A0A077ZF96_TRITR Loading...

Mediator of RNA polymerase II transcription

AlphaFold DB , UniProt , Accession A0A077ZF96, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 625 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	49.6	Very low	83.6	Confident	245 Å²	245	98.9 Å²	98.9	100%	1.207	50%	0.504	S	S	*	.				0	145.1	0	-55.6	177.4	-154	0	0	107.7
2	Q	54.1	Low	84.7	Confident	185 Å²	185	102.7 Å²	102.7	86%	0.864	51%	0.507	S	S	*	.			trans	-69	136.4	171.3	-70.2	178.8	-7.5	0	0	109.4	V4	Q2-V4 PolarHBondContact O-N 3.45Å
3	A	71.7	Confident	85.7	Confident	102 Å²	102	94.8 Å²	94.8	84%	0.843	47%	0.468	S	S	*	.			trans	-71.9	94.4	172.5	0	0	0	0	0	109	K5	A3-K5 PolarHBondContact O-N 2.63Å
4	V	79.6	Confident	86.6	Confident	44 Å²	44	93.4 Å²	93.4	27%	0.267	46%	0.463	S	S	.	.			trans	-60	119.8	176	-176.1	0	0	0	0	107.8	Q2 V6 Q8 L9	Q2-V4 PolarHBondContact O-N 3.45Å; V4-V6 PolarHBondContact O-N 2.88Å; V4-Q8 HydrophobicContact CG1-CB 4.05Å; V4-L9 HydrophobicContact CB-CD2 4.3Å; V4-L9 HydrophobicContact CG1-CD2 3.6Å; V4-L9 HydrophobicContact CG1-CG 3.99Å
5	K	90.9	Very high	87.3	Confident	154 Å²	154	93.5 Å²	93.5	67%	0.67	48%	0.477	S	S	*	.			trans	-62	135.7	-178.7	-67.7	-175.6	177.1	-176.8	0	108.4	A3 E7 Q8 L9	A3-K5 PolarHBondContact O-N 2.63Å; K5-E7 PolarHBondContact O-N 3.04Å; K5-E7 VanDerWaalsContact O-N 3.09Å; K5-Q8 HydrophobicContact CB-CG 4.2Å; K5-Q8 WeakPolarHBondContact O-CA 3.35Å; K5-Q8 VanDerWaalsContact O-CB 3.31Å; K5-Q8 WeakPolarHBondContact O-CB 3.34Å; K5-Q8 PolarHBondContact O-N 2.6Å; K5-L9 PolarHBondContact O-N 2.86Å
6	V	93.8	Very high	88	Confident	25 Å²	25	87.7 Å²	87.7	15%	0.152	45%	0.447	C	S	.	.	H	α-helix	trans	-58	-32.1	-174.5	-172.4	0	0	0	0	111.7	V4 Q8 L9 K10 L41 L51	V4-V6 PolarHBondContact O-N 2.88Å; V6-Q8 VanDerWaalsContact C-N 3.33Å; V6-Q8 PolarHBondContact O-N 2.79Å; V6-L9 WeakPolarHBondContact O-CB 3.49Å; V6-L9 PolarHBondContact O-N 3.19Å; V6-L9 VanDerWaalsContact O-N 3.15Å; V6-K10 PolarHBondContact O-N 3.04Å; V6-L41 HydrophobicContact CB-CD2 4.28Å; V6-L41 HydrophobicContact CG1-CD1 4.46Å; V6-L41 HydrophobicContact CG1-CD2 3.82Å; V6-L41 HydrophobicContact CG2-CD2 3.51Å; V6-L51 HydrophobicContact CG1-CD2 4.24Å
7	E	94.1	Very high	88.6	Confident	78 Å²	78	83.5 Å²	83.5	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-32.5	173.2	-164.6	56.9	-148.3	0	0	113.5	K5 L9 K10 Q11	K5-E7 PolarHBondContact O-N 3.04Å; K5-E7 VanDerWaalsContact O-N 3.09Å; E7-L9 VanDerWaalsContact C-N 3.34Å; E7-K10 PolarHBondContact O-N 3.38Å; E7-K10 IonicContact OE1-NZ 2.68Å; E7-K10 PolarHBondContact OE1-NZ 3.28Å; E7-K10 WeakPolarHBondContact OE2-CD 3.48Å; E7-K10 IonicContact OE2-NZ 3.39Å; E7-K10 PolarHBondContact OE2-NZ 3.38Å; E7-Q11 WeakPolarHBondContact O-CB 3.42Å; E7-Q11 VanDerWaalsContact O-CG 3.22Å; E7-Q11 WeakPolarHBondContact O-CG 3.4Å; E7-Q11 PolarHBondContact O-N 3.09Å
8	Q	95.7	Very high	89.1	Confident	93 Å²	93	82.3 Å²	82.3	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-69.3	-32.1	173.6	-65.4	173.8	-35.4	0	0	111.9	V4 K5 V6 R12	V4-Q8 HydrophobicContact CG1-CB 4.05Å; K5-Q8 HydrophobicContact CB-CG 4.2Å; K5-Q8 WeakPolarHBondContact O-CA 3.35Å; K5-Q8 VanDerWaalsContact O-CB 3.31Å; K5-Q8 WeakPolarHBondContact O-CB 3.34Å; K5-Q8 PolarHBondContact O-N 2.6Å; V6-Q8 VanDerWaalsContact C-N 3.33Å; V6-Q8 PolarHBondContact O-N 2.79Å; Q8-R12 WeakPolarHBondContact O-CB 3.25Å; Q8-R12 VanDerWaalsContact O-CG 3.3Å; Q8-R12 WeakPolarHBondContact O-CG 3.38Å; Q8-R12 PolarHBondContact O-N 3.18Å
9	L	96.2	Very high	89.5	Confident	2 Å²	2	86.9 Å²	86.9	1%	0.01	44%	0.44	C	S	.	.	H	α-helix	trans	-68	-44.3	173.3	-57.6	177.4	0	0	0	110.8	V4 K5 V6 E7 R12 L13 L35 I36 T39 L41	V4-L9 HydrophobicContact CB-CD2 4.3Å; V4-L9 HydrophobicContact CG1-CD2 3.6Å; V4-L9 HydrophobicContact CG1-CG 3.99Å; K5-L9 PolarHBondContact O-N 2.86Å; V6-L9 WeakPolarHBondContact O-CB 3.49Å; V6-L9 PolarHBondContact O-N 3.19Å; V6-L9 VanDerWaalsContact O-N 3.15Å; E7-L9 VanDerWaalsContact C-N 3.34Å; L9-R12 PolarHBondContact O-N 2.77Å; L9-L13 PolarHBondContact O-N 3.22Å; L9-L35 HydrophobicContact CD2-CB 4.38Å; L9-L35 HydrophobicContact CD2-CD2 3.54Å; L9-L35 HydrophobicContact CD2-CG 3.59Å; L9-I36 HydrophobicContact CB-CD1 4.31Å; L9-I36 HydrophobicContact CB-CG1 3.78Å; L9-I36 HydrophobicContact CD1-CG1 4.09Å; L9-I36 HydrophobicContact CD2-CG1 4.47Å; L9-I36 HydrophobicContact CG-CG1 4.34Å; L9-T39 HydrophobicContact CD1-CG2 3.97Å; L9-L41 HydrophobicContact CD1-CD2 4.38Å
10	K	96.8	Very high	89.8	Confident	49 Å²	49	89 Å²	89	21%	0.213	45%	0.448	C	S	.	.	H	α-helix	trans	-60.5	-45.5	174	173.5	165.7	157.3	-113.8	0	111.8	V6 E7 L13 L14 S49 L51 L54	V6-K10 PolarHBondContact O-N 3.04Å; E7-K10 PolarHBondContact O-N 3.38Å; E7-K10 IonicContact OE1-NZ 2.68Å; E7-K10 PolarHBondContact OE1-NZ 3.28Å; E7-K10 WeakPolarHBondContact OE2-CD 3.48Å; E7-K10 IonicContact OE2-NZ 3.39Å; E7-K10 PolarHBondContact OE2-NZ 3.38Å; K10-L13 PolarHBondContact O-N 2.87Å; K10-L14 HydrophobicContact CG-CD1 4.03Å; K10-L14 WeakPolarHBondContact O-CB 3.32Å; K10-L14 VanDerWaalsContact O-CG 3.27Å; K10-L14 WeakPolarHBondContact O-CG 3.02Å; K10-L14 PolarHBondContact O-N 3.24Å; K10-S49 VanDerWaalsContact CD-O 3.3Å; K10-S49 WeakPolarHBondContact CD-O 3.37Å; K10-S49 WeakPolarHBondContact CE-O 3.38Å; K10-L51 HydrophobicContact CB-CD1 4.21Å; K10-L54 HydrophobicContact CG-CD2 4.14Å
11	Q	97.2	Very high	90.1	Very high	111 Å²	111	87.6 Å²	87.6	52%	0.519	44%	0.439	S	S	.	.	H	α-helix	trans	-61.6	-44.7	174.3	-75	169.4	-10.2	0	0	112.4	E7 L13 L14 S15	E7-Q11 WeakPolarHBondContact O-CB 3.42Å; E7-Q11 VanDerWaalsContact O-CG 3.22Å; E7-Q11 WeakPolarHBondContact O-CG 3.4Å; E7-Q11 PolarHBondContact O-N 3.09Å; Q11-L13 PolarHBondContact O-N 3.25Å; Q11-L14 PolarHBondContact O-N 3.34Å; Q11-S15 WeakPolarHBondContact O-CB 3.47Å; Q11-S15 PolarHBondContact O-N 2.92Å; Q11-S15 PolarHBondContact O-OG 3.04Å
12	R	97.1	Very high	92.4	Very high	144 Å²	144	78.1 Å²	78.1	54%	0.543	39%	0.392	S	S	.	.	H	α-helix	trans	-60.5	-43.8	175.2	-77.5	177.4	-177.9	-154.5	-0.3	112.2	Q8 L9 S15 A32	Q8-R12 WeakPolarHBondContact O-CB 3.25Å; Q8-R12 VanDerWaalsContact O-CG 3.3Å; Q8-R12 WeakPolarHBondContact O-CG 3.38Å; Q8-R12 PolarHBondContact O-N 3.18Å; L9-R12 PolarHBondContact O-N 2.77Å; R12-S15 WeakPolarHBondContact CA-OG 3.48Å; R12-S15 PolarHBondContact O-N 3.37Å; R12-S15 PolarHBondContact O-OG 3.5Å; R12-A32 HydrophobicContact CB-CB 4.36Å
13	L	97.7	Very high	94.5	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-47.1	175.3	-179.8	60.5	0	0	0	111.3	L9 K10 Q11 S15 A16 L17 A32 I33 I36 L51 L54 I55	L9-L13 PolarHBondContact O-N 3.22Å; K10-L13 PolarHBondContact O-N 2.87Å; Q11-L13 PolarHBondContact O-N 3.25Å; L13-S15 VanDerWaalsContact C-N 3.3Å; L13-S15 PolarHBondContact O-N 3.28Å; L13-A16 PolarHBondContact O-N 2.97Å; L13-A16 VanDerWaalsContact O-N 3.12Å; L13-L17 HydrophobicContact CD1-CD1 4.36Å; L13-L17 HydrophobicContact CG-CD1 4.08Å; L13-L17 WeakPolarHBondContact O-CD1 3.41Å; L13-L17 VanDerWaalsContact O-CG 3.3Å; L13-L17 WeakPolarHBondContact O-CG 3.29Å; L13-A32 HydrophobicContact CB-CB 4.28Å; L13-A32 HydrophobicContact CD1-CB 4.43Å; L13-I33 HydrophobicContact CD1-CD1 4.21Å; L13-I33 HydrophobicContact CD1-CG1 4.4Å; L13-I33 HydrophobicContact CD2-CD1 4.35Å; L13-I36 HydrophobicContact CD2-CD1 4.37Å; L13-L51 HydrophobicContact CD2-CD1 4.31Å; L13-L54 HydrophobicContact CD2-CD2 4.02Å; L13-L54 HydrophobicContact CD2-CG 4.21Å; L13-I55 HydrophobicContact CD2-CD1 4.23Å; L13-I55 HydrophobicContact CD2-CG1 3.7Å
14	L	97.8	Very high	95.7	Very high	75 Å²	75	69.3 Å²	69.3	39%	0.393	34%	0.34	S	S	.	.	H	α-helix	trans	-60.2	-36.2	176.7	-71.3	168.4	0	0	0	112.8	K10 Q11 A16 L17 L54	K10-L14 HydrophobicContact CG-CD1 4.03Å; K10-L14 WeakPolarHBondContact O-CB 3.32Å; K10-L14 VanDerWaalsContact O-CG 3.27Å; K10-L14 WeakPolarHBondContact O-CG 3.02Å; K10-L14 PolarHBondContact O-N 3.24Å; Q11-L14 PolarHBondContact O-N 3.34Å; L14-A16 PolarHBondContact O-N 3.18Å; L14-L17 HydrophobicContact CD2-CD1 4.49Å; L14-L17 PolarHBondContact O-N 3.07Å; L14-L54 HydrophobicContact CD2-CD1 3.92Å; L14-L54 HydrophobicContact CD2-CD2 3.93Å; L14-L54 HydrophobicContact CG-CD2 4Å
15	S	97.5	Very high	96.5	Very high	96 Å²	96	71.1 Å²	71.1	67%	0.671	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-8.4	176.9	69.4	0	0	0	0	115.1	Q11 R12 L13	Q11-S15 WeakPolarHBondContact O-CB 3.47Å; Q11-S15 PolarHBondContact O-N 2.92Å; Q11-S15 PolarHBondContact O-OG 3.04Å; R12-S15 WeakPolarHBondContact CA-OG 3.48Å; R12-S15 PolarHBondContact O-N 3.37Å; R12-S15 PolarHBondContact O-OG 3.5Å; L13-S15 VanDerWaalsContact C-N 3.3Å; L13-S15 PolarHBondContact O-N 3.28Å
16	A	97.9	Very high	96.8	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	13.7	175.4	0	0	0	0	0	112.9	L13 L14 T24 A28 A29	L13-A16 PolarHBondContact O-N 2.97Å; L13-A16 VanDerWaalsContact O-N 3.12Å; L14-A16 PolarHBondContact O-N 3.18Å; A16-T24 PolarHBondContact O-N 3.4Å; A16-T24 PolarHBondContact O-OG1 2.89Å; A16-A28 HydrophobicContact CB-CB 3.74Å; A16-A29 HydrophobicContact CB-CB 3.84Å
17	L	98.1	Very high	96.9	Very high	16 Å²	16	73.4 Å²	73.4	8%	0.084	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-124.8	161.1	-178.5	-63.7	169.6	0	0	0	110.2	L13 L14 Q22 V23 V58	L13-L17 HydrophobicContact CD1-CD1 4.36Å; L13-L17 HydrophobicContact CG-CD1 4.08Å; L13-L17 WeakPolarHBondContact O-CD1 3.41Å; L13-L17 VanDerWaalsContact O-CG 3.3Å; L13-L17 WeakPolarHBondContact O-CG 3.29Å; L14-L17 HydrophobicContact CD2-CD1 4.49Å; L14-L17 PolarHBondContact O-N 3.07Å; L17-Q22 WeakPolarHBondContact CA-O 3.29Å; L17-Q22 WeakPolarHBondContact CD2-O 3.48Å; L17-V23 HydrophobicContact CD2-CB 4.41Å; L17-V23 HydrophobicContact CD2-CG2 3.62Å; L17-V58 HydrophobicContact CD1-CG1 4.5Å; L17-V58 HydrophobicContact CD1-CG2 3.53Å; L17-V58 HydrophobicContact CD2-CG1 3.73Å; L17-V58 HydrophobicContact CD2-CG2 4.1Å
18	D	97.6	Very high	97.1	Very high	63 Å²	63	71.5 Å²	71.5	34%	0.337	36%	0.36	S	S	.	.			trans	-92.8	-177.9	167	57.7	23.7	0	0	0	112.5	E20 K21 Q22 T24	D18-E20 PolarHBondContact O-N 3.45Å; D18-E20 VanDerWaalsContact OD1-C 3.3Å; D18-E20 WeakPolarHBondContact OD1-CA 3.5Å; D18-E20 WeakPolarHBondContact OD1-CB 3.27Å; D18-E20 PolarHBondContact OD1-N 3.26Å; D18-K21 PolarHBondContact O-N 3.05Å; D18-K21 PolarHBondContact OD1-N 3.27Å; D18-Q22 PolarHBondContact N-O 3.45Å; D18-Q22 VanDerWaalsContact N-O 3.09Å; D18-Q22 PolarHBondContact OD1-N 3.02Å; D18-Q22 WeakPolarHBondContact OD2-CB 3.4Å; D18-T24 HydrophobicContact CB-CG2 3.65Å
19	E	96.6	Very high	97.2	Very high	169 Å²	169	67.1 Å²	67.1	79%	0.79	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.6	174.6	-60.9	-171.2	170.4	0	0	112.1	K21 R381	E19-K21 VanDerWaalsContact C-N 3.33Å; E19-R381 IonicContact OE1-NH2 2.69Å; E19-R381 PolarHBondContact OE1-NH2 2.8Å
20	E	96.9	Very high	97.3	Very high	128 Å²	128	67.6 Å²	67.6	60%	0.598	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-13.2	173.8	-65.8	-153.8	166.3	0	0	113.7	D18 Q22 K61	D18-E20 PolarHBondContact O-N 3.45Å; D18-E20 VanDerWaalsContact OD1-C 3.3Å; D18-E20 WeakPolarHBondContact OD1-CA 3.5Å; D18-E20 WeakPolarHBondContact OD1-CB 3.27Å; D18-E20 PolarHBondContact OD1-N 3.26Å; E20-Q22 HydrophobicContact CB-CG 4.24Å; E20-K61 WeakPolarHBondContact O-CD 3.4Å; E20-K61 WeakPolarHBondContact O-CE 3.41Å; E20-K61 PolarHBondContact O-NZ 3.39Å
21	K	96.4	Very high	97.3	Very high	60 Å²	60	69.3 Å²	69.3	26%	0.261	36%	0.356	S	S	.	.			trans	68.9	28.9	-172.5	-44.7	173.1	-161.5	139.9	0	114	D18 E19 L54 E57 V58 K61 N62	D18-K21 PolarHBondContact O-N 3.05Å; D18-K21 PolarHBondContact OD1-N 3.27Å; E19-K21 VanDerWaalsContact C-N 3.33Å; K21-L54 HydrophobicContact CD-CD1 4.02Å; K21-E57 WeakPolarHBondContact CD-OE1 3.4Å; K21-E57 IonicContact NZ-OE1 3.22Å; K21-E57 PolarHBondContact NZ-OE1 2.62Å; K21-E57 IonicContact NZ-OE2 3.2Å; K21-E57 PolarHBondContact NZ-OE2 2.71Å; K21-V58 HydrophobicContact CB-CG2 4.14Å; K21-K61 HydrophobicContact CB-CD 4.47Å; K21-N62 PolarHBondContact O-ND2 2.73Å
22	Q	96.8	Very high	97.3	Very high	46 Å²	46	64.4 Å²	64.4	22%	0.215	33%	0.334	C	S	.	.			trans	-76.6	156.2	157.1	-48.7	-67.6	5.5	0	0	109.7	L17 D18 E20 T24 K61	L17-Q22 WeakPolarHBondContact CA-O 3.29Å; L17-Q22 WeakPolarHBondContact CD2-O 3.48Å; D18-Q22 PolarHBondContact N-O 3.45Å; D18-Q22 VanDerWaalsContact N-O 3.09Å; D18-Q22 PolarHBondContact OD1-N 3.02Å; D18-Q22 WeakPolarHBondContact OD2-CB 3.4Å; E20-Q22 HydrophobicContact CB-CG 4.24Å; Q22-T24 PolarHBondContact O-N 3.3Å; Q22-K61 PolarHBondContact OE1-O 3.29Å
23	V	97.6	Very high	97.4	Very high	12 Å²	12	57.6 Å²	57.6	7%	0.073	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-85.3	103.1	-178.7	171.4	0	0	0	0	110.2	L17 V26 A29 V58 N62 F66 F69	L17-V23 HydrophobicContact CD2-CB 4.41Å; L17-V23 HydrophobicContact CD2-CG2 3.62Å; V23-V26 VanDerWaalsContact CG1-CA 3.5Å; V23-V26 HydrophobicContact CG1-CB 4.29Å; V23-V26 HydrophobicContact CG1-CG2 4.05Å; V23-A29 HydrophobicContact CG1-CB 3.62Å; V23-A29 HydrophobicContact CG2-CB 4.06Å; V23-V58 HydrophobicContact CG2-CG1 4.23Å; V23-N62 WeakPolarHBondContact CB-OD1 3.48Å; V23-N62 WeakPolarHBondContact CG2-OD1 3.34Å; V23-N62 PolarHBondContact N-OD1 2.72Å; V23-F66 HydrophobicContact CB-CD2 4.07Å; V23-F66 HydrophobicContact CB-CE2 4Å; V23-F66 HydrophobicContact CG1-CD2 4.48Å; V23-F66 HydrophobicContact CG1-CE2 4.35Å; V23-F69 HydrophobicContact CG2-CD1 4.42Å; V23-F69 HydrophobicContact CG2-CE1 3.89Å; V23-F69 HydrophobicContact CG2-CZ 4.12Å
24	T	97.4	Very high	97.3	Very high	90 Å²	90	60.2 Å²	60.2	55%	0.552	32%	0.323	S	S	*	.	S	Bend	trans	-74.9	-35.4	175.7	52.7	0	0	0	0	111.9	A16 D18 Q22	A16-T24 PolarHBondContact O-N 3.4Å; A16-T24 PolarHBondContact O-OG1 2.89Å; D18-T24 HydrophobicContact CB-CG2 3.65Å; Q22-T24 PolarHBondContact O-N 3.3Å
25	N	96.7	Very high	97.3	Very high	83 Å²	83	58.9 Å²	58.9	44%	0.444	32%	0.316	S	S	.	.			trans	-127	93.8	178.5	-173.4	-27	0	0	0	110.7	K27 A28 A29	N25-K27 PolarHBondContact O-N 2.82Å; N25-K27 PolarHBondContact OD1-N 3Å; N25-A28 HydrophobicContact CB-CB 3.97Å; N25-A28 PolarHBondContact O-N 2.95Å; N25-A28 PolarHBondContact OD1-N 3.46Å; N25-A29 WeakPolarHBondContact O-CB 3.37Å; N25-A29 PolarHBondContact O-N 3.1Å
26	V	96.3	Very high	97.2	Very high	68 Å²	68	54.4 Å²	54.4	41%	0.412	28%	0.284	S	S	.	.	H	α-helix	trans	-55.2	-36.2	-177.4	-171.2	0	0	0	0	112.6	V23 G30 F66	V23-V26 VanDerWaalsContact CG1-CA 3.5Å; V23-V26 HydrophobicContact CG1-CB 4.29Å; V23-V26 HydrophobicContact CG1-CG2 4.05Å; V26-G30 PolarHBondContact O-N 3.38Å; V26-F66 HydrophobicContact CG1-CD1 4.26Å; V26-F66 HydrophobicContact CG1-CE1 4.42Å; V26-F66 HydrophobicContact CG2-CD1 4.07Å; V26-F66 HydrophobicContact CG2-CE1 3.46Å; V26-F66 VanDerWaalsContact CG2-CE1 3.46Å; V26-F66 HydrophobicContact CG2-CE2 3.96Å; V26-F66 HydrophobicContact CG2-CZ 3.4Å; V26-F66 VanDerWaalsContact CG2-CZ 3.4Å
27	K	97.2	Very high	97.2	Very high	159 Å²	159	57.8 Å²	57.8	69%	0.691	30%	0.3	S	S	*	.	H	α-helix	trans	-70.7	-52.1	178	-174.1	179.3	176.8	-175.6	0	111	N25 A29 G30 D31	N25-K27 PolarHBondContact O-N 2.82Å; N25-K27 PolarHBondContact OD1-N 3Å; K27-A29 VanDerWaalsContact C-N 3.33Å; K27-A29 PolarHBondContact O-N 2.9Å; K27-G30 PolarHBondContact O-N 3.26Å; K27-G30 VanDerWaalsContact O-N 3.15Å; K27-D31 WeakPolarHBondContact O-CB 3.49Å; K27-D31 PolarHBondContact O-N 3.46Å
28	A	97.7	Very high	97	Very high	38 Å²	38	66.9 Å²	66.9	31%	0.314	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-38.6	-180	0	0	0	0	0	112.4	A16 N25 A32	A16-A28 HydrophobicContact CB-CB 3.74Å; N25-A28 HydrophobicContact CB-CB 3.97Å; N25-A28 PolarHBondContact O-N 2.95Å; N25-A28 PolarHBondContact OD1-N 3.46Å; A28-A32 VanDerWaalsContact O-CB 3.31Å; A28-A32 WeakPolarHBondContact O-CB 3.46Å; A28-A32 PolarHBondContact O-N 3.41Å
29	A	98	Very high	96.9	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-66.2	-42.3	173.7	0	0	0	0	0	111.4	A16 V23 N25 K27 A32 I33 F69	A16-A29 HydrophobicContact CB-CB 3.84Å; V23-A29 HydrophobicContact CG1-CB 3.62Å; V23-A29 HydrophobicContact CG2-CB 4.06Å; N25-A29 WeakPolarHBondContact O-CB 3.37Å; N25-A29 PolarHBondContact O-N 3.1Å; K27-A29 VanDerWaalsContact C-N 3.33Å; K27-A29 PolarHBondContact O-N 2.9Å; A29-A32 PolarHBondContact O-N 3.13Å; A29-I33 WeakPolarHBondContact O-CG1 2.87Å; A29-I33 PolarHBondContact O-N 3Å; A29-F69 HydrophobicContact CB-CE2 3.86Å; A29-F69 HydrophobicContact CB-CZ 4.02Å
30	G	97.8	Very high	96.7	Very high	12 Å²	12	64.2 Å²	64.2	12%	0.124	33%	0.331	C	S	.	.	H	α-helix	trans	-60.9	-44.9	174.7	0	0	0	0	0	112.9	V26 K27 I33 L34	V26-G30 PolarHBondContact O-N 3.38Å; K27-G30 PolarHBondContact O-N 3.26Å; K27-G30 VanDerWaalsContact O-N 3.15Å; G30-I33 PolarHBondContact O-N 3.36Å; G30-L34 WeakPolarHBondContact O-CB 3.2Å; G30-L34 VanDerWaalsContact O-CG 3.31Å; G30-L34 WeakPolarHBondContact O-CG 3.47Å; G30-L34 PolarHBondContact O-N 3.47Å
31	D	97.6	Very high	96.5	Very high	86 Å²	86	58.9 Å²	58.9	46%	0.46	31%	0.306	S	S	.	.	H	α-helix	trans	-66.8	-36.4	176.7	-69.8	-27.4	0	0	0	111.6	K27 L35	K27-D31 WeakPolarHBondContact O-CB 3.49Å; K27-D31 PolarHBondContact O-N 3.46Å; D31-L35 WeakPolarHBondContact O-CB 3.12Å; D31-L35 PolarHBondContact O-N 2.86Å
32	A	97.5	Very high	96.4	Very high	7 Å²	7	59.7 Å²	59.7	6%	0.058	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-45.4	172.8	0	0	0	0	0	112.1	R12 L13 A28 A29 L35 I36	R12-A32 HydrophobicContact CB-CB 4.36Å; L13-A32 HydrophobicContact CB-CB 4.28Å; L13-A32 HydrophobicContact CD1-CB 4.43Å; A28-A32 VanDerWaalsContact O-CB 3.31Å; A28-A32 WeakPolarHBondContact O-CB 3.46Å; A28-A32 PolarHBondContact O-N 3.41Å; A29-A32 PolarHBondContact O-N 3.13Å; A32-L35 PolarHBondContact O-N 3.02Å; A32-I36 WeakPolarHBondContact O-CD1 3.21Å; A32-I36 VanDerWaalsContact O-CG1 3.25Å; A32-I36 WeakPolarHBondContact O-CG1 3.16Å; A32-I36 PolarHBondContact O-N 2.95Å
33	I	97.6	Very high	96.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-43.3	175	-68.2	-63.2	0	0	0	111.2	L13 A29 G30 L35 I36 E37 I55 F69 R72	L13-I33 HydrophobicContact CD1-CD1 4.21Å; L13-I33 HydrophobicContact CD1-CG1 4.4Å; L13-I33 HydrophobicContact CD2-CD1 4.35Å; A29-I33 WeakPolarHBondContact O-CG1 2.87Å; A29-I33 PolarHBondContact O-N 3Å; G30-I33 PolarHBondContact O-N 3.36Å; I33-L35 VanDerWaalsContact C-N 3.28Å; I33-L35 PolarHBondContact O-N 3.42Å; I33-I36 HydrophobicContact CD1-CD1 4.39Å; I33-I36 CarbonylContact O-C 3.56Å; I33-I36 PolarHBondContact O-N 2.79Å; I33-I36 VanDerWaalsContact O-N 3.11Å; I33-E37 HydrophobicContact CG2-CG 4.2Å; I33-E37 WeakPolarHBondContact CG2-OE1 3.43Å; I33-E37 WeakPolarHBondContact O-CB 3.37Å; I33-E37 WeakPolarHBondContact O-CG 3.28Å; I33-E37 PolarHBondContact O-N 3.23Å; I33-I55 HydrophobicContact CD1-CD1 3.76Å; I33-I55 HydrophobicContact CD1-CG1 4.26Å; I33-I55 HydrophobicContact CD1-CG2 4.43Å; I33-F69 HydrophobicContact CB-CE2 4.29Å; I33-F69 HydrophobicContact CD1-CZ 4.38Å; I33-F69 HydrophobicContact CG1-CE2 3.5Å; I33-F69 HydrophobicContact CG1-CZ 3.67Å; I33-R72 HydrophobicContact CG2-CB 4.38Å
34	L	96.9	Very high	96.1	Very high	56 Å²	56	67.4 Å²	67.4	29%	0.293	35%	0.351	S	S	.	.	H	α-helix	trans	-60.9	-34.7	175.4	-77.3	166.9	0	0	0	112.8	G30 R38	G30-L34 WeakPolarHBondContact O-CB 3.2Å; G30-L34 VanDerWaalsContact O-CG 3.31Å; G30-L34 WeakPolarHBondContact O-CG 3.47Å; G30-L34 PolarHBondContact O-N 3.47Å; L34-R38 WeakPolarHBondContact O-CB 3.37Å; L34-R38 WeakPolarHBondContact O-CD 3.48Å; L34-R38 VanDerWaalsContact O-CG 3.25Å; L34-R38 WeakPolarHBondContact O-CG 3.31Å; L34-R38 PolarHBondContact O-N 2.99Å; L34-R38 VanDerWaalsContact O-N 3.15Å
35	L	96.2	Very high	96	Very high	47 Å²	47	64.9 Å²	64.9	25%	0.246	34%	0.336	C	S	.	.	H	α-helix	trans	-72.8	-34.6	175.2	-172.8	63	0	0	0	112	L9 D31 A32 I33 T39	L9-L35 HydrophobicContact CD2-CB 4.38Å; L9-L35 HydrophobicContact CD2-CD2 3.54Å; L9-L35 HydrophobicContact CD2-CG 3.59Å; D31-L35 WeakPolarHBondContact O-CB 3.12Å; D31-L35 PolarHBondContact O-N 2.86Å; A32-L35 PolarHBondContact O-N 3.02Å; I33-L35 VanDerWaalsContact C-N 3.28Å; I33-L35 PolarHBondContact O-N 3.42Å; L35-T39 PolarHBondContact O-N 3.46Å; L35-T39 PolarHBondContact O-OG1 3.43Å
36	I	97	Very high	95.9	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-45.2	173.8	-68.3	161.2	0	0	0	110.8	L9 L13 A32 I33 R38 T39 L41 L51 I55 L76 W80	L9-I36 HydrophobicContact CB-CD1 4.31Å; L9-I36 HydrophobicContact CB-CG1 3.78Å; L9-I36 HydrophobicContact CD1-CG1 4.09Å; L9-I36 HydrophobicContact CD2-CG1 4.47Å; L9-I36 HydrophobicContact CG-CG1 4.34Å; L13-I36 HydrophobicContact CD2-CD1 4.37Å; A32-I36 WeakPolarHBondContact O-CD1 3.21Å; A32-I36 VanDerWaalsContact O-CG1 3.25Å; A32-I36 WeakPolarHBondContact O-CG1 3.16Å; A32-I36 PolarHBondContact O-N 2.95Å; I33-I36 HydrophobicContact CD1-CD1 4.39Å; I33-I36 CarbonylContact O-C 3.56Å; I33-I36 PolarHBondContact O-N 2.79Å; I33-I36 VanDerWaalsContact O-N 3.11Å; I36-R38 PolarHBondContact O-N 3.4Å; I36-T39 PolarHBondContact O-N 2.75Å; I36-L41 HydrophobicContact CG2-CD1 4.49Å; I36-L51 HydrophobicContact CD1-CD1 4.45Å; I36-L51 HydrophobicContact CD1-CD2 4.29Å; I36-L51 HydrophobicContact CG1-CD2 4.41Å; I36-L51 HydrophobicContact CG2-CD2 4.09Å; I36-I55 HydrophobicContact CD1-CD1 4.21Å; I36-I55 HydrophobicContact CG2-CD1 4.35Å; I36-L76 HydrophobicContact CG2-CD1 4.38Å; I36-L76 HydrophobicContact CG2-CD2 3.71Å; I36-W80 HydrophobicContact CG2-CH2 3.71Å; I36-W80 HydrophobicContact CG2-CZ2 3.46Å; I36-W80 VanDerWaalsContact CG2-CZ2 3.46Å
37	E	96.3	Very high	95.8	Very high	72 Å²	72	62.9 Å²	62.9	34%	0.336	32%	0.32	S	S	.	.	H	α-helix	trans	-58.2	-34.1	174.5	-73.8	170.4	171.7	0	0	112.1	I33 L76	I33-E37 HydrophobicContact CG2-CG 4.2Å; I33-E37 WeakPolarHBondContact CG2-OE1 3.43Å; I33-E37 WeakPolarHBondContact O-CB 3.37Å; I33-E37 WeakPolarHBondContact O-CG 3.28Å; I33-E37 PolarHBondContact O-N 3.23Å; E37-L76 HydrophobicContact CG-CD1 4.12Å; E37-L76 HydrophobicContact CG-CD2 4.41Å
38	R	95.6	Very high	95.7	Very high	207 Å²	207	62.9 Å²	62.9	78%	0.781	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-12.4	175	-73.4	171.7	177.1	179.1	-0.8	114.6	L34 I36	L34-R38 WeakPolarHBondContact O-CB 3.37Å; L34-R38 WeakPolarHBondContact O-CD 3.48Å; L34-R38 VanDerWaalsContact O-CG 3.25Å; L34-R38 WeakPolarHBondContact O-CG 3.31Å; L34-R38 PolarHBondContact O-N 2.99Å; L34-R38 VanDerWaalsContact O-N 3.15Å; I36-R38 PolarHBondContact O-N 3.4Å
