03Å; V499-V503 VanDerWaalsContact O-CG2 3.27Å; V499-V503 WeakPolarHBondContact O-CG2 3.35Å; V499-V503 PolarHBondContact O-N 3.16Å; V499-I510 HydrophobicContact CG1-CD1 3.6Å
500	K	89.4	Confident	79.7	Confident	64 Å²	64	61.6 Å²	61.6	28%	0.278	35%	0.345	S	S	.	.	H	α-helix	trans	-55.7	-48.8	176.8	179.4	172.8	177.4	179.2	0	111.2	F481 L496 Q502 V503 E504 I510	F481-K500 HydrophobicContact CB-CD 3.49Å; F481-K500 VanDerWaalsContact CB-CD 3.49Å; F481-K500 HydrophobicContact CD1-CB 4.08Å; F481-K500 HydrophobicContact CD1-CD 4.15Å; F481-K500 HydrophobicContact CG-CD 3.86Å; L496-K500 WeakPolarHBondContact O-CB 3.49Å; L496-K500 PolarHBondContact O-N 3.02Å; K500-Q502 PolarHBondContact O-N 3.46Å; K500-V503 PolarHBondContact O-N 2.79Å; K500-E504 WeakPolarHBondContact CE-OE1 3.38Å; K500-E504 HydrophobicContact CG-CG 4.25Å; K500-E504 WeakPolarHBondContact CG-OE1 3.29Å; K500-E504 VanDerWaalsContact O-CB 3.3Å; K500-E504 WeakPolarHBondContact O-CB 3.36Å; K500-E504 VanDerWaalsContact O-CG 3.27Å; K500-E504 WeakPolarHBondContact O-CG 3.48Å; K500-E504 PolarHBondContact O-N 3.2Å; K500-I510 HydrophobicContact CB-CG2 3.92Å; K500-I510 HydrophobicContact CG-CG2 3.94Å
501	Q	85.5	Confident	82.1	Confident	82 Å²	82	57.8 Å²	57.8	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-59.1	-44.2	178.6	-174.7	178.8	-18.2	0	0	112.2	A497 L498 V499 N505	A497-Q501 VanDerWaalsContact O-CB 3.32Å; A497-Q501 WeakPolarHBondContact O-CB 3.25Å; A497-Q501 PolarHBondContact O-N 3.5Å; L498-Q501 PolarHBondContact O-N 2.96Å; V499-Q501 VanDerWaalsContact C-N 3.33Å; V499-Q501 PolarHBondContact O-N 3.02Å; Q501-N505 VanDerWaalsContact O-CB 3.29Å; Q501-N505 WeakPolarHBondContact O-CB 3.11Å; Q501-N505 PolarHBondContact O-N 2.76Å; Q501-N505 PolarHBondContact O-ND2 3.15Å; Q501-N505 PolarHBondContact O-OD1 3.31Å
502	Q	86.8	Confident	84.3	Confident	47 Å²	47	49.9 Å²	49.9	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-70.7	-41.7	-179.8	-72.1	-179.7	-5.6	0	0	112.8	T426 L498 V499 K500 N505 L506	T426-Q502 HydrophobicContact CG2-CB 3.94Å; L498-Q502 HydrophobicContact CD1-CG 4.4Å; L498-Q502 HydrophobicContact CG-CG 4.47Å; L498-Q502 WeakPolarHBondContact O-CB 3.5Å; L498-Q502 VanDerWaalsContact O-CG 3.32Å; L498-Q502 WeakPolarHBondContact O-CG 3.29Å; L498-Q502 PolarHBondContact O-N 3.25Å; V499-Q502 PolarHBondContact O-N 3.06Å; K500-Q502 PolarHBondContact O-N 3.46Å; Q502-N505 WeakPolarHBondContact O-CB 3.28Å; Q502-N505 PolarHBondContact O-N 2.92Å; Q502-L506 PolarHBondContact O-N 3.29Å
503	V	91.6	Very high	86.