39	T	94.9	Very high	95.6	Very high	36 Å²	36	61.4 Å²	61.4	22%	0.221	31%	0.31	C	S	.	.	S	Bend	trans	-96.8	118.5	-177.8	-56.3	0	0	0	0	110.1	L9 L35 I36 L41	L9-T39 HydrophobicContact CD1-CG2 3.97Å; L35-T39 PolarHBondContact O-N 3.46Å; L35-T39 PolarHBondContact O-OG1 3.43Å; I36-T39 PolarHBondContact O-N 2.75Å; T39-L41 VanDerWaalsContact C-N 3.32Å; T39-L41 HydrophobicContact CG2-CD2 3.84Å; T39-L41 PolarHBondContact O-N 3.37Å
40	T	92.4	Very high	95.5	Very high	140 Å²	140	70.1 Å²	70.1	86%	0.859	34%	0.343	S	S	*	.			trans	-71.1	84.1	175.7	53.5	0	0	0	0	110.9
41	L	93.4	Very high	95.4	Very high	16 Å²	16	69.5 Å²	69.5	8%	0.084	34%	0.337	C	S	.	.			trans	-70.9	131.1	176.5	-59.8	-176.6	0	0	0	111	V6 L9 I36 T39 L46 L51 W80	V6-L41 HydrophobicContact CB-CD2 4.28Å; V6-L41 HydrophobicContact CG1-CD1 4.46Å; V6-L41 HydrophobicContact CG1-CD2 3.82Å; V6-L41 HydrophobicContact CG2-CD2 3.51Å; L9-L41 HydrophobicContact CD1-CD2 4.38Å; I36-L41 HydrophobicContact CG2-CD1 4.49Å; T39-L41 VanDerWaalsContact C-N 3.32Å; T39-L41 HydrophobicContact CG2-CD2 3.84Å; T39-L41 PolarHBondContact O-N 3.37Å; L41-L46 HydrophobicContact CD1-CD1 4Å; L41-L51 HydrophobicContact CD1-CD2 3.9Å; L41-W80 HydrophobicContact CD1-CH2 4.11Å; L41-W80 HydrophobicContact CD1-CZ2 3.4Å; L41-W80 VanDerWaalsContact CD1-CZ2 3.4Å
42	T	94.4	Very high	95.4	Very high	76 Å²	76	66.6 Å²	66.6	47%	0.466	33%	0.327	S	S	.	.			trans	-73.1	160.5	164.7	66.2	0	0	0	0	109.8	E44 S45 L46	T42-E44 VanDerWaalsContact C-N 3.32Å; T42-E44 PolarHBondContact O-N 2.97Å; T42-S45 PolarHBondContact OG1-N 3.27Å; T42-S45 PolarHBondContact OG1-OG 3.44Å; T42-L46 WeakPolarHBondContact O-CB 3.09Å; T42-L46 PolarHBondContact O-N 2.89Å; T42-L46 VanDerWaalsContact O-N 3.15Å
43	K	94.1	Very high	95.4	Very high	69 Å²	69	72 Å²	72	30%	0.3	35%	0.354	S	S	.	.	H	α-helix	trans	-55.3	-48.9	171.4	168.5	179.4	173.9	-167.8	0	111.6	S45 L46 E47 S87	K43-S45 PolarHBondContact O-N 3Å; K43-L46 WeakPolarHBondContact O-CA 3.27Å; K43-L46 WeakPolarHBondContact O-CB 3.2Å; K43-L46 PolarHBondContact O-N 2.93Å; K43-E47 WeakPolarHBondContact CE-OE1 3.45Å; K43-E47 WeakPolarHBondContact CE-OE2 3.35Å; K43-E47 HydrophobicContact CG-CG 4.25Å; K43-E47 WeakPolarHBondContact CG-OE2 3.49Å; K43-E47 IonicContact NZ-OE1 3.37Å; K43-E47 WeakPolarHBondContact O-CG 3.47Å; K43-E47 PolarHBondContact O-N 2.82Å; K43-S87 WeakPolarHBondContact CD-OG 3.37Å; K43-S87 WeakPolarHBondContact CE-OG 3.5Å; K43-S87 PolarHBondContact NZ-OG 3.31Å
44	E	93.8	Very high	95.4	Very high	152 Å²	152	73 Å²	73	71%	0.71	36%	0.359	S	S	*	.	H	α-helix	trans	-58.5	-48.6	-175.1	-65.1	168.9	176	0	0	110.9	T42 L46 E47 E48	T42-E44 VanDerWaalsContact C-N 3.32Å; T42-E44 PolarHBondContact O-N 2.97Å; E44-L46 VanDerWaalsContact C-N 3.27Å; E44-L46 PolarHBondContact O-N 3.13Å; E44-E47 PolarHBondContact O-N 3.04Å; E44-E48 VanDerWaalsContact O-CB 3.27Å; E44-E48 WeakPolarHBondContact O-CB 3.22Å; E44-E48 PolarHBondContact O-N 2.92Å
45	S	94.3	Very high	95.4	Very high	36 Å²	36	70.3 Å²	70.3	25%	0.252	35%	0.346	S	S	.	.	H	α-helix	trans	-69.6	-22.5	177.6	-54.3	0	0	0	0	113.6	T42 K43 S49	T42-S45 PolarHBondContact OG1-N 3.27Å; T42-S45 PolarHBondContact OG1-OG 3.44Å; K43-S45 PolarHBondContact O-N 3Å; S45-S49 WeakPolarHBondContact O-CB 3.4Å; S45-S49 PolarHBondContact O-N 3.3Å; S45-S49 VanDerWaalsContact O-N 3.15Å; S45-S49 PolarHBondContact O-OG 3.25Å
46	L	95.4	Very high	95.5	Very high	11 Å²	11	70.3 Å²	70.3	6%	0.058	35%	0.345	C	S	.	.	H	α-helix	trans	-75.5	-39.7	172.7	-174.5	74.5	0	0	0	112	L41 T42 K43 E44 S49 R50 L51 W80 I84	L41-L46 HydrophobicContact CD1-CD1 4Å; T42-L46 WeakPolarHBondContact O-CB 3.09Å; T42-L46 PolarHBondContact O-N 2.89Å; T42-L46 VanDerWaalsContact O-N 3.15Å; K43-L46 WeakPolarHBondContact O-CA 3.27Å; K43-L46 WeakPolarHBondContact O-CB 3.2Å; K43-L46 PolarHBondContact O-N 2.93Å; E44-L46 VanDerWaalsContact C-N 3.27Å; E44-L46 PolarHBondContact O-N 3.13Å; L46-S49 PolarHBondContact O-OG 2.97Å; L46-R50 PolarHBondContact O-N 3.29Å; L46-L51 HydrophobicContact CD1-CB 4.24Å; L46-W80 HydrophobicContact CD1-CD2 3.62Å; L46-W80 HydrophobicContact CD1-CE3 3.51Å; L46-W80 HydrophobicContact CD1-CG 4.25Å; L46-W80 HydrophobicContact CD1-CH2 3.91Å; L46-W80 HydrophobicContact CD1-CZ2 4.05Å; L46-W80 HydrophobicContact CD1-CZ3 3.67Å; L46-W80 HydrophobicContact CD2-CB 3.66Å; L46-W80 HydrophobicContact CD2-CD2 4.01Å; L46-W80 HydrophobicContact CD2-CE3 4.23Å; L46-W80 HydrophobicContact CD2-CG 3.8Å; L46-W80 HydrophobicContact CG-CD2 4.5Å; L46-W80 HydrophobicContact CG-CE3 4.49Å; L46-I84 HydrophobicContact CD2-CD1 4.04Å; L46-I84 HydrophobicContact CD2-CG1 4.42Å
47	E	93.9	Very high	95.5	Very high	98 Å²	98	72.4 Å²	72.4	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-70.8	-44.3	177.2	-71	174.5	162	0	0	111	K43 E44 R50	K43-E47 WeakPolarHBondContact CE-OE1 3.45Å; K43-E47 WeakPolarHBondContact CE-OE2 3.35Å; K43-E47 HydrophobicContact CG-CG 4.25Å; K43-E47 WeakPolarHBondContact CG-OE2 3.49Å; K43-E47 IonicContact NZ-OE1 3.37Å; K43-E47 WeakPolarHBondContact O-CG 3.47Å; K43-E47 PolarHBondContact O-N 2.82Å; E44-E47 PolarHBondContact O-N 3.04Å; E47-R50 PolarHBondContact O-N 3.32Å
48	E	94.3	Very high	95.6	Very high	160 Å²	160	69 Å²	69	75%	0.748	34%	0.34	S	S	*	.	H	α-helix	trans	-60.7	-54.1	175	-178.5	-175.1	-152.6	0	0	112.3	E44 R50	E44-E48 VanDerWaalsContact O-CB 3.27Å; E44-E48 WeakPolarHBondContact O-CB 3.22Å; E44-E48 PolarHBondContact O-N 2.92Å; E48-R50 PolarHBondContact O-N 3.39Å
49	S	95.5	Very high	95.7	Very high	7 Å²	7	60.8 Å²	60.8	5%	0.049	31%	0.309	C	S	.	.	H	α-helix	trans	-70.3	-16.4	-178.3	64.2	0	0	0	0	114	K10 S45 L46 L51	K10-S49 VanDerWaalsContact CD-O 3.3Å; K10-S49 WeakPolarHBondContact CD-O 3.37Å; K10-S49 WeakPolarHBondContact CE-O 3.38Å; S45-S49 WeakPolarHBondContact O-CB 3.4Å; S45-S49 PolarHBondContact O-N 3.3Å; S45-S49 VanDerWaalsContact O-N 3.15Å; S45-S49 PolarHBondContact O-OG 3.25Å; L46-S49 PolarHBondContact O-OG 2.97Å; S49-L51 PolarHBondContact O-N 3.45Å; S49-L51 VanDerWaalsContact O-N 3.13Å; S49-L51 WeakPolarHBondContact OG-CB 3.26Å; S49-L51 PolarHBondContact OG-N 2.72Å
50	R	96	Very high	95.9	Very high	182 Å²	182	66 Å²	66	69%	0.687	32%	0.324	S	S	*	.			trans	54.9	20	-171.1	-59	-179.5	175.9	-177.9	-2.5	114.2	L46 E47 E48 G52 L53 L54	L46-R50 PolarHBondContact O-N 3.29Å; E47-R50 PolarHBondContact O-N 3.32Å; E48-R50 PolarHBondContact O-N 3.39Å; R50-G52 PolarHBondContact O-N 3.47Å; R50-G52 VanDerWaalsContact O-N 3.14Å; R50-L53 HydrophobicContact CB-CD1 4.49Å; R50-L53 WeakPolarHBondContact O-CB 3.31Å; R50-L53 PolarHBondContact O-N 2.98Å; R50-L54 PolarHBondContact O-N 3.45Å
51	L	97	Very high	96.1	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-31.3	-173.1	-176.2	62.9	0	0	0	113	V6 K10 L13 I36 L41 L46 S49 L53 L54 I55 W80	V6-L51 HydrophobicContact CG1-CD2 4.24Å; K10-L51 HydrophobicContact CB-CD1 4.21Å; L13-L51 HydrophobicContact CD2-CD1 4.31Å; I36-L51 HydrophobicContact CD1-CD1 4.45Å; I36-L51 HydrophobicContact CD1-CD2 4.29Å; I36-L51 HydrophobicContact CG1-CD2 4.41Å; I36-L51 HydrophobicContact CG2-CD2 4.09Å; L41-L51 HydrophobicContact CD1-CD2 3.9Å; L46-L51 HydrophobicContact CD1-CB 4.24Å; S49-L51 PolarHBondContact O-N 3.45Å; S49-L51 VanDerWaalsContact O-N 3.13Å; S49-L51 WeakPolarHBondContact OG-CB 3.26Å; S49-L51 PolarHBondContact OG-N 2.72Å; L51-L53 VanDerWaalsContact C-N 3.31Å; L51-L53 PolarHBondContact O-N 2.87Å; L51-L54 HydrophobicContact CD1-CD2 4.24Å; L51-L54 PolarHBondContact O-N 2.91Å; L51-I55 HydrophobicContact CD1-CD1 4.17Å; L51-I55 HydrophobicContact CD1-CG1 4.16Å; L51-I55 HydrophobicContact CG-CD1 4.09Å; L51-I55 HydrophobicContact CG-CG1 4.37Å; L51-I55 PolarHBondContact O-N 3.05Å; L51-W80 HydrophobicContact CD2-CH2 3.67Å; L51-W80 HydrophobicContact CD2-CZ2 4.28Å; L51-W80 HydrophobicContact CG-CH2 3.76Å; L51-W80 HydrophobicContact CG-CZ3 4.21Å
52	G	97	Very high	96.3	Very high	24 Å²	24	62.1 Å²	62.1	25%	0.247	30%	0.295	C	S	.	.	H	α-helix	trans	-59.6	-35.1	173.7	0	0	0	0	0	114.4	R50 N56	R50-G52 PolarHBondContact O-N 3.47Å; R50-G52 VanDerWaalsContact O-N 3.14Å; G52-N56 WeakPolarHBondContact O-CB 3.38Å; G52-N56 PolarHBondContact O-N 3.15Å
53	L	96.8	Very high	96.5	Very high	122 Å²	122	62.8 Å²	62.8	64%	0.639	29%	0.293	S	S	*	.	H	α-helix	trans	-73	-44.8	176	-66.6	176.2	0	0	0	111.1	R50 L51 N56 E57	R50-L53 HydrophobicContact CB-CD1 4.49Å; R50-L53 WeakPolarHBondContact O-CB 3.31Å; R50-L53 PolarHBondContact O-N 2.98Å; L51-L53 VanDerWaalsContact C-N 3.31Å; L51-L53 PolarHBondContact O-N 2.87Å; L53-N56 PolarHBondContact O-N 2.65Å; L53-E57 PolarHBondContact O-N 3.25Å
54	L	97.5	Very high	96.6	Very high	20 Å²	20	63.7 Å²	63.7	11%	0.105	31%	0.308	C	S	.	.	H	α-helix	trans	-57.6	-53.5	178.1	177.3	59.5	0	0	0	111.1	K10 L13 L14 K21 R50 L51 N56 E57 V58	K10-L54 HydrophobicContact CG-CD2 4.14Å; L13-L54 HydrophobicContact CD2-CD2 4.02Å; L13-L54 HydrophobicContact CD2-CG 4.21Å; L14-L54 HydrophobicContact CD2-CD1 3.92Å; L14-L54 HydrophobicContact CD2-CD2 3.93Å; L14-L54 HydrophobicContact CG-CD2 4Å; K21-L54 HydrophobicContact CD-CD1 4.02Å; R50-L54 PolarHBondContact O-N 3.45Å; L51-L54 HydrophobicContact CD1-CD2 4.24Å; L51-L54 PolarHBondContact O-N 2.91Å; L54-N56 VanDerWaalsContact C-N 3.29Å; L54-N56 PolarHBondContact O-N 3.33Å; L54-E57 PolarHBondContact O-N 3.47Å; L54-E57 VanDerWaalsContact O-N 3.13Å; L54-V58 HydrophobicContact CD1-CG2 4Å; L54-V58 HydrophobicContact CG-CG2 4.41Å; L54-V58 VanDerWaalsContact O-CG2 3.28Å; L54-V58 WeakPolarHBondContact O-CG2 3.4Å; L54-V58 PolarHBondContact O-N 3.4Å
55	I	97.8	Very high	96.8	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-33.6	180	-62.3	-174.1	0	0	0	111.4	L13 I33 I36 L51 R59 C73 L76 I77 W80	L13-I55 HydrophobicContact CD2-CD1 4.23Å; L13-I55 HydrophobicContact CD2-CG1 3.7Å; I33-I55 HydrophobicContact CD1-CD1 3.76Å; I33-I55 HydrophobicContact CD1-CG1 4.26Å; I33-I55 HydrophobicContact CD1-CG2 4.43Å; I36-I55 HydrophobicContact CD1-CD1 4.21Å; I36-I55 HydrophobicContact CG2-CD1 4.35Å; L51-I55 HydrophobicContact CD1-CD1 4.17Å; L51-I55 HydrophobicContact CD1-CG1 4.16Å; L51-I55 HydrophobicContact CG-CD1 4.09Å; L51-I55 HydrophobicContact CG-CG1 4.37Å; L51-I55 PolarHBondContact O-N 3.05Å; I55-R59 WeakPolarHBondContact O-CB 3.49Å; I55-R59 PolarHBondContact O-N 3.15Å; I55-C73 HydrophobicContact CG2-CB 3.66Å; I55-L76 HydrophobicContact CD1-CD2 3.67Å; I55-I77 HydrophobicContact CG2-CD1 4.05Å; I55-I77 HydrophobicContact CG2-CG1 4.28Å; I55-W80 HydrophobicContact CD1-CH2 3.49Å; I55-W80 VanDerWaalsContact CD1-CH2 3.49Å; I55-W80 HydrophobicContact CD1-CZ3 3.76Å; I55-W80 HydrophobicContact CG1-CZ3 4.46Å
56	N	98	Very high	96.9	Very high	46 Å²	46	63.5 Å²	63.5	25%	0.246	30%	0.302	C	S	.	.	H	α-helix	trans	-67.7	-32.5	175.1	-178.9	67.8	0	0	0	113	G52 L53 L54 R59 R60 I77	G52-N56 WeakPolarHBondContact O-CB 3.38Å; G52-N56 PolarHBondContact O-N 3.15Å; L53-N56 PolarHBondContact O-N 2.65Å; L54-N56 VanDerWaalsContact C-N 3.29Å; L54-N56 PolarHBondContact O-N 3.33Å; N56-R59 PolarHBondContact OD1-NH1 3.19Å; N56-R59 PolarHBondContact OD1-NH2 3.25Å; N56-R60 WeakPolarHBondContact O-CG 3.33Å; N56-R60 PolarHBondContact O-N 3.42Å; N56-I77 HydrophobicContact CB-CD1 3.81Å
57	E	97.9	Very high	96.9	Very high	45 Å²	45	66.1 Å²	66.1	21%	0.21	32%	0.319	C	S	.	.	H	α-helix	trans	-74.3	-51	174.4	-164.5	-174.2	152.2	0	0	111.7	K21 L53 L54 R59 R60 K61	K21-E57 WeakPolarHBondContact CD-OE1 3.4Å; K21-E57 IonicContact NZ-OE1 3.22Å; K21-E57 PolarHBondContact NZ-OE1 2.62Å; K21-E57 IonicContact NZ-OE2 3.2Å; K21-E57 PolarHBondContact NZ-OE2 2.71Å; L53-E57 PolarHBondContact O-N 3.25Å; L54-E57 PolarHBondContact O-N 3.47Å; L54-E57 VanDerWaalsContact O-N 3.13Å; E57-R59 VanDerWaalsContact C-N 3.28Å; E57-R59 PolarHBondContact O-N 3.37Å; E57-R60 WeakPolarHBondContact O-CB 3.32Å; E57-R60 PolarHBondContact O-N 3.39Å; E57-K61 HydrophobicContact CG-CD 4.35Å; E57-K61 PolarHBondContact O-N 2.93Å; E57-K61 IonicContact OE1-NZ 3.04Å; E57-K61 PolarHBondContact OE1-NZ 3.19Å
58	V	98	Very high	97.1	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-55.5	-44.7	176.4	178.2	0	0	0	0	110.2	L17 K21 V23 L54 R60 K61 N62 F69	L17-V58 HydrophobicContact CD1-CG1 4.5Å; L17-V58 HydrophobicContact CD1-CG2 3.53Å; L17-V58 HydrophobicContact CD2-CG1 3.73Å; L17-V58 HydrophobicContact CD2-CG2 4.1Å; K21-V58 HydrophobicContact CB-CG2 4.14Å; V23-V58 HydrophobicContact CG2-CG1 4.23Å; L54-V58 HydrophobicContact CD1-CG2 4Å; L54-V58 HydrophobicContact CG-CG2 4.41Å; L54-V58 VanDerWaalsContact O-CG2 3.28Å; L54-V58 WeakPolarHBondContact O-CG2 3.4Å; L54-V58 PolarHBondContact O-N 3.4Å; V58-R60 VanDerWaalsContact C-N 3.31Å; V58-R60 PolarHBondContact O-N 3.38Å; V58-K61 PolarHBondContact O-N 3.26Å; V58-N62 WeakPolarHBondContact CG1-ND2 3.48Å; V58-N62 WeakPolarHBondContact O-CB 3.44Å; V58-N62 PolarHBondContact O-N 3.18Å; V58-N62 PolarHBondContact O-ND2 2.76Å; V58-F69 HydrophobicContact CG1-CE1 3.84Å; V58-F69 HydrophobicContact CG1-CZ 4.37Å
59	R	98.2	Very high	97.2	Very high	35 Å²	35	59.3 Å²	59.3	13%	0.132	29%	0.29	C	S	.	.	H	α-helix	trans	-59	-38.3	175.3	-171.3	-156.3	73.2	-129.4	-11.4	112.8	I55 N56 E57 Q63 A70 C73 I77	I55-R59 WeakPolarHBondContact O-CB 3.49Å; I55-R59 PolarHBondContact O-N 3.15Å; N56-R59 PolarHBondContact OD1-NH1 3.19Å; N56-R59 PolarHBondContact OD1-NH2 3.25Å; E57-R59 VanDerWaalsContact C-N 3.28Å; E57-R59 PolarHBondContact O-N 3.37Å; R59-Q63 WeakPolarHBondContact O-CB 3.48Å; R59-Q63 PolarHBondContact O-N 3.27Å; R59-A70 HydrophobicContact CG-CB 4.01Å; R59-A70 WeakPolarHBondContact CG-O 3.44Å; R59-C73 HydrophobicContact CB-CB 3.83Å; R59-C73 HydrophobicContact CG-CB 3.81Å; R59-I77 VanDerWaalsContact NH1-CD1 3.27Å
60	R	97.9	Very high	97.3	Very high	145 Å²	145	59.1 Å²	59.1	55%	0.547	29%	0.289	S	S	.	.	H	α-helix	trans	-68.3	-50.9	178.9	-80.1	-173.1	-67.5	173.3	4	110.6	N56 E57 V58 Q63	N56-R60 WeakPolarHBondContact O-CG 3.33Å; N56-R60 PolarHBondContact O-N 3.42Å; E57-R60 WeakPolarHBondContact O-CB 3.32Å; E57-R60 PolarHBondContact O-N 3.39Å; V58-R60 VanDerWaalsContact C-N 3.31Å; V58-R60 PolarHBondContact O-N 3.38Å; R60-Q63 WeakPolarHBondContact O-CB 3.49Å; R60-Q63 PolarHBondContact O-N 2.87Å
61	K	97.6	Very high	97.4	Very high	73 Å²	73	56.5 Å²	56.5	32%	0.317	28%	0.283	S	S	.	.	H	α-helix	trans	-65.2	-42.4	-176	-69	-178.9	167.3	170.2	0	112.5	E20 K21 Q22 E57 V58 Q63	E20-K61 WeakPolarHBondContact O-CD 3.4Å; E20-K61 WeakPolarHBondContact O-CE 3.41Å; E20-K61 PolarHBondContact O-NZ 3.39Å; K21-K61 HydrophobicContact CB-CD 4.47Å; Q22-K61 PolarHBondContact OE1-O 3.29Å; E57-K61 HydrophobicContact CG-CD 4.35Å; E57-K61 PolarHBondContact O-N 2.93Å; E57-K61 IonicContact OE1-NZ 3.04Å; E57-K61 PolarHBondContact OE1-NZ 3.19Å; V58-K61 PolarHBondContact O-N 3.26Å; K61-Q63 VanDerWaalsContact C-N 3.34Å; K61-Q63 PolarHBondContact O-N 3.09Å
62	N	97.5	Very high	97.4	Very high	1 Å²	1	62 Å²	62	1%	0.005	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	8.4	-178.6	-64.1	-89.8	0	0	0	114.5	K21 V23 V58 S64 H65 F66	K21-N62 PolarHBondContact O-ND2 2.73Å; V23-N62 WeakPolarHBondContact CB-OD1 3.48Å; V23-N62 WeakPolarHBondContact CG2-OD1 3.34Å; V23-N62 PolarHBondContact N-OD1 2.72Å; V58-N62 WeakPolarHBondContact CG1-ND2 3.48Å; V58-N62 WeakPolarHBondContact O-CB 3.44Å; V58-N62 PolarHBondContact O-N 3.18Å; V58-N62 PolarHBondContact O-ND2 2.76Å; N62-S64 VanDerWaalsContact C-N 3.3Å; N62-S64 PolarHBondContact O-N 2.93Å; N62-H65 PolarHBondContact O-N 2.99Å; N62-F66 HydrophobicContact CB-CD2 4.32Å; N62-F66 PolarHBondContact O-N 3.28Å
63	Q	97.3	Very high	97.5	Very high	91 Å²	91	60.9 Å²	60.9	43%	0.425	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-31.4	-174.8	-163	175.1	-83.3	0	0	113.2	R59 R60 K61 A70	R59-Q63 WeakPolarHBondContact O-CB 3.48Å; R59-Q63 PolarHBondContact O-N 3.27Å; R60-Q63 WeakPolarHBondContact O-CB 3.49Å; R60-Q63 PolarHBondContact O-N 2.87Å; K61-Q63 VanDerWaalsContact C-N 3.34Å; K61-Q63 PolarHBondContact O-N 3.09Å; Q63-A70 HydrophobicContact CB-CB 4.38Å; Q63-A70 HydrophobicContact CG-CB 4.19Å
64	S	97.3	Very high	97.5	Very high	88 Å²	88	60.6 Å²	60.6	62%	0.615	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-53.7	174.4	41.7	0	0	0	0	111.8	N62	N62-S64 VanDerWaalsContact C-N 3.3Å; N62-S64 PolarHBondContact O-N 2.93Å
65	H	96.6	Very high	97.5	Very high	120 Å²	120	62 Å²	62	56%	0.556	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-39.6	-170	-55.2	-74.7	0	0	0	113	N62	N62-H65 PolarHBondContact O-N 2.99Å
66	F	96.8	Very high	97.5	Very high	64 Å²	64	62.1 Å²	62.1	28%	0.281	30%	0.297	S	S	.	.			trans	-131.4	69.1	-171.7	-54.3	-59.9	0	0	0	111.4	V23 V26 N62 D68 F69 A70	V23-F66 HydrophobicContact CB-CD2 4.07Å; V23-F66 HydrophobicContact CB-CE2 4Å; V23-F66 HydrophobicContact CG1-CD2 4.48Å; V23-F66 HydrophobicContact CG1-CE2 4.35Å; V26-F66 HydrophobicContact CG1-CD1 4.26Å; V26-F66 HydrophobicContact CG1-CE1 4.42Å; V26-F66 HydrophobicContact CG2-CD1 4.07Å; V26-F66 HydrophobicContact CG2-CE1 3.46Å; V26-F66 VanDerWaalsContact CG2-CE1 3.46Å; V26-F66 HydrophobicContact CG2-CE2 3.96Å; V26-F66 HydrophobicContact CG2-CZ 3.4Å; V26-F66 VanDerWaalsContact CG2-CZ 3.4Å; N62-F66 HydrophobicContact CB-CD2 4.32Å; N62-F66 PolarHBondContact O-N 3.28Å; F66-D68 VanDerWaalsContact C-N 3.31Å; F66-D68 PolarHBondContact O-N 2.9Å; F66-F69 HydrophobicContact CB-CB 3.82Å; F66-F69 WeakPolarHBondContact O-CB 3.42Å; F66-F69 PolarHBondContact O-N 3.23Å; F66-F69 VanDerWaalsContact O-N 3.14Å; F66-A70 PolarHBondContact O-N 3.37Å
67	P	96.9	Very high	97.5	Very high	65 Å²	65	60.7 Å²	60.7	42%	0.422	29%	0.29	S	S	.	.	H	α-helix	trans	-59.8	-35.4	-172.1	22.2	-33.8	0	0	0	113.5	A70 K71	P67-A70 PolarHBondContact O-N 2.96Å; P67-K71 VanDerWaalsContact O-CG 3.29Å; P67-K71 WeakPolarHBondContact O-CG 3.48Å; P67-K71 PolarHBondContact O-N 3.43Å
68	D	96.7	Very high	97.5	Very high	99 Å²	99	64.6 Å²	64.6	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-73.9	-33.7	177.8	-68.4	-55.8	0	0	0	113.6	F66 A70 K71 R72	F66-D68 VanDerWaalsContact C-N 3.31Å; F66-D68 PolarHBondContact O-N 2.9Å; D68-A70 VanDerWaalsContact C-N 3.34Å; D68-K71 WeakPolarHBondContact O-CB 3.5Å; D68-K71 PolarHBondContact O-N 2.96Å; D68-K71 WeakPolarHBondContact OD1-CD 3.42Å; D68-K71 WeakPolarHBondContact OD1-CE 3.36Å; D68-K71 IonicContact OD1-NZ 2.97Å; D68-K71 PolarHBondContact OD1-NZ 3.06Å; D68-R72 PolarHBondContact O-N 3.45Å
69	F	96.8	Very high	97.4	Very high	17 Å²	17	69.4 Å²	69.4	8%	0.075	33%	0.328	C	S	.	.	H	α-helix	trans	-64.2	-42.4	169.2	179.4	-93.5	0	0	0	110.7	V23 A29 I33 V58 F66 K71 R72 C73	V23-F69 HydrophobicContact CG2-CD1 4.42Å; V23-F69 HydrophobicContact CG2-CE1 3.89Å; V23-F69 HydrophobicContact CG2-CZ 4.12Å; A29-F69 HydrophobicContact CB-CE2 3.86Å; A29-F69 HydrophobicContact CB-CZ 4.02Å; I33-F69 HydrophobicContact CB-CE2 4.29Å; I33-F69 HydrophobicContact CD1-CZ 4.38Å; I33-F69 HydrophobicContact CG1-CE2 3.5Å; I33-F69 HydrophobicContact CG1-CZ 3.67Å; V58-F69 HydrophobicContact CG1-CE1 3.84Å; V58-F69 HydrophobicContact CG1-CZ 4.37Å; F66-F69 HydrophobicContact CB-CB 3.82Å; F66-F69 WeakPolarHBondContact O-CB 3.42Å; F66-F69 PolarHBondContact O-N 3.23Å; F66-F69 VanDerWaalsContact O-N 3.14Å; F69-K71 VanDerWaalsContact C-N 3.33Å; F69-K71 PolarHBondContact O-N 3.48Å; F69-R72 PolarHBondContact O-N 3.39Å; F69-C73 PolarHBondContact O-N 3.36Å; F69-C73 PolarHBondContact O-SG 2.99Å
70	A	97.6	Very high	97.3	Very high	3 Å²	3	68.4 Å²	68.4	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-65.9	-31.2	174.2	0	0	0	0	0	113.1	R59 Q63 F66 P67 D68 R74	R59-A70 HydrophobicContact CG-CB 4.01Å; R59-A70 WeakPolarHBondContact CG-O 3.44Å; Q63-A70 HydrophobicContact CB-CB 4.38Å; Q63-A70 HydrophobicContact CG-CB 4.19Å; F66-A70 PolarHBondContact O-N 3.37Å; P67-A70 PolarHBondContact O-N 2.96Å; D68-A70 VanDerWaalsContact C-N 3.34Å; A70-R74 WeakPolarHBondContact O-CB 3.45Å; A70-R74 PolarHBondContact O-N 3.39Å
71	K	98	Very high	97.2	Very high	126 Å²	126	66.8 Å²	66.8	55%	0.548	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-47.9	170.6	-72.9	168.7	-153	166.5	0	111.4	P67 D68 F69 R74 A75	P67-K71 VanDerWaalsContact O-CG 3.29Å; P67-K71 WeakPolarHBondContact O-CG 3.48Å; P67-K71 PolarHBondContact O-N 3.43Å; D68-K71 WeakPolarHBondContact O-CB 3.5Å; D68-K71 PolarHBondContact O-N 2.96Å; D68-K71 WeakPolarHBondContact OD1-CD 3.42Å; D68-K71 WeakPolarHBondContact OD1-CE 3.36Å; D68-K71 IonicContact OD1-NZ 2.97Å; D68-K71 PolarHBondContact OD1-NZ 3.06Å; F69-K71 VanDerWaalsContact C-N 3.33Å; F69-K71 PolarHBondContact O-N 3.48Å; K71-R74 WeakPolarHBondContact O-CA 3.3Å; K71-R74 WeakPolarHBondContact O-CB 3.42Å; K71-R74 PolarHBondContact O-N 3.48Å; K71-R74 VanDerWaalsContact O-N 3.11Å; K71-A75 PolarHBondContact O-N 2.75Å
72	R	97.7	Very high	97.1	Very high	116 Å²	116	70 Å²	70	44%	0.438	34%	0.337	S	S	.	.	H	α-helix	trans	-58.2	-52.3	176.2	-70.5	-172.3	-163.8	-175.4	5.1	111.9	I33 D68 F69 R74 A75 L76	I33-R72 HydrophobicContact CG2-CB 4.38Å; D68-R72 PolarHBondContact O-N 3.45Å; F69-R72 PolarHBondContact O-N 3.39Å; R72-R74 PolarHBondContact O-N 3.03Å; R72-R74 VanDerWaalsContact O-N 3.13Å; R72-A75 WeakPolarHBondContact O-CA 3.35Å; R72-A75 WeakPolarHBondContact O-CB 3.4Å; R72-A75 PolarHBondContact O-N 3.01Å; R72-L76 PolarHBondContact O-N 2.94Å
73	C	98.1	Very high	96.9	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-56.2	-32.7	174.6	-65.3	0	0	0	0	112.8	I55 R59 F69 I77	I55-C73 HydrophobicContact CG2-CB 3.66Å; R59-C73 HydrophobicContact CB-CB 3.83Å; R59-C73 HydrophobicContact CG-CB 3.81Å; F69-C73 PolarHBondContact O-N 3.36Å; F69-C73 PolarHBondContact O-SG 2.99Å; C73-I77 WeakPolarHBondContact O-CB 3.37Å; C73-I77 VanDerWaalsContact O-CD1 3.31Å; C73-I77 WeakPolarHBondContact O-CD1 3.44Å; C73-I77 WeakPolarHBondContact O-CG1 3.41Å; C73-I77 PolarHBondContact O-N 3.5Å
74	R	98.1	Very high	96.6	Very high	116 Å²	116	72.5 Å²	72.5	44%	0.438	35%	0.352	S	S	.	.	H	α-helix	trans	-72.8	-31.8	174.7	-161.2	-179.8	-71.1	-154.8	-1.5	113.1	A70 K71 R72 K78	A70-R74 WeakPolarHBondContact O-CB 3.45Å; A70-R74 PolarHBondContact O-N 3.39Å; K71-R74 WeakPolarHBondContact O-CA 3.3Å; K71-R74 WeakPolarHBondContact O-CB 3.42Å; K71-R74 PolarHBondContact O-N 3.48Å; K71-R74 VanDerWaalsContact O-N 3.11Å; R72-R74 PolarHBondContact O-N 3.03Å; R72-R74 VanDerWaalsContact O-N 3.13Å; R74-K78 WeakPolarHBondContact O-CG 3.46Å; R74-K78 PolarHBondContact O-N 2.92Å
75	A	97.8	Very high	96.3	Very high	49 Å²	49	72 Å²	72	41%	0.405	35%	0.349	S	S	.	.	H	α-helix	trans	-70.2	-51.9	174.9	0	0	0	0	0	110.7	K71 R72 I77 K78 E79	K71-A75 PolarHBondContact O-N 2.75Å; R72-A75 WeakPolarHBondContact O-CA 3.35Å; R72-A75 WeakPolarHBondContact O-CB 3.4Å; R72-A75 PolarHBondContact O-N 3.01Å; A75-I77 VanDerWaalsContact C-N 3.34Å; A75-I77 PolarHBondContact O-N 3.04Å; A75-K78 WeakPolarHBondContact O-CA 3.22Å; A75-K78 WeakPolarHBondContact O-CB 3.38Å; A75-K78 PolarHBondContact O-N 2.66Å; A75-E79 PolarHBondContact O-N 3.44Å
76	L	97.4	Very high	95.5	Very high	4 Å²	4	70 Å²	70	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-53.8	-46.3	177.4	-177	62.8	0	0	0	112.5	I36 E37 I55 R72 K78 E79 W80	I36-L76 HydrophobicContact CG2-CD1 4.38Å; I36-L76 HydrophobicContact CG2-CD2 3.71Å; E37-L76 HydrophobicContact CG-CD1 4.12Å; E37-L76 HydrophobicContact CG-CD2 4.41Å; I55-L76 HydrophobicContact CD1-CD2 3.67Å; R72-L76 PolarHBondContact O-N 2.94Å; L76-K78 VanDerWaalsContact C-N 3.31Å; L76-K78 PolarHBondContact O-N 2.97Å; L76-E79 PolarHBondContact O-N 3.27Å; L76-E79 VanDerWaalsContact O-N 3.16Å; L76-W80 HydrophobicContact CD1-CD2 4.3Å; L76-W80 HydrophobicContact CD1-CH2 4.37Å; L76-W80 HydrophobicContact CD1-CZ2 3.56Å; L76-W80 HydrophobicContact CD2-CH2 3.75Å; L76-W80 HydrophobicContact CD2-CZ2 3.76Å; L76-W80 HydrophobicContact CD2-CZ3 4.31Å; L76-W80 HydrophobicContact CG-CD2 4.12Å; L76-W80 HydrophobicContact CG-CE3 4.34Å; L76-W80 HydrophobicContact CG-CH2 3.92Å; L76-W80 HydrophobicContact CG-CZ2 3.61Å; L76-W80 HydrophobicContact CG-CZ3 4.25Å; L76-W80 PolarHBondContact O-N 2.69Å
77	I	97.4	Very high	94.2	Very high	17 Å²	17	69.1 Å²	69.1	9%	0.087	35%	0.35	C	S	.	.	H	α-helix	trans	-61.7	-36.7	175.5	-71.4	166.4	0	0	0	112.2	I55 N56 R59 C73 A75 E79 Q81	I55-I77 HydrophobicContact CG2-CD1 4.05Å; I55-I77 HydrophobicContact CG2-CG1 4.28Å; N56-I77 HydrophobicContact CB-CD1 3.81Å; R59-I77 VanDerWaalsContact NH1-CD1 3.27Å; C73-I77 WeakPolarHBondContact O-CB 3.37Å; C73-I77 VanDerWaalsContact O-CD1 3.31Å; C73-I77 WeakPolarHBondContact O-CD1 3.44Å; C73-I77 WeakPolarHBondContact O-CG1 3.41Å; C73-I77 PolarHBondContact O-N 3.5Å; A75-I77 VanDerWaalsContact C-N 3.34Å; A75-I77 PolarHBondContact O-N 3.04Å; I77-E79 VanDerWaalsContact C-N 3.34Å; I77-Q81 HydrophobicContact CG2-CG 4.41Å; I77-Q81 WeakPolarHBondContact O-CB 3.44Å; I77-Q81 VanDerWaalsContact O-CG 3.24Å; I77-Q81 WeakPolarHBondContact O-CG 3.45Å; I77-Q81 PolarHBondContact O-N 2.97Å
78	K	97.3	Very high	93	Very high	126 Å²	126	68.3 Å²	68.3	55%	0.548	35%	0.346	S	S	.	.	H	α-helix	trans	-68.1	-33.8	176.1	-77.6	176.2	172.4	-172.4	0	112.2	R74 A75 L76 K82	R74-K78 WeakPolarHBondContact O-CG 3.46Å; R74-K78 PolarHBondContact O-N 2.92Å; A75-K78 WeakPolarHBondContact O-CA 3.22Å; A75-K78 WeakPolarHBondContact O-CB 3.38Å; A75-K78 PolarHBondContact O-N 2.66Å; L76-K78 VanDerWaalsContact C-N 3.31Å; L76-K78 PolarHBondContact O-N 2.97Å; K78-K82 WeakPolarHBondContact O-CG 3.37Å; K78-K82 PolarHBondContact O-N 3.1Å; K78-K82 VanDerWaalsContact O-N 3.14Å
79	E	96.6	Very high	91.9	Very high	102 Å²	102	68.5 Å²	68.5	48%	0.477	35%	0.353	S	S	.	.	H	α-helix	trans	-70.9	-43.5	177	-67.9	177.8	157.5	0	0	110.9	A75 L76 I77 Q81 K82 L83	A75-E79 PolarHBondContact O-N 3.44Å; L76-E79 PolarHBondContact O-N 3.27Å; L76-E79 VanDerWaalsContact O-N 3.16Å; I77-E79 VanDerWaalsContact C-N 3.34Å; E79-Q81 PolarHBondContact O-N 3.07Å; E79-K82 WeakPolarHBondContact O-CB 3.3Å; E79-K82 PolarHBondContact O-N 3.41Å; E79-K82 VanDerWaalsContact O-N 3.1Å; E79-L83 PolarHBondContact O-N 2.92Å
80	W	96.7	Very high	90.9	Very high	14 Å²	14	70 Å²	70	5%	0.053	37%	0.368	C	S	.	.	H	α-helix	trans	-62.8	-39.2	172.3	-65.7	-10.1	0	0	0	113.2	I36 L41 L46 L51 I55 L76 K82 L83 I84	I36-W80 HydrophobicContact CG2-CH2 3.71Å; I36-W80 HydrophobicContact CG2-CZ2 3.46Å; I36-W80 VanDerWaalsContact CG2-CZ2 3.46Å; L41-W80 HydrophobicContact CD1-CH2 4.11Å; L41-W80 HydrophobicContact CD1-CZ2 3.4Å; L41-W80 VanDerWaalsContact CD1-CZ2 3.4Å; L46-W80 HydrophobicContact CD1-CD2 3.62Å; L46-W80 HydrophobicContact CD1-CE3 3.51Å; L46-W80 HydrophobicContact CD1-CG 4.25Å; L46-W80 HydrophobicContact CD1-CH2 3.91Å; L46-W80 HydrophobicContact CD1-CZ2 4.05Å; L46-W80 HydrophobicContact CD1-CZ3 3.67Å; L46-W80 HydrophobicContact CD2-CB 3.66Å; L46-W80 HydrophobicContact CD2-CD2 4.01Å; L46-W80 HydrophobicContact CD2-CE3 4.23Å; L46-W80 HydrophobicContact CD2-CG 3.8Å; L46-W80 HydrophobicContact CG-CD2 4.5Å; L46-W80 HydrophobicContact CG-CE3 4.49Å; L51-W80 HydrophobicContact CD2-CH2 3.67Å; L51-W80 HydrophobicContact CD2-CZ2 4.28Å; L51-W80 HydrophobicContact CG-CH2 3.76Å; L51-W80 HydrophobicContact CG-CZ3 4.21Å; I55-W80 HydrophobicContact CD1-CH2 3.49Å; I55-W80 VanDerWaalsContact CD1-CH2 3.49Å; I55-W80 HydrophobicContact CD1-CZ3 3.76Å; I55-W80 HydrophobicContact CG1-CZ3 4.46Å; L76-W80 HydrophobicContact CD1-CD2 4.3Å; L76-W80 HydrophobicContact CD1-CH2 4.37Å; L76-W80 HydrophobicContact CD1-CZ2 3.56Å; L76-W80 HydrophobicContact CD2-CH2 3.75Å; L76-W80 HydrophobicContact CD2-CZ2 3.76Å; L76-W80 HydrophobicContact CD2-CZ3 4.31Å; L76-W80 HydrophobicContact CG-CD2 4.12Å; L76-W80 HydrophobicContact CG-CE3 4.34Å; L76-W80 HydrophobicContact CG-CH2 3.92Å; L76-W80 HydrophobicContact CG-CZ2 3.61Å; L76-W80 HydrophobicContact CG-CZ3 4.25Å; L76-W80 PolarHBondContact O-N 2.69Å; W80-K82 VanDerWaalsContact C-N 3.27Å; W80-K82 PolarHBondContact O-N 2.95Å; W80-L83 PolarHBondContact O-N 2.96Å; W80-I84 WeakPolarHBondContact O-CG1 3.49Å; W80-I84 PolarHBondContact O-N 2.99Å
81	Q	95.8	Very high	89.8	Confident	111 Å²	111	71.9 Å²	71.9	52%	0.519	38%	0.384	S	S	.	.	H	α-helix	trans	-60.3	-35.9	171.9	-79.3	174.2	-20.8	0	0	112.3	I77 E79 S85	I77-Q81 HydrophobicContact CG2-CG 4.41Å; I77-Q81 WeakPolarHBondContact O-CB 3.44Å; I77-Q81 VanDerWaalsContact O-CG 3.24Å; I77-Q81 WeakPolarHBondContact O-CG 3.45Å; I77-Q81 PolarHBondContact O-N 2.97Å; E79-Q81 PolarHBondContact O-N 3.07Å; Q81-S85 VanDerWaalsContact O-CB 3.26Å; Q81-S85 WeakPolarHBondContact O-CB 3.48Å; Q81-S85 PolarHBondContact O-N 3.36Å; Q81-S85 PolarHBondContact O-OG 3.45Å
82	K	94.9	Very high	89	Confident	140 Å²	140	69.5 Å²	69.5	61%	0.609	38%	0.377	S	S	*	.	H	α-helix	trans	-64.4	-50	171.3	-66.4	166.9	-173.3	173	0	110.9	K78 E79 W80 I84 S85 S86	K78-K82 WeakPolarHBondContact O-CG 3.37Å; K78-K82 PolarHBondContact O-N 3.1Å; K78-K82 VanDerWaalsContact O-N 3.14Å; E79-K82 WeakPolarHBondContact O-CB 3.3Å; E79-K82 PolarHBondContact O-N 3.41Å; E79-K82 VanDerWaalsContact O-N 3.1Å; W80-K82 VanDerWaalsContact C-N 3.27Å; W80-K82 PolarHBondContact O-N 2.95Å; K82-I84 VanDerWaalsContact C-N 3.35Å; K82-I84 PolarHBondContact O-N 2.99Å; K82-S85 PolarHBondContact O-N 3.01Å; K82-S85 VanDerWaalsContact O-N 3.09Å; K82-S86 PolarHBondContact O-N 2.97Å; K82-S86 PolarHBondContact O-OG 3.36Å
83	L	92.5	Very high	88.4	Confident	81 Å²	81	69.7 Å²	69.7	42%	0.424	38%	0.383	S	S	.	.	H	α-helix	trans	-57	-45.1	-179.5	-66.4	175.3	0	0	0	112.4	E79 W80 S86 S87	E79-L83 PolarHBondContact O-N 2.92Å; W80-L83 PolarHBondContact O-N 2.96Å; L83-S86 PolarHBondContact O-OG 3.39Å; L83-S87 WeakPolarHBondContact O-CB 3.27Å; L83-S87 PolarHBondContact O-N 3.14Å
84	I	91.5	Very high	87.9	Confident	64 Å²	64	78.2 Å²	78.2	33%	0.328	42%	0.415	S	S	.	.	H	α-helix	trans	-63.5	-46.5	175.1	-62.1	163	0	0	0	110.1	L46 W80 K82 S87	L46-I84 HydrophobicContact CD2-CD1 4.04Å; L46-I84 HydrophobicContact CD2-CG1 4.42Å; W80-I84 WeakPolarHBondContact O-CG1 3.49Å; W80-I84 PolarHBondContact O-N 2.99Å; K82-I84 VanDerWaalsContact C-N 3.35Å; K82-I84 PolarHBondContact O-N 2.99Å; I84-S87 WeakPolarHBondContact O-CB 3.24Å; I84-S87 PolarHBondContact O-N 2.93Å; I84-S87 PolarHBondContact O-OG 2.97Å
85	S	90.7	Very high	87.4	Confident	77 Å²	77	80.4 Å²	80.4	54%	0.538	42%	0.423	S	S	.	.	H	α-helix	trans	-64.8	-43.2	-177.9	-58.6	0	0	0	0	113.1	Q81 K82 S87 S88	Q81-S85 VanDerWaalsContact O-CB 3.26Å; Q81-S85 WeakPolarHBondContact O-CB 3.48Å; Q81-S85 PolarHBondContact O-N 3.36Å; Q81-S85 PolarHBondContact O-OG 3.45Å; K82-S85 PolarHBondContact O-N 3.01Å; K82-S85 VanDerWaalsContact O-N 3.09Å; S85-S87 PolarHBondContact O-N 3.27Å; S85-S88 PolarHBondContact O-N 3.04Å
86	S	81.7	Confident	87	Confident	80 Å²	80	85.7 Å²	85.7	56%	0.559	43%	0.433	S	S	*	.	H	α-helix	trans	-70.7	-19.9	178	57.4	0	0	0	0	113.2	K82 L83 S88	K82-S86 PolarHBondContact O-N 2.97Å; K82-S86 PolarHBondContact O-OG 3.36Å; L83-S86 PolarHBondContact O-OG 3.39Å; S86-S88 PolarHBondContact O-N 2.92Å
87	S	68.9	Low	86.7	Confident	44 Å²	44	90 Å²	90	31%	0.308	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.8	176.5	79.2	0	0	0	0	114.4	K43 L83 I84 S85 P89	K43-S87 WeakPolarHBondContact CD-OG 3.37Å; K43-S87 WeakPolarHBondContact CE-OG 3.5Å; K43-S87 PolarHBondContact NZ-OG 3.31Å; L83-S87 WeakPolarHBondContact O-CB 3.27Å; L83-S87 PolarHBondContact O-N 3.14Å; I84-S87 WeakPolarHBondContact O-CB 3.24Å; I84-S87 PolarHBondContact O-N 2.93Å; I84-S87 PolarHBondContact O-OG 2.97Å; S85-S87 PolarHBondContact O-N 3.27Å; S87-P89 WeakPolarHBondContact O-CD 3.31Å
88	S	71.7	Confident	86.4	Confident	48 Å²	48	94.9 Å²	94.9	34%	0.336	48%	0.475	S	S	.	.			trans	-83.5	105.3	-174.7	-176.2	0	0	0	0	110.3	S85 S86 A90 A91 D92	S85-S88 PolarHBondContact O-N 3.04Å; S86-S88 PolarHBondContact O-N 2.92Å; S88-A90 PolarHBondContact O-N 3.05Å; S88-A90 VanDerWaalsContact O-N 3.13Å; S88-A91 WeakPolarHBondContact O-CB 3.3Å; S88-A91 PolarHBondContact O-N 3.27Å; S88-D92 PolarHBondContact O-N 3.38Å
89	P	72.3	Confident	86.2	Confident	103 Å²	103	93.4 Å²	93.4	67%	0.669	47%	0.47	S	S	*	.	H	α-helix	trans	-62.7	-25	180	27.6	-35.9	0	0	0	111.6	S87 A91 Q93	S87-P89 WeakPolarHBondContact O-CD 3.31Å; P89-A91 VanDerWaalsContact C-N 3.34Å; P89-Q93 WeakPolarHBondContact O-CB 2.98Å; P89-Q93 PolarHBondContact O-N 3.33Å
90	A	75.9	Confident	86.1	Confident	48 Å²	48	93.8 Å²	93.8	40%	0.397	47%	0.472	S	S	.	.	H	α-helix	trans	-67.7	-29.7	173.7	0	0	0	0	0	113.1	S88 R94	S88-A90 PolarHBondContact O-N 3.05Å; S88-A90 VanDerWaalsContact O-N 3.13Å; A90-R94 WeakPolarHBondContact O-CB 3.36Å; A90-R94 WeakPolarHBondContact O-CG 3.35Å; A90-R94 PolarHBondContact O-N 3.13Å
91	A	75.2	Confident	85.9	Confident	43 Å²	43	98.6 Å²	98.6	36%	0.355	50%	0.495	S	S	.	.	H	α-helix	trans	-72.9	-45.3	175.1	0	0	0	0	0	111.1	S88 P89 R94 R95	S88-A91 WeakPolarHBondContact O-CB 3.3Å; S88-A91 PolarHBondContact O-N 3.27Å; P89-A91 VanDerWaalsContact C-N 3.34Å; A91-R94 PolarHBondContact O-N 3.41Å; A91-R95 PolarHBondContact O-N 3.2Å
92	D	80.9	Confident	85.7	Confident	76 Å²	76	99.6 Å²	99.6	41%	0.406	50%	0.5	S	S	.	.	H	α-helix	trans	-65.5	-39	174.5	-94.2	11	0	0	0	112.3	S88 R95 R96	S88-D92 PolarHBondContact O-N 3.38Å; D92-R95 WeakPolarHBondContact O-CB 3.41Å; D92-R95 PolarHBondContact O-N 3.48Å; D92-R96 WeakPolarHBondContact O-CG 3.38Å; D92-R96 PolarHBondContact O-N 3.02Å
93	Q	84.9	Confident	85.6	Confident	120 Å²	120	99 Å²	99	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-63.8	-40.4	174.4	-171.3	176.1	17.4	0	0	111.5	P89 R96 Q97	P89-Q93 WeakPolarHBondContact O-CB 2.98Å; P89-Q93 PolarHBondContact O-N 3.33Å; Q93-R96 PolarHBondContact O-N 2.68Å; Q93-Q97 WeakPolarHBondContact O-CB 3.46Å; Q93-Q97 VanDerWaalsContact O-CG 3.28Å; Q93-Q97 WeakPolarHBondContact O-CG 3.5Å; Q93-Q97 PolarHBondContact O-N 2.82Å
94	R	87.1	Confident	85.5	Confident	180 Å²	180	101.3 Å²	101.3	68%	0.679	51%	0.508	S	S	*	.	H	α-helix	trans	-64.8	-40.1	172.7	-77.6	173.7	179.8	-158.3	-0.3	112.3	A90 A91 Q97 Q98	A90-R94 WeakPolarHBondContact O-CB 3.36Å; A90-R94 WeakPolarHBondContact O-CG 3.35Å; A90-R94 PolarHBondContact O-N 3.13Å; A91-R94 PolarHBondContact O-N 3.41Å; R94-Q97 PolarHBondContact O-N 3.09Å; R94-Q98 WeakPolarHBondContact O-CG 3.38Å; R94-Q98 PolarHBondContact O-N 3.02Å
95	R	87.5	Confident	85.4	Confident	161 Å²	161	104.5 Å²	104.5	61%	0.608	52%	0.521	S	S	*	.	H	α-helix	trans	-59.6	-52	172.2	-96.6	-174.2	162	-135.7	-4.1	111.6	A91 D92 Q97 Q98 E99	A91-R95 PolarHBondContact O-N 3.2Å; D92-R95 WeakPolarHBondContact O-CB 3.41Å; D92-R95 PolarHBondContact O-N 3.48Å; R95-Q97 VanDerWaalsContact C-N 3.27Å; R95-Q97 PolarHBondContact O-N 3.01Å; R95-Q98 PolarHBondContact O-N 2.84Å; R95-E99 WeakPolarHBondContact O-CG 3.45Å; R95-E99 PolarHBondContact O-N 2.93Å
96	R	89.8	Confident	85.4	Confident	161 Å²	161	103.5 Å²	103.5	61%	0.608	52%	0.518	S	S	*	.	H	α-helix	trans	-59.6	-36.3	177.8	-69.4	176.8	-172.1	-167.2	4.2	112.4	D92 Q93 Q100	D92-R96 WeakPolarHBondContact O-CG 3.38Å; D92-R96 PolarHBondContact O-N 3.02Å; Q93-R96 PolarHBondContact O-N 2.68Å; R96-Q100 WeakPolarHBondContact O-CB 3.43Å; R96-Q100 WeakPolarHBondContact O-CG 3.47Å; R96-Q100 PolarHBondContact O-N 3.39Å
97	Q	91.3	Very high	85.7	Confident	95 Å²	95	104.4 Å²	104.4	44%	0.444	52%	0.516	S	S	.	.	H	α-helix	trans	-66.3	-41	173	-76.7	172.7	-7.1	0	0	112.6	Q93 R94 R95 Q100 Q101	Q93-Q97 WeakPolarHBondContact O-CB 3.46Å; Q93-Q97 VanDerWaalsContact O-CG 3.28Å; Q93-Q97 WeakPolarHBondContact O-CG 3.5Å; Q93-Q97 PolarHBondContact O-N 2.82Å; R94-Q97 PolarHBondContact O-N 3.09Å; R95-Q97 VanDerWaalsContact C-N 3.27Å; R95-Q97 PolarHBondContact O-N 3.01Å; Q97-Q100 PolarHBondContact O-N 3.2Å; Q97-Q101 WeakPolarHBondContact O-CG 3.09Å; Q97-Q101 PolarHBondContact O-N 3.41Å
98	Q	92.3	Very high	86.6	Confident	118 Å²	118	109.6 Å²	109.6	55%	0.551	53%	0.53	S	S	*	.	H	α-helix	trans	-67.5	-40.1	174.9	-73.7	-179	-12.8	0	0	112.2	R94 R95 Q101 Q102	R94-Q98 WeakPolarHBondContact O-CG 3.38Å; R94-Q98 PolarHBondContact O-N 3.02Å; R95-Q98 PolarHBondContact O-N 2.84Å; Q98-Q101 PolarHBondContact O-N 2.88Å; Q98-Q102 WeakPolarHBondContact O-CG 3.21Å; Q98-Q102 PolarHBondContact O-N 3.3Å
99	E	92.9	Very high	87.2	Confident	95 Å²	95	111 Å²	111	44%	0.444	54%	0.539	S	S	.	.	H	α-helix	trans	-62.6	-42.9	174.3	-71.2	162.5	179.7	0	0	111.2	R95 Q102 Q103	R95-E99 WeakPolarHBondContact O-CG 3.45Å; R95-E99 PolarHBondContact O-N 2.93Å; E99-Q102 PolarHBondContact O-N 2.97Å; E99-Q103 WeakPolarHBondContact O-CG 3.27Å; E99-Q103 PolarHBondContact O-N 2.91Å
100	Q	93.6	Very high	87.8	Confident	111 Å²	111	112.1 Å²	112.1	52%	0.519	54%	0.535	S	S	.	.	H	α-helix	trans	-63.5	-39.8	173.3	-75.5	172.3	8.1	0	0	112.7	R96 Q97 Q103 Q104	R96-Q100 WeakPolarHBondContact O-CB 3.43Å; R96-Q100 WeakPolarHBondContact O-CG 3.47Å; R96-Q100 PolarHBondContact O-N 3.39Å; Q97-Q100 PolarHBondContact O-N 3.2Å; Q100-Q103 PolarHBondContact O-N 3.49Å; Q100-Q104 VanDerWaalsContact O-CG 3.31Å; Q100-Q104 WeakPolarHBondContact O-CG 3.24Å; Q100-Q104 PolarHBondContact O-N 2.95Å
101	Q	92.4	Very high	88	Confident	115 Å²	115	117.1 Å²	117.1	54%	0.537	55%	0.551	S	S	.	*	H	α-helix	trans	-65.9	-39.7	174.8	-74.8	178.4	11.7	0	0	112.1	Q97 Q98 Q104 Q105	Q97-Q101 WeakPolarHBondContact O-CG 3.09Å; Q97-Q101 PolarHBondContact O-N 3.41Å; Q98-Q101 PolarHBondContact O-N 2.88Å; Q101-Q104 PolarHBondContact O-N 3.38Å; Q101-Q105 WeakPolarHBondContact O-CG 3.37Å; Q101-Q105 PolarHBondContact O-N 3.31Å
102	Q	92.3	Very high	88.2	Confident	132 Å²	132	121.1 Å²	121.1	62%	0.617	56%	0.562	S	S	*	*	H	α-helix	trans	-67	-39.8	175	-72.6	-177.3	22.8	0	0	112.2	Q98 E99 Q104 Q105 A106	Q98-Q102 WeakPolarHBondContact O-CG 3.21Å; Q98-Q102 PolarHBondContact O-N 3.3Å; E99-Q102 PolarHBondContact O-N 2.97Å; Q102-Q104 VanDerWaalsContact C-N 3.35Å; Q102-Q104 PolarHBondContact O-N 3Å; Q102-Q105 PolarHBondContact O-N 3.39Å; Q102-A106 WeakPolarHBondContact O-CB 3.26Å; Q102-A106 PolarHBondContact O-N 3.24Å
103	Q	92.5	Very high	87.7	Confident	127 Å²	127	125.2 Å²	125.2	59%	0.593	58%	0.579	S	S	*	*	H	α-helix	trans	-63.6	-38.6	173.7	-74.6	-179.5	0.3	0	0	112.3	E99 Q100 A106 N107	E99-Q103 WeakPolarHBondContact O-CG 3.27Å; E99-Q103 PolarHBondContact O-N 2.91Å; Q100-Q103 PolarHBondContact O-N 3.49Å; Q103-A106 PolarHBondContact O-N 3.01Å; Q103-N107 WeakPolarHBondContact O-CB 3.49Å; Q103-N107 VanDerWaalsContact O-CG 3.22Å; Q103-N107 PolarHBondContact O-N 3.05Å; Q103-N107 PolarHBondContact O-ND2 2.82Å
104	Q	90.4	Very high	86.8	Confident	130 Å²	130	126.3 Å²	126.3	61%	0.607	59%	0.589	S	S	*	*	H	α-helix	trans	-63	-42	173.5	-73.4	171.8	37.1	0	0	112	Q100 Q101 Q102 Y108	Q100-Q104 VanDerWaalsContact O-CG 3.31Å; Q100-Q104 WeakPolarHBondContact O-CG 3.24Å; Q100-Q104 PolarHBondContact O-N 2.95Å; Q101-Q104 PolarHBondContact O-N 3.38Å; Q102-Q104 VanDerWaalsContact C-N 3.35Å; Q102-Q104 PolarHBondContact O-N 3Å; Q104-Y108 WeakPolarHBondContact O-CB 3.48Å; Q104-Y108 PolarHBondContact O-N 3.09Å
105	Q	88.6	Confident	85.8	Confident	130 Å²	130	120.5 Å²	120.5	61%	0.607	58%	0.584	S	S	*	*	H	α-helix	trans	-65.9	-42.4	175.5	-70.4	176.2	16.6	0	0	112.3	Q101 Q102 Y108 C109	Q101-Q105 WeakPolarHBondContact O-CG 3.37Å; Q101-Q105 PolarHBondContact O-N 3.31Å; Q102-Q105 PolarHBondContact O-N 3.39Å; Q105-Y108 PolarHBondContact O-N 2.97Å; Q105-C109 PolarHBondContact O-N 3.13Å
106	A	90.5	Very high	84.8	Confident	56 Å²	56	119.7 Å²	119.7	46%	0.463	59%	0.592	S	S	.	*	H	α-helix	trans	-61.1	-48.4	176.4	0	0	0	0	0	111.8	Q102 Q103 Y108 C109 Q110	Q102-A106 WeakPolarHBondContact O-CB 3.26Å; Q102-A106 PolarHBondContact O-N 3.24Å; Q103-A106 PolarHBondContact O-N 3.01Å; A106-Y108 VanDerWaalsContact C-N 3.3Å; A106-Y108 PolarHBondContact O-N 2.8Å; A106-C109 PolarHBondContact O-N 3.27Å; A106-Q110 PolarHBondContact O-N 2.84Å
107	N	89.6	Confident	83.5	Confident	100 Å²	100	117.5 Å²	117.5	54%	0.535	60%	0.599	S	S	.	*	H	α-helix	trans	-60.6	-38.4	176.4	-71.7	-23.5	0	0	0	112.2	Q103 Q110 Q111	Q103-N107 WeakPolarHBondContact O-CB 3.49Å; Q103-N107 VanDerWaalsContact O-CG 3.22Å; Q103-N107 PolarHBondContact O-N 3.05Å; Q103-N107 PolarHBondContact O-ND2 2.82Å; N107-Q110 PolarHBondContact O-N 3.41Å; N107-Q111 PolarHBondContact O-N 3.15Å
108	Y	87.8	Confident	82.1	Confident	152 Å²	152	119.6 Å²	119.6	60%	0.596	62%	0.618	S	S	*	*	H	α-helix	trans	-66.8	-39	177.2	-174	-105.2	0	0	0	112.7	Q104 Q105 A106	Q104-Y108 WeakPolarHBondContact O-CB 3.48Å; Q104-Y108 PolarHBondContact O-N 3.09Å; Q105-Y108 PolarHBondContact O-N 2.97Å; A106-Y108 VanDerWaalsContact C-N 3.3Å; A106-Y108 PolarHBondContact O-N 2.8Å
109	C	83.9	Confident	80.7	Confident	78 Å²	78	122.1 Å²	122.1	53%	0.527	63%	0.627	S	S	.	*	H	α-helix	trans	-67.4	-36.1	172.2	-74	0	0	0	0	112.5	Q105 A106 Q112	Q105-C109 PolarHBondContact O-N 3.13Å; A106-C109 PolarHBondContact O-N 3.27Å; C109-Q112 PolarHBondContact O-N 3.42Å
110	Q	83.5	Confident	78.6	Confident	126 Å²	126	127 Å²	127	59%	0.589	65%	0.649	S	S	*	*	H	α-helix	trans	-66.8	-43.9	179.3	-163.2	117.9	31.6	0	0	111.7	A106 N107 Q112 Q113	A106-Q110 PolarHBondContact O-N 2.84Å; N107-Q110 PolarHBondContact O-N 3.41Å; Q110-Q112 PolarHBondContact O-N 3.38Å; Q110-Q112 VanDerWaalsContact O-N 3.09Å; Q110-Q113 PolarHBondContact O-N 3.05Å
111	Q	81.9	Confident	76.5	Confident	154 Å²	154	131.3 Å²	131.3	72%	0.72	66%	0.662	S	S	*	*	H	α-helix	trans	-61.7	-17.6	177.5	-75.7	-175.8	-7.8	0	0	114.6	N107	N107-Q111 PolarHBondContact O-N 3.15Å
112	Q	77.6	Confident	74.7	Confident	126 Å²	126	131 Å²	131	59%	0.589	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-10.4	174.9	-66.7	-176	22.3	0	0	113.7	C109 Q110	C109-Q112 PolarHBondContact O-N 3.42Å; Q110-Q112 PolarHBondContact O-N 3.38Å; Q110-Q112 VanDerWaalsContact O-N 3.09Å
113	Q	71.3	Confident	72.5	Confident	162 Å²	162	131.3 Å²	131.3	76%	0.757	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-24.3	-177.8	-62.9	-169.4	0.6	0	0	113.8	Q110 G115	Q110-Q113 PolarHBondContact O-N 3.05Å; Q113-G115 PolarHBondContact O-N 3.02Å
114	D	67.1	Low	70.6	Confident	144 Å²	144	132.2 Å²	132.2	77%	0.77	69%	0.69	S	S	*	*	S	Bend	trans	-81	13.7	171.1	-68.5	-52.3	0	0	0	113.1	D116	D114-D116 PolarHBondContact O-N 2.73Å; D114-D116 VanDerWaalsContact O-N 3.13Å
115	G	65.7	Low	68.5	Low	57 Å²	57	133.1 Å²	133.1	59%	0.588	70%	0.699	S	S	*	*	S	Bend	trans	-73.7	96	170.4	0	0	0	0	0	111.2	Q113	Q113-G115 PolarHBondContact O-N 3.02Å
116	D	66.3	Low	66.4	Low	145 Å²	145	133.1 Å²	133.1	78%	0.775	71%	0.712	S	S	*	*			trans	-38.2	123.8	179	-146	-8.8	0	0	0	112.3	D114 V118	D114-D116 PolarHBondContact O-N 2.73Å; D114-D116 VanDerWaalsContact O-N 3.13Å; D116-V118 PolarHBondContact O-N 3Å
117	P	62.3	Low	64.4	Low	114 Å²	114	137 Å²	137	74%	0.74	72%	0.72	S	S	*	*			trans	-65.4	99	-170.5	24.4	-34.8	0	0	0	111.9	K119	P117-K119 PolarHBondContact O-N 3.21Å; P117-K119 VanDerWaalsContact O-N 3.13Å
118	V	62.6	Low	62.5	Low	140 Å²	140	139.5 Å²	139.5	85%	0.848	73%	0.729	S	S	*	*			trans	-53.4	120.8	177.9	178.1	0	0	0	0	109.4	D116 Q120	D116-V118 PolarHBondContact O-N 3Å; V118-Q120 PolarHBondContact O-N 2.86Å
119	K	61.7	Low	60.5	Low	171 Å²	171	139.8 Å²	139.8	74%	0.743	74%	0.736	S	S	*	*			trans	-47.1	120.9	-169.6	-65.6	171.6	-178.9	173.4	0	111.7	P117 Y121	P117-K119 PolarHBondContact O-N 3.21Å; P117-K119 VanDerWaalsContact O-N 3.13Å; K119-Y121 WeakPolarHBondContact O-CD2 3.42Å; K119-Y121 PolarHBondContact O-N 3.43Å
120	Q	48.4	Very low	58.6	Low	196 Å²	196	142.9 Å²	142.9	92%	0.916	74%	0.742	S	S	*	*			trans	-58.9	109.7	167.8	-73.7	-179.9	-49.8	0	0	109.2	V118	V118-Q120 PolarHBondContact O-N 2.86Å
121	Y	51.2	Low	56.7	Low	202 Å²	202	144.1 Å²	144.1	79%	0.792	75%	0.753	S	S	*	*			trans	-73.9	138.1	162.8	-77.3	-94.1	0	0	0	108.6	K119	K119-Y121 WeakPolarHBondContact O-CD2 3.42Å; K119-Y121 PolarHBondContact O-N 3.43Å
122	P	53.7	Low	55	Low	109 Å²	109	140.6 Å²	140.6	71%	0.708	76%	0.758	S	S	*	*			trans	-66.7	138.6	-175.1	26.5	-34.3	0	0	0	111.5	N124	P122-N124 PolarHBondContact O-N 2.71Å
123	V	45.6	Very low	53.5	Low	138 Å²	138	143.8 Å²	143.8	84%	0.836	77%	0.773	S	S	*	*			trans	-70.1	109.4	175.7	178.8	0	0	0	0	109.3
124	N	52.8	Low	52.5	Low	146 Å²	146	140.8 Å²	140.8	78%	0.781	77%	0.768	S	S	*	*			trans	-99.6	117.8	165.6	-86.8	-10.4	0	0	0	109.7	P122 C126	P122-N124 PolarHBondContact O-N 2.71Å; N124-C126 PolarHBondContact O-N 3.37Å
125	N	45.6	Very low	51.6	Low	150 Å²	150	141.8 Å²	141.8	80%	0.802	77%	0.772	S	S	*	*			trans	-58.2	130.5	161.3	-79.1	-24	0	0	0	109.2
126	C	45.6	Very low	50.6	Low	129 Å²	129	146.7 Å²	146.7	87%	0.872	78%	0.78	S	S	*	*			trans	-140.9	131.1	141.9	-152.7	0	0	0	0	111	N124	N124-C126 PolarHBondContact O-N 3.37Å
127	Q	48.3	Very low	49.4	Very low	138 Å²	138	147.5 Å²	147.5	65%	0.645	78%	0.779	S	S	*	*			trans	-64.2	144.8	-175.6	-139	86.7	-22.3	0	0	112.4
128	Q	50.2	Low	48.6	Very low	153 Å²	153	148.7 Å²	148.7	72%	0.715	78%	0.777	S	S	*	*			trans	69.5	138.3	130.7	-92.7	166	7.5	0	0	123.2
129	Q	45.2	Very low	47.7	Very low	157 Å²	157	148.3 Å²	148.3	73%	0.734	78%	0.775	S	S	*	*			trans	87.2	107.1	144.1	-67.9	-178.3	-32.6	0	0	121.9
130	H	44.4	Very low	46.9	Very low	144 Å²	144	144 Å²	144	67%	0.667	77%	0.771	S	S	*	*				68.1	116.7	127.9	-67.4	-65.8	0	0	0	123.3