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-46.7	176.3	168.1	0	0	0	0	110.4	T426 T430 V499 K500 N505 L506 G508 S509 I510 V524 I526	T426-V503 HydrophobicContact CG2-CG2 4.29Å; T430-V503 HydrophobicContact CG2-CG2 4.4Å; V499-V503 HydrophobicContact CG1-CG2 4.12Å; V499-V503 WeakPolarHBondContact O-CB 3.03Å; V499-V503 VanDerWaalsContact O-CG2 3.27Å; V499-V503 WeakPolarHBondContact O-CG2 3.35Å; V499-V503 PolarHBondContact O-N 3.16Å; K500-V503 PolarHBondContact O-N 2.79Å; V503-N505 VanDerWaalsContact C-N 3.35Å; V503-N505 PolarHBondContact O-N 2.84Å; V503-L506 PolarHBondContact O-N 3.23Å; V503-G508 VanDerWaalsContact O-CA 3.28Å; V503-G508 WeakPolarHBondContact O-CA 3.44Å; V503-G508 PolarHBondContact O-N 2.8Å; V503-S509 VanDerWaalsContact CG1-C 3.48Å; V503-S509 WeakPolarHBondContact CG1-O 3.5Å; V503-I510 HydrophobicContact CG1-CB 4.41Å; V503-V524 HydrophobicContact CG1-CG1 4.2Å; V503-V524 HydrophobicContact CG2-CG1 3.8Å; V503-I526 HydrophobicContact CB-CG2 4.36Å; V503-I526 HydrophobicContact CG1-CG2 3.94Å; V503-I526 HydrophobicContact CG2-CG2 4.15Å
504	E	91.3	Very high	87.8	Confident	103 Å²	103	49.2 Å²	49.2	48%	0.481	29%	0.286	S	S	.	.	H	α-helix	trans	-65.1	-36.2	176.7	-72.4	175.9	169.4	0	0	112.2	K500 L506 G507	K500-E504 WeakPolarHBondContact CE-OE1 3.38Å; K500-E504 HydrophobicContact CG-CG 4.25Å; K500-E504 WeakPolarHBondContact CG-OE1 3.29Å; K500-E504 VanDerWaalsContact O-CB 3.3Å; K500-E504 WeakPolarHBondContact O-CB 3.36Å; K500-E504 VanDerWaalsContact O-CG 3.27Å; K500-E504 WeakPolarHBondContact O-CG 3.48Å; K500-E504 PolarHBondContact O-N 3.2Å; E504-L506 PolarHBondContact O-N 3.42Å; E504-G507 WeakPolarHBondContact O-CA 3.18Å; E504-G507 PolarHBondContact O-N 3.12Å
505	N	87.5	Confident	88.9	Confident	121 Å²	121	49.4 Å²	49.4	65%	0.647	28%	0.28	S	S	*	.	H	α-helix	trans	-61.1	-29.9	175.5	-77.6	-8.8	0	0	0	113.1	Q501 Q502 V503 G507	Q501-N505 VanDerWaalsContact O-CB 3.29Å; Q501-N505 WeakPolarHBondContact O-CB 3.11Å; Q501-N505 PolarHBondContact O-N 2.76Å; Q501-N505 PolarHBondContact O-ND2 3.15Å; Q501-N505 PolarHBondContact O-OD1 3.31Å; Q502-N505 WeakPolarHBondContact O-CB 3.28Å; Q502-N505 PolarHBondContact O-N 2.92Å; V503-N505 VanDerWaalsContact C-N 3.35Å; V503-N505 PolarHBondContact O-N 2.84Å; N505-G507 VanDerWaalsContact C-N 3.26Å
506	L	87.9	Confident	89.4	Confident	43 Å²	43	51.8 Å²	51.8	23%	0.225	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-0.1	172.8	-71.8	-175.8	0	0	0	113.3	D422 Q423 T426 Q502 V503 E504 G508 P527	D422-L506 HydrophobicContact CB-CD2 4.17Å; Q423-L506 HydrophobicContact CG-CD1 4.16Å; T426-L506 VanDerWaalsContact CB-CD1 3.48Å; T426-L506 HydrophobicContact CG2-CD1 3.67Å; T426-L506 HydrophobicContact CG2-CG 4.42Å; T426-L506 WeakPolarHBondContact OG1-CD1 3.31Å; Q502-L506 PolarHBondContact O-N 3.29Å; V503-L506 PolarHBondContact O-N 3.23Å; E504-L506 PolarHBondContact O-N 3.42Å; L506-G508 VanDerWaalsContact C-N 3.3Å; L506-P527 VanDerWaalsContact O-CD 3.32Å; L506-P527 WeakPolarHBondContact O-CD 3.47Å; L506-P527 VanDerWaalsContact O-CG 3.23Å; L506-P527 WeakPolarHBondContact O-CG 3.48Å
507	G	89	Confident	89.4	Confident	52 Å²	52	53.5 Å²	53.5	54%	0.536	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	17.9	-171.5	0	0	0	0	0	113.4	E504 N505	E504-G507 WeakPolarHBondContact O-CA 3.18Å; E504-G507 PolarHBondContact O-N 3.12Å; N505-G507 VanDerWaalsContact C-N 3.26Å