131	D	44	Very low	47	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	77%	0.772	S	S	*	*				62.6	116.8	120.9	-46.2	-11.7	0	0	0	120.6
132	G	45.2	Very low	46.8	Very low	81 Å²	81	139.3 Å²	139.3	84%	0.835	77%	0.766	S	S	*	*			trans	-174.8	119.3	167.3	0	0	0	0	0	112.2
133	E	46.2	Very low	46.5	Very low	193 Å²	193	141.7 Å²	141.7	90%	0.902	77%	0.765	S	S	*	*			trans	-78	162.4	-177.5	-99.9	-106.8	108.5	0	0	113.6
134	P	51.3	Low	46.4	Very low	99 Å²	99	144 Å²	144	64%	0.643	77%	0.767	S	S	*	*			trans	-94.4	164.1	-168.9	38.2	-34.3	0	0	0	113.7
135	L	46.7	Very low	46.5	Very low	164 Å²	164	146.2 Å²	146.2	86%	0.859	77%	0.77	S	S	*	*			trans	-144.3	168	157	-111.9	176.2	0	0	0	112.7
136	Q	44.7	Very low	47	Very low	161 Å²	161	148.4 Å²	148.4	75%	0.752	77%	0.772	S	S	*	*			trans	-96.3	174.4	-155.8	-59.1	161.3	15.5	0	0	114.3
137	Q	42.4	Very low	46.8	Very low	162 Å²	162	146 Å²	146	76%	0.757	77%	0.77	S	S	*	*				112.9	150.7	122.4	-132.7	-178.5	14.7	0	0	119.3
138	I	44.3	Very low	47.1	Very low	139 Å²	139	145.2 Å²	145.2	71%	0.713	78%	0.779	S	S	*	*			trans	67.7	102.2	166	-48.7	-178.1	0	0	0	114.9
139	V	44.5	Very low	46.7	Very low	131 Å²	131	145.9 Å²	145.9	79%	0.794	79%	0.788	S	S	*	*			cis	94.7	113.2	48.7	172.6	0	0	0	0	114.1
140	A	44.6	Very low	47	Very low	81 Å²	81	145.3 Å²	145.3	67%	0.669	80%	0.795	S	S	*	*			trans	53.2	130.3	152.8	0	0	0	0	0	122
141	N	51.1	Low	46.9	Very low	172 Å²	172	147.9 Å²	147.9	92%	0.92	80%	0.804	S	S	*	*				-155.7	168.7	110	-109.7	-65.1	0	0	0	112.9
142	D	46	Very low	47	Very low	127 Å²	127	148.6 Å²	148.6	68%	0.679	81%	0.807	S	S	*	*			trans	-129.3	172.6	-159.8	177.2	31.8	0	0	0	112.7
143	K	47.3	Very low	47.4	Very low	159 Å²	159	151.1 Å²	151.1	69%	0.691	81%	0.806	S	S	*	*			trans	93.5	98.2	158.9	-53.9	-167.2	177.4	173.2	0	120.7
144	Q	44.6	Very low	47.6	Very low	186 Å²	186	146.7 Å²	146.7	87%	0.869	80%	0.796	S	S	*	*				44.2	123.4	116.5	-63.8	-176.7	-12.8	0	0	120.1
145	K	54.3	Low	48.2	Very low	194 Å²	194	147.6 Å²	147.6	84%	0.843	80%	0.802	S	S	*	*			trans	-155.1	130.2	144.1	-151.5	161.7	-174.9	171.3	0	114.4
146	K	55.2	Low	48.4	Very low	196 Å²	196	146.4 Å²	146.4	85%	0.852	80%	0.802	S	S	*	*			trans	36.8	127.5	158.8	-71.9	-170.5	170.8	-169.8	0	120.3
147	G	42.7	Very low	49.2	Very low	79 Å²	79	142.8 Å²	142.8	81%	0.814	80%	0.799	S	S	*	*			trans	-102.8	-174.2	153.9	0	0	0	0	0	113.1
148	S	54.3	Low	50.4	Low	121 Å²	121	140.7 Å²	140.7	85%	0.846	80%	0.8	S	S	*	*			trans	-148.4	142.6	170.9	49.3	0	0	0	0	111.3
149	N	42.1	Very low	51.4	Low	167 Å²	167	139.4 Å²	139.4	89%	0.893	80%	0.801	S	S	*	*			trans	-78.9	138.1	180	-85.2	-39.4	0	0	0	112.6
150	T	50.8	Low	51.8	Low	144 Å²	144	141.2 Å²	141.2	88%	0.883	81%	0.805	S	S	*	*			trans	-136.7	160.3	152.3	42.9	0	0	0	0	110.1
151	K	42.9	Very low	52.4	Low	199 Å²	199	142.9 Å²	142.9	87%	0.865	81%	0.806	S	S	*	*			trans	-139.3	96.7	-152.7	176.4	-166	175.7	-174.2	0	111.7
152	L	45.8	Very low	52	Low	165 Å²	165	142 Å²	142	86%	0.864	80%	0.802	S	S	*	*			trans	-127.4	113.1	165	-99.4	82.3	0	0	0	107.8
153	V	53.1	Low	52.1	Low	134 Å²	134	141.7 Å²	141.7	81%	0.812	80%	0.804	S	S	*	*				75.2	109	84.7	172.5	0	0	0	0	111.9
154	S	50	Low	51.7	Low	100 Å²	100	138.5 Å²	138.5	70%	0.699	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-89.2	147.4	175	-175.1	0	0	0	0	110.9
155	P	64.3	Low	51.7	Low	119 Å²	119	137.1 Å²	137.1	77%	0.773	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69.6	147.5	162.2	31.1	-33.9	0	0	0	110.6
156	T	52.1	Low	51	Low	139 Å²	139	134.1 Å²	134.1	85%	0.853	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-100.8	144.5	175.6	-57.7	0	0	0	0	109.8
157	A	60.2	Low	50.3	Low	84 Å²	84	132.4 Å²	132.4	69%	0.694	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.3	150.5	177.6	0	0	0	0	0	112.6
158	P	69	Low	50.3	Low	119 Å²	119	132.7 Å²	132.7	77%	0.773	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-72.8	148.7	174	31.4	-35.2	0	0	0	111.7
159	P	63.8	Low	49.7	Very low	112 Å²	112	132 Å²	132	73%	0.727	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-77	150.5	175.7	32.3	-34.9	0	0	0	112.4
160	L	53.9	Low	50.3	Low	168 Å²	168	130.5 Å²	130.5	88%	0.88	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.1	145.9	161.5	-92.7	150.2	0	0	0	110.2
161	V	57.5	Low	50.5	Low	116 Å²	116	127.6 Å²	127.6	70%	0.703	79%	0.786	S	S	*	*			trans	-119.6	106.7	174.3	-179.1	0	0	0	0	108.1	V163	V161-V163 PolarHBondContact O-N 3.39Å
162	D	43.2	Very low	51.1	Low	153 Å²	153	123.7 Å²	123.7	82%	0.818	78%	0.781	S	S	*	*			trans	-72.7	116.8	173.1	-79.2	-53.7	0	0	0	110.5	A164	D162-A164 PolarHBondContact O-N 3.35Å
163	V	48	Very low	51.9	Low	122 Å²	122	122.5 Å²	122.5	74%	0.739	78%	0.781	S	S	*	*			trans	-95.2	80.7	175.4	-176.5	0	0	0	0	109.4	V161 L165	V161-V163 PolarHBondContact O-N 3.39Å; V163-L165 PolarHBondContact O-N 3.24Å
164	A	38.4	Very low	52.1	Low	92 Å²	92	124.2 Å²	124.2	76%	0.76	78%	0.78	S	S	*	*			trans	-82.3	91.2	169.5	0	0	0	0	0	110.2	D162	D162-A164 PolarHBondContact O-N 3.35Å
165	L	43.3	Very low	52.5	Low	157 Å²	157	128.1 Å²	128.1	82%	0.822	79%	0.787	S	S	*	*			trans	-97	94.5	178	-150.5	83	0	0	0	111.6	V163	V163-L165 PolarHBondContact O-N 3.24Å
166	T	40.4	Very low	52	Low	131 Å²	131	129.2 Å²	129.2	80%	0.804	79%	0.786	S	S	*	*			trans	-77.5	123.3	174.3	-51.7	0	0	0	0	111
167	L	41.1	Very low	52	Low	160 Å²	160	127.4 Å²	127.4	84%	0.838	78%	0.779	S	S	*	*			trans	-155.9	149.6	163.6	-144.6	71.6	0	0	0	114.2
168	A	41.8	Very low	51.6	Low	85 Å²	85	131.8 Å²	131.8	70%	0.702	79%	0.791	S	S	*	*			trans	54.8	90.6	161.9	0	0	0	0	0	118.1
169	A	41.3	Very low	50.7	Low	106 Å²	106	130.2 Å²	130.2	88%	0.876	79%	0.788	S	S	*	*			trans	-72.1	145.2	149.5	0	0	0	0	0	110
170	V	54.7	Low	50.6	Low	136 Å²	136	132.4 Å²	132.4	82%	0.824	79%	0.793	S	S	*	*			trans	-116.3	139.1	169.9	176.2	0	0	0	0	107.9
171	A	55.8	Low	50.7	Low	83 Å²	83	131.5 Å²	131.5	69%	0.686	79%	0.789	S	S	*	*			trans	-74.6	152	-173.1	0	0	0	0	0	112.9
172	P	55.3	Low	50.5	Low	116 Å²	116	133 Å²	133	75%	0.753	79%	0.788	S	S	*	*			trans	-73.9	157.2	167.9	33.5	-35.1	0	0	0	111.3
173	V	63.4	Low	51.2	Low	141 Å²	141	131.2 Å²	131.2	86%	0.855	79%	0.785	S	S	*	*			trans	-110.2	131.8	162.7	175.2	0	0	0	0	106.8
174	E	56	Low	51.2	Low	170 Å²	170	129.5 Å²	129.5	79%	0.794	78%	0.778	S	S	*	*			trans	-97.5	148.8	171.3	-52.4	-142.9	139.5	0	0	109.7
175	E	58.7	Low	51.9	Low	182 Å²	182	134.3 Å²	134.3	85%	0.85	79%	0.785	S	S	*	*			trans	-167.4	139.9	138.7	-110	163.1	-159.5	0	0	112.3
176	D	53.1	Low	52.4	Low	142 Å²	142	134.7 Å²	134.7	76%	0.759	79%	0.787	S	S	*	*			trans	52.7	86.4	149.4	-65.8	7.5	0	0	0	122.4
177	S	53	Low	53.4	Low	100 Å²	100	138 Å²	138	70%	0.699	79%	0.79	S	S	*	*				28.7	124.9	118.3	64.2	0	0	0	0	121
178	N	52.8	Low	54.4	Low	176 Å²	176	137.4 Å²	137.4	94%	0.941	79%	0.786	S	S	*	*				-152	154	127	-109.2	-62.5	0	0	0	110.1
179	A	49.9	Very low	55.4	Low	87 Å²	87	143.9 Å²	143.9	72%	0.719	79%	0.793	S	S	*	*			trans	-130.5	149.7	-171.3	0	0	0	0	0	112.2
180	L	60.6	Low	56.4	Low	157 Å²	157	145.5 Å²	145.5	82%	0.822	79%	0.785	S	S	*	*			trans	-177	135.1	142.1	-98.6	156.1	0	0	0	112
181	D	55.3	Low	56.7	Low	149 Å²	149	147.9 Å²	147.9	80%	0.797	78%	0.784	S	S	*	*			trans	51.2	113.5	155.5	-57.9	-17.4	0	0	0	124.1
182	E	55.1	Low	56.9	Low	147 Å²	147	153.5 Å²	153.5	69%	0.687	79%	0.794	S	S	*	*			trans	-70.2	166.1	151.3	-109.3	-90.1	118.8	0	0	110.1	S184	E182-S184 PolarHBondContact OE1-N 3.34Å; E182-S184 WeakPolarHBondContact OE2-CB 3.25Å; E182-S184 PolarHBondContact OE2-N 2.97Å; E182-S184 PolarHBondContact OE2-OG 3Å
183	P	56.3	Low	56.7	Low	117 Å²	117	151.5 Å²	151.5	76%	0.76	79%	0.794	S	S	*	*				-148.6	134.9	57	37.3	-14.6	0	0	0	120.4
184	S	49.6	Very low	56	Low	85 Å²	85	156.1 Å²	156.1	59%	0.594	80%	0.796	S	S	*	*				51.3	109.2	126.4	-70.3	0	0	0	0	120.6	E182	E182-S184 PolarHBondContact OE1-N 3.34Å; E182-S184 WeakPolarHBondContact OE2-CB 3.25Å; E182-S184 PolarHBondContact OE2-N 2.97Å; E182-S184 PolarHBondContact OE2-OG 3Å
185	Q	53.2	Low	55.9	Low	193 Å²	193	153.7 Å²	153.7	90%	0.902	80%	0.798	S	S	*	*			trans	-136.5	159.2	145	-72.9	-158.2	12.1	0	0	112.5
186	L	53	Low	55.5	Low	165 Å²	165	151.3 Å²	151.3	86%	0.864	79%	0.791	S	S	*	*			trans	-68.9	147	-161.8	-76.3	68.3	0	0	0	114.5
187	K	61.8	Low	55.2	Low	200 Å²	200	153.9 Å²	153.9	87%	0.87	80%	0.799	S	S	*	*			trans	-128.4	89	171.7	-164	165.5	-169.4	164.9	0	112.2
188	I	62.4	Low	54.8	Low	148 Å²	148	154 Å²	154	76%	0.759	81%	0.805	S	S	*	*			trans	-67.4	131.8	174.4	-60.6	174.6	0	0	0	109.3	I190	I188-I190 HydrophobicContact CG2-CG1 4.35Å
189	R	61.5	Low	54.4	Low	221 Å²	221	151.1 Å²	151.1	83%	0.834	80%	0.799	S	S	*	*			trans	-130.4	88.5	-178	-170.9	178.4	-175	173.1	2.8	111.4	K191	R189-K191 PolarHBondContact O-N 2.79Å
190	I	63.9	Low	54.5	Low	141 Å²	141	153.7 Å²	153.7	72%	0.723	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.5	126.1	173.1	-59.2	175.7	0	0	0	108.9	I188 F192	I188-I190 HydrophobicContact CG2-CG1 4.35Å; I190-F192 HydrophobicContact CG2-CD2 4.46Å; I190-F192 HydrophobicContact CG2-CE2 4.41Å
191	K	59.9	Low	53.7	Low	185 Å²	185	152.6 Å²	152.6	80%	0.804	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-97.4	120.5	168.1	-76.1	-178.1	175.5	179.3	0	108.9	R189	R189-K191 PolarHBondContact O-N 2.79Å
192	F	59.6	Low	53.5	Low	202 Å²	202	155.8 Å²	155.8	89%	0.886	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-79.3	125.8	157.6	-86.6	-90.4	0	0	0	109	I190	I190-F192 HydrophobicContact CG2-CD2 4.46Å; I190-F192 HydrophobicContact CG2-CE2 4.41Å
193	G	51.4	Low	53.1	Low	74 Å²	74	154.5 Å²	154.5	76%	0.763	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.8	148.1	170.9	0	0	0	0	0	111.2
194	R	48.6	Very low	52.6	Low	237 Å²	237	154.7 Å²	154.7	89%	0.894	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-86.2	144.4	156.8	-71.4	-176.8	175.2	179.8	-2.8	108.5
195	S	53.4	Low	52.8	Low	120 Å²	120	158.1 Å²	158.1	84%	0.839	81%	0.813	S	S	*	*			trans	-138.1	116	163	-166.4	0	0	0	0	107.2
196	D	50.3	Low	52.4	Low	131 Å²	131	156.6 Å²	156.6	70%	0.701	81%	0.806	S	S	*	*			trans	-93.5	177.8	170.3	-60.7	-63.3	0	0	0	109.4
197	E	46.9	Very low	52.4	Low	197 Å²	197	156.8 Å²	156.8	92%	0.921	81%	0.806	S	S	*	*			trans	62.4	100.5	169.4	-54.4	-162	148.3	0	0	119.4
198	A	45	Very low	51.5	Low	101 Å²	101	153.2 Å²	153.2	84%	0.835	80%	0.801	S	S	*	*			trans	-152.1	95.4	148.6	0	0	0	0	0	111
199	S	45	Very low	51.3	Low	116 Å²	116	151.9 Å²	151.9	81%	0.811	80%	0.802	S	S	*	*			trans	-99.4	117	173.1	-177.4	0	0	0	0	110.5
200	I	52.1	Low	50.6	Low	141 Å²	141	146.5 Å²	146.5	72%	0.723	79%	0.793	S	S	*	*			trans	-134.5	114.3	172.8	-61.9	-177.1	0	0	0	109.7	R202	I200-R202 HydrophobicContact CG2-CG 4.4Å
201	V	43.3	Very low	50.1	Low	134 Å²	134	148.2 Å²	148.2	81%	0.812	80%	0.802	S	S	*	*			trans	-95.3	120.7	168.7	174.5	0	0	0	0	108.8
202	R	51.4	Low	49.4	Very low	217 Å²	217	145.4 Å²	145.4	82%	0.819	80%	0.796	S	S	*	*			trans	-140.7	110.7	161.8	-75.3	-163.3	173.4	130.8	4.2	112.4	I200	I200-R202 HydrophobicContact CG2-CG 4.4Å
203	T	45.9	Very low	48.6	Very low	119 Å²	119	140.5 Å²	140.5	73%	0.73	79%	0.786	S	S	*	*			trans	18.9	111	140.3	51.6	0	0	0	0	118.6
204	V	47.3	Very low	48.1	Very low	122 Å²	122	142.3 Å²	142.3	74%	0.739	79%	0.787	S	S	*	*				19.1	121.7	117.3	179.4	0	0	0	0	116.1
205	D	53	Low	48	Very low	157 Å²	157	141.5 Å²	141.5	84%	0.84	78%	0.784	S	S	*	*				-145.8	164.6	125.3	-133.3	-32.5	0	0	0	111.6
206	Q	45.4	Very low	47.6	Very low	161 Å²	161	142.1 Å²	142.1	75%	0.752	78%	0.778	S	S	*	*			trans	-98	152.1	-169.9	-56.5	175	21.8	0	0	112.9
207	I	53	Low	47.2	Very low	169 Å²	169	145.1 Å²	145.1	87%	0.867	79%	0.788	S	S	*	*			trans	-173	133.7	135.6	-96.5	149	0	0	0	109.2
208	T	42.5	Very low	47.4	Very low	124 Å²	124	141.4 Å²	141.4	76%	0.761	78%	0.779	S	S	*	*			trans	-129.8	148.6	173.6	-37.6	0	0	0	0	108.6
209	P	56.9	Low	47.5	Very low	121 Å²	121	143.8 Å²	143.8	79%	0.786	78%	0.778	S	S	*	*			trans	-124.2	151.6	145.7	35	-26.2	0	0	0	112.9
210	V	48.2	Very low	47.7	Very low	108 Å²	108	146.5 Å²	146.5	66%	0.655	78%	0.782	S	S	*	*			trans	-99.7	140.7	-174.2	173.4	0	0	0	0	111	N212	V210-N212 WeakPolarHBondContact CG1-OD1 3.34Å
211	I	53.1	Low	47.7	Very low	177 Å²	177	146.1 Å²	146.1	91%	0.908	79%	0.786	S	S	*	*			trans	-130.1	146.1	154.4	-63.7	-174.4	0	0	0	108.5
212	N	44.3	Very low	47.9	Very low	126 Å²	126	142.7 Å²	142.7	67%	0.674	78%	0.778	S	S	*	*			trans	-106.2	134.3	-155.1	-80.5	-33.5	0	0	0	115.7	V210	V210-N212 WeakPolarHBondContact CG1-OD1 3.34Å
213	S	42.8	Very low	47.8	Very low	98 Å²	98	139.7 Å²	139.7	69%	0.685	78%	0.777	S	S	*	*				63.3	138.7	123.3	-48.8	0	0	0	0	123.9
214	S	41.8	Very low	48	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	78%	0.782	S	S	*	*			trans	101.9	143.2	140.2	-61	0	0	0	0	119.2
215	R	45.7	Very low	48.3	Very low	220 Å²	220	145 Å²	145	83%	0.83	79%	0.785	S	S	*	*			trans	76.6	130.5	-178.1	-54.8	-158.2	98.9	113.3	0.8	115.1
216	D	46.5	Very low	48.1	Very low	133 Å²	133	141 Å²	141	71%	0.711	78%	0.775	S	S	*	*			cis	-133.8	154	-9.1	-80.1	-48.2	0	0	0	109.9
217	Q	40.7	Very low	48.5	Very low	194 Å²	194	141.2 Å²	141.2	91%	0.907	78%	0.775	S	S	*	*			trans	-137	92.8	-175.1	-174.6	-174.9	18.6	0	0	111.2
218	T	51	Low	48.8	Very low	119 Å²	119	139.7 Å²	139.7	73%	0.73	77%	0.769	S	S	*	*			trans	-143	161.5	169.9	46.1	0	0	0	0	111.4
219	D	48.3	Very low	49.5	Very low	151 Å²	151	144.7 Å²	144.7	81%	0.807	77%	0.774	S	S	*	*			trans	67.6	50.9	161.3	-53.4	-23.6	0	0	0	119.5
220	L	48.4	Very low	49.5	Very low	173 Å²	173	150.1 Å²	150.1	91%	0.906	78%	0.779	S	S	*	*	S	Bend	trans	-112	32.3	160.4	-85.3	172.4	0	0	0	113.8
221	V	51.4	Low	49.9	Very low	133 Å²	133	153.8 Å²	153.8	81%	0.806	79%	0.786	S	S	*	*	S	Bend	trans	-124.1	-7.1	-176.8	-170.1	0	0	0	0	113.3
222	G	48	Very low	49.7	Very low	63 Å²	63	156.8 Å²	156.8	65%	0.649	79%	0.786	S	S	*	*	S	Bend	trans	-83.8	-17.5	-166.6	0	0	0	0	0	117.9
223	I	50.5	Low	49.8	Very low	154 Å²	154	160.3 Å²	160.3	79%	0.79	80%	0.795	S	S	*	*	S	Bend	trans	-89.9	-34.4	-160.9	-59.9	179.2	0	0	0	113.2	Q225 A226	I223-Q225 PolarHBondContact O-N 3.12Å; I223-A226 PolarHBondContact O-N 2.71Å
224	E	48	Very low	50	Low	181 Å²	181	164.5 Å²	164.5	85%	0.846	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-17.2	-170.2	-159.3	169.7	-169.7	0	0	114.4
225	Q	54.2	Low	50	Low	170 Å²	170	165.4 Å²	165.4	79%	0.794	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-12.1	176.7	-73.6	-164.1	-1.5	0	0	114.7	I223	I223-Q225 PolarHBondContact O-N 3.12Å
226	A	49.5	Very low	50.2	Low	75 Å²	75	163.1 Å²	163.1	62%	0.62	81%	0.807	S	S	*	*	S	Bend	trans	-72.7	-32.1	-173.1	0	0	0	0	0	113.8	I223	I223-A226 PolarHBondContact O-N 2.71Å
227	E	54.5	Low	50.2	Low	164 Å²	164	160.3 Å²	160.3	77%	0.766	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-80	-32.3	-167.9	-164.5	165.6	166.8	0	0	113.7	R229 R230	E227-R229 PolarHBondContact O-N 3.13Å; E227-R229 VanDerWaalsContact O-N 3.08Å; E227-R230 PolarHBondContact O-N 2.91Å
228	N	57.5	Low	50.3	Low	138 Å²	138	156.9 Å²	156.9	74%	0.738	81%	0.807	S	S	*	*	G	3₁₀ helix	trans	-68.6	-8.4	-175.7	-96.9	-48.4	0	0	0	115.1
229	R	57.1	Low	50	Low	229 Å²	229	160 Å²	160	86%	0.864	81%	0.813	S	S	*	*	G	3₁₀ helix	trans	-81.3	-9	178.7	-74.8	-171.1	172.2	-161.9	-1.8	115	E227	E227-R229 PolarHBondContact O-N 3.13Å; E227-R229 VanDerWaalsContact O-N 3.08Å
230	R	58.8	Low	49.8	Very low	234 Å²	234	160 Å²	160	88%	0.883	81%	0.812	S	S	*	*	G	3₁₀ helix	trans	-92	3	-174	-70.2	-173.3	174.7	-175.1	-0.8	116.3	E227	E227-R230 PolarHBondContact O-N 2.91Å
231	K	56.5	Low	50	Low	185 Å²	185	158.5 Å²	158.5	80%	0.804	81%	0.81	S	S	*	*	S	Bend	trans	-115.5	20.6	-172.6	-70	-176.6	177.8	172.9	0	116.3
232	R	48.6	Very low	49.8	Very low	241 Å²	241	156.2 Å²	156.2	91%	0.909	81%	0.805	S	S	*	*			trans	-135.8	84.6	178	-69.7	-171.5	179.5	-172.5	0.3	113.5
233	K	45.9	Very low	50.4	Low	199 Å²	199	159 Å²	159	87%	0.865	81%	0.812	S	S	*	*			trans	-157.3	55.9	163.8	-149.2	173.5	-174.3	179.8	0	115
234	H	47	Very low	50.7	Low	186 Å²	186	157.8 Å²	157.8	86%	0.861	81%	0.814	S	S	*	*			trans	-142.6	139	166.4	-88.1	-80.7	0	0	0	111.6
235	T	41.7	Very low	51	Low	131 Å²	131	152.4 Å²	152.4	80%	0.804	81%	0.807	S	S	*	*			trans	73.2	140.1	157.9	-38.1	0	0	0	0	119.4
236	I	49.5	Very low	50.8	Low	173 Å²	173	150.4 Å²	150.4	89%	0.887	81%	0.806	S	S	*	*			trans	106.3	129.4	167.5	-59.8	166.9	0	0	0	115.2
237	G	46.5	Very low	50.8	Low	74 Å²	74	154.4 Å²	154.4	76%	0.763	82%	0.817	S	S	*	*			trans	129.7	78.5	159.9	0	0	0	0	0	116.8
238	S	42.8	Very low	50.3	Low	121 Å²	121	151 Å²	151	85%	0.846	81%	0.811	S	S	*	*			trans	-87.9	152.2	156.1	-60.4	0	0	0	0	109.7
239	E	44.8	Very low	49.5	Very low	185 Å²	185	151.5 Å²	151.5	86%	0.864	81%	0.812	S	S	*	*				-167.9	-179.2	112.5	-157	145.9	148.3	0	0	111.1
240	L	44.6	Very low	48.8	Very low	150 Å²	150	147.7 Å²	147.7	79%	0.785	82%	0.815	S	S	*	*			trans	-84.4	154.8	-165.9	-62.4	121.4	0	0	0	114.9
241	V	52.4	Low	48	Very low	143 Å²	143	141.4 Å²	141.4	87%	0.867	81%	0.807	S	S	*	*				177.3	151.5	108.7	154	0	0	0	0	109.5
242	A	47.6	Very low	47.5	Very low	85 Å²	85	137.1 Å²	137.1	70%	0.702	81%	0.806	S	S	*	*			trans	-151.7	-162.6	-176.7	0	0	0	0	0	108.9
243	P	61.2	Low	47.2	Very low	122 Å²	122	133.8 Å²	133.8	79%	0.792	81%	0.806	S	S	*	*			cis	-123.5	-135.4	-25.7	36.4	-14.4	0	0	0	107.9
244	P	56.1	Low	47.2	Very low	127 Å²	127	128.2 Å²	128.2	83%	0.825	81%	0.805	S	S	*	*			cis	-130.6	176.2	-23	38.1	-20	0	0	0	116
245	G	54	Low	46.8	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	81%	0.805	S	S	*	*			trans	-172.2	60.9	178.3	0	0	0	0	0	120.4
246	V	50.9	Low	46.9	Very low	128 Å²	128	127.1 Å²	127.1	78%	0.776	80%	0.799	S	S	*	*			trans	65.9	103.7	143.7	-172.8	0	0	0	0	121.7
247	L	49.8	Very low	46.6	Very low	159 Å²	159	125 Å²	125	83%	0.832	79%	0.794	S	S	*	*			trans	55.8	154.9	135.9	-52.2	179.8	0	0	0	121.6
248	S	42.4	Very low	46.8	Very low	92 Å²	92	127 Å²	127	64%	0.643	79%	0.794	S	S	*	*			cis	-160.1	138.2	-14.8	-97.2	0	0	0	0	107
249	L	41.2	Very low	46.6	Very low	148 Å²	148	130.4 Å²	130.4	78%	0.775	79%	0.793	S	S	*	*				72.6	104.9	63.1	-81.4	175.2	0	0	0	116.6
250	T	43.3	Very low	46.5	Very low	149 Å²	149	126.7 Å²	126.7	91%	0.914	78%	0.783	S	S	*	*			trans	-156.3	165.8	131.1	16.9	0	0	0	0	111
251	S	41.7	Very low	46.3	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	79%	0.788	S	S	*	*			trans	-156.6	146	-151.2	-59.5	0	0	0	0	111.9
252	A	45	Very low	45.8	Very low	96 Å²	96	124 Å²	124	79%	0.793	78%	0.783	S	S	*	*			trans	175.9	103.3	144	0	0	0	0	0	117.2
253	N	43.3	Very low	45.3	Very low	171 Å²	171	126.3 Å²	126.3	91%	0.914	78%	0.783	S	S	*	*			trans	12.5	147.4	135.3	-47.4	-7	0	0	0	122.4
254	G	46.2	Very low	44.7	Very low	82 Å²	82	130.6 Å²	130.6	85%	0.845	79%	0.789	S	S	*	*			trans	-169.5	27.8	177.4	0	0	0	0	0	120.6
255	E	38.7	Very low	43.9	Very low	184 Å²	184	131.3 Å²	131.3	86%	0.86	79%	0.786	S	S	*	*			trans	6.2	131.9	160.4	-148.4	158.5	124	0	0	125.4
256	V	42.9	Very low	43.5	Very low	109 Å²	109	131.4 Å²	131.4	66%	0.661	79%	0.787	S	S	*	*			trans	81.8	101.7	138.1	161.9	0	0	0	0	125.6
257	T	42.7	Very low	43.1	Very low	128 Å²	128	130.1 Å²	130.1	79%	0.785	78%	0.784	S	S	*	*			trans	70.6	159.6	133.8	71.7	0	0	0	0	123.8
258	P	50.6	Low	42.8	Very low	118 Å²	118	128.8 Å²	128.8	77%	0.766	78%	0.778	S	S	*	*			trans	-121.2	169.8	-162.9	43.3	-31.7	0	0	0	116.9
259	K	40.1	Very low	42.9	Very low	192 Å²	192	132.4 Å²	132.4	84%	0.835	78%	0.784	S	S	*	*			trans	-171.4	149.2	150	-111.4	172.5	-176.5	174.3	0	116.5
260	T	42.2	Very low	43.3	Very low	107 Å²	107	131.8 Å²	131.8	66%	0.656	78%	0.782	S	S	*	*			trans	62.6	116.3	146.3	51.7	0	0	0	0	125.3
261	N	39.9	Very low	43	Very low	163 Å²	163	129.9 Å²	129.9	87%	0.872	78%	0.775	S	S	*	*				82.4	147.2	118.4	-60.9	8.6	0	0	0	123.7
262	G	42.6	Very low	43.9	Very low	74 Å²	74	130.5 Å²	130.5	76%	0.763	78%	0.777	S	S	*	*			trans	125.8	94.5	178.1	0	0	0	0	0	110.1
263	N	37.7	Very low	43.8	Very low	132 Å²	132	132.6 Å²	132.6	71%	0.706	78%	0.78	S	S	*	*			cis	74	107.4	37.4	-162.9	98.4	0	0	0	115.2	N265	N263-N265 PolarHBondContact ND2-OD1 3.44Å
264	F	47	Very low	43.8	Very low	212 Å²	212	129 Å²	129	93%	0.93	77%	0.768	S	S	*	*			trans	-145.8	153.7	157.4	-116.5	-86.2	0	0	0	110.4
265	N	39.8	Very low	43.7	Very low	143 Å²	143	130.6 Å²	130.6	77%	0.765	77%	0.766	S	S	*	*			trans	-111.2	162.8	-164.2	-65.4	-1.1	0	0	0	113.9	N263	N263-N265 PolarHBondContact ND2-OD1 3.44Å
266	G	45	Very low	44	Very low	71 Å²	71	125.4 Å²	125.4	73%	0.732	76%	0.755	S	S	*	*			trans	143	144.8	149.9	0	0	0	0	0	114.2
267	S	43.2	Very low	44.3	Very low	101 Å²	101	129.7 Å²	129.7	71%	0.706	77%	0.765	S	S	*	*			cis	-169.8	156.7	-23.3	-132	0	0	0	0	110.6
268	D	43.5	Very low	44.6	Very low	130 Å²	130	126.9 Å²	126.9	70%	0.695	76%	0.762	S	S	*	*			trans	73.9	116	145.7	-48.3	-15.3	0	0	0	123
269	E	44.4	Very low	44.7	Very low	168 Å²	168	129.4 Å²	129.4	79%	0.785	77%	0.765	S	S	*	*			trans	65.1	145.5	130	-60.7	-167.1	178.8	0	0	121.8
270	N	50.1	Low	44.9	Very low	135 Å²	135	124.4 Å²	124.4	72%	0.722	76%	0.76	S	S	*	*			cis	-149.8	-175.7	21.9	-133.7	-49.6	0	0	0	113.5
271	S	37.4	Very low	45.4	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	76%	0.76	S	S	*	*			trans	-137	-139.9	-175.9	-66.4	0	0	0	0	116.4
272	P	58.8	Low	45.9	Very low	115 Å²	115	124.9 Å²	124.9	75%	0.747	75%	0.753	S	S	*	*				-128.8	-179.7	-110.5	41.6	-24.6	0	0	0	116.4
273	T	44.9	Very low	46.3	Very low	140 Å²	140	128.9 Å²	128.9	86%	0.859	75%	0.752	S	S	*	*			trans	173.5	160.2	154.5	24.8	0	0	0	0	110.6
274	S	42.9	Very low	46.9	Very low	96 Å²	96	127.8 Å²	127.8	67%	0.671	75%	0.75	S	S	*	*			cis	-172.8	161.8	-17.1	50.8	0	0	0	0	113.1
275	S	42.5	Very low	47	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	74%	0.744	S	S	*	*			trans	74	152.1	151.6	77	0	0	0	0	120.5
276	A	46.6	Very low	47.5	Very low	75 Å²	75	123.9 Å²	123.9	62%	0.62	74%	0.741	S	S	*	*			cis	-169.5	171	-19.9	0	0	0	0	0	113.2
277	F	48.4	Very low	48	Very low	198 Å²	198	123.9 Å²	123.9	87%	0.868	74%	0.742	S	S	*	*			trans	67.3	146.6	172.7	-59.9	-83.7	0	0	0	117.5
278	G	48.3	Very low	48	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	75%	0.754	S	S	*	*			cis	147.5	158	-1.6	0	0	0	0	0	111.3
279	M	52.6	Low	48	Very low	170 Å²	170	122.9 Å²	122.9	84%	0.837	75%	0.754	S	S	*	*			cis	-160.5	169.9	-6.4	-62	-177.8	60.8	0	0	109.9
280	A	45.3	Very low	48.2	Very low	88 Å²	88	120.2 Å²	120.2	73%	0.727	76%	0.76	S	S	*	*			trans	69.5	152	160.1	0	0	0	0	0	119.6
281	N	51.9	Low	47.6	Very low	123 Å²	123	117.9 Å²	117.9	66%	0.658	77%	0.769	S	S	*	*			cis	-158.3	155.6	-12.4	-113.9	25	0	0	0	111.5
282	E	51	Low	48.1	Very low	157 Å²	157	116.4 Å²	116.4	73%	0.734	77%	0.77	S	S	*	*			trans	56.9	151.8	143.1	-68.3	164.5	149.8	0	0	121
283	E	51.3	Low	47.1	Very low	158 Å²	158	119.2 Å²	119.2	74%	0.738	78%	0.778	S	S	*	*			cis	-150.2	175.8	5.5	-134.2	-177.6	146.4	0	0	113.6
284	T	50.1	Low	47.2	Very low	108 Å²	108	121.9 Å²	121.9	66%	0.663	78%	0.78	S	S	*	*			trans	-13.5	161.3	162	48.6	0	0	0	0	120.9
285	E	50.1	Low	47	Very low	172 Å²	172	121.3 Å²	121.3	80%	0.804	78%	0.781	S	S	*	*			cis	-164.9	169.5	-7.8	-109.6	-151.8	-119.8	0	0	106.4
286	S	49.8	Very low	47	Very low	101 Å²	101	123.7 Å²	123.7	71%	0.706	79%	0.785	S	S	*	*			cis	-170.6	-155	-23.6	64.6	0	0	0	0	108.7
287	G	54.7	Low	46.9	Very low	72 Å²	72	124.3 Å²	124.3	74%	0.742	79%	0.79	S	S	*	*			trans	132.2	109.3	164.6	0	0	0	0	0	116.9
288	C	44.6	Very low	46.4	Very low	142 Å²	142	120.2 Å²	120.2	96%	0.959	79%	0.793	S	S	*	*			trans	-63.4	158.4	174.1	-51.5	0	0	0	0	113.1
289	G	43.2	Very low	46.3	Very low	67 Å²	67	120.8 Å²	120.8	69%	0.691	79%	0.791	S	S	*	*			cis	162.5	-159.9	2.5	0	0	0	0	0	111.4
290	A	48.5	Very low	45.9	Very low	112 Å²	112	119 Å²	119	93%	0.926	80%	0.795	S	S	*	*			trans	65.8	109.5	175.4	0	0	0	0	0	117.4
291	G	37.4	Very low	46	Very low	87 Å²	87	126.2 Å²	126.2	90%	0.897	80%	0.803	S	S	*	*			trans	-91.1	174	179.2	0	0	0	0	0	115.1
292	G	47.4	Very low	46.2	Very low	78 Å²	78	128 Å²	128	80%	0.804	81%	0.813	S	S	*	*			trans	-156.6	109.5	173	0	0	0	0	0	111.1
293	I	37.1	Very low	46.7	Very low	175 Å²	175	126 Å²	126	90%	0.897	81%	0.813	S	S	*	*			trans	-86.1	120	177.8	-60.4	173	0	0	0	109
294	Q	46.9	Very low	47.7	Very low	195 Å²	195	128.2 Å²	128.2	91%	0.911	82%	0.82	S	S	*	*			trans	-149	130.5	157	-111.3	175.8	50.6	0	0	110.1
295	A	39.9	Very low	48.8	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	83%	0.831	S	S	*	*			trans	-96.3	144.7	172.6	0	0	0	0	0	109.8
296	N	43	Very low	50.2	Low	165 Å²	165	128.7 Å²	128.7	88%	0.882	82%	0.818	S	S	*	*			trans	-170.1	160.4	137.5	-110.1	-42.8	0	0	0	115.5
297	A	42.8	Very low	51.9	Low	87 Å²	87	127.6 Å²	127.6	72%	0.719	81%	0.81	S	S	*	*			trans	52.3	103.3	154.9	0	0	0	0	0	118.9
298	A	38.5	Very low	53	Low	112 Å²	112	129.6 Å²	129.6	93%	0.926	81%	0.808	S	S	*	*			trans	-65.6	132	159.6	0	0	0	0	0	111
299	A	46.6	Very low	54.7	Low	82 Å²	82	126.2 Å²	126.2	68%	0.678	79%	0.79	S	S	*	*			trans	-136.4	111.7	171.9	0	0	0	0	0	109.8	R301	A299-R301 PolarHBondContact O-N 3.36Å
300	S	44.9	Very low	56.7	Low	134 Å²	134	125.3 Å²	125.3	94%	0.937	78%	0.776	S	S	*	*			trans	-63.1	98.1	-171.4	-52	0	0	0	0	112.8
301	R	46.1	Very low	58.1	Low	238 Å²	238	124.1 Å²	124.1	90%	0.898	75%	0.754	S	S	*	*			trans	-98.2	110.8	171.7	-71.4	-171	172.2	-157.1	-3.5	110.1	A299	A299-R301 PolarHBondContact O-N 3.36Å
302	L	56.6	Low	60.3	Low	162 Å²	162	123.8 Å²	123.8	85%	0.848	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-52.1	137.2	170.4	-80.3	151.9	0	0	0	110.5	K304	L302-K304 PolarHBondContact O-N 3.08Å
303	P	61.7	Low	61.9	Low	114 Å²	114	122.6 Å²	122.6	74%	0.74	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-63.3	127.3	174.9	26.7	-33.3	0	0	0	109.3	L305	P303-L305 PolarHBondContact O-N 3.43Å
304	K	71.1	Confident	64	Low	204 Å²	204	119.1 Å²	119.1	89%	0.887	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-64.5	119.1	174.2	-70.1	-175.9	177.2	-177.2	0	108.7	L302 K306	L302-K304 PolarHBondContact O-N 3.08Å; K304-K306 PolarHBondContact O-N 3.12Å
305	L	73	Confident	65.3	Low	171 Å²	171	115.8 Å²	115.8	90%	0.895	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-56.9	132.5	174.1	-66.2	171.4	0	0	0	109.6	P303 S307	P303-L305 PolarHBondContact O-N 3.43Å; L305-S307 PolarHBondContact O-N 2.67Å
306	K	80.5	Confident	67	Low	120 Å²	120	116.7 Å²	116.7	52%	0.522	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-62.3	134	171.4	-67.3	-175.9	-173.4	175.8	0	108.4	K304 A310 E314	K304-K306 PolarHBondContact O-N 3.12Å; K306-A310 HydrophobicContact CB-CB 4.41Å; K306-E314 IonicContact NZ-OE1 2.79Å; K306-E314 PolarHBondContact NZ-OE1 3.25Å; K306-E314 IonicContact NZ-OE2 2.64Å; K306-E314 PolarHBondContact NZ-OE2 3.38Å
307	S	85.7	Confident	68.5	Low	78 Å²	78	117.9 Å²	117.9	55%	0.545	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-56.7	145.9	168.9	172.2	0	0	0	0	109.9	L305 A309 A310 L311	L305-S307 PolarHBondContact O-N 2.67Å; S307-A309 PolarHBondContact O-N 2.77Å; S307-A309 VanDerWaalsContact O-N 3.11Å; S307-A309 PolarHBondContact OG-N 2.9Å; S307-A310 WeakPolarHBondContact O-CA 3.31Å; S307-A310 WeakPolarHBondContact O-CB 3.39Å; S307-A310 PolarHBondContact O-N 3.46Å; S307-L311 PolarHBondContact O-N 3.12Å
308	T	77.2	Confident	69.5	Low	113 Å²	113	117.5 Å²	117.5	69%	0.693	67%	0.669	S	S	*	*	H	α-helix	trans	-50.6	-37.9	176.5	-43.5	0	0	0	0	111.8	A310 L311 V312	T308-A310 PolarHBondContact O-N 2.94Å; T308-L311 PolarHBondContact O-N 3.04Å; T308-V312 WeakPolarHBondContact O-CG2 3.47Å; T308-V312 PolarHBondContact O-N 3.31Å
309	A	80.4	Confident	70.5	Confident	71 Å²	71	121.4 Å²	121.4	59%	0.587	66%	0.661	S	S	*	*	H	α-helix	trans	-64.3	-36.7	176.2	0	0	0	0	0	113.2	S307 A313	S307-A309 PolarHBondContact O-N 2.77Å; S307-A309 VanDerWaalsContact O-N 3.11Å; S307-A309 PolarHBondContact OG-N 2.9Å; A309-A313 VanDerWaalsContact O-CB 3.25Å; A309-A313 WeakPolarHBondContact O-CB 3.4Å; A309-A313 PolarHBondContact O-N 3.1Å
310	A	84.5	Confident	71.2	Confident	49 Å²	49	122.8 Å²	122.8	41%	0.405	66%	0.663	S	S	.	*	H	α-helix	trans	-73.1	-33.8	175.9	0	0	0	0	0	111.9	K306 S307 T308 E314	K306-A310 HydrophobicContact CB-CB 4.41Å; S307-A310 WeakPolarHBondContact O-CA 3.31Å; S307-A310 WeakPolarHBondContact O-CB 3.39Å; S307-A310 PolarHBondContact O-N 3.46Å; T308-A310 PolarHBondContact O-N 2.94Å; A310-E314 VanDerWaalsContact O-CB 3.3Å; A310-E314 WeakPolarHBondContact O-CB 3.25Å; A310-E314 PolarHBondContact O-N 3.1Å
311	L	79.6	Confident	71.4	Confident	87 Å²	87	124.2 Å²	124.2	46%	0.455	66%	0.66	S	S	.	*	H	α-helix	trans	-69.9	-41.7	176.1	-132.8	169.1	0	0	0	111.3	S307 T308 E314 M315	S307-L311 PolarHBondContact O-N 3.12Å; T308-L311 PolarHBondContact O-N 3.04Å; L311-E314 PolarHBondContact O-N 3.28Å; L311-M315 HydrophobicContact CD2-SD 4.42Å; L311-M315 WeakPolarHBondContact O-CG 3.45Å; L311-M315 PolarHBondContact O-N 3.24Å
312	V	82.1	Confident	71.4	Confident	80 Å²	80	119.1 Å²	119.1	49%	0.485	66%	0.656	S	S	.	*	H	α-helix	trans	-63.2	-46.1	171.7	170.4	0	0	0	0	111.1	T308 E314 M315 T316	T308-V312 WeakPolarHBondContact O-CG2 3.47Å; T308-V312 PolarHBondContact O-N 3.31Å; V312-E314 PolarHBondContact O-N 2.96Å; V312-M315 PolarHBondContact O-N 3.18Å; V312-T316 PolarHBondContact O-N 3Å; V312-T316 PolarHBondContact O-OG1 3.37Å
313	A	81.7	Confident	70.8	Confident	53 Å²	53	117.6 Å²	117.6	44%	0.438	65%	0.653	S	S	.	*	H	α-helix	trans	-63.8	-28.9	178.4	0	0	0	0	0	113.5	A309 T316	A309-A313 VanDerWaalsContact O-CB 3.25Å; A309-A313 WeakPolarHBondContact O-CB 3.4Å; A309-A313 PolarHBondContact O-N 3.1Å; A313-T316 WeakPolarHBondContact CA-OG1 3.27Å; A313-T316 PolarHBondContact O-OG1 3.14Å
314	E	80.8	Confident	69.9	Low	101 Å²	101	117.2 Å²	117.2	47%	0.472	66%	0.659	S	S	.	*	H	α-helix	trans	-74.4	-41	173.5	-171.2	165.3	-117.9	0	0	111.3	K306 A310 L311 V312 K317	K306-E314 IonicContact NZ-OE1 2.79Å; K306-E314 PolarHBondContact NZ-OE1 3.25Å; K306-E314 IonicContact NZ-OE2 2.64Å; K306-E314 PolarHBondContact NZ-OE2 3.38Å; A310-E314 VanDerWaalsContact O-CB 3.3Å; A310-E314 WeakPolarHBondContact O-CB 3.25Å; A310-E314 PolarHBondContact O-N 3.1Å; L311-E314 PolarHBondContact O-N 3.28Å; V312-E314 PolarHBondContact O-N 2.96Å; E314-K317 PolarHBondContact O-N 3.1Å; E314-K317 VanDerWaalsContact O-N 3.17Å
315	M	75.2	Confident	68.6	Low	125 Å²	125	112.7 Å²	112.7	62%	0.616	65%	0.648	S	S	*	*	H	α-helix	trans	-64.5	-38.2	173.3	-75.2	175.7	55.8	0	0	113.5	L311 V312 K317 S318	L311-M315 HydrophobicContact CD2-SD 4.42Å; L311-M315 WeakPolarHBondContact O-CG 3.45Å; L311-M315 PolarHBondContact O-N 3.24Å; V312-M315 PolarHBondContact O-N 3.18Å; M315-K317 PolarHBondContact O-N 3.2Å; M315-S318 PolarHBondContact O-OG 3.18Å
316	T	76	Confident	67.3	Low	105 Å²	105	111.8 Å²	111.8	64%	0.644	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-6.4	175.3	50.4	0	0	0	0	113.3	V312 A313	V312-T316 PolarHBondContact O-N 3Å; V312-T316 PolarHBondContact O-OG1 3.37Å; A313-T316 WeakPolarHBondContact CA-OG1 3.27Å; A313-T316 PolarHBondContact O-OG1 3.14Å
317	K	72.6	Confident	65.6	Low	189 Å²	189	112 Å²	112	82%	0.822	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-4.3	-180	-130.7	178.5	-176.9	-176.9	0	114.3	E314 M315	E314-K317 PolarHBondContact O-N 3.1Å; E314-K317 VanDerWaalsContact O-N 3.17Å; M315-K317 PolarHBondContact O-N 3.2Å
318	S	63.9	Low	63.9	Low	79 Å²	79	114.3 Å²	114.3	55%	0.552	65%	0.651	S	S	*	*	S	Bend	trans	-106.9	9.6	-175.6	57.2	0	0	0	0	115	M315	M315-S318 PolarHBondContact O-OG 3.18Å
319	Y	60.7	Low	62.3	Low	194 Å²	194	116.3 Å²	116.3	76%	0.761	66%	0.658	S	S	*	*			trans	-121	107.5	172.2	-76.1	-86.9	0	0	0	110.1
320	P	60.7	Low	60.6	Low	112 Å²	112	116.4 Å²	116.4	73%	0.727	67%	0.665	S	S	*	*			trans	-79.3	137.1	168	31.8	-31.7	0	0	0	110.5	T322	P320-T322 PolarHBondContact O-N 2.89Å
321	D	49.9	Very low	59.3	Low	164 Å²	164	120.4 Å²	120.4	88%	0.877	69%	0.685	S	S	*	*			trans	-65.3	122.2	176	-66.5	-64.5	0	0	0	111.6
322	T	45.5	Very low	57.5	Low	131 Å²	131	123.1 Å²	123.1	80%	0.804	70%	0.699	S	S	*	*			trans	-166.7	71.6	160.9	4.4	0	0	0	0	112.2	P320	P320-T322 PolarHBondContact O-N 2.89Å
323	V	44.4	Very low	56.3	Low	130 Å²	130	128.4 Å²	128.4	79%	0.788	72%	0.719	S	S	*	*			trans	-130.5	87	159.8	-172.7	0	0	0	0	108.8	V325	V323-V325 HydrophobicContact CG1-CG2 4.04Å; V323-V325 PolarHBondContact O-N 3.17Å
324	A	41.7	Very low	54.5	Low	105 Å²	105	131.1 Å²	131.1	87%	0.868	73%	0.734	S	S	*	*			trans	-74.7	102.1	170.1	0	0	0	0	0	108.9	H326	A324-H326 PolarHBondContact O-N 3.46Å
325	V	44.1	Very low	52.8	Low	109 Å²	109	131.4 Å²	131.4	66%	0.661	75%	0.745	S	S	*	*			trans	-83.5	107.4	170.7	-177.6	0	0	0	0	107.7	V323 I327	V323-V325 HydrophobicContact CG1-CG2 4.04Å; V323-V325 PolarHBondContact O-N 3.17Å; V325-I327 HydrophobicContact CG1-CG1 4.11Å
326	H	46.2	Very low	51.4	Low	152 Å²	152	132.7 Å²	132.7	70%	0.704	75%	0.753	S	S	*	*			trans	-72.2	125.6	169.2	-143.1	-86.4	0	0	0	108.2	A324 D328	A324-H326 PolarHBondContact O-N 3.46Å; H326-D328 IonicContact CE1-OD1 2.67Å; H326-D328 PolarHBondContact CE1-OD1 3.21Å; H326-D328 IonicContact CE1-OD2 2.77Å; H326-D328 PolarHBondContact CE1-OD2 2.74Å; H326-D328 IonicContact CG-OD2 3.4Å; H326-D328 VanDerWaalsContact ND1-CG 3.34Å; H326-D328 IonicContact ND1-OD1 2.77Å; H326-D328 PolarHBondContact ND1-OD1 2.68Å; H326-D328 IonicContact ND1-OD2 2.8Å; H326-D328 PolarHBondContact ND1-OD2 3.13Å
327	I	43.9	Very low	50	Low	125 Å²	125	136.7 Å²	136.7	64%	0.641	76%	0.764	S	S	*	*			trans	-116.1	108.2	174.4	-58.5	176.5	0	0	0	106.1	V325	V325-I327 HydrophobicContact CG1-CG1 4.11Å
328	D	51.6	Low	48.6	Very low	127 Å²	127	133.4 Å²	133.4	68%	0.679	76%	0.76	S	S	*	*			trans	-105.5	96.3	172.9	-66.5	-72.9	0	0	0	109.4	H326	H326-D328 IonicContact CE1-OD1 2.67Å; H326-D328 PolarHBondContact CE1-OD1 3.21Å; H326-D328 IonicContact CE1-OD2 2.77Å; H326-D328 PolarHBondContact CE1-OD2 2.74Å; H326-D328 IonicContact CG-OD2 3.4Å; H326-D328 VanDerWaalsContact ND1-CG 3.34Å; H326-D328 IonicContact ND1-OD1 2.77Å; H326-D328 PolarHBondContact ND1-OD1 2.68Å; H326-D328 IonicContact ND1-OD2 2.8Å; H326-D328 PolarHBondContact ND1-OD2 3.13Å
329	D	41.8	Very low	47.6	Very low	155 Å²	155	141.5 Å²	141.5	83%	0.829	78%	0.778	S	S	*	*			trans	-75.7	119.8	164.9	-70.3	-60.3	0	0	0	108.9
330	G	46.6	Very low	46.6	Very low	72 Å²	72	137.4 Å²	137.4	74%	0.742	78%	0.778	S	S	*	*			trans	-149.1	43.2	-157.3	0	0	0	0	0	117.9
331	V	56	Low	45.9	Very low	134 Å²	134	140 Å²	140	81%	0.812	79%	0.785	S	S	*	*			trans	38.3	127	148.9	-175.5	0	0	0	0	119.8
332	D	42.1	Very low	45.5	Very low	143 Å²	143	136.3 Å²	136.3	77%	0.765	78%	0.777	S	S	*	*			trans	-52	146.4	171	-59.2	-88.1	0	0	0	115
333	H	56.1	Low	45.3	Very low	192 Å²	192	135.3 Å²	135.3	89%	0.889	78%	0.775	S	S	*	*				-164.5	140.1	127.9	-88.3	-42.5	0	0	0	111.7
334	S	44.6	Very low	45.3	Very low	109 Å²	109	135 Å²	135	76%	0.762	78%	0.779	S	S	*	*			trans	-123.9	158.3	159	72.9	0	0	0	0	108
335	P	45.5	Very low	45.2	Very low	108 Å²	108	136.7 Å²	136.7	70%	0.701	78%	0.779	S	S	*	*				-150.9	169.3	82.9	40.4	-22.7	0	0	0	116.4
336	I	44.9	Very low	45.3	Very low	152 Å²	152	136.1 Å²	136.1	78%	0.779	79%	0.786	S	S	*	*			trans	28.5	119.1	140.4	-55.5	165.1	0	0	0	118.1
337	E	47	Very low	45.1	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	79%	0.794	S	S	*	*			trans	-141.3	139	135.3	-146.6	-177.9	-149.6	0	0	111.8
338	T	42.7	Very low	45.4	Very low	120 Å²	120	136 Å²	136	74%	0.736	80%	0.802	S	S	*	*			trans	-98.3	139.5	-175.7	51.4	0	0	0	0	112.4
339	R	43.6	Very low	44.9	Very low	248 Å²	248	133.3 Å²	133.3	94%	0.936	80%	0.804	S	S	*	*			trans	-143.9	134.4	156.4	-110.8	167.9	-172.9	171.6	4.4	112.9
340	S	39.8	Very low	45.2	Very low	108 Å²	108	135.5 Å²	135.5	76%	0.755	81%	0.806	S	S	*	*			trans	-106.2	159.6	178.1	172.6	0	0	0	0	109.8
341	L	45.6	Very low	45.3	Very low	168 Å²	168	143.3 Å²	143.3	88%	0.88	81%	0.813	S	S	*	*			trans	-173.4	152	131.8	-100.6	168.3	0	0	0	112.7
342	A	42.8	Very low	44.5	Very low	85 Å²	85	140.4 Å²	140.4	70%	0.702	81%	0.811	S	S	*	*			trans	14.8	125.5	167.5	0	0	0	0	0	120.4
343	S	40.8	Very low	44.8	Very low	110 Å²	110	145 Å²	145	77%	0.769	82%	0.817	S	S	*	*			cis	73.8	114	43.7	-166.6	0	0	0	0	115.7
344	S	43.4	Very low	44.3	Very low	124 Å²	124	144.1 Å²	144.1	87%	0.867	81%	0.813	S	S	*	*			trans	-164.7	122.9	151.4	-81.6	0	0	0	0	110.4
345	T	41	Very low	44.4	Very low	141 Å²	141	143.5 Å²	143.5	87%	0.865	81%	0.809	S	S	*	*			trans	-120.3	142.8	170.9	42.6	0	0	0	0	109.7
346	A	45.3	Very low	44.9	Very low	97 Å²	97	144.3 Å²	144.3	80%	0.802	81%	0.812	S	S	*	*			trans	-143.3	131.5	171.6	0	0	0	0	0	109.7
347	T	42.4	Very low	45	Very low	143 Å²	143	142.9 Å²	142.9	88%	0.877	81%	0.806	S	S	*	*			trans	-139.9	115.9	-179.8	-53.8	0	0	0	0	108.7
348	T	51	Low	45.1	Very low	131 Å²	131	143.2 Å²	143.2	80%	0.804	80%	0.799	S	S	*	*			trans	-135.2	107	-178.1	-50.7	0	0	0	0	109.4
349	G	39.3	Very low	45.4	Very low	70 Å²	70	148.8 Å²	148.8	72%	0.722	81%	0.807	S	S	*	*			trans	-93.5	153.4	170.5	0	0	0	0	0	111.6
350	F	49.6	Very low	45.6	Very low	201 Å²	201	140.3 Å²	140.3	88%	0.882	80%	0.796	S	S	*	*			trans	-137.7	158.5	169	-122.4	-93.5	0	0	0	112.7
351	R	47.1	Very low	46	Very low	237 Å²	237	143.7 Å²	143.7	89%	0.894	80%	0.8	S	S	*	*			trans	-72.1	143	-166.3	-63.4	168.3	168.1	179.3	-5.8	113.7
352	G	39.7	Very low	46	Very low	73 Å²	73	142.5 Å²	142.5	75%	0.753	79%	0.79	S	S	*	*			trans	-93.9	-170.9	162.7	0	0	0	0	0	113.7
353	R	47.9	Very low	46.2	Very low	239 Å²	239	146.2 Å²	146.2	90%	0.902	80%	0.795	S	S	*	*			trans	-153.5	166	168.7	-105.3	-176	177.9	-165.7	-1.8	112.3
354	H	46.4	Very low	46.5	Very low	174 Å²	174	146.2 Å²	146.2	81%	0.806	79%	0.79	S	S	*	*			trans	-61.3	172.6	-177.1	-40.8	-84.4	0	0	0	113.7
355	S	47.1	Very low	46.5	Very low	96 Å²	96	147.1 Å²	147.1	67%	0.671	79%	0.785	S	S	*	*			cis	-166.5	161.6	26.3	-158	0	0	0	0	114.4
356	T	55.1	Low	46.8	Very low	125 Å²	125	149.4 Å²	149.4	77%	0.767	78%	0.784	S	S	*	*			trans	18.8	138.9	144.7	56.2	0	0	0	0	119.9
357	D	48.3	Very low	46.9	Very low	121 Å²	121	152 Å²	152	65%	0.647	78%	0.779	S	S	*	*			cis	-158.4	-159.1	28.8	-155.9	7.3	0	0	0	108.3
358	R	49	Very low	47.2	Very low	197 Å²	197	151.7 Å²	151.7	74%	0.743	78%	0.777	S	S	*	*			cis	-160	171.3	8.6	-176.6	153.5	-73.8	-173.7	0.8	111.8
359	R	48.2	Very low	47.1	Very low	237 Å²	237	154.6 Å²	154.6	89%	0.894	78%	0.784	S	S	*	*			trans	-38.2	154.9	166.6	-50.4	165.6	-170.1	-172.7	-1.1	115.9
360	G	47.7	Very low	47.9	Very low	69 Å²	69	154.8 Å²	154.8	71%	0.711	79%	0.786	S	S	*	*			cis	135.6	163.8	-3.9	0	0	0	0	0	114.3
361	Q	48	Very low	48.2	Very low	179 Å²	179	151.8 Å²	151.8	84%	0.836	78%	0.784	S	S	*	*			trans	74.6	139.8	160.4	-156.9	160	15	0	0	117.1
362	E	45.3	Very low	48.8	Very low	144 Å²	144	145.9 Å²	145.9	67%	0.673	78%	0.775	S	S	*	*			cis	-164.6	175.4	-15.3	-123.1	176	144.7	0	0	110.1
363	M	48.2	Very low	50.1	Low	163 Å²	163	146.8 Å²	146.8	80%	0.803	77%	0.766	S	S	*	*			trans	66.3	150.4	161.9	-71.3	174.9	174.4	0	0	119.1
364	T	47.3	Very low	50.9	Low	109 Å²	109	139.3 Å²	139.3	67%	0.669	76%	0.755	S	S	*	*			cis	-160.5	150.1	-25.2	17	0	0	0	0	109.1
365	D	43.5	Very low	52.1	Low	144 Å²	144	136 Å²	136	77%	0.77	75%	0.748	S	S	*	*			trans	31.6	113.6	148.7	-45.2	-24.2	0	0	0	121
366	F	46.6	Very low	53.1	Low	189 Å²	189	136.1 Å²	136.1	83%	0.829	74%	0.74	S	S	*	*			trans	-151.5	164.3	142.4	-142.6	-110.4	0	0	0	114
367	E	46.3	Very low	54.1	Low	150 Å²	150	134.6 Å²	134.6	70%	0.701	73%	0.731	S	S	*	*			trans	-46.6	154	-155.2	-65.8	176	147.2	0	0	121.9
368	T	49.1	Very low	55.5	Low	138 Å²	138	133.5 Å²	133.5	85%	0.847	73%	0.725	S	S	*	*			trans	-52.7	132.7	162.8	42.8	0	0	0	0	114.2
369	M	49.1	Very low	56.7	Low	191 Å²	191	126.7 Å²	126.7	94%	0.941	71%	0.711	S	S	*	*			trans	-106.4	137	152.1	-71.8	-159.2	-175.8	0	0	110.4
370	G	55.9	Low	58.1	Low	74 Å²	74	118.8 Å²	118.8	76%	0.763	69%	0.691	S	S	*	*			trans	-81.4	140.2	-179.6	0	0	0	0	0	112.9	T372	G370-T372 PolarHBondContact O-N 3.42Å
371	T	56.8	Low	59.6	Low	139 Å²	139	122.7 Å²	122.7	85%	0.853	68%	0.684	S	S	*	*			trans	-74	106.3	171.7	49.9	0	0	0	0	110.4
372	T	59.9	Low	61	Low	113 Å²	113	120.6 Å²	120.6	69%	0.693	67%	0.674	S	S	*	*			trans	-62.7	136	171	42.4	0	0	0	0	110.6	G370	G370-T372 PolarHBondContact O-N 3.42Å
373	T	67.2	Low	62.8	Low	92 Å²	92	116.3 Å²	116.3	56%	0.564	66%	0.661	S	S	*	*			trans	-90.2	149.1	178.4	51.7	0	0	0	0	110.2	T375 D376	T373-T375 PolarHBondContact O-N 3.37Å; T373-T375 PolarHBondContact OG1-OG1 2.88Å; T373-D376 WeakPolarHBondContact O-CB 3.47Å; T373-D376 PolarHBondContact O-N 3.29Å
374	A	63	Low	64.5	Low	82 Å²	82	113.9 Å²	113.9	68%	0.678	65%	0.647	S	S	*	*	H	α-helix	trans	-57	-25.8	-171.6	0	0	0	0	0	114.5	D376 V377	A374-D376 PolarHBondContact O-N 2.9Å; A374-V377 PolarHBondContact O-N 3.36Å
375	T	72.3	Confident	66.1	Low	105 Å²	105	113.1 Å²	113.1	64%	0.644	64%	0.638	S	S	*	*	H	α-helix	trans	-61.2	-27.2	175.3	41.5	0	0	0	0	114.2	T373 A379	T373-T375 PolarHBondContact O-N 3.37Å; T373-T375 PolarHBondContact OG1-OG1 2.88Å; T375-A379 PolarHBondContact O-N 3.37Å
376	D	69.4	Low	67.9	Low	97 Å²	97	110.2 Å²	110.2	52%	0.519	63%	0.626	S	S	.	*	H	α-helix	trans	-76.5	-32.8	-177.4	-151.9	23.8	0	0	0	111.5	T373 A374 A379 C380	T373-D376 WeakPolarHBondContact O-CB 3.47Å; T373-D376 PolarHBondContact O-N 3.29Å; A374-D376 PolarHBondContact O-N 2.9Å; D376-A379 PolarHBondContact O-N 3.47Å; D376-C380 PolarHBondContact O-N 3.29Å
377	V	76.1	Confident	69.7	Low	93 Å²	93	106.8 Å²	106.8	56%	0.564	62%	0.615	S	S	*	*	H	α-helix	trans	-66.7	-42.5	175.9	-176.5	0	0	0	0	111.1	A374 C380 R381	A374-V377 PolarHBondContact O-N 3.36Å; V377-C380 PolarHBondContact O-N 3Å; V377-R381 WeakPolarHBondContact O-CB 3.3Å; V377-R381 PolarHBondContact O-N 2.96Å
378	D	76.9	Confident	71.5	Confident	98 Å²	98	103.2 Å²	103.2	52%	0.524	60%	0.604	S	S	.	*	H	α-helix	trans	-65.3	-37.5	175.2	-82.9	-27.2	0	0	0	112.2	Q382	D378-Q382 WeakPolarHBondContact O-CB 3.4Å; D378-Q382 WeakPolarHBondContact O-CG 3.37Å; D378-Q382 PolarHBondContact O-N 3.36Å
379	A	74.7	Confident	72.9	Confident	55 Å²	55	102 Å²	102	46%	0.455	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-44.8	175.4	0	0	0	0	0	111.5	T375 D376 Q382 S383	T375-A379 PolarHBondContact O-N 3.37Å; D376-A379 PolarHBondContact O-N 3.47Å; A379-Q382 PolarHBondContact O-N 3.16Å; A379-S383 PolarHBondContact O-N 3Å; A379-S383 VanDerWaalsContact O-N 3.1Å
380	C	77.1	Confident	74.4	Confident	70 Å²	70	96.7 Å²	96.7	47%	0.473	57%	0.567	S	S	.	*	H	α-helix	trans	-58.7	-52	174.8	-167.5	0	0	0	0	111.5	D376 V377 Q382 S383 E384	D376-C380 PolarHBondContact O-N 3.29Å; V377-C380 PolarHBondContact O-N 3Å; C380-Q382 VanDerWaalsContact C-N 3.3Å; C380-Q382 PolarHBondContact O-N 3.33Å; C380-S383 WeakPolarHBondContact O-CA 3.49Å; C380-S383 WeakPolarHBondContact O-CB 3.27Å; C380-S383 PolarHBondContact O-N 3.11Å; C380-S383 PolarHBondContact O-OG 3.48Å; C380-E384 PolarHBondContact O-N 3.33Å; C380-E384 VanDerWaalsContact O-N 3.12Å
381	R	79.7	Confident	75.7	Confident	152 Å²	152	95.4 Å²	95.4	57%	0.574	55%	0.55	S	S	*	.	H	α-helix	trans	-63.4	-31.3	-178.8	-166.2	172.7	175.6	-157.9	-9.1	113.1	E19 V377 L385	E19-R381 IonicContact OE1-NH2 2.69Å; E19-R381 PolarHBondContact OE1-NH2 2.8Å; V377-R381 WeakPolarHBondContact O-CB 3.3Å; V377-R381 PolarHBondContact O-N 2.96Å; R381-L385 WeakPolarHBondContact O-CB 3.46Å; R381-L385 PolarHBondContact O-N 2.99Å
382	Q	77.5	Confident	76.8	Confident	134 Å²	134	94.2 Å²	94.2	63%	0.626	54%	0.536	S	S	*	.	H	α-helix	trans	-70.2	-33.8	170.8	-75.1	-178.4	37.1	0	0	113	D378 A379 C380 T386	D378-Q382 WeakPolarHBondContact O-CB 3.4Å; D378-Q382 WeakPolarHBondContact O-CG 3.37Å; D378-Q382 PolarHBondContact O-N 3.36Å; A379-Q382 PolarHBondContact O-N 3.16Å; C380-Q382 VanDerWaalsContact C-N 3.3Å; C380-Q382 PolarHBondContact O-N 3.33Å; Q382-T386 WeakPolarHBondContact O-CB 3.34Å; Q382-T386 PolarHBondContact O-N 3.3Å; Q382-T386 VanDerWaalsContact O-N 3.1Å; Q382-T386 PolarHBondContact O-OG1 3.19Å
383	S	82.7	Confident	77.5	Confident	55 Å²	55	94 Å²	94	39%	0.385	53%	0.53	S	S	.	.	H	α-helix	trans	-66.6	-45	176.4	81.2	0	0	0	0	111.7	A379 C380 L385 T386 I387	A379-S383 PolarHBondContact O-N 3Å; A379-S383 VanDerWaalsContact O-N 3.1Å; C380-S383 WeakPolarHBondContact O-CA 3.49Å; C380-S383 WeakPolarHBondContact O-CB 3.27Å; C380-S383 PolarHBondContact O-N 3.11Å; C380-S383 PolarHBondContact O-OG 3.48Å; S383-L385 PolarHBondContact O-N 3.15Å; S383-T386 WeakPolarHBondContact O-CB 3.45Å; S383-T386 PolarHBondContact O-N 3.2Å; S383-T386 VanDerWaalsContact O-N 3.1Å; S383-I387 WeakPolarHBondContact O-CG1 3.2Å; S383-I387 PolarHBondContact O-N 3.4Å
384	E	82.6	Confident	78.2	Confident	112 Å²	112	94.6 Å²	94.6	52%	0.523	53%	0.526	S	S	.	.	H	α-helix	trans	-61.8	-43.7	176.9	-65.4	-178.2	140.5	0	0	112.1	C380 T386 I387 T388	C380-E384 PolarHBondContact O-N 3.33Å; C380-E384 VanDerWaalsContact O-N 3.12Å; E384-T386 PolarHBondContact O-N 2.83Å; E384-I387 PolarHBondContact O-N 3.4Å; E384-T388 WeakPolarHBondContact O-CB 3.5Å; E384-T388 PolarHBondContact O-N 3.07Å; E384-T388 PolarHBondContact O-OG1 2.87Å
385	L	82.3	Confident	79	Confident	92 Å²	92	99.9 Å²	99.9	48%	0.482	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-33.4	175.3	-177.5	62.2	0	0	0	112.1	R381 S383 K389	R381-L385 WeakPolarHBondContact O-CB 3.46Å; R381-L385 PolarHBondContact O-N 2.99Å; S383-L385 PolarHBondContact O-N 3.15Å; L385-K389 HydrophobicContact CG-CD 4.39Å; L385-K389 WeakPolarHBondContact O-CB 3.36Å; L385-K389 WeakPolarHBondContact O-CD 3.4Å; L385-K389 VanDerWaalsContact O-CG 3.27Å; L385-K389 WeakPolarHBondContact O-CG 3.45Å; L385-K389 PolarHBondContact O-N 3.41Å; L385-K389 VanDerWaalsContact O-N 3.09Å