508	G	91.5	Very high	89.7	Confident	12 Å²	12	57.4 Å²	57.4	12%	0.124	34%	0.336	C	S	.	.			trans	-86.6	-176.9	175.6	0	0	0	0	0	113.8	V503 L506 Q525	V503-G508 VanDerWaalsContact O-CA 3.28Å; V503-G508 WeakPolarHBondContact O-CA 3.44Å; V503-G508 PolarHBondContact O-N 2.8Å; L506-G508 VanDerWaalsContact C-N 3.3Å; G508-Q525 CarbonylContact C-O 3.59Å; G508-Q525 WeakPolarHBondContact CA-O 3.3Å
509	S	94.4	Very high	90.2	Very high	57 Å²	57	56.7 Å²	56.7	40%	0.399	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.4	172.9	61.3	0	0	0	0	111.1	V503 V524 Q525	V503-S509 VanDerWaalsContact CG1-C 3.48Å; V503-S509 WeakPolarHBondContact CG1-O 3.5Å; S509-V524 WeakPolarHBondContact O-CA 3.15Å; S509-Q525 PolarHBondContact N-O 3.31Å; S509-Q525 PolarHBondContact O-N 3.3Å
510	I	94.4	Very high	90.5	Very high	22 Å²	22	57 Å²	57	11%	0.113	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.2	171.7	-176.5	163.8	0	0	0	108.7	L434 F481 V499 K500 V503 F522 F523 V524	L434-I510 HydrophobicContact CD2-CD1 4.44Å; F481-I510 HydrophobicContact CD1-CG2 4.27Å; F481-I510 HydrophobicContact CE1-CB 4.44Å; F481-I510 HydrophobicContact CE1-CD1 3.68Å; F481-I510 HydrophobicContact CE1-CG1 3.76Å; F481-I510 HydrophobicContact CE1-CG2 3.83Å; F481-I510 HydrophobicContact CZ-CD1 4.28Å; F481-I510 HydrophobicContact CZ-CG1 3.9Å; F481-I510 HydrophobicContact CZ-CG2 4.17Å; V499-I510 HydrophobicContact CG1-CD1 3.6Å; K500-I510 HydrophobicContact CB-CG2 3.92Å; K500-I510 HydrophobicContact CG-CG2 3.94Å; V503-I510 HydrophobicContact CG1-CB 4.41Å; I510-F522 HydrophobicContact CD1-CD1 4.45Å; I510-F523 CarbonylContact C-O 3.51Å; I510-F523 VanDerWaalsContact CA-O 3.31Å; I510-F523 WeakPolarHBondContact CA-O 3.23Å; I510-V524 HydrophobicContact CB-CG2 4.27Å; I510-V524 HydrophobicContact CD1-CG2 3.75Å; I510-V524 HydrophobicContact CG1-CG2 3.78Å
511	A	93.3	Very high	90.8	Very high	50 Å²	50	55.8 Å²	55.8	41%	0.413	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	162.7	175.4	0	0	0	0	0	109.6	F522 F523	A511-F522 WeakPolarHBondContact O-CA 3.44Å; A511-F523 HydrophobicContact CB-CB 4.42Å; A511-F523 PolarHBondContact N-O 3.03Å; A511-F523 PolarHBondContact O-N 3.25Å
512	V	93.9	Very high	91.3	Very high	22 Å²	22	52.3 Å²	52.3	13%	0.133	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.8	176.5	59.4	0	0	0	0	109.3	I472 I477 I480 F481 T520 Q521 F522	I472-V512 HydrophobicContact CD1-CG2 4.17Å; I477-V512 HydrophobicContact CG2-CG1 3.88Å; I480-V512 HydrophobicContact CD1-CB 4.06Å; I480-V512 HydrophobicContact CD1-CG1 3.47Å; I480-V512 VanDerWaalsContact CD1-CG1 3.47Å; I480-V512 HydrophobicContact CD1-CG2 4.18Å; F481-V512 HydrophobicContact CE2-CG1 4.1Å; F481-V512 HydrophobicContact CZ-CG1 4.31Å; V512-T520 HydrophobicContact CG2-CG2 3.89Å; V512-Q521 CarbonylContact C-O 3.58Å; V512-Q521 WeakPolarHBondContact CA-O 3.21Å; V512-F522 HydrophobicContact CB-CD1 3.88Å; V512-F522 HydrophobicContact CB-CE1 3.86Å; V512-F522 HydrophobicContact CG2-CD1 3.97Å; V512-F522 HydrophobicContact CG2-CE1 3.77Å; V512-F522 HydrophobicContact CG2-CE2 4.44Å; V512-F522 HydrophobicContact CG2-CG 4.4Å; V512-F522 HydrophobicContact CG2-CZ 4.02Å