386	T	80.6	Confident	79.1	Confident	84 Å²	84	100.9 Å²	100.9	52%	0.515	52%	0.524	S	S	.	.	H	α-helix	trans	-72.4	-47.4	177	-56.7	0	0	0	0	110.9	Q382 S383 E384 T388 K389 C390	Q382-T386 WeakPolarHBondContact O-CB 3.34Å; Q382-T386 PolarHBondContact O-N 3.3Å; Q382-T386 VanDerWaalsContact O-N 3.1Å; Q382-T386 PolarHBondContact O-OG1 3.19Å; S383-T386 WeakPolarHBondContact O-CB 3.45Å; S383-T386 PolarHBondContact O-N 3.2Å; S383-T386 VanDerWaalsContact O-N 3.1Å; E384-T386 PolarHBondContact O-N 2.83Å; T386-T388 VanDerWaalsContact C-N 3.3Å; T386-T388 PolarHBondContact O-N 3.16Å; T386-K389 PolarHBondContact O-N 3.44Å; T386-C390 PolarHBondContact O-N 3.47Å; T386-C390 PolarHBondContact O-SG 3.21Å; T386-C390 VanDerWaalsContact O-SG 3.4Å
387	I	84.4	Confident	79.6	Confident	116 Å²	116	100.2 Å²	100.2	60%	0.595	52%	0.52	S	S	*	.	H	α-helix	trans	-56.6	-45.2	174.3	-67.8	163.4	0	0	0	110.5	S383 E384 K389 C390 A391	S383-I387 WeakPolarHBondContact O-CG1 3.2Å; S383-I387 PolarHBondContact O-N 3.4Å; E384-I387 PolarHBondContact O-N 3.4Å; I387-K389 PolarHBondContact O-N 3.04Å; I387-C390 PolarHBondContact O-N 2.93Å; I387-A391 WeakPolarHBondContact O-CB 3.3Å; I387-A391 PolarHBondContact O-N 3.08Å
388	T	84.5	Confident	79.7	Confident	75 Å²	75	99.6 Å²	99.6	46%	0.46	51%	0.514	S	S	.	.	H	α-helix	trans	-62.3	-42.1	178.5	-55.2	0	0	0	0	111.9	E384 T386 A391 M392	E384-T388 WeakPolarHBondContact O-CB 3.5Å; E384-T388 PolarHBondContact O-N 3.07Å; E384-T388 PolarHBondContact O-OG1 2.87Å; T386-T388 VanDerWaalsContact C-N 3.3Å; T386-T388 PolarHBondContact O-N 3.16Å; T388-A391 PolarHBondContact O-N 3Å; T388-M392 HydrophobicContact CG2-CE 4.29Å; T388-M392 WeakPolarHBondContact O-CG 3.28Å; T388-M392 PolarHBondContact O-N 3.38Å
389	K	79.2	Confident	79.8	Confident	114 Å²	114	98.9 Å²	98.9	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-64.1	-43.7	174.8	-76.3	168.3	-178.3	172.3	0	112.3	L385 T386 I387 A391 M392 L393	L385-K389 HydrophobicContact CG-CD 4.39Å; L385-K389 WeakPolarHBondContact O-CB 3.36Å; L385-K389 WeakPolarHBondContact O-CD 3.4Å; L385-K389 VanDerWaalsContact O-CG 3.27Å; L385-K389 WeakPolarHBondContact O-CG 3.45Å; L385-K389 PolarHBondContact O-N 3.41Å; L385-K389 VanDerWaalsContact O-N 3.09Å; T386-K389 PolarHBondContact O-N 3.44Å; I387-K389 PolarHBondContact O-N 3.04Å; K389-A391 PolarHBondContact O-N 3.36Å; K389-M392 HydrophobicContact CG-CE 4.21Å; K389-M392 PolarHBondContact O-N 2.68Å; K389-L393 PolarHBondContact O-N 3.4Å
390	C	79.6	Confident	79.6	Confident	78 Å²	78	99.7 Å²	99.7	53%	0.527	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-42.4	174.7	-68.4	0	0	0	0	111.9	T386 I387 M392 L393 Q394	T386-C390 PolarHBondContact O-N 3.47Å; T386-C390 PolarHBondContact O-SG 3.21Å; T386-C390 VanDerWaalsContact O-SG 3.4Å; I387-C390 PolarHBondContact O-N 2.93Å; C390-M392 PolarHBondContact O-N 3.3Å; C390-L393 PolarHBondContact O-N 3.39Å; C390-Q394 WeakPolarHBondContact O-CB 3.47Å; C390-Q394 PolarHBondContact O-N 2.95Å
391	A	83.8	Confident	79.4	Confident	48 Å²	48	101.3 Å²	101.3	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-64.9	-37.6	177.4	0	0	0	0	0	113.1	I387 T388 K389 R395	I387-A391 WeakPolarHBondContact O-CB 3.3Å; I387-A391 PolarHBondContact O-N 3.08Å; T388-A391 PolarHBondContact O-N 3Å; K389-A391 PolarHBondContact O-N 3.36Å; A391-R395 WeakPolarHBondContact O-CG 3.31Å; A391-R395 PolarHBondContact O-N 2.75Å; A391-R395 VanDerWaalsContact O-N 3.08Å
392	M	80.2	Confident	79.2	Confident	114 Å²	114	97.9 Å²	97.9	56%	0.562	51%	0.509	S	S	*	.	H	α-helix	trans	-67.4	-40.8	173	-70.9	-173	-64.6	0	0	112.2	T388 K389 C390 R395 F396	T388-M392 HydrophobicContact CG2-CE 4.29Å; T388-M392 WeakPolarHBondContact O-CG 3.28Å; T388-M392 PolarHBondContact O-N 3.38Å; K389-M392 HydrophobicContact CG-CE 4.21Å; K389-M392 PolarHBondContact O-N 2.68Å; C390-M392 PolarHBondContact O-N 3.3Å; M392-R395 PolarHBondContact O-N 3.38Å; M392-F396 PolarHBondContact O-N 2.88Å
393	L	74	Confident	78.8	Confident	107 Å²	107	98.2 Å²	98.2	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-64	-42.3	175.8	-113.4	161.1	0	0	0	111.9	K389 C390 F396 L397	K389-L393 PolarHBondContact O-N 3.4Å; C390-L393 PolarHBondContact O-N 3.39Å; L393-F396 PolarHBondContact O-N 3.36Å; L393-L397 WeakPolarHBondContact O-CG 3.21Å; L393-L397 PolarHBondContact O-N 3.19Å
394	Q	81.7	Confident	77.9	Confident	105 Å²	105	100.4 Å²	100.4	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-60.3	-51.4	175	-170.6	61.3	53.1	0	0	110.8	C390 F396 L397 D398	C390-Q394 WeakPolarHBondContact O-CB 3.47Å; C390-Q394 PolarHBondContact O-N 2.95Å; Q394-F396 PolarHBondContact O-N 2.89Å; Q394-L397 PolarHBondContact O-N 3.27Å; Q394-D398 PolarHBondContact NE2-OD1 3.35Å; Q394-D398 PolarHBondContact O-N 3.46Å
395	R	80.6	Confident	76.6	Confident	193 Å²	193	98.6 Å²	98.6	73%	0.728	53%	0.526	S	S	*	.	H	α-helix	trans	-58.1	-32.6	177.1	-74.4	178.3	177.6	-174.1	0.6	113.7	A391 M392 N399	A391-R395 WeakPolarHBondContact O-CG 3.31Å; A391-R395 PolarHBondContact O-N 2.75Å; A391-R395 VanDerWaalsContact O-N 3.08Å; M392-R395 PolarHBondContact O-N 3.38Å; R395-N399 WeakPolarHBondContact O-CB 3.12Å; R395-N399 PolarHBondContact O-N 3.09Å; R395-N399 VanDerWaalsContact O-N 3.12Å
396	F	74.7	Confident	75	Confident	126 Å²	126	98.9 Å²	98.9	55%	0.553	54%	0.535	S	S	*	.	H	α-helix	trans	-69.5	-41.5	175	177.8	-103.8	0	0	0	112	M392 L393 Q394 N399 I400	M392-F396 PolarHBondContact O-N 2.88Å; L393-F396 PolarHBondContact O-N 3.36Å; Q394-F396 PolarHBondContact O-N 2.89Å; F396-N399 PolarHBondContact O-N 2.79Å; F396-I400 HydrophobicContact CD1-CD1 4.01Å; F396-I400 HydrophobicContact CE1-CD1 3.52Å; F396-I400 HydrophobicContact CE2-CD1 4.44Å; F396-I400 HydrophobicContact CZ-CD1 3.77Å; F396-I400 WeakPolarHBondContact O-CG1 3.45Å; F396-I400 PolarHBondContact O-N 3.4Å
397	L	78.1	Confident	73.9	Confident	83 Å²	83	99.4 Å²	99.4	44%	0.435	54%	0.541	S	S	.	.	H	α-helix	trans	-67.5	-44	174.4	-65.7	170.9	0	0	0	111.7	L393 Q394 N399 I400 D401	L393-L397 WeakPolarHBondContact O-CG 3.21Å; L393-L397 PolarHBondContact O-N 3.19Å; Q394-L397 PolarHBondContact O-N 3.27Å; L397-N399 PolarHBondContact O-N 3.06Å; L397-I400 WeakPolarHBondContact O-CB 3.38Å; L397-I400 PolarHBondContact O-N 2.7Å; L397-D401 PolarHBondContact O-N 2.77Å
398	D	78.9	Confident	72.7	Confident	80 Å²	80	99.4 Å²	99.4	43%	0.428	55%	0.548	S	S	.	.	H	α-helix	trans	-58	-37.5	176.3	-57.8	-25.5	0	0	0	111.6	Q394 S402	Q394-D398 PolarHBondContact NE2-OD1 3.35Å; Q394-D398 PolarHBondContact O-N 3.46Å; D398-S402 WeakPolarHBondContact O-CB 3.46Å; D398-S402 PolarHBondContact O-N 3.29Å
399	N	78.2	Confident	71.2	Confident	84 Å²	84	105.1 Å²	105.1	45%	0.449	57%	0.567	S	S	.	*	H	α-helix	trans	-68	-39.4	174.9	-176	19.6	0	0	0	112.3	R395 F396 L397 Q403	R395-N399 WeakPolarHBondContact O-CB 3.12Å; R395-N399 PolarHBondContact O-N 3.09Å; R395-N399 VanDerWaalsContact O-N 3.12Å; F396-N399 PolarHBondContact O-N 2.79Å; L397-N399 PolarHBondContact O-N 3.06Å; N399-Q403 WeakPolarHBondContact O-CG 3.41Å; N399-Q403 PolarHBondContact O-N 2.95Å; N399-Q403 VanDerWaalsContact O-N 3.08Å; N399-Q403 PolarHBondContact OD1-NE2 2.76Å
400	I	71.8	Confident	69.7	Low	72 Å²	72	106.5 Å²	106.5	37%	0.369	58%	0.578	S	S	.	*	H	α-helix	trans	-64.2	-48.3	174.5	-70.8	168.9	0	0	0	110.4	F396 L397 S402 Q403 V404	F396-I400 HydrophobicContact CD1-CD1 4.01Å; F396-I400 HydrophobicContact CE1-CD1 3.52Å; F396-I400 HydrophobicContact CE2-CD1 4.44Å; F396-I400 HydrophobicContact CZ-CD1 3.77Å; F396-I400 WeakPolarHBondContact O-CG1 3.45Å; F396-I400 PolarHBondContact O-N 3.4Å; L397-I400 WeakPolarHBondContact O-CB 3.38Å; L397-I400 PolarHBondContact O-N 2.7Å; I400-S402 VanDerWaalsContact C-N 3.34Å; I400-S402 PolarHBondContact O-N 3.05Å; I400-Q403 PolarHBondContact O-N 2.67Å; I400-V404 WeakPolarHBondContact O-CG2 3.4Å; I400-V404 PolarHBondContact O-N 2.93Å; I400-V404 VanDerWaalsContact O-N 3.08Å
401	D	73.2	Confident	68.5	Low	103 Å²	103	110.5 Å²	110.5	55%	0.551	59%	0.589	S	S	*	*	H	α-helix	trans	-65.7	-37	179.2	-82.3	-25.5	0	0	0	111.6	L397 Q403 V404 A405	L397-D401 PolarHBondContact O-N 2.77Å; D401-Q403 PolarHBondContact O-N 2.8Å; D401-V404 CarbonylContact O-C 3.56Å; D401-V404 PolarHBondContact O-N 3.13Å; D401-V404 VanDerWaalsContact O-N 3.1Å; D401-A405 VanDerWaalsContact O-CB 3.26Å; D401-A405 WeakPolarHBondContact O-CB 3.49Å; D401-A405 PolarHBondContact O-N 2.85Å
402	S	74.7	Confident	66.8	Low	81 Å²	81	114.7 Å²	114.7	57%	0.566	61%	0.605	S	S	*	*	H	α-helix	trans	-58.7	-42.1	172.4	-173.4	0	0	0	0	112.7	D398 I400 V404 A405	D398-S402 WeakPolarHBondContact O-CB 3.46Å; D398-S402 PolarHBondContact O-N 3.29Å; I400-S402 VanDerWaalsContact C-N 3.34Å; I400-S402 PolarHBondContact O-N 3.05Å; S402-V404 VanDerWaalsContact C-N 3.3Å; S402-V404 PolarHBondContact O-N 3.32Å; S402-A405 PolarHBondContact O-N 3.02Å
403	Q	70.1	Confident	65.4	Low	141 Å²	141	117.8 Å²	117.8	66%	0.659	62%	0.618	S	S	*	*	H	α-helix	trans	-71.4	-22.2	175.5	-70.8	177.7	47.9	0	0	113.5	N399 I400 D401	N399-Q403 WeakPolarHBondContact O-CG 3.41Å; N399-Q403 PolarHBondContact O-N 2.95Å; N399-Q403 VanDerWaalsContact O-N 3.08Å; N399-Q403 PolarHBondContact OD1-NE2 2.76Å; I400-Q403 PolarHBondContact O-N 2.67Å; D401-Q403 PolarHBondContact O-N 2.8Å
404	V	63.7	Low	64.2	Low	100 Å²	100	117.8 Å²	117.8	61%	0.606	62%	0.624	S	S	*	*	H	α-helix	trans	-90.4	-19.6	176.8	173.9	0	0	0	0	112.5	I400 D401 S402 S406	I400-V404 WeakPolarHBondContact O-CG2 3.4Å; I400-V404 PolarHBondContact O-N 2.93Å; I400-V404 VanDerWaalsContact O-N 3.08Å; D401-V404 CarbonylContact O-C 3.56Å; D401-V404 PolarHBondContact O-N 3.13Å; D401-V404 VanDerWaalsContact O-N 3.1Å; S402-V404 VanDerWaalsContact C-N 3.3Å; S402-V404 PolarHBondContact O-N 3.32Å; V404-S406 VanDerWaalsContact C-N 3.3Å; V404-S406 PolarHBondContact O-N 2.78Å
405	A	55.4	Low	62.3	Low	74 Å²	74	118.8 Å²	118.8	61%	0.612	64%	0.639	S	S	*	*			trans	-77.5	-0.7	-173.1	0	0	0	0	0	115.9	D401 S402 P407	D401-A405 VanDerWaalsContact O-CB 3.26Å; D401-A405 WeakPolarHBondContact O-CB 3.49Å; D401-A405 PolarHBondContact O-N 2.85Å; S402-A405 PolarHBondContact O-N 3.02Å; A405-P407 WeakPolarHBondContact O-CD 3.42Å
406	S	48.3	Very low	60.8	Low	98 Å²	98	114.6 Å²	114.6	69%	0.685	64%	0.64	S	S	*	*			trans	-93.2	103.4	179.5	-68.4	0	0	0	0	112.2	V404	V404-S406 VanDerWaalsContact C-N 3.3Å; V404-S406 PolarHBondContact O-N 2.78Å
407	P	57.1	Low	59.5	Low	96 Å²	96	116 Å²	116	62%	0.623	65%	0.65	S	S	*	*			trans	-73.6	137.4	174	30.9	-34.8	0	0	0	110.9	A405 F409	A405-P407 WeakPolarHBondContact O-CD 3.42Å; P407-F409 PolarHBondContact O-N 3.19Å
408	P	59.1	Low	58	Low	115 Å²	115	118.8 Å²	118.8	75%	0.747	66%	0.664	S	S	*	*			trans	-67.9	116.7	170.9	27.9	-32.7	0	0	0	109.7	I410	P408-I410 PolarHBondContact O-N 3.09Å
409	F	52.3	Low	56.7	Low	195 Å²	195	120.4 Å²	120.4	86%	0.855	68%	0.682	S	S	*	*			trans	-69	99.7	173.1	-104	-93	0	0	0	110	P407 H411	P407-F409 PolarHBondContact O-N 3.19Å; F409-H411 PolarHBondContact O-N 3.34Å
410	I	48.6	Very low	55.1	Low	143 Å²	143	123.2 Å²	123.2	73%	0.733	70%	0.697	S	S	*	*			trans	-76.8	115.2	166.3	-61.2	169.1	0	0	0	107.2	P408	P408-I410 PolarHBondContact O-N 3.09Å
411	H	54.7	Low	54.6	Low	162 Å²	162	124.9 Å²	124.9	75%	0.75	71%	0.713	S	S	*	*			trans	-124.9	84.9	171.5	-158.3	-20.1	0	0	0	110.6	F409	F409-H411 PolarHBondContact O-N 3.34Å
412	D	47.4	Very low	53.5	Low	137 Å²	137	126.1 Å²	126.1	73%	0.733	72%	0.724	S	S	*	*			trans	-62.9	138.1	158.3	-75.2	-63.6	0	0	0	109.9
413	Q	50.9	Low	52.4	Low	179 Å²	179	129.1 Å²	129.1	84%	0.836	73%	0.732	S	S	*	*			trans	-165.5	155.1	131.9	-105.7	-171.4	12.2	0	0	111.4
414	P	48.1	Very low	51.2	Low	107 Å²	107	128.5 Å²	128.5	70%	0.695	73%	0.733	S	S	*	*			trans	-94.3	163.1	-164.3	37.2	-36.7	0	0	0	114.8
415	P	42.3	Very low	50.5	Low	125 Å²	125	127.5 Å²	127.5	81%	0.812	74%	0.743	S	S	*	*			trans	-77	142.8	179.2	32.7	-36.4	0	0	0	113
416	S	48.8	Very low	50.1	Low	106 Å²	106	134.7 Å²	134.7	74%	0.741	76%	0.755	S	S	*	*			trans	-161.8	128.2	168.9	-82.3	0	0	0	0	115.8
417	M	47.4	Very low	49.8	Very low	154 Å²	154	134.6 Å²	134.6	76%	0.759	75%	0.754	S	S	*	*			trans	70.5	121	138.3	-64.2	-67.9	119.9	0	0	122.8
418	L	47.6	Very low	49.2	Very low	142 Å²	142	139.4 Å²	139.4	74%	0.743	77%	0.765	S	S	*	*			trans	67.1	132.6	139.5	-56.5	166.3	0	0	0	118.1
419	S	50.6	Low	48.6	Very low	115 Å²	115	138.7 Å²	138.7	80%	0.804	76%	0.763	S	S	*	*			cis	-156.5	156	43.7	-53.4	0	0	0	0	115
420	D	45.8	Very low	48.2	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	77%	0.765	S	S	*	*			trans	-65.6	-179.8	169.1	-73	-67.6	0	0	0	113.8
421	P	60	Low	48	Very low	106 Å²	106	134.1 Å²	134.1	69%	0.688	77%	0.766	S	S	*	*			cis	-155.4	-176.7	25.8	45.1	-22.8	0	0	0	121.5
422	V	50.6	Low	47.6	Very low	129 Å²	129	133.7 Å²	133.7	78%	0.782	77%	0.769	S	S	*	*			trans	74.5	133.9	141.9	150.4	0	0	0	0	118
423	I	50.6	Low	47.5	Very low	144 Å²	144	135 Å²	135	74%	0.738	78%	0.777	S	S	*	*			cis	-148.3	170.4	1.7	-123	168.6	0	0	0	113
424	D	45.5	Very low	47.3	Very low	128 Å²	128	130.6 Å²	130.6	68%	0.684	78%	0.779	S	S	*	*			trans	-46.6	153.5	-172.4	-58.2	-96.3	0	0	0	121.5
425	G	50.3	Low	47.2	Very low	79 Å²	79	131 Å²	131	81%	0.814	78%	0.784	S	S	*	*			trans	-161.7	110.4	159.1	0	0	0	0	0	111.7
426	W	45.7	Very low	47.4	Very low	226 Å²	226	130.5 Å²	130.5	86%	0.856	78%	0.784	S	S	*	*			trans	-83.4	126.9	-162.2	-80.5	11.6	0	0	0	117.2
427	S	43.4	Very low	47.2	Very low	96 Å²	96	130.2 Å²	130.2	67%	0.671	79%	0.788	S	S	*	*				55.2	124.6	124.4	-59.2	0	0	0	0	123.8
428	K	44.1	Very low	47.2	Very low	196 Å²	196	127.4 Å²	127.4	85%	0.852	79%	0.789	S	S	*	*				94.4	148	127	-89.1	179.9	175.1	174.8	0	123
429	S	46.3	Very low	47.6	Very low	100 Å²	100	126 Å²	126	70%	0.699	79%	0.788	S	S	*	*			trans	72.9	105.2	157	44.6	0	0	0	0	121
430	N	42.7	Very low	47.3	Very low	169 Å²	169	125.8 Å²	125.8	90%	0.904	79%	0.787	S	S	*	*				42.8	132.4	117.9	-48.3	8.3	0	0	0	120
431	G	44.2	Very low	47.2	Very low	74 Å²	74	125 Å²	125	76%	0.763	79%	0.787	S	S	*	*			trans	169	115.3	159.5	0	0	0	0	0	113.9
432	D	47.7	Very low	46.5	Very low	152 Å²	152	125.1 Å²	125.1	81%	0.813	79%	0.791	S	S	*	*			trans	-65.4	167.5	-176.2	-51.6	-65.6	0	0	0	116.3
433	D	45.8	Very low	46.1	Very low	166 Å²	166	124.8 Å²	124.8	89%	0.888	79%	0.789	S	S	*	*			trans	47.7	110	146.5	-64.8	-18.8	0	0	0	121.3
434	G	45	Very low	45.7	Very low	86 Å²	86	123 Å²	123	89%	0.887	79%	0.789	S	S	*	*			trans	-148.9	96.8	166.1	0	0	0	0	0	112.1
435	S	47	Very low	45.6	Very low	114 Å²	114	128.4 Å²	128.4	80%	0.797	80%	0.8	S	S	*	*			trans	-98.3	161.9	-169.6	-171.3	0	0	0	0	114.7
436	S	46.4	Very low	45.3	Very low	115 Å²	115	129 Å²	129	80%	0.804	79%	0.792	S	S	*	*			trans	93.2	162.5	150.9	83.4	0	0	0	0	121.3
437	A	45.3	Very low	45.3	Very low	100 Å²	100	123.6 Å²	123.6	83%	0.826	79%	0.789	S	S	*	*			trans	81.9	107.2	168.2	0	0	0	0	0	120.2
438	A	45.7	Very low	45.1	Very low	96 Å²	96	124.5 Å²	124.5	79%	0.793	80%	0.795	S	S	*	*			trans	-120.3	-152.4	153.9	0	0	0	0	0	107.2
439	P	57	Low	45.6	Very low	112 Å²	112	121.3 Å²	121.3	73%	0.727	79%	0.794	S	S	*	*			cis	-126.4	166.3	-38.9	37.9	-24.1	0	0	0	113.3
440	S	44.6	Very low	45.1	Very low	110 Å²	110	122.4 Å²	122.4	77%	0.769	80%	0.802	S	S	*	*			trans	-162.3	111.5	162	-50	0	0	0	0	109.6
441	T	43.9	Very low	45.3	Very low	127 Å²	127	119.1 Å²	119.1	78%	0.779	80%	0.798	S	S	*	*				78.2	128.5	68.7	63.4	0	0	0	0	117.5
442	S	44	Very low	45.1	Very low	108 Å²	108	123.1 Å²	123.1	76%	0.755	80%	0.802	S	S	*	*			trans	116.7	105.7	137.4	75.7	0	0	0	0	122
443	T	42.4	Very low	45	Very low	123 Å²	123	122.5 Å²	122.5	76%	0.755	80%	0.803	S	S	*	*				83.6	92.5	114.8	-52.2	0	0	0	0	122.7
444	S	42.4	Very low	44.7	Very low	105 Å²	105	120.1 Å²	120.1	73%	0.734	80%	0.8	S	S	*	*				64.1	127.3	120.4	-50.7	0	0	0	0	124.3
445	R	43.1	Very low	44.8	Very low	243 Å²	243	122.7 Å²	122.7	92%	0.917	80%	0.798	S	S	*	*			trans	165	157.3	132.3	-94.7	166.5	171.8	-148.8	-2.8	111.1
446	S	43.8	Very low	44.5	Very low	91 Å²	91	121.8 Å²	121.8	64%	0.636	80%	0.797	S	S	*	*			cis	-176.7	158.1	-31.7	51.5	0	0	0	0	110.8
447	S	46.3	Very low	44.5	Very low	113 Å²	113	127 Å²	127	79%	0.79	80%	0.799	S	S	*	*			trans	82.1	113.5	153.5	-48.4	0	0	0	0	121.1
448	S	39.9	Very low	44.9	Very low	114 Å²	114	129.4 Å²	129.4	80%	0.797	79%	0.793	S	S	*	*			trans	-81.5	173.1	144.7	-45.8	0	0	0	0	110.3
449	P	53.2	Low	45.1	Very low	130 Å²	130	130.9 Å²	130.9	84%	0.844	80%	0.795	S	S	*	*				-150.3	171.6	101.4	39.5	-23.3	0	0	0	115.9
450	S	36.9	Very low	45	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	80%	0.801	S	S	*	*			trans	-88.4	159.1	175.7	-44.8	0	0	0	0	113.3
451	A	47.7	Very low	45	Very low	99 Å²	99	133 Å²	133	82%	0.818	80%	0.799	S	S	*	*			trans	-146.3	142	164.1	0	0	0	0	0	111.8
452	N	40.1	Very low	45.1	Very low	159 Å²	159	133.7 Å²	133.7	85%	0.85	80%	0.803	S	S	*	*			trans	-86.3	157.9	174.5	-64.7	-37.4	0	0	0	111.4
453	V	45.1	Very low	45.1	Very low	139 Å²	139	132.4 Å²	132.4	84%	0.842	81%	0.807	S	S	*	*			trans	-153.6	139.9	137.8	134.3	0	0	0	0	108.9
454	S	38.7	Very low	45.1	Very low	116 Å²	116	130.8 Å²	130.8	81%	0.811	82%	0.815	S	S	*	*			trans	-112.6	139.5	178.4	-50.9	0	0	0	0	110.6
455	V	47.2	Very low	45.4	Very low	139 Å²	139	129.7 Å²	129.7	84%	0.842	82%	0.819	S	S	*	*			trans	-137.8	134.9	163.2	-177	0	0	0	0	108.2
456	A	41.5	Very low	45.7	Very low	95 Å²	95	123.7 Å²	123.7	79%	0.785	82%	0.815	S	S	*	*			trans	-113.5	156.7	-176.4	0	0	0	0	0	111.7
457	R	46.5	Very low	46.1	Very low	226 Å²	226	125.3 Å²	125.3	85%	0.853	82%	0.823	S	S	*	*			trans	-155.1	112.5	157.4	-135.4	169.6	-179.7	159.1	1.2	114.2
458	E	53.4	Low	46.8	Very low	149 Å²	149	125.3 Å²	125.3	70%	0.696	82%	0.82	S	S	*	*			trans	39.5	122.9	144.8	-63.7	174.2	-175.8	0	0	121.8
459	P	49.6	Very low	47.1	Very low	127 Å²	127	125.7 Å²	125.7	83%	0.825	82%	0.818	S	S	*	*			trans	-92.8	129.6	148.4	34.2	-26.6	0	0	0	111.2
460	L	55.7	Low	46.6	Very low	165 Å²	165	124.7 Å²	124.7	86%	0.864	81%	0.814	S	S	*	*			trans	-78.5	152.5	167.1	-98.1	77.1	0	0	0	111.2
461	S	44.1	Very low	47	Very low	102 Å²	102	126 Å²	126	71%	0.713	82%	0.816	S	S	*	*			trans	-138.8	151.7	-177.8	-167.3	0	0	0	0	112.3
462	T	45.4	Very low	46.7	Very low	141 Å²	141	125.5 Å²	125.5	87%	0.865	81%	0.813	S	S	*	*			trans	51.7	111	162.1	49.2	0	0	0	0	119.5
463	G	44.1	Very low	47	Very low	82 Å²	82	127 Å²	127	85%	0.845	82%	0.815	S	S	*	*			trans	-164	120.6	158.9	0	0	0	0	0	109.8
464	G	42.2	Very low	46.9	Very low	89 Å²	89	129.4 Å²	129.4	92%	0.918	82%	0.816	S	S	*	*			trans	-96	162.4	-170.6	0	0	0	0	0	114.9
465	G	48.2	Very low	47.2	Very low	81 Å²	81	127.5 Å²	127.5	84%	0.835	82%	0.815	S	S	*	*			trans	-152.3	132.8	171.9	0	0	0	0	0	111.4
466	S	51.2	Low	46.8	Very low	117 Å²	117	127.2 Å²	127.2	82%	0.818	81%	0.814	S	S	*	*			trans	-88.9	152.5	-173	-54.5	0	0	0	0	113.3
467	P	50.5	Low	46.7	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	82%	0.819	S	S	*	*			trans	-87.8	155.6	174.3	35.9	-35.2	0	0	0	113
468	P	60.9	Low	46.3	Very low	113 Å²	113	128.3 Å²	128.3	73%	0.734	81%	0.814	S	S	*	*			trans	-123.7	121	156.2	13.5	8.5	0	0	0	113.8
469	T	46.5	Very low	45.6	Very low	123 Å²	123	127.9 Å²	127.9	76%	0.755	82%	0.816	S	S	*	*			trans	30.4	108.2	134.3	55	0	0	0	0	120.9
470	S	42.7	Very low	45.2	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	81%	0.81	S	S	*	*				33.9	121.1	122.2	62.9	0	0	0	0	121.2
471	V	45.4	Very low	44.4	Very low	150 Å²	150	125.2 Å²	125.2	91%	0.909	81%	0.807	S	S	*	*			trans	-135.5	147.7	134.5	-172	0	0	0	0	107.2
472	A	42.1	Very low	44.2	Very low	89 Å²	89	128.5 Å²	128.5	74%	0.736	82%	0.817	S	S	*	*			trans	-127	142.9	172.9	0	0	0	0	0	109.4
473	E	45.2	Very low	44.1	Very low	192 Å²	192	127.4 Å²	127.4	90%	0.897	82%	0.815	S	S	*	*			trans	-161.9	173.5	155.3	-122.2	164.7	-149.2	0	0	111.8
474	H	43.1	Very low	44.6	Very low	188 Å²	188	127.7 Å²	127.7	87%	0.87	80%	0.8	S	S	*	*			trans	-86.6	149.6	-161.1	-67.1	-102.6	0	0	0	114.3
475	G	45.5	Very low	45.6	Very low	76 Å²	76	128.2 Å²	128.2	78%	0.784	78%	0.782	S	S	*	*			trans	-153.5	85.8	171.2	0	0	0	0	0	111.7
476	T	38.7	Very low	46.2	Very low	134 Å²	134	133.3 Å²	133.3	82%	0.822	78%	0.776	S	S	*	*			trans	-75.4	123.6	169.8	-50.8	0	0	0	0	109
477	F	40.7	Very low	46.3	Very low	206 Å²	206	136 Å²	136	90%	0.904	78%	0.776	S	S	*	*			trans	-139	150.2	162.1	-121.2	-89.6	0	0	0	110.1
478	D	36.9	Very low	46.9	Very low	138 Å²	138	134 Å²	134	74%	0.738	77%	0.769	S	S	*	*			trans	-121.6	-179.8	-169.6	-156.6	-19.1	0	0	0	109.4
479	L	39.6	Very low	46.6	Very low	140 Å²	140	135.5 Å²	135.5	73%	0.733	77%	0.768	S	S	*	*			trans	86.8	108.4	169	-49.6	-179.1	0	0	0	118.6
480	C	39.9	Very low	47	Very low	103 Å²	103	136.3 Å²	136.3	70%	0.696	77%	0.767	S	S	*	*				76.3	117.7	121.6	-62.9	0	0	0	0	122.2
481	T	39.4	Very low	48	Very low	133 Å²	133	134.7 Å²	134.7	82%	0.816	75%	0.754	S	S	*	*			trans	57	94.7	137.8	54.7	0	0	0	0	119.3
482	D	41	Very low	49.4	Very low	170 Å²	170	131.6 Å²	131.6	91%	0.909	74%	0.737	S	S	*	*			trans	-104.4	125.3	140.8	-87.8	-48.3	0	0	0	109.2
483	S	43.3	Very low	50.1	Low	119 Å²	119	133.5 Å²	133.5	83%	0.832	73%	0.734	S	S	*	*			trans	-95.4	114	174.5	-177	0	0	0	0	109.2	D485	S483-D485 PolarHBondContact O-N 3.36Å
484	V	54.3	Low	51	Low	88 Å²	88	129.8 Å²	129.8	53%	0.533	72%	0.72	S	S	.	*			trans	-69.8	116.6	179.7	178.8	0	0	0	0	110	W486	V484-W486 HydrophobicContact CB-CZ2 4.43Å; V484-W486 HydrophobicContact CG1-CD2 4.08Å; V484-W486 HydrophobicContact CG1-CG 4.42Å; V484-W486 HydrophobicContact CG1-CZ2 4.08Å; V484-W486 PolarHBondContact O-N 2.94Å; V484-W486 VanDerWaalsContact O-N 3.13Å; V484-W486 PolarHBondContact O-NE1 2.89Å
485	D	62.9	Low	52	Low	99 Å²	99	127.6 Å²	127.6	53%	0.529	71%	0.71	S	S	.	*			trans	-78.2	92.7	172.8	-176.6	2.1	0	0	0	110.9	S483 Q487 A488	S483-D485 PolarHBondContact O-N 3.36Å; D485-Q487 PolarHBondContact O-N 3.36Å; D485-Q487 WeakPolarHBondContact OD1-CB 3.35Å; D485-Q487 PolarHBondContact OD1-N 3.19Å; D485-A488 PolarHBondContact O-N 3.12Å
486	W	61.5	Low	52.2	Low	189 Å²	189	129.6 Å²	129.6	72%	0.716	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-67.2	-16.4	176.8	-60.2	93.5	0	0	0	113.7	V484 A488 M489	V484-W486 HydrophobicContact CB-CZ2 4.43Å; V484-W486 HydrophobicContact CG1-CD2 4.08Å; V484-W486 HydrophobicContact CG1-CG 4.42Å; V484-W486 HydrophobicContact CG1-CZ2 4.08Å; V484-W486 PolarHBondContact O-N 2.94Å; V484-W486 VanDerWaalsContact O-N 3.13Å; V484-W486 PolarHBondContact O-NE1 2.89Å; W486-A488 VanDerWaalsContact C-N 3.26Å; W486-A488 PolarHBondContact O-N 3.26Å; W486-M489 PolarHBondContact O-N 3.27Å