513	E	92.8	Very high	91.7	Very high	116 Å²	116	52.1 Å²	52.1	54%	0.542	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136	164.4	-64.8	-178.8	176	0	0	107.3	Q521 F523	E513-Q521 PolarHBondContact N-O 3.34Å; E513-Q521 PolarHBondContact O-N 3.06Å; E513-F523 HydrophobicContact CB-CE2 3.9Å; E513-F523 HydrophobicContact CG-CD2 4.33Å; E513-F523 HydrophobicContact CG-CE2 3.63Å
514	S	92.5	Very high	91.9	Very high	21 Å²	21	52.2 Å²	52.2	15%	0.147	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	140.1	-179.9	-174.7	0	0	0	0	110.3	G471 I472 F519 T520	G471-S514 VanDerWaalsContact CA-OG 3.27Å; G471-S514 WeakPolarHBondContact CA-OG 3.46Å; I472-S514 PolarHBondContact N-OG 3.3Å; S514-F519 VanDerWaalsContact CA-O 3.31Å; S514-F519 WeakPolarHBondContact CA-O 3.33Å; S514-F519 WeakPolarHBondContact CB-O 3.41Å; S514-F519 PolarHBondContact OG-O 2.79Å; S514-T520 PolarHBondContact OG-OG1 3.17Å
515	E	90.5	Very high	92.1	Very high	102 Å²	102	50.9 Å²	50.9	48%	0.477	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.6	172.5	-171.7	169.6	-178.9	0	0	108.5	G517 I518 F519	E515-G517 PolarHBondContact O-N 2.67Å; E515-I518 HydrophobicContact CB-CB 4.15Å; E515-I518 HydrophobicContact CB-CD1 4.48Å; E515-I518 HydrophobicContact CB-CG1 4.37Å; E515-I518 HydrophobicContact CG-CB 4.32Å; E515-I518 HydrophobicContact CG-CD1 3.78Å; E515-I518 HydrophobicContact CG-CG1 3.98Å; E515-I518 PolarHBondContact O-N 3.44Å; E515-I518 WeakPolarHBondContact OE1-CD1 3.4Å; E515-F519 HydrophobicContact CB-CD1 3.99Å; E515-F519 HydrophobicContact CB-CE1 3.66Å; E515-F519 HydrophobicContact CB-CZ 4.36Å; E515-F519 PolarHBondContact N-O 3.01Å; E515-F519 PolarHBondContact O-N 2.76Å
516	P	87.9	Confident	92.4	Very high	71 Å²	71	45.1 Å²	45.1	46%	0.461	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	124.2	-178.7	-26.5	32.7	0	0	0	112.3	P474 I518	P474-P516 HydrophobicContact CG-CG 4.41Å; P516-I518 VanDerWaalsContact C-N 3.34Å
517	G	85.2	Confident	92.6	Very high	64 Å²	64	44.7 Å²	44.7	66%	0.66	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	4.8	-178.9	0	0	0	0	0	115.4	P470 E515	P470-G517 PolarHBondContact O-N 3.3Å; E515-G517 PolarHBondContact O-N 2.67Å
518	I	88.4	Confident	92.8	Very high	90 Å²	90	42.2 Å²	42.2	46%	0.462	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-58.4	-179.2	-45.4	-166.9	0	0	0	112.2	E515 P516	E515-I518 HydrophobicContact CB-CB 4.15Å; E515-I518 HydrophobicContact CB-CD1 4.48Å; E515-I518 HydrophobicContact CB-CG1 4.37Å; E515-I518 HydrophobicContact CG-CB 4.32Å; E515-I518 HydrophobicContact CG-CD1 3.78Å; E515-I518 HydrophobicContact CG-CG1 3.98Å; E515-I518 PolarHBondContact O-N 3.44Å; E515-I518 WeakPolarHBondContact OE1-CD1 3.4Å; P516-I518 VanDerWaalsContact C-N 3.34Å
519	F	91.7	Very high	92.5	Very high	52 Å²	52	46.5 Å²	46.5	23%	0.228	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	163	-175.5	72.3	-85.1	0	0	0	114	D467 S514 E515 Q521	D467-F519 CarbonylContact O-C 3.5Å; D467-F519 WeakPolarHBondContact O-CA 3.45Å; D467-F519 VanDerWaalsContact O-CB 3.28Å; D467-F519 WeakPolarHBondContact O-CB 3.37Å; S514-F519 VanDerWaalsContact CA-O 3.31Å; S514-F519 WeakPolarHBondContact CA-O 3.33Å; S514-F519 WeakPolarHBondContact CB-O 3.41Å; S514-F519 PolarHBondContact OG-O 2.79Å; E515-F519 HydrophobicContact CB-CD1 3.99Å; E515-F519 HydrophobicContact CB-CE1 3.66Å; E515-F519 HydrophobicContact CB-CZ 4.36Å; E515-F519 PolarHBondContact N-O 3.01Å; E515-F519 PolarHBondContact O-N 2.76Å; F519-Q521 HydrophobicContact CD2-CB 4.04Å; F519-Q521 HydrophobicContact CE2-CB 4.05Å
520	T	94.5	Very high	91.3	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.1	162.6	-47.6	0	0	0	0	109.3	N466 D467 G471 I472 V512 S514 F522	N466-T520 CarbonylContact C-O 3.57Å; N466-T520 WeakPolarHBondContact CA-O 3.23Å; N466-T520 PolarHBondContact OD1-O 2.95Å; D467-T520 PolarHBondContact N-O 3.28Å; D467-T520 PolarHBondContact O-N 2.98Å; D467-T520 WeakPolarHBondContact OD2-CB 3.28Å; G471-T520 WeakPolarHBondContact CA-OG1 3.46Å; I472-T520 HydrophobicContact CD1-CG2 3.6Å; I472-T520 HydrophobicContact CG1-CG2 4.02Å; V512-T520 HydrophobicContact CG2-CG2 3.89Å; S514-T520 PolarHBondContact OG-OG1 3.17Å; T520-F522 HydrophobicContact CG2-CD2 4.11Å; T520-F522 HydrophobicContact CG2-CE2 3.6Å; T520-F522 HydrophobicContact CG2-CZ 4.17Å
521	Q	95.5	Very high	89.7	Confident	38 Å²	38	49.7 Å²	49.7	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	118	178.6	-172	170.1	16.6	0	0	110.6	E464 V465 N466 V512 E513 F519 F523	E464-Q521 PolarHBondContact OE2-NE2 3.47Å; V465-Q521 WeakPolarHBondContact O-CA 3.28Å; N466-Q521 HydrophobicContact CB-CB 4.31Å; N466-Q521 HydrophobicContact CB-CG 4.06Å; V512-Q521 CarbonylContact C-O 3.58Å; V512-Q521 WeakPolarHBondContact CA-O 3.21Å; E513-Q521 PolarHBondContact N-O 3.34Å; E513-Q521 PolarHBondContact O-N 3.06Å; F519-Q521 HydrophobicContact CD2-CB 4.04Å; F519-Q521 HydrophobicContact CE2-CB 4.05Å; Q521-F523 HydrophobicContact CB-CE2 4.12Å; Q521-F523 HydrophobicContact CB-CZ 4.33Å; Q521-F523 HydrophobicContact CG-CD2 4.35Å; Q521-F523 HydrophobicContact CG-CE1 4.07Å; Q521-F523 HydrophobicContact CG-CE2 3.69Å; Q521-F523 HydrophobicContact CG-CZ 3.55Å
522	F	96.1	Very high	87.6	Confident	9 Å²	9	58.2 Å²	58.2	4%	0.039	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.5	172.1	-72.1	-85.8	0	0	0	110.5	L434 E464 V465 I472 I480 F481 L496 I510 A511 V512 T520	L434-F522 HydrophobicContact CD1-CB 3.84Å; L434-F522 HydrophobicContact CD1-CG 4.41Å; L434-F522 HydrophobicContact CD2-CB 4Å; L434-F522 HydrophobicContact CD2-CD1 3.83Å; L434-F522 HydrophobicContact CD2-CD2 3.89Å; L434-F522 HydrophobicContact CD2-CE1 4.25Å; L434-F522 HydrophobicContact CD2-CE2 4.31Å; L434-F522 HydrophobicContact CD2-CG 3.63Å; L434-F522 