487	Q	52.7	Low	52.7	Low	174 Å²	174	129.4 Å²	129.4	81%	0.813	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-74.4	-19.1	177.4	-62	-169.3	-79.6	0	0	112.1	D485 M489	D485-Q487 PolarHBondContact O-N 3.36Å; D485-Q487 WeakPolarHBondContact OD1-CB 3.35Å; D485-Q487 PolarHBondContact OD1-N 3.19Å; Q487-M489 VanDerWaalsContact C-N 3.29Å; Q487-M489 PolarHBondContact O-N 3.27Å
488	A	61.9	Low	53.3	Low	81 Å²	81	122.9 Å²	122.9	67%	0.669	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-77.1	-6.1	174.1	0	0	0	0	0	114.6	D485 W486	D485-A488 PolarHBondContact O-N 3.12Å; W486-A488 VanDerWaalsContact C-N 3.26Å; W486-A488 PolarHBondContact O-N 3.26Å
489	M	54.8	Low	53.8	Low	145 Å²	145	123.5 Å²	123.5	71%	0.714	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-107.2	3	-176.3	-72.6	-157.5	72.2	0	0	115.4	W486 Q487	W486-M489 PolarHBondContact O-N 3.27Å; Q487-M489 VanDerWaalsContact C-N 3.29Å; Q487-M489 PolarHBondContact O-N 3.27Å
490	L	56	Low	54.3	Low	140 Å²	140	124.1 Å²	124.1	73%	0.733	69%	0.686	S	S	*	*	S	Bend	trans	-101.5	135.2	177	-68	174	0	0	0	111.2
491	P	64.2	Low	54.4	Low	75 Å²	75	126 Å²	126	49%	0.487	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-67.4	156.3	173.8	29.6	-34.8	0	0	0	111.3
492	P	73.7	Confident	54.7	Low	84 Å²	84	127.1 Å²	127.1	55%	0.545	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-57.6	139.2	179.1	-24.4	35	0	0	0	112.9	D494 E495	P492-D494 PolarHBondContact O-N 3.13Å; P492-E495 PolarHBondContact O-N 3.32Å
493	I	57.7	Low	54.8	Low	130 Å²	130	125 Å²	125	67%	0.667	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-56.5	-26.8	-177.2	-69.9	173.2	0	0	0	112.7	E495 L496	I493-E495 VanDerWaalsContact C-N 3.32Å; I493-E495 PolarHBondContact O-N 3.02Å; I493-L496 PolarHBondContact O-N 2.92Å
494	D	64.5	Low	55	Low	114 Å²	114	125.8 Å²	125.8	61%	0.61	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-73.8	-18.8	-178.5	-60.4	-54.4	0	0	0	114	P492 L496 K497	P492-D494 PolarHBondContact O-N 3.13Å; D494-L496 VanDerWaalsContact C-N 3.34Å; D494-K497 IonicContact OD1-NZ 2.68Å; D494-K497 PolarHBondContact OD1-NZ 3.4Å
495	E	62.9	Low	54.3	Low	141 Å²	141	129.2 Å²	129.2	66%	0.659	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-73.4	-27.1	171.1	-64.3	-169.1	150.4	0	0	112.2	P492 I493	P492-E495 PolarHBondContact O-N 3.32Å; I493-E495 VanDerWaalsContact C-N 3.32Å; I493-E495 PolarHBondContact O-N 3.02Å
496	L	49	Very low	53.6	Low	118 Å²	118	127.9 Å²	127.9	62%	0.618	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-80.2	-12.5	-179.1	-85.6	163.8	0	0	0	114.2	I493 D494	I493-L496 PolarHBondContact O-N 2.92Å; D494-L496 VanDerWaalsContact C-N 3.34Å
497	K	50	Low	52.7	Low	130 Å²	130	125 Å²	125	57%	0.565	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-78.1	-23.3	178.3	-71	174.3	-174.7	155.5	0	113.5	D494 L499	D494-K497 IonicContact OD1-NZ 2.68Å; D494-K497 PolarHBondContact OD1-NZ 3.4Å; K497-L499 PolarHBondContact O-N 3.06Å; K497-L499 VanDerWaalsContact O-N 3.14Å
498	G	54	Low	52.4	Low	69 Å²	69	125.1 Å²	125.1	71%	0.711	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-75.1	4.8	-174.9	0	0	0	0	0	116.3
499	L	47.3	Very low	51.6	Low	151 Å²	151	130 Å²	130	79%	0.791	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-122	6.3	-167.9	-101.5	165.2	0	0	0	115.1	K497	K497-L499 PolarHBondContact O-N 3.06Å; K497-L499 VanDerWaalsContact O-N 3.14Å
500	L	49.1	Very low	51.6	Low	153 Å²	153	134.1 Å²	134.1	80%	0.801	73%	0.727	S	S	*	*	S	Bend	trans	-122.6	-14.1	-174.8	-94.1	157.3	0	0	0	115.5
501	D	41.4	Very low	51.5	Low	143 Å²	143	133.2 Å²	133.2	77%	0.765	72%	0.722	S	S	*	*			trans	-101.7	102.7	176.5	-70.9	-48.5	0	0	0	111
502	N	45.9	Very low	51.3	Low	156 Å²	156	134.6 Å²	134.6	83%	0.834	73%	0.726	S	S	*	*			trans	-148.9	133.2	157.8	-95.1	-92.2	0	0	0	109.3
503	D	44.7	Very low	50.8	Low	127 Å²	127	134.7 Å²	134.7	68%	0.679	73%	0.728	S	S	*	*			trans	-48.7	164.7	-175.7	-63.6	-70.5	0	0	0	116.1
504	V	46.6	Very low	50.9	Low	135 Å²	135	131.5 Å²	131.5	82%	0.818	72%	0.721	S	S	*	*			cis	-149.3	146	44.5	176.4	0	0	0	0	112.8
505	Q	40.5	Very low	50.8	Low	159 Å²	159	129.8 Å²	129.8	74%	0.743	71%	0.712	S	S	*	*			trans	-75.9	155.3	-179.6	-55.1	85.4	1.8	0	0	114.9
506	G	48.2	Very low	50.6	Low	72 Å²	72	132.6 Å²	132.6	74%	0.742	72%	0.717	S	S	*	*			trans	-148.1	120.5	159.3	0	0	0	0	0	110.2
507	P	41.1	Very low	51	Low	129 Å²	129	135.9 Å²	135.9	84%	0.838	72%	0.721	S	S	*	*			trans	-88.4	142.8	-170.8	33.4	-34.7	0	0	0	113.4
508	L	47.5	Very low	51.7	Low	175 Å²	175	132.6 Å²	132.6	92%	0.916	72%	0.715	S	S	*	*			trans	-149.8	114.7	165.4	-156.2	79.3	0	0	0	111.5
509	E	43.9	Very low	52	Low	184 Å²	184	137 Å²	137	86%	0.86	71%	0.709	S	S	*	*			trans	-80.1	136.3	173.4	-59.1	-177.6	134.4	0	0	111.6
510	R	55.4	Low	52.7	Low	232 Å²	232	135.4 Å²	135.4	88%	0.875	70%	0.698	S	S	*	*			trans	179.4	144.3	135.1	-100.6	158.8	-166.6	175.5	5.2	115.2
511	D	54.3	Low	53.5	Low	120 Å²	120	134 Å²	134	64%	0.642	68%	0.682	S	S	*	*			trans	60.4	61.8	152.3	-64.4	-54.7	0	0	0	120.6	S513	D511-S513 PolarHBondContact O-N 2.91Å; D511-S513 VanDerWaalsContact O-N 3.11Å
512	D	60.1	Low	54.2	Low	105 Å²	105	132 Å²	132	56%	0.561	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-9.4	167.9	-114.1	-31.3	0	0	0	115.6	A514 N515 R516	D512-A514 PolarHBondContact O-N 2.88Å; D512-N515 PolarHBondContact O-N 2.93Å; D512-R516 PolarHBondContact O-N 3.36Å
513	S	62.3	Low	54.8	Low	85 Å²	85	133.1 Å²	133.1	59%	0.594	66%	0.663	S	S	*	*	H	α-helix	trans	-63.8	-41.4	-175	60.1	0	0	0	0	112.6	D511 R516	D511-S513 PolarHBondContact O-N 2.91Å; D511-S513 VanDerWaalsContact O-N 3.11Å; S513-R516 PolarHBondContact O-N 2.83Å
514	A	60	Low	55.4	Low	63 Å²	63	131.4 Å²	131.4	52%	0.521	65%	0.654	S	S	.	*	H	α-helix	trans	-64.8	-39.2	176.5	0	0	0	0	0	112	D512 R516 W517 S518	D512-A514 PolarHBondContact O-N 2.88Å; A514-R516 PolarHBondContact O-N 2.89Å; A514-W517 PolarHBondContact O-N 3.44Å; A514-S518 PolarHBondContact O-N 3.18Å; A514-S518 VanDerWaalsContact O-N 3.12Å; A514-S518 PolarHBondContact O-OG 3.39Å
515	N	61.9	Low	56.1	Low	78 Å²	78	128.4 Å²	128.4	42%	0.417	63%	0.631	S	S	.	*	H	α-helix	trans	-62.1	-39.5	179.6	-85.4	-29.2	0	0	0	112.5	D512 W517 S518 R519	D512-N515 PolarHBondContact O-N 2.93Å; N515-W517 PolarHBondContact O-N 3.32Å; N515-S518 PolarHBondContact O-N 3.33Å; N515-R519 WeakPolarHBondContact O-CB 3.43Å; N515-R519 VanDerWaalsContact O-CG 3.26Å; N515-R519 WeakPolarHBondContact O-CG 3.31Å; N515-R519 PolarHBondContact O-N 2.98Å
516	R	59.1	Low	57.2	Low	200 Å²	200	124.3 Å²	124.3	76%	0.755	62%	0.617	S	S	*	*	H	α-helix	trans	-62.9	-41	177	-69.2	-168.5	-177.7	-154.6	1.4	112.5	D512 S513 A514 R519 H520	D512-R516 PolarHBondContact O-N 3.36Å; S513-R516 PolarHBondContact O-N 2.83Å; A514-R516 PolarHBondContact O-N 2.89Å; R516-R519 PolarHBondContact O-N 3.2Å; R516-H520 PolarHBondContact O-N 3.12Å; R516-H520 VanDerWaalsContact O-N 3.08Å
517	W	57.8	Low	58.2	Low	187 Å²	187	125.2 Å²	125.2	71%	0.708	61%	0.608	S	S	*	*	H	α-helix	trans	-67.9	-43.4	-179.9	-152.8	71.8	0	0	0	111.5	A514 N515 H520 R521	A514-W517 PolarHBondContact O-N 3.44Å; N515-W517 PolarHBondContact O-N 3.32Å; W517-H520 PolarHBondContact O-N 3.4Å; W517-R521 WeakPolarHBondContact O-CB 3.45Å; W517-R521 PolarHBondContact O-N 2.92Å
518	S	65.6	Low	59.4	Low	62 Å²	62	123 Å²	123	43%	0.434	59%	0.586	S	S	.	*	H	α-helix	trans	-60.4	-45.1	173.3	-62.6	0	0	0	0	112.6	A514 N515 R521 L522	A514-S518 PolarHBondContact O-N 3.18Å; A514-S518 VanDerWaalsContact O-N 3.12Å; A514-S518 PolarHBondContact O-OG 3.39Å; N515-S518 PolarHBondContact O-N 3.33Å; S518-R521 PolarHBondContact O-N 3.25Å; S518-L522 WeakPolarHBondContact O-CG 3.34Å; S518-L522 PolarHBondContact O-N 3.01Å
519	R	59.8	Low	60.4	Low	160 Å²	160	123.4 Å²	123.4	60%	0.604	58%	0.576	S	S	*	*	H	α-helix	trans	-64	-42.2	179	-71.7	176.4	-162.9	-175	9.5	112.9	N515 R516 R521 L522 R523	N515-R519 WeakPolarHBondContact O-CB 3.43Å; N515-R519 VanDerWaalsContact O-CG 3.26Å; N515-R519 WeakPolarHBondContact O-CG 3.31Å; N515-R519 PolarHBondContact O-N 2.98Å; R516-R519 PolarHBondContact O-N 3.2Å; R519-R521 VanDerWaalsContact C-N 3.35Å; R519-L522 PolarHBondContact O-N 3.25Å; R519-R523 PolarHBondContact O-N 2.88Å; R519-R523 VanDerWaalsContact O-N 3.14Å
520	H	60.9	Low	61.7	Low	119 Å²	119	119.7 Å²	119.7	55%	0.551	56%	0.558	S	S	*	*	H	α-helix	trans	-67.8	-37.9	176.6	-168.3	-12.1	0	0	0	111.6	R516 W517 R523 N524	R516-H520 PolarHBondContact O-N 3.12Å; R516-H520 VanDerWaalsContact O-N 3.08Å; W517-H520 PolarHBondContact O-N 3.4Å; H520-R523 PolarHBondContact O-N 3.37Å; H520-N524 PolarHBondContact O-N 3.5Å
521	R	66.6	Low	62.6	Low	123 Å²	123	113.6 Å²	113.6	46%	0.464	54%	0.543	S	S	.	.	H	α-helix	trans	-62.2	-46.5	175.4	-179.9	171.3	172.6	-176.1	-8.4	112.1	W517 S518 R519 R523 N524 E525	W517-R521 WeakPolarHBondContact O-CB 3.45Å; W517-R521 PolarHBondContact O-N 2.92Å; S518-R521 PolarHBondContact O-N 3.25Å; R519-R521 VanDerWaalsContact C-N 3.35Å; R521-R523 VanDerWaalsContact C-N 3.33Å; R521-R523 PolarHBondContact O-N 2.84Å; R521-N524 PolarHBondContact O-N 2.88Å; R521-N524 VanDerWaalsContact O-N 3.12Å; R521-E525 WeakPolarHBondContact CG-OE1 3.48Å; R521-E525 IonicContact CZ-OE1 2.64Å; R521-E525 IonicContact NE-OE1 2.66Å; R521-E525 PolarHBondContact NE-OE1 3.49Å; R521-E525 IonicContact NH2-OE1 2.66Å; R521-E525 PolarHBondContact NH2-OE1 3Å; R521-E525 WeakPolarHBondContact O-CG 3.35Å; R521-E525 PolarHBondContact O-N 2.95Å
522	L	55.8	Low	63.5	Low	101 Å²	101	111.1 Å²	111.1	53%	0.529	53%	0.529	S	S	.	.	H	α-helix	trans	-58	-41.8	175.3	-75.3	166.5	0	0	0	112.2	S518 R519 N524 E525 V526	S518-L522 WeakPolarHBondContact O-CG 3.34Å; S518-L522 PolarHBondContact O-N 3.01Å; R519-L522 PolarHBondContact O-N 3.25Å; L522-N524 VanDerWaalsContact C-N 3.33Å; L522-N524 PolarHBondContact O-N 3.29Å; L522-E525 PolarHBondContact O-N 2.99Å; L522-V526 WeakPolarHBondContact O-CG2 3.46Å; L522-V526 PolarHBondContact O-N 3.44Å
523	R	58.5	Low	64	Low	179 Å²	179	109.9 Å²	109.9	68%	0.675	52%	0.522	S	S	*	.	H	α-helix	trans	-57.7	-43.1	174.1	-78.1	-174.6	169.6	-168.6	-5.2	112.7	R519 H520 R521 V526 V527	R519-R523 PolarHBondContact O-N 2.88Å; R519-R523 VanDerWaalsContact O-N 3.14Å; H520-R523 PolarHBondContact O-N 3.37Å; R521-R523 VanDerWaalsContact C-N 3.33Å; R521-R523 PolarHBondContact O-N 2.84Å; R523-V526 PolarHBondContact O-N 3.36Å; R523-V527 WeakPolarHBondContact O-CG2 3.47Å; R523-V527 PolarHBondContact O-N 3.37Å; R523-V527 VanDerWaalsContact O-N 3.16Å
524	N	57.8	Low	64.7	Low	92 Å²	92	109.8 Å²	109.8	49%	0.492	52%	0.515	S	S	.	.	H	α-helix	trans	-70	-33.6	178.4	-67.7	-9.9	0	0	0	112.3	H520 R521 L522 Q528	H520-N524 PolarHBondContact O-N 3.5Å; R521-N524 PolarHBondContact O-N 2.88Å; R521-N524 VanDerWaalsContact O-N 3.12Å; L522-N524 VanDerWaalsContact C-N 3.33Å; L522-N524 PolarHBondContact O-N 3.29Å; N524-Q528 PolarHBondContact O-N 2.87Å
525	E	61.1	Low	65.4	Low	71 Å²	71	112.7 Å²	112.7	33%	0.332	51%	0.514	S	S	.	.	H	α-helix	trans	-69.5	-40.7	175.5	-71.2	169.2	177.9	0	0	110.7	R521 L522 Q528 W529	R521-E525 WeakPolarHBondContact CG-OE1 3.48Å; R521-E525 IonicContact CZ-OE1 2.64Å; R521-E525 IonicContact NE-OE1 2.66Å; R521-E525 PolarHBondContact NE-OE1 3.49Å; R521-E525 IonicContact NH2-OE1 2.66Å; R521-E525 PolarHBondContact NH2-OE1 3Å; R521-E525 WeakPolarHBondContact O-CG 3.35Å; R521-E525 PolarHBondContact O-N 2.95Å; L522-E525 PolarHBondContact O-N 2.99Å; E525-Q528 PolarHBondContact O-N 2.84Å; E525-W529 PolarHBondContact O-N 3.17Å
526	V	63.3	Low	66.1	Low	74 Å²	74	112 Å²	112	45%	0.448	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-44	174	168.4	0	0	0	0	112.8	L522 R523 Q528 W529 H530	L522-V526 WeakPolarHBondContact O-CG2 3.46Å; L522-V526 PolarHBondContact O-N 3.44Å; R523-V526 PolarHBondContact O-N 3.36Å; V526-Q528 PolarHBondContact O-N 3.35Å; V526-W529 WeakPolarHBondContact O-CB 3.46Å; V526-W529 PolarHBondContact O-N 3.13Å; V526-W529 VanDerWaalsContact O-N 3.08Å; V526-H530 PolarHBondContact O-CD2 3.03Å; V526-H530 VanDerWaalsContact O-CD2 3.25Å; V526-H530 PolarHBondContact O-N 2.79Å
527	V	69.3	Low	67.2	Low	91 Å²	91	106.7 Å²	106.7	55%	0.552	50%	0.497	S	S	*	.	H	α-helix	trans	-60.8	-35.3	175.6	172.5	0	0	0	0	111.7	R523 H530 L531	R523-V527 WeakPolarHBondContact O-CG2 3.47Å; R523-V527 PolarHBondContact O-N 3.37Å; R523-V527 VanDerWaalsContact O-N 3.16Å; V527-H530 PolarHBondContact O-N 2.99Å; V527-L531 PolarHBondContact O-N 3.38Å
528	Q	67.1	Low	68.4	Low	82 Å²	82	102.2 Å²	102.2	38%	0.383	48%	0.484	S	S	.	.	H	α-helix	trans	-72	-29.5	175.9	-168.4	167.6	-4.2	0	0	112.6	N524 E525 V526 L532	N524-Q528 PolarHBondContact O-N 2.87Å; E525-Q528 PolarHBondContact O-N 2.84Å; V526-Q528 PolarHBondContact O-N 3.35Å; Q528-L532 PolarHBondContact O-N 3.32Å
529	W	67.9	Low	69.1	Low	183 Å²	183	101.2 Å²	101.2	69%	0.693	47%	0.474	S	S	*	.	H	α-helix	trans	-69.4	-40.5	171.1	-76.2	110.3	0	0	0	113.1	E525 V526 L531 L532 D533	E525-W529 PolarHBondContact O-N 3.17Å; V526-W529 WeakPolarHBondContact O-CB 3.46Å; V526-W529 PolarHBondContact O-N 3.13Å; V526-W529 VanDerWaalsContact O-N 3.08Å; W529-L531 VanDerWaalsContact C-N 3.33Å; W529-L531 PolarHBondContact O-N 3.4Å; W529-L532 HydrophobicContact CE3-CD1 4.22Å; W529-L532 HydrophobicContact CZ3-CD1 4.46Å; W529-L532 PolarHBondContact O-N 2.97Å; W529-L532 VanDerWaalsContact O-N 3.13Å; W529-D533 PolarHBondContact O-N 3.42Å
530	H	72.1	Confident	70.2	Confident	106 Å²	106	96 Å²	96	49%	0.491	46%	0.462	S	S	.	.	H	α-helix	trans	-58.5	-43.2	176.2	-76.9	-68.6	0	0	0	112.3	V526 V527 L532 D533 D534	V526-H530 PolarHBondContact O-CD2 3.03Å; V526-H530 VanDerWaalsContact O-CD2 3.25Å; V526-H530 PolarHBondContact O-N 2.79Å; V527-H530 PolarHBondContact O-N 2.99Å; H530-L532 VanDerWaalsContact C-N 3.31Å; H530-L532 PolarHBondContact O-N 3.36Å; H530-D533 PolarHBondContact O-N 3.37Å; H530-D534 PolarHBondContact O-N 2.8Å
531	L	72.9	Confident	71.1	Confident	105 Å²	105	93.6 Å²	93.6	55%	0.55	45%	0.453	S	S	.	.	H	α-helix	trans	-59.9	-39	175.5	-73.2	166.8	0	0	0	112.7	V527 W529 Y535	V527-L531 PolarHBondContact O-N 3.38Å; W529-L531 VanDerWaalsContact C-N 3.33Å; W529-L531 PolarHBondContact O-N 3.4Å; L531-Y535 VanDerWaalsContact O-CD2 3.24Å; L531-Y535 WeakPolarHBondContact O-CD2 3.29Å; L531-Y535 PolarHBondContact O-N 3.02Å; L531-Y535 VanDerWaalsContact O-N 3.12Å
532	L	72.7	Confident	71.7	Confident	67 Å²	67	89.4 Å²	89.4	35%	0.351	44%	0.439	S	S	.	.	H	α-helix	trans	-69.9	-37.4	176.2	-72.5	167.9	0	0	0	112.3	Q528 W529 H530 S536	Q528-L532 PolarHBondContact O-N 3.32Å; W529-L532 HydrophobicContact CE3-CD1 4.22Å; W529-L532 HydrophobicContact CZ3-CD1 4.46Å; W529-L532 PolarHBondContact O-N 2.97Å; W529-L532 VanDerWaalsContact O-N 3.13Å; H530-L532 VanDerWaalsContact C-N 3.31Å; H530-L532 PolarHBondContact O-N 3.36Å; L532-S536 WeakPolarHBondContact O-CB 3.5Å; L532-S536 PolarHBondContact O-N 3.39Å
533	D	71.8	Confident	72.7	Confident	79 Å²	79	89.3 Å²	89.3	42%	0.422	44%	0.436	S	S	.	.	H	α-helix	trans	-67.1	-36.9	176.3	-170.9	46.5	0	0	0	111.7	W529 H530 S536 K537	W529-D533 PolarHBondContact O-N 3.42Å; H530-D533 PolarHBondContact O-N 3.37Å; D533-S536 WeakPolarHBondContact O-CB 3.33Å; D533-S536 PolarHBondContact O-N 3.01Å; D533-K537 VanDerWaalsContact CG-CE 3.45Å; D533-K537 VanDerWaalsContact O-CG 3.31Å; D533-K537 WeakPolarHBondContact O-CG 3.48Å; D533-K537 PolarHBondContact O-N 2.94Å; D533-K537 WeakPolarHBondContact OD2-CE 3.38Å; D533-K537 IonicContact OD2-NZ 2.76Å; D533-K537 PolarHBondContact OD2-NZ 3.45Å
534	D	77.3	Confident	73.7	Confident	84 Å²	84	89 Å²	89	45%	0.449	44%	0.435	S	S	.	.	H	α-helix	trans	-70.8	-40	175.2	-67	-21.5	0	0	0	112.6	H530 S536 K537 Q538	H530-D534 PolarHBondContact O-N 2.8Å; D534-S536 VanDerWaalsContact C-N 3.28Å; D534-S536 PolarHBondContact O-N 3.37Å; D534-K537 PolarHBondContact O-N 3.02Å; D534-K537 IonicContact OD1-NZ 3.45Å; D534-K537 PolarHBondContact OD1-NZ 2.96Å; D534-Q538 WeakPolarHBondContact O-CB 3.44Å; D534-Q538 PolarHBondContact O-N 2.86Å
535	Y	75	Confident	74.7	Confident	124 Å²	124	91.5 Å²	91.5	49%	0.486	44%	0.437	S	S	.	.	H	α-helix	trans	-61.8	-35.8	168.4	-86.8	-66.8	0	0	0	112.4	L531 Q538 L539	L531-Y535 VanDerWaalsContact O-CD2 3.24Å; L531-Y535 WeakPolarHBondContact O-CD2 3.29Å; L531-Y535 PolarHBondContact O-N 3.02Å; L531-Y535 VanDerWaalsContact O-N 3.12Å; Y535-Q538 PolarHBondContact O-N 3.29Å; Y535-L539 WeakPolarHBondContact O-CB 3.42Å; Y535-L539 PolarHBondContact O-N 3.11Å
536	S	75.5	Confident	75.2	Confident	64 Å²	64	92.6 Å²	92.6	45%	0.448	44%	0.441	S	S	.	.	H	α-helix	trans	-66.6	-42.9	176.8	-172	0	0	0	0	112.2	L532 D533 D534 L539 S540	L532-S536 WeakPolarHBondContact O-CB 3.5Å; L532-S536 PolarHBondContact O-N 3.39Å; D533-S536 WeakPolarHBondContact O-CB 3.33Å; D533-S536 PolarHBondContact O-N 3.01Å; D534-S536 VanDerWaalsContact C-N 3.28Å; D534-S536 PolarHBondContact O-N 3.37Å; S536-L539 PolarHBondContact O-N 3.07Å; S536-S540 WeakPolarHBondContact O-CB 3.28Å; S536-S540 PolarHBondContact O-N 3.18Å; S536-S540 PolarHBondContact O-OG 3.38Å
537	K	83.1	Confident	75.9	Confident	88 Å²	88	99.9 Å²	99.9	38%	0.383	46%	0.46	S	S	.	.	H	α-helix	trans	-60.8	-49.4	171.9	-68.4	161.1	-154.1	154.1	0	111	D533 D534 L539 S540 D541	D533-K537 VanDerWaalsContact CG-CE 3.45Å; D533-K537 VanDerWaalsContact O-CG 3.31Å; D533-K537 WeakPolarHBondContact O-CG 3.48Å; D533-K537 PolarHBondContact O-N 2.94Å; D533-K537 WeakPolarHBondContact OD2-CE 3.38Å; D533-K537 IonicContact OD2-NZ 2.76Å; D533-K537 PolarHBondContact OD2-NZ 3.45Å; D534-K537 PolarHBondContact O-N 3.02Å; D534-K537 IonicContact OD1-NZ 3.45Å; D534-K537 PolarHBondContact OD1-NZ 2.96Å; K537-L539 VanDerWaalsContact C-N 3.34Å; K537-L539 PolarHBondContact O-N 2.98Å; K537-S540 CarbonylContact O-C 3.59Å; K537-S540 WeakPolarHBondContact O-CA 3.5Å; K537-S540 WeakPolarHBondContact O-CB 3.37Å; K537-S540 PolarHBondContact O-N 3.15Å; K537-D541 PolarHBondContact O-N 3.19Å
538	Q	82	Confident	76.4	Confident	92 Å²	92	99.4 Å²	99.4	43%	0.43	47%	0.466	S	S	.	.	H	α-helix	trans	-57.8	-45.6	179.7	-170.8	177.2	8.9	0	0	111.7	D534 Y535 S540 D541 E542	D534-Q538 WeakPolarHBondContact O-CB 3.44Å; D534-Q538 PolarHBondContact O-N 2.86Å; Y535-Q538 PolarHBondContact O-N 3.29Å; Q538-S540 VanDerWaalsContact C-N 3.31Å; Q538-S540 PolarHBondContact O-N 3.01Å; Q538-D541 PolarHBondContact O-N 2.96Å; Q538-E542 WeakPolarHBondContact O-CB 3.37Å; Q538-E542 PolarHBondContact O-N 3.02Å
539	L	81.1	Confident	76.8	Confident	41 Å²	41	100.2 Å²	100.2	22%	0.215	47%	0.473	C	S	.	.	H	α-helix	trans	-61.9	-39.1	175.2	-167.9	77.2	0	0	0	112.1	Y535 S536 K537 Q543 L561	Y535-L539 WeakPolarHBondContact O-CB 3.42Å; Y535-L539 PolarHBondContact O-N 3.11Å; S536-L539 PolarHBondContact O-N 3.07Å; K537-L539 VanDerWaalsContact C-N 3.34Å; K537-L539 PolarHBondContact O-N 2.98Å; L539-Q543 WeakPolarHBondContact O-CB 3.35Å; L539-Q543 VanDerWaalsContact O-CG 3.27Å; L539-Q543 WeakPolarHBondContact O-CG 3.42Å; L539-Q543 PolarHBondContact O-N 3.24Å; L539-L561 HydrophobicContact CD1-CB 4.1Å
540	S	81.5	Confident	77.2	Confident	52 Å²	52	99.8 Å²	99.8	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-68.4	-36.2	179.1	-58.6	0	0	0	0	112.6	S536 K537 Q538 Q543 R544	S536-S540 WeakPolarHBondContact O-CB 3.28Å; S536-S540 PolarHBondContact O-N 3.18Å; S536-S540 PolarHBondContact O-OG 3.38Å; K537-S540 CarbonylContact O-C 3.59Å; K537-S540 WeakPolarHBondContact O-CA 3.5Å; K537-S540 WeakPolarHBondContact O-CB 3.37Å; K537-S540 PolarHBondContact O-N 3.15Å; Q538-S540 VanDerWaalsContact C-N 3.31Å; Q538-S540 PolarHBondContact O-N 3.01Å; S540-Q543 PolarHBondContact O-N 3.47Å; S540-R544 WeakPolarHBondContact O-CG 3.46Å; S540-R544 PolarHBondContact O-N 2.86Å
541	D	80.6	Confident	77.7	Confident	67 Å²	67	98.2 Å²	98.2	36%	0.358	48%	0.479	S	S	.	.	H	α-helix	trans	-80	-34.4	-179.6	-68.7	-22.9	0	0	0	112.3	K537 Q538 Q543 R544 R545	K537-D541 PolarHBondContact O-N 3.19Å; Q538-D541 PolarHBondContact O-N 2.96Å; D541-Q543 VanDerWaalsContact C-N 3.31Å; D541-R544 WeakPolarHBondContact O-CB 3.46Å; D541-R544 PolarHBondContact O-N 2.9Å; D541-R544 VanDerWaalsContact O-N 3.13Å; D541-R544 IonicContact OD1-CZ 3.55Å; D541-R544 IonicContact OD1-NE 2.72Å; D541-R544 PolarHBondContact OD1-NE 2.97Å; D541-R544 IonicContact OD1-NH2 3.99Å; D541-R544 PolarHBondContact OD1-NH2 3.11Å; D541-R545 PolarHBondContact O-N 3.39Å
542	E	80	Confident	78	Confident	35 Å²	35	98.2 Å²	98.2	16%	0.164	49%	0.485	C	S	.	.	H	α-helix	trans	-65.1	-35.3	167.6	-131.8	65.3	-111.5	0	0	111.3	Q538 R544 R545 F546 V558 L561	Q538-E542 WeakPolarHBondContact O-CB 3.37Å; Q538-E542 PolarHBondContact O-N 3.02Å; E542-R544 VanDerWaalsContact C-N 3.33Å; E542-R545 PolarHBondContact O-N 3.28Å; E542-R545 WeakPolarHBondContact OE1-CD 3.4Å; E542-R545 IonicContact OE1-CZ 2.73Å; E542-R545 IonicContact OE1-NE 3.81Å; E542-R545 IonicContact OE1-NH1 3.62Å; E542-R545 PolarHBondContact OE1-NH1 3.48Å; E542-R545 IonicContact OE2-NH1 2.71Å; E542-R545 PolarHBondContact OE2-NH1 3.15Å; E542-F546 WeakPolarHBondContact O-CB 3.06Å; E542-F546 PolarHBondContact O-N 3.03Å; E542-V558 HydrophobicContact CB-CG2 4.41Å; E542-V558 HydrophobicContact CG-CG2 4.38Å; E542-L561 HydrophobicContact CB-CD1 4.34Å; E542-L561 HydrophobicContact CG-CD1 4.1Å
543	Q	76.8	Confident	78.4	Confident	100 Å²	100	99.6 Å²	99.6	47%	0.467	50%	0.497	S	S	.	.	H	α-helix	trans	-68.6	-26.5	170.1	-77.4	179.5	18.7	0	0	113.6	L539 S540 D541 V558	L539-Q543 WeakPolarHBondContact O-CB 3.35Å; L539-Q543 VanDerWaalsContact O-CG 3.27Å; L539-Q543 WeakPolarHBondContact O-CG 3.42Å; L539-Q543 PolarHBondContact O-N 3.24Å; S540-Q543 PolarHBondContact O-N 3.47Å; D541-Q543 VanDerWaalsContact C-N 3.31Å; Q543-V558 HydrophobicContact CG-CG1 4.37Å
544	R	79.7	Confident	78.5	Confident	172 Å²	172	97.4 Å²	97.4	65%	0.649	49%	0.486	S	S	*	.	H	α-helix	trans	-72.8	-43.1	170.6	-77.7	-167.9	-93.8	-153.1	-2.1	111.5	S540 D541 E542 F546 R547 A548	S540-R544 WeakPolarHBondContact O-CG 3.46Å; S540-R544 PolarHBondContact O-N 2.86Å; D541-R544 WeakPolarHBondContact O-CB 3.46Å; D541-R544 PolarHBondContact O-N 2.9Å; D541-R544 VanDerWaalsContact O-N 3.13Å; D541-R544 IonicContact OD1-CZ 3.55Å; D541-R544 IonicContact OD1-NE 2.72Å; D541-R544 PolarHBondContact OD1-NE 2.97Å; D541-R544 IonicContact OD1-NH2 3.99Å; D541-R544 PolarHBondContact OD1-NH2 3.11Å; E542-R544 VanDerWaalsContact C-N 3.33Å; R544-F546 VanDerWaalsContact C-N 3.33Å; R544-F546 PolarHBondContact O-N 3.29Å; R544-R547 PolarHBondContact O-N 3.17Å; R544-A548 PolarHBondContact O-N 3.18Å