HydrophobicContact CD2-CZ 4.47Å; L434-F522 HydrophobicContact CG-CB 4.48Å; E464-F522 WeakPolarHBondContact CA-O 3.32Å; V465-F522 PolarHBondContact N-O 2.92Å; V465-F522 PolarHBondContact O-N 3.11Å; I472-F522 HydrophobicContact CD1-CZ 4.41Å; I480-F522 HydrophobicContact CD1-CE1 3.84Å; I480-F522 HydrophobicContact CD1-CZ 4.14Å; F481-F522 HydrophobicContact CE1-CE1 4.4Å; F481-F522 HydrophobicContact CZ-CD1 4.48Å; F481-F522 HydrophobicContact CZ-CE1 4.27Å; L496-F522 HydrophobicContact CD1-CZ 4.42Å; L496-F522 HydrophobicContact CD2-CE1 3.88Å; L496-F522 HydrophobicContact CD2-CZ 4.1Å; I510-F522 HydrophobicContact CD1-CD1 4.45Å; A511-F522 WeakPolarHBondContact O-CA 3.44Å; V512-F522 HydrophobicContact CB-CD1 3.88Å; V512-F522 HydrophobicContact CB-CE1 3.86Å; V512-F522 HydrophobicContact CG2-CD1 3.97Å; V512-F522 HydrophobicContact CG2-CE1 3.77Å; V512-F522 HydrophobicContact CG2-CE2 4.44Å; V512-F522 HydrophobicContact CG2-CG 4.4Å; V512-F522 HydrophobicContact CG2-CZ 4.02Å; T520-F522 HydrophobicContact CG2-CD2 4.11Å; T520-F522 HydrophobicContact CG2-CE2 3.6Å; T520-F522 HydrophobicContact CG2-CZ 4.17Å
523	F	96.1	Very high	85	Confident	44 Å²	44	62.6 Å²	62.6	19%	0.193	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.6	174.6	-58.9	-89.7	0	0	0	109.2	E464 I510 A511 E513 Q521	E464-F523 HydrophobicContact CG-CD1 3.83Å; E464-F523 HydrophobicContact CG-CE1 4.15Å; I510-F523 CarbonylContact C-O 3.51Å; I510-F523 VanDerWaalsContact CA-O 3.31Å; I510-F523 WeakPolarHBondContact CA-O 3.23Å; A511-F523 HydrophobicContact CB-CB 4.42Å; A511-F523 PolarHBondContact N-O 3.03Å; A511-F523 PolarHBondContact O-N 3.25Å; E513-F523 HydrophobicContact CB-CE2 3.9Å; E513-F523 HydrophobicContact CG-CD2 4.33Å; E513-F523 HydrophobicContact CG-CE2 3.63Å; Q521-F523 HydrophobicContact CB-CE2 4.12Å; Q521-F523 HydrophobicContact CB-CZ 4.33Å; Q521-F523 HydrophobicContact CG-CD2 4.35Å; Q521-F523 HydrophobicContact CG-CE1 4.07Å; Q521-F523 HydrophobicContact CG-CE2 3.69Å; Q521-F523 HydrophobicContact CG-CZ 3.55Å
524	V	96	Very high	82.1	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.006	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.2	177.8	176.5	0	0	0	0	108.8	T430 L434 C463 V503 S509 I510 I526	T430-V524 HydrophobicContact CG2-CB 4.28Å; T430-V524 HydrophobicContact CG2-CG1 3.97Å; T430-V524 HydrophobicContact CG2-CG2 3.69Å; L434-V524 HydrophobicContact CD1-CG2 3.82Å; C463-V524 HydrophobicContact CB-CB 4.1Å; C463-V524 PolarHBondContact N-O 3.48Å; C463-V524 PolarHBondContact O-N 2.79Å; V503-V524 HydrophobicContact CG1-CG1 4.2Å; V503-V524 HydrophobicContact CG2-CG1 3.8Å; S509-V524 WeakPolarHBondContact O-CA 3.15Å; I510-V524 HydrophobicContact CB-CG2 4.27Å; I510-V524 HydrophobicContact CD1-CG2 3.75Å; I510-V524 HydrophobicContact CG1-CG2 3.78Å; V524-I526 HydrophobicContact CG1-CG2 4.09Å
525	Q	95.4	Very high	79	Confident	76 Å²	76	78.3 Å²	78.3	36%	0.355	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.6	174.5	-58.5	-174.4	-5.9	0	0	108.4	W460 L461 H462 G508 S509	W460-Q525 HydrophobicContact CE3-CB 4.44Å; L461-Q525 WeakPolarHBondContact O-CA 3.06Å; H462-Q525 PolarHBondContact ND1-NE2 3.21Å; G508-Q525 CarbonylContact C-O 3.59Å; G508-Q525 WeakPolarHBondContact CA-O 3.3Å; S509-Q525 PolarHBondContact N-O 3.31Å; S509-Q525 PolarHBondContact O-N 3.3Å
526	I	94.1	Very high	78.4	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.5	174.4	56.8	176.9	0	0	0	109.9	L427 L461 V503 V524 W528	L427-I526 HydrophobicContact CB-CD1 4.09Å; L427-I526 HydrophobicContact CD1-CD1 4.24Å; L461-I526 HydrophobicContact CB-CG1 4.08Å; L461-I526 HydrophobicContact CD2-CD1 4.27Å; L461-I526 HydrophobicContact CD2-CG1 4.38Å; L461-I526 PolarHBondContact N-O 3.09Å; L461-I526 PolarHBondContact O-N 3.07Å; L461-I526 VanDerWaalsContact O-N 3.16Å; V503-I526 HydrophobicContact CB-CG2 4.36Å; V503-I526 HydrophobicContact CG1-CG2 3.94Å; V503-I526 HydrophobicContact CG2-CG2 4.15Å; V524-I526 HydrophobicContact CG1-CG2 4.09Å; I526-W528 HydrophobicContact CD1-CE3 3.8Å; I526-W528 HydrophobicContact CD1-CZ3 3.84Å; I526-W528 HydrophobicContact CG1-CE3 4.25Å; I526-W528 PolarHBondContact O-N 3.18Å
527	P	92.5	Very high	77.9	Confident	33 Å²	33	77.5 Å²	77.5	21%	0.214	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	135.5	165.9	-26.8	38.6	0	0	0	110.2	Q423 W460 L506	Q423-P527 VanDerWaalsContact CD-O 3.25Å; Q423-P527 WeakPolarHBondContact CG-O 3.49Å; Q423-P527 PolarHBondContact NE2-O 2.7Å; W460-P527 HydrophobicContact CE3-CG 4.28Å; W460-P527 HydrophobicContact CH2-CG 3.88Å; W460-P527 HydrophobicContact CZ2-CG 4.47Å; W460-P527 HydrophobicContact CZ3-CG 3.78Å; L506-P527 VanDerWaalsContact O-CD 3.32Å; L506-P527 WeakPolarHBondContact O-CD 3.47Å; L506-P527 VanDerWaalsContact O-CG 3.23Å; L506-P527 WeakPolarHBondContact O-CG 3.48Å
528	W	91.4	Very high	77.5	Confident	1 Å²	1	78.2 Å²	78.2	0%	0.004	37%	0.37	C	S	.	.			trans	-135	115.4	-177.2	-162.3	-96.2	0	0	0	110.6	I389 L415 P416 S418 Q423 V424 L427 Y456 G459 L461 I526 G530	I389-W528 HydrophobicContact CD1-CH2 3.66Å; I389-W528 HydrophobicContact CD1-CZ2 3.9Å; L415-W528 HydrophobicContact CD1-CD2 4.33Å; L415-W528 HydrophobicContact CD1-CH2 4.47Å; L415-W528 HydrophobicContact CD1-CZ2 3.77Å; L415-W528 HydrophobicContact CD2-CZ2 4.4Å; L415-W528 HydrophobicContact CG-CZ2 4.28Å; P416-W528 PolarHBondContact O-NE1 3.01Å; S418-W528 VanDerWaalsContact CB-CE2 3.5Å; Q423-W528 HydrophobicContact CB-CE3 3.8Å; Q423-W528 HydrophobicContact CB-CH2 4.43Å; Q423-W528 HydrophobicContact CB-CZ3 3.71Å; Q423-W528 WeakPolarHBondContact O-CZ3 3.37Å; V424-W528 HydrophobicContact CG2-CH2 4.06Å; V424-W528 HydrophobicContact CG2-CZ2 4.37Å; L427-W528 HydrophobicContact CB-CH2 4.17Å; L427-W528 HydrophobicContact CB-CZ3 3.87Å; L427-W528 HydrophobicContact CD2-CH2 3.79Å; L427-W528 HydrophobicContact CD2-CZ3 3.97Å; L427-W528 HydrophobicContact CG-CZ3 4.49Å; Y456-W528 HydrophobicContact CD2-CB 4Å; Y456-W528 AromaticContact CD2-CD1 3.78Å; Y456-W528 HydrophobicContact CD2-CG 4.19Å; Y456-W528 HydrophobicContact CE2-CB 4.04Å; Y456-W528 AromaticContact CE2-CD1 3.99Å; Y456-W528 HydrophobicContact CE2-CG 4.41Å; Y456-W528 WeakPolarHBondContact CE2-O 3.44Å; G459-W528 PolarHBondContact O-N 2.92Å; L461-W528 HydrophobicContact CB-CB 3.71Å; L461-W528 HydrophobicContact CB-CD2 4.12Å; L461-W528 HydrophobicContact CB-CE3 4.16Å; L461-W528 HydrophobicContact CB-CG 3.95Å; L461-W528 HydrophobicContact CD2-CD2 3.91Å; L461-W528 HydrophobicContact CD2-CE3 3.62Å; L461-W528 HydrophobicContact CD2-CH2 4.35Å; L461-W528 HydrophobicContact CD2-CZ3 3.85Å; I526-W528 HydrophobicContact CD1-CE3 3.8Å; I526-W528 HydrophobicContact CD1-CZ3 3.84Å; I526-W528 HydrophobicContact CG1-CE3 4.25Å; I526-W528 PolarHBondContact O-N 3.18Å; W528-G530 PolarHBondContact O-N 3.48Å
529	D	85.2	Confident	76.9	Confident	102 Å²	102	77.5 Å²	77.5	55%	0.545	37%	0.365	S	S	.	.			trans	-83	65.6	175.6	-65.4	-44	0	0	0	109.7	S418 Q423 E531	S418-D529 WeakPolarHBondContact CA-O 3.47Å; Q423-D529 PolarHBondContact NE2-OD2 3.45Å; D529-E531 PolarHBondContact O-N 3.38Å; D529-E531 VanDerWaalsContact O-N 3.11Å
530	G	69.5	Low	76	Confident	10 Å²	10	79.1 Å²	79.1	10%	0.103	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-58.3	118.7	174.7	0	0	0	0	0	109.4	D417 W528 R532	D417-G530 WeakPolarHBondContact O-CA 3.44Å; W528-G530 PolarHBondContact O-N 3.48Å; G530-R532 PolarHBondContact O-N 3.26Å
531	E	60.8	Low	74.7	Confident	136 Å²	136	84 Å²	84	64%	0.636	40%	0.396	S	S	*	.			trans	-50.6	118.2	171.5	-83.8	-164.3	160.7	0	0	107.2	D417 D529 S533	D417-E531 PolarHBondContact O-N 2.88Å; D529-E531 PolarHBondContact O-N 3.38Å; D529-E531 VanDerWaalsContact O-N 3.11Å; E531-S533 VanDerWaalsContact C-N 3.25Å; E531-S533 PolarHBondContact O-N 3.14Å
532	R	49.8	Very low	73.3	Confident	229 Å²	229	87.3 Å²	87.3	86%	0.864	41%	0.412	S	S	*	.			trans	-58.2	100.9	169.8	-77.4	-178.8	179.4	166.1	1.1	105.1	G530 N534	G530-R532 PolarHBondContact O-N 3.26Å; R532-N534 VanDerWaalsContact C-N 3.29Å; R532-N534 PolarHBondContact O-N 2.93Å
533	S	39.2	Very low	71.5	Confident	114 Å²	114	93.3 Å²	93.3	80%	0.797	44%	0.44	S	S	*	.			trans	-47.5	102.6	168.7	172.3	0	0	0	0	106.5	E531 R535	E531-S533 VanDerWaalsContact C-N 3.25Å; E531-S533 PolarHBondContact O-N 3.14Å; S533-R535 VanDerWaalsContact C-N 3.33Å; S533-R535 PolarHBondContact O-N 3.1Å
534	N	31.5	Very low	69.4	Low	155 Å²	155	97.4 Å²	97.4	83%	0.829	46%	0.461	S	S	*	.			trans	-68.4	100.1	173.5	-97	-26.1	0	0	0	105.3	R532	R532-N534 VanDerWaalsContact C-N 3.29Å; R532-N534 PolarHBondContact O-N 2.93Å
535	R	28	Very low	67	Low	312 Å²	312	106.2 Å²	106.2	100%	1.177	50%	0.502	S	S	*	.			trans	47	0	157.5	-73.6	-175.3	173.9	-178.8	-1.4	119.2	S533	S533-R535 VanDerWaalsContact C-N 3.33Å; S533-R535 PolarHBondContact O-N 3.1Å

Retrieved 535 of 535 residues in 97 ms (Link to these results)

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