545	R	78.5	Confident	78.6	Confident	144 Å²	144	96.1 Å²	96.1	54%	0.543	48%	0.484	S	S	.	.	H	α-helix	trans	-58	-43.1	172.3	-73.1	167.7	172.8	169.1	2.3	112.1	D541 E542 R547 A548 D549	D541-R545 PolarHBondContact O-N 3.39Å; E542-R545 PolarHBondContact O-N 3.28Å; E542-R545 WeakPolarHBondContact OE1-CD 3.4Å; E542-R545 IonicContact OE1-CZ 2.73Å; E542-R545 IonicContact OE1-NE 3.81Å; E542-R545 IonicContact OE1-NH1 3.62Å; E542-R545 PolarHBondContact OE1-NH1 3.48Å; E542-R545 IonicContact OE2-NH1 2.71Å; E542-R545 PolarHBondContact OE2-NH1 3.15Å; R545-R547 PolarHBondContact O-N 3.22Å; R545-A548 PolarHBondContact O-N 2.93Å; R545-D549 PolarHBondContact O-N 3.17Å; R545-D549 VanDerWaalsContact O-N 3.07Å
546	F	70.4	Confident	79	Confident	94 Å²	94	94 Å²	94	41%	0.412	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.1	174.3	-172.9	-95.8	0	0	0	114.6	E542 R544 T554	E542-F546 WeakPolarHBondContact O-CB 3.06Å; E542-F546 PolarHBondContact O-N 3.03Å; R544-F546 VanDerWaalsContact C-N 3.33Å; R544-F546 PolarHBondContact O-N 3.29Å; F546-T554 HydrophobicContact CD2-CG2 4.28Å
547	R	78.6	Confident	79.3	Confident	228 Å²	228	93.2 Å²	93.2	86%	0.86	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-7	171.6	-69.7	-174	178.6	-162.3	1.5	114.2	R544 R545	R544-R547 PolarHBondContact O-N 3.17Å; R545-R547 PolarHBondContact O-N 3.22Å
548	A	79.3	Confident	79.2	Confident	80 Å²	80	90.3 Å²	90.3	66%	0.661	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-40.8	176	0	0	0	0	0	111.2	R544 R545	R544-A548 PolarHBondContact O-N 3.18Å; R545-A548 PolarHBondContact O-N 2.93Å
549	D	76.3	Confident	79.1	Confident	100 Å²	100	93 Å²	93	54%	0.535	47%	0.474	S	S	.	.			trans	-112.1	112.2	-178.1	-59.5	-60.1	0	0	0	111	R545 D551	R545-D549 PolarHBondContact O-N 3.17Å; R545-D549 VanDerWaalsContact O-N 3.07Å; D549-D551 PolarHBondContact O-N 3.31Å
550	D	75.3	Confident	79.3	Confident	174 Å²	174	97.7 Å²	97.7	93%	0.93	50%	0.495	S	S	*	.			trans	-69.2	28.3	173.1	-84.6	-50.1	0	0	0	113.3
551	D	82.8	Confident	79.4	Confident	73 Å²	73	97.5 Å²	97.5	39%	0.39	49%	0.49	S	S	.	.			trans	-83.2	120.1	-177.7	-166	-52.3	0	0	0	111.5	D549 T553 T554	D549-D551 PolarHBondContact O-N 3.31Å; D551-T553 PolarHBondContact O-N 3.36Å; D551-T553 VanDerWaalsContact OD1-CB 3.25Å; D551-T553 WeakPolarHBondContact OD1-CB 3.35Å; D551-T553 WeakPolarHBondContact OD1-CG2 3.39Å; D551-T553 PolarHBondContact OD1-N 3.39Å; D551-T553 PolarHBondContact OD1-OG1 3.16Å; D551-T554 PolarHBondContact O-N 3.46Å
552	P	80.1	Confident	79.4	Confident	104 Å²	104	101.7 Å²	101.7	68%	0.675	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.1	-178.5	28.4	-35.9	0	0	0	114.1	S555	P552-S555 WeakPolarHBondContact O-CB 3.39Å
553	T	80.9	Confident	79.6	Confident	96 Å²	96	104.5 Å²	104.5	59%	0.589	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-40.2	177.2	63.9	0	0	0	0	111.8	D551 S555 N556	D551-T553 PolarHBondContact O-N 3.36Å; D551-T553 VanDerWaalsContact OD1-CB 3.25Å; D551-T553 WeakPolarHBondContact OD1-CB 3.35Å; D551-T553 WeakPolarHBondContact OD1-CG2 3.39Å; D551-T553 PolarHBondContact OD1-N 3.39Å; D551-T553 PolarHBondContact OD1-OG1 3.16Å; T553-S555 PolarHBondContact O-N 3.12Å; T553-N556 PolarHBondContact O-N 3.22Å
554	T	72.8	Confident	79.7	Confident	33 Å²	33	102.8 Å²	102.8	20%	0.202	52%	0.515	C	S	.	.	H	α-helix	trans	-58.2	-31.1	178.5	-51.2	0	0	0	0	112.6	F546 D551 N556 A557 V558	F546-T554 HydrophobicContact CD2-CG2 4.28Å; D551-T554 PolarHBondContact O-N 3.46Å; T554-N556 PolarHBondContact O-N 3.4Å; T554-A557 PolarHBondContact O-N 2.82Å; T554-A557 VanDerWaalsContact O-N 3.09Å; T554-V558 PolarHBondContact O-N 3.35Å
555	S	80.8	Confident	79.5	Confident	58 Å²	58	97.3 Å²	97.3	41%	0.406	50%	0.498	S	S	.	.	H	α-helix	trans	-56.9	-34.3	175.6	-169.3	0	0	0	0	113.2	P552 T553 R559	P552-S555 WeakPolarHBondContact O-CB 3.39Å; T553-S555 PolarHBondContact O-N 3.12Å; S555-R559 WeakPolarHBondContact O-CB 3.32Å; S555-R559 PolarHBondContact O-N 2.77Å
556	N	83.4	Confident	79.3	Confident	79 Å²	79	93.6 Å²	93.6	42%	0.422	49%	0.487	S	S	.	.	H	α-helix	trans	-70.9	-37.7	176.4	-77	-58	0	0	0	112.5	T553 T554 R559 E560	T553-N556 PolarHBondContact O-N 3.22Å; T554-N556 PolarHBondContact O-N 3.4Å; N556-R559 WeakPolarHBondContact O-CB 3.43Å; N556-R559 PolarHBondContact O-N 2.92Å; N556-R559 PolarHBondContact OD1-NH2 2.77Å; N556-E560 PolarHBondContact O-N 3.22Å
557	A	81.3	Confident	79.6	Confident	47 Å²	47	92.4 Å²	92.4	39%	0.388	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-44.8	178.3	0	0	0	0	0	111.7	T554 R559 E560 L561	T554-A557 PolarHBondContact O-N 2.82Å; T554-A557 VanDerWaalsContact O-N 3.09Å; A557-R559 VanDerWaalsContact C-N 3.27Å; A557-R559 PolarHBondContact O-N 3.18Å; A557-E560 PolarHBondContact O-N 3.02Å; A557-L561 WeakPolarHBondContact O-CG 3.36Å; A557-L561 PolarHBondContact O-N 3.45Å
558	V	79.9	Confident	79.3	Confident	28 Å²	28	84.3 Å²	84.3	17%	0.17	46%	0.461	C	S	.	.	H	α-helix	trans	-62	-37.1	175.3	-179	0	0	0	0	111.2	E542 Q543 T554 R562	E542-V558 HydrophobicContact CB-CG2 4.41Å; E542-V558 HydrophobicContact CG-CG2 4.38Å; Q543-V558 HydrophobicContact CG-CG1 4.37Å; T554-V558 PolarHBondContact O-N 3.35Å; V558-R562 WeakPolarHBondContact O-CB 3.49Å; V558-R562 PolarHBondContact O-N 3.29Å; V558-R562 VanDerWaalsContact O-N 3.1Å
559	R	80.6	Confident	78.9	Confident	148 Å²	148	84.4 Å²	84.4	56%	0.558	45%	0.45	S	S	*	.	H	α-helix	trans	-68.4	-41.4	176.2	-173.3	170	65.1	109.9	-0.1	112.6	S555 N556 A557 R562 L563	S555-R559 WeakPolarHBondContact O-CB 3.32Å; S555-R559 PolarHBondContact O-N 2.77Å; N556-R559 WeakPolarHBondContact O-CB 3.43Å; N556-R559 PolarHBondContact O-N 2.92Å; N556-R559 PolarHBondContact OD1-NH2 2.77Å; A557-R559 VanDerWaalsContact C-N 3.27Å; A557-R559 PolarHBondContact O-N 3.18Å; R559-R562 PolarHBondContact O-N 3.06Å; R559-L563 HydrophobicContact CG-CD1 4.27Å; R559-L563 WeakPolarHBondContact O-CG 3.44Å; R559-L563 PolarHBondContact O-N 3.08Å
560	E	86.4	Confident	78.7	Confident	139 Å²	139	88 Å²	88	65%	0.65	46%	0.456	S	S	*	.	H	α-helix	trans	-68.8	-41	175.7	-73.3	-164.4	160.9	0	0	112.5	N556 A557 R562 L563 S564	N556-E560 PolarHBondContact O-N 3.22Å; A557-E560 PolarHBondContact O-N 3.02Å; E560-R562 VanDerWaalsContact C-N 3.32Å; E560-R562 PolarHBondContact O-N 3.04Å; E560-L563 PolarHBondContact O-N 2.97Å; E560-S564 VanDerWaalsContact O-CB 3.29Å; E560-S564 WeakPolarHBondContact O-CB 3.45Å; E560-S564 PolarHBondContact O-N 3.25Å
561	L	83.3	Confident	78.6	Confident	48 Å²	48	88.3 Å²	88.3	25%	0.251	45%	0.445	S	S	.	.	H	α-helix	trans	-57.9	-44.4	173.4	-75.4	172.5	0	0	0	111.6	L539 E542 A557 S564 L565	L539-L561 HydrophobicContact CD1-CB 4.1Å; E542-L561 HydrophobicContact CB-CD1 4.34Å; E542-L561 HydrophobicContact CG-CD1 4.1Å; A557-L561 WeakPolarHBondContact O-CG 3.36Å; A557-L561 PolarHBondContact O-N 3.45Å; L561-S564 PolarHBondContact O-N 3.13Å; L561-L565 PolarHBondContact O-N 3.38Å
562	R	79.8	Confident	78.3	Confident	156 Å²	156	86.9 Å²	86.9	59%	0.589	44%	0.44	S	S	*	.	H	α-helix	trans	-62.1	-47.2	175.7	179.8	173.2	174.3	160.5	1.2	112.2	V558 R559 E560 S564 L565 E566	V558-R562 WeakPolarHBondContact O-CB 3.49Å; V558-R562 PolarHBondContact O-N 3.29Å; V558-R562 VanDerWaalsContact O-N 3.1Å; R559-R562 PolarHBondContact O-N 3.06Å; E560-R562 VanDerWaalsContact C-N 3.32Å; E560-R562 PolarHBondContact O-N 3.04Å; R562-S564 VanDerWaalsContact C-N 3.32Å; R562-S564 PolarHBondContact O-N 3.47Å; R562-L565 PolarHBondContact O-N 3.4Å; R562-E566 WeakPolarHBondContact CG-OE1 3.48Å; R562-E566 IonicContact CZ-OE1 2.71Å; R562-E566 IonicContact NE-OE1 3.3Å; R562-E566 PolarHBondContact NE-OE1 2.93Å; R562-E566 IonicContact NH2-OE1 3.43Å; R562-E566 PolarHBondContact NH2-OE1 3.38Å; R562-E566 WeakPolarHBondContact O-CG 3.44Å; R562-E566 PolarHBondContact O-N 2.88Å
563	L	83.9	Confident	77.5	Confident	94 Å²	94	88 Å²	88	49%	0.492	44%	0.44	S	S	.	.	H	α-helix	trans	-64.3	-36.3	178	-71.4	169.1	0	0	0	112.3	R559 E560 E566 E567	R559-L563 HydrophobicContact CG-CD1 4.27Å; R559-L563 WeakPolarHBondContact O-CG 3.44Å; R559-L563 PolarHBondContact O-N 3.08Å; E560-L563 PolarHBondContact O-N 2.97Å; L563-E566 PolarHBondContact O-N 2.9Å; L563-E567 VanDerWaalsContact O-CB 3.29Å; L563-E567 WeakPolarHBondContact O-CB 3.44Å; L563-E567 PolarHBondContact O-N 3.48Å
564	S	79.8	Confident	76.5	Confident	64 Å²	64	92.4 Å²	92.4	45%	0.448	45%	0.446	S	S	.	.	H	α-helix	trans	-65	-40.6	175.1	-172	0	0	0	0	112.1	E560 L561 R562 S568	E560-S564 VanDerWaalsContact O-CB 3.29Å; E560-S564 WeakPolarHBondContact O-CB 3.45Å; E560-S564 PolarHBondContact O-N 3.25Å; L561-S564 PolarHBondContact O-N 3.13Å; R562-S564 VanDerWaalsContact C-N 3.32Å; R562-S564 PolarHBondContact O-N 3.47Å; S564-S568 VanDerWaalsContact O-CB 3.26Å; S564-S568 WeakPolarHBondContact O-CB 3.48Å; S564-S568 PolarHBondContact O-N 3.23Å; S564-S568 PolarHBondContact O-OG 3.46Å
565	L	75.7	Confident	75.6	Confident	56 Å²	56	96 Å²	96	29%	0.293	46%	0.459	S	S	.	.	H	α-helix	trans	-66.5	-46.1	174.1	-175.5	63.8	0	0	0	111.7	L561 R562 E567 S568 L569	L561-L565 PolarHBondContact O-N 3.38Å; R562-L565 PolarHBondContact O-N 3.4Å; L565-E567 PolarHBondContact O-N 3.3Å; L565-S568 PolarHBondContact O-N 3.4Å; L565-L569 HydrophobicContact CG-CD1 4.37Å; L565-L569 WeakPolarHBondContact O-CG 3.25Å; L565-L569 PolarHBondContact O-N 2.97Å
566	E	73.5	Confident	74.5	Confident	66 Å²	66	98 Å²	98	31%	0.308	47%	0.465	S	S	.	.	H	α-helix	trans	-61.8	-40.9	177.2	-72.6	177.3	-162.1	0	0	112	R562 L563 R570	R562-E566 WeakPolarHBondContact CG-OE1 3.48Å; R562-E566 IonicContact CZ-OE1 2.71Å; R562-E566 IonicContact NE-OE1 3.3Å; R562-E566 PolarHBondContact NE-OE1 2.93Å; R562-E566 IonicContact NH2-OE1 3.43Å; R562-E566 PolarHBondContact NH2-OE1 3.38Å; R562-E566 WeakPolarHBondContact O-CG 3.44Å; R562-E566 PolarHBondContact O-N 2.88Å; L563-E566 PolarHBondContact O-N 2.9Å; E566-R570 WeakPolarHBondContact O-CG 3.42Å; E566-R570 PolarHBondContact O-N 2.64Å
567	E	78.2	Confident	73.6	Confident	69 Å²	69	96.3 Å²	96.3	32%	0.322	46%	0.461	S	S	.	.	H	α-helix	trans	-69.9	-37.3	174.9	-179.8	64.7	-179.3	0	0	112.4	L563 L565 L569 R570 R571	L563-E567 VanDerWaalsContact O-CB 3.29Å; L563-E567 WeakPolarHBondContact O-CB 3.44Å; L563-E567 PolarHBondContact O-N 3.48Å; L565-E567 PolarHBondContact O-N 3.3Å; E567-L569 VanDerWaalsContact C-N 3.33Å; E567-L569 PolarHBondContact O-N 2.87Å; E567-R570 PolarHBondContact O-N 3.14Å; E567-R571 WeakPolarHBondContact O-CG 3.35Å; E567-R571 PolarHBondContact O-N 3.14Å; E567-R571 IonicContact OE1-CZ 3.75Å; E567-R571 IonicContact OE1-NE 2.79Å; E567-R571 PolarHBondContact OE1-NE 3.04Å; E567-R571 IonicContact OE1-NH2 3.16Å; E567-R571 PolarHBondContact OE1-NH2 3.32Å
568	S	71.8	Confident	72.5	Confident	58 Å²	58	98.9 Å²	98.9	41%	0.406	47%	0.468	S	S	.	.	H	α-helix	trans	-64.2	-38.2	175.2	-63.6	0	0	0	0	112.1	S564 L565 C572	S564-S568 VanDerWaalsContact O-CB 3.26Å; S564-S568 WeakPolarHBondContact O-CB 3.48Å; S564-S568 PolarHBondContact O-N 3.23Å; S564-S568 PolarHBondContact O-OG 3.46Å; L565-S568 PolarHBondContact O-N 3.4Å; S568-C572 PolarHBondContact O-N 3.49Å; S568-C572 PolarHBondContact O-SG 3.48Å
569	L	69.7	Low	71	Confident	83 Å²	83	100.6 Å²	100.6	44%	0.435	47%	0.474	S	S	.	.	H	α-helix	trans	-66.9	-39.6	172.7	-70.9	168.6	0	0	0	111.8	L565 E567 C572	L565-L569 HydrophobicContact CG-CD1 4.37Å; L565-L569 WeakPolarHBondContact O-CG 3.25Å; L565-L569 PolarHBondContact O-N 2.97Å; E567-L569 VanDerWaalsContact C-N 3.33Å; E567-L569 PolarHBondContact O-N 2.87Å; L569-C572 WeakPolarHBondContact O-CB 3.42Å; L569-C572 PolarHBondContact O-N 3.08Å
570	R	71.8	Confident	69.7	Low	174 Å²	174	97.1 Å²	97.1	66%	0.657	47%	0.473	S	S	*	.	H	α-helix	trans	-64.5	-38.9	174.9	-73.9	171.9	-176.7	-173.8	3.8	113.3	E566 E567 C572	E566-R570 WeakPolarHBondContact O-CG 3.42Å; E566-R570 PolarHBondContact O-N 2.64Å; E567-R570 PolarHBondContact O-N 3.14Å; R570-C572 PolarHBondContact O-N 3Å
571	R	74	Confident	68.4	Low	181 Å²	181	100.4 Å²	100.4	68%	0.683	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-7.9	178.3	-69.9	180	-170.7	179.1	8.1	114.1	E567 D573	E567-R571 WeakPolarHBondContact O-CG 3.35Å; E567-R571 PolarHBondContact O-N 3.14Å; E567-R571 IonicContact OE1-CZ 3.75Å; E567-R571 IonicContact OE1-NE 2.79Å; E567-R571 PolarHBondContact OE1-NE 3.04Å; E567-R571 IonicContact OE1-NH2 3.16Å; E567-R571 PolarHBondContact OE1-NH2 3.32Å; R571-D573 PolarHBondContact O-N 3.49Å
572	C	76.2	Confident	67.8	Low	44 Å²	44	99.5 Å²	99.5	30%	0.297	48%	0.475	S	S	.	.			trans	-74.8	87.5	173.7	-76.1	0	0	0	0	110.8	S568 L569 R570 R574 F575	S568-C572 PolarHBondContact O-N 3.49Å; S568-C572 PolarHBondContact O-SG 3.48Å; L569-C572 WeakPolarHBondContact O-CB 3.42Å; L569-C572 PolarHBondContact O-N 3.08Å; R570-C572 PolarHBondContact O-N 3Å; C572-R574 PolarHBondContact O-N 3.45Å; C572-F575 HydrophobicContact CB-CB 4.07Å; C572-F575 WeakPolarHBondContact O-CA 3.37Å; C572-F575 VanDerWaalsContact O-CB 3.27Å; C572-F575 WeakPolarHBondContact O-CB 3.4Å; C572-F575 PolarHBondContact O-N 2.94Å
573	D	63.5	Low	67.7	Low	127 Å²	127	96 Å²	96	68%	0.679	47%	0.468	S	S	*	.	H	α-helix	trans	-48.8	-31.6	170.1	-74.2	-37.8	0	0	0	112.6	R571 F575 I576 A577	R571-D573 PolarHBondContact O-N 3.49Å; D573-F575 VanDerWaalsContact C-N 3.31Å; D573-F575 PolarHBondContact O-N 3.12Å; D573-I576 PolarHBondContact O-N 3.12Å; D573-A577 VanDerWaalsContact O-CB 3.27Å; D573-A577 WeakPolarHBondContact O-CB 3.29Å; D573-A577 PolarHBondContact O-N 3.49Å
574	R	59.9	Low	67.2	Low	188 Å²	188	95 Å²	95	71%	0.709	47%	0.466	S	S	*	.	H	α-helix	trans	-61.1	-33.9	174	-71.2	-174.4	178.3	177.8	0.5	113.4	C572 L578	C572-R574 PolarHBondContact O-N 3.45Å; R574-L578 VanDerWaalsContact O-CB 3.3Å; R574-L578 WeakPolarHBondContact O-CB 3.39Å; R574-L578 PolarHBondContact O-N 3.18Å
575	F	54.1	Low	67.4	Low	108 Å²	108	96 Å²	96	47%	0.474	47%	0.469	S	S	.	.	H	α-helix	trans	-69.1	-46.3	176.3	-170.8	-100.6	0	0	0	110.4	C572 D573 A577 L578 H579	C572-F575 HydrophobicContact CB-CB 4.07Å; C572-F575 WeakPolarHBondContact O-CA 3.37Å; C572-F575 VanDerWaalsContact O-CB 3.27Å; C572-F575 WeakPolarHBondContact O-CB 3.4Å; C572-F575 PolarHBondContact O-N 2.94Å; D573-F575 VanDerWaalsContact C-N 3.31Å; D573-F575 PolarHBondContact O-N 3.12Å; F575-A577 VanDerWaalsContact C-N 3.34Å; F575-A577 PolarHBondContact O-N 3.04Å; F575-L578 WeakPolarHBondContact O-CB 3.32Å; F575-L578 PolarHBondContact O-N 3.43Å; F575-L578 VanDerWaalsContact O-N 3.16Å; F575-H579 AromaticContact CD1-CD2 3.86Å; F575-H579 AromaticContact CE1-CD2 3.57Å; F575-H579 AromaticContact CE1-NE2 3.41Å; F575-H579 WeakPolarHBondContact CE1-NE2 3.49Å; F575-H579 AromaticContact CE2-NE2 3.99Å; F575-H579 AromaticContact CZ-CD2 3.8Å; F575-H579 AromaticContact CZ-NE2 3.3Å; F575-H579 VanDerWaalsContact CZ-NE2 3.3Å; F575-H579 WeakPolarHBondContact CZ-NE2 3.48Å; F575-H579 PolarHBondContact O-CD2 2.91Å; F575-H579 PolarHBondContact O-N 3.29Å
576	I	58.3	Low	67.8	Low	102 Å²	102	96.8 Å²	96.8	52%	0.523	47%	0.473	S	S	.	.	H	α-helix	trans	-60.8	-43.4	174.4	-57.9	174.4	0	0	0	110.8	D573 L578 H579 S580	D573-I576 PolarHBondContact O-N 3.12Å; I576-L578 VanDerWaalsContact C-N 3.33Å; I576-L578 PolarHBondContact O-N 3.39Å; I576-H579 PolarHBondContact O-N 3.32Å; I576-S580 PolarHBondContact O-N 2.66Å
577	A	64.6	Low	68	Low	43 Å²	43	106.6 Å²	106.6	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-71.1	-22.7	176.8	0	0	0	0	0	114.1	D573 F575 S580 R581	D573-A577 VanDerWaalsContact O-CB 3.27Å; D573-A577 WeakPolarHBondContact O-CB 3.29Å; D573-A577 PolarHBondContact O-N 3.49Å; F575-A577 VanDerWaalsContact C-N 3.34Å; F575-A577 PolarHBondContact O-N 3.04Å; A577-S580 PolarHBondContact O-OG 2.64Å; A577-R581 WeakPolarHBondContact O-CD 3.3Å; A577-R581 WeakPolarHBondContact O-CG 3.36Å
578	L	58.6	Low	68.3	Low	101 Å²	101	108.3 Å²	108.3	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-74.8	-48.2	170.6	-163.6	74	0	0	0	109.7	R574 F575 I576 S580 R581 V582	R574-L578 VanDerWaalsContact O-CB 3.3Å; R574-L578 WeakPolarHBondContact O-CB 3.39Å; R574-L578 PolarHBondContact O-N 3.18Å; F575-L578 WeakPolarHBondContact O-CB 3.32Å; F575-L578 PolarHBondContact O-N 3.43Å; F575-L578 VanDerWaalsContact O-N 3.16Å; I576-L578 VanDerWaalsContact C-N 3.33Å; I576-L578 PolarHBondContact O-N 3.39Å; L578-S580 VanDerWaalsContact C-N 3.33Å; L578-S580 PolarHBondContact O-N 3.19Å; L578-R581 PolarHBondContact O-N 3.47Å; L578-R581 VanDerWaalsContact O-N 3.12Å; L578-V582 VanDerWaalsContact O-CG2 3.29Å; L578-V582 WeakPolarHBondContact O-CG2 3.35Å; L578-V582 PolarHBondContact O-N 3.46Å
579	H	47.3	Very low	69.1	Low	63 Å²	63	108.2 Å²	108.2	29%	0.292	53%	0.527	S	S	.	.	H	α-helix	trans	-56.9	-41.8	175.7	-90.2	-92.6	0	0	0	112.8	F575 I576 R581 V582 L593	F575-H579 AromaticContact CD1-CD2 3.86Å; F575-H579 AromaticContact CE1-CD2 3.57Å; F575-H579 AromaticContact CE1-NE2 3.41Å; F575-H579 WeakPolarHBondContact CE1-NE2 3.49Å; F575-H579 AromaticContact CE2-NE2 3.99Å; F575-H579 AromaticContact CZ-CD2 3.8Å; F575-H579 AromaticContact CZ-NE2 3.3Å; F575-H579 VanDerWaalsContact CZ-NE2 3.3Å; F575-H579 WeakPolarHBondContact CZ-NE2 3.48Å; F575-H579 PolarHBondContact O-CD2 2.91Å; F575-H579 PolarHBondContact O-N 3.29Å; I576-H579 PolarHBondContact O-N 3.32Å; H579-R581 VanDerWaalsContact C-N 3.3Å; H579-R581 PolarHBondContact O-N 3.27Å; H579-V582 PolarHBondContact O-N 3.31Å; H579-L593 WeakPolarHBondContact O-CD1 3.26Å
580	S	53.1	Low	69.8	Low	76 Å²	76	111.6 Å²	111.6	53%	0.531	53%	0.534	S	S	.	.	H	α-helix	trans	-67.8	-27.9	178.4	69.1	0	0	0	0	113.7	I576 A577 L578 V582	I576-S580 PolarHBondContact O-N 2.66Å; A577-S580 PolarHBondContact O-OG 2.64Å; L578-S580 VanDerWaalsContact C-N 3.33Å; L578-S580 PolarHBondContact O-N 3.19Å; S580-V582 VanDerWaalsContact C-N 3.32Å
581	R	58.6	Low	70.3	Confident	208 Å²	208	109.3 Å²	109.3	79%	0.785	53%	0.531	S	S	*	.	H	α-helix	trans	-79.9	-9.6	177.2	-78.1	175.9	163.4	170.7	-4.4	114.5	A577 L578 H579	A577-R581 WeakPolarHBondContact O-CD 3.3Å; A577-R581 WeakPolarHBondContact O-CG 3.36Å; L578-R581 PolarHBondContact O-N 3.47Å; L578-R581 VanDerWaalsContact O-N 3.12Å; H579-R581 VanDerWaalsContact C-N 3.3Å; H579-R581 PolarHBondContact O-N 3.27Å
582	V	71.8	Confident	70.9	Confident	29 Å²	29	102.1 Å²	102.1	18%	0.176	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-0.9	-175.1	171.1	0	0	0	0	112.4	L578 H579 S580 T584 L593 A594	L578-V582 VanDerWaalsContact O-CG2 3.29Å; L578-V582 WeakPolarHBondContact O-CG2 3.35Å; L578-V582 PolarHBondContact O-N 3.46Å; H579-V582 PolarHBondContact O-N 3.31Å; S580-V582 VanDerWaalsContact C-N 3.32Å; V582-T584 PolarHBondContact O-N 3.34Å; V582-L593 HydrophobicContact CB-CD1 3.84Å; V582-L593 HydrophobicContact CG1-CD1 3.68Å; V582-L593 HydrophobicContact CG1-CG 3.9Å; V582-A594 HydrophobicContact CG1-CB 4.28Å; V582-A594 VanDerWaalsContact CG1-N 3.34Å; V582-A594 VanDerWaalsContact CG1-O 3.28Å; V582-A594 WeakPolarHBondContact CG1-O 3.43Å; V582-A594 PolarHBondContact O-N 3.42Å
583	L	76.4	Confident	71.1	Confident	82 Å²	82	103.5 Å²	103.5	43%	0.429	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	104	175.3	-68.9	171.5	0	0	0	112.1	L593	L583-L593 HydrophobicContact CD2-CB 4.41Å; L583-L593 HydrophobicContact CD2-CD1 4.15Å; L583-L593 HydrophobicContact CG-CD1 4.42Å
584	T	75	Confident	71.8	Confident	73 Å²	73	100.3 Å²	100.3	45%	0.448	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.9	174.3	-59.3	0	0	0	0	110.5	V582 Q591 V592	V582-T584 PolarHBondContact O-N 3.34Å; T584-Q591 CarbonylContact O-C 3.59Å; T584-Q591 WeakPolarHBondContact O-CA 3.36Å; T584-V592 PolarHBondContact N-O 3.47Å; T584-V592 WeakPolarHBondContact O-CG2 3.39Å; T584-V592 PolarHBondContact O-N 3.44Å
585	T	82.7	Confident	72.4	Confident	86 Å²	86	96.3 Å²	96.3	53%	0.528	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	121.2	175.7	-56	0	0	0	0	111	R590	T585-R590 WeakPolarHBondContact CA-O 3.46Å
586	L	83.7	Confident	72.8	Confident	71 Å²	71	95.9 Å²	95.9	37%	0.372	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-73.4	161.8	175.7	-67.5	171.3	0	0	0	111.7	N588 G589 R590 V592	L586-N588 VanDerWaalsContact CB-OD1 3.32Å; L586-N588 WeakPolarHBondContact CB-OD1 3.21Å; L586-N588 PolarHBondContact O-N 3.29Å; L586-G589 PolarHBondContact O-N 3.31Å; L586-R590 HydrophobicContact CD1-CB 4.45Å; L586-R590 PolarHBondContact N-O 3.28Å; L586-V592 HydrophobicContact CD1-CG1 4.35Å; L586-V592 HydrophobicContact CD1-CG2 3.9Å; L586-V592 HydrophobicContact CD2-CG2 4.2Å; L586-V592 HydrophobicContact CG-CG2 3.76Å
587	R	77.7	Confident	72.5	Confident	272 Å²	272	100.3 Å²	100.3	100%	1.026	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-15.6	176.4	-72.6	-174	176.7	-179.5	-0.3	115.1
588	N	85.4	Confident	71.7	Confident	105 Å²	105	103.4 Å²	103.4	56%	0.561	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	11.5	176.1	65	7.7	0	0	0	113.7	L586 R590	L586-N588 VanDerWaalsContact CB-OD1 3.32Å; L586-N588 WeakPolarHBondContact CB-OD1 3.21Å; L586-N588 PolarHBondContact O-N 3.29Å; N588-R590 VanDerWaalsContact C-N 3.28Å; N588-R590 PolarHBondContact O-N 3.44Å; N588-R590 WeakPolarHBondContact OD1-CB 3.47Å; N588-R590 WeakPolarHBondContact OD1-CG 3.37Å; N588-R590 PolarHBondContact OD1-N 2.87Å
589	G	88.9	Confident	71.1	Confident	56 Å²	56	106 Å²	106	58%	0.577	54%	0.541	S	S	*	.	S	Bend	trans	78.3	0.1	179	0	0	0	0	0	115.5	L586	L586-G589 PolarHBondContact O-N 3.31Å
590	R	83.7	Confident	70.8	Confident	154 Å²	154	109.5 Å²	109.5	58%	0.581	56%	0.56	S	S	*	*			trans	-77.8	134.8	175.1	-63.3	-176	-178	-164.6	-1.1	110.8	T585 L586 N588	T585-R590 WeakPolarHBondContact CA-O 3.46Å; L586-R590 HydrophobicContact CD1-CB 4.45Å; L586-R590 PolarHBondContact N-O 3.28Å; N588-R590 VanDerWaalsContact C-N 3.28Å; N588-R590 PolarHBondContact O-N 3.44Å; N588-R590 WeakPolarHBondContact OD1-CB 3.47Å; N588-R590 WeakPolarHBondContact OD1-CG 3.37Å; N588-R590 PolarHBondContact OD1-N 2.87Å
591	Q	83.7	Confident	70.6	Confident	126 Å²	126	108.7 Å²	108.7	59%	0.589	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86	138.9	169	-64	178.3	1.8	0	0	109.9	T584	T584-Q591 CarbonylContact O-C 3.59Å; T584-Q591 WeakPolarHBondContact O-CA 3.36Å
592	V	85	Confident	69.8	Low	30 Å²	30	106.4 Å²	106.4	18%	0.182	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-136.1	141	175.3	-88.4	0	0	0	0	110	T584 L586 A594	T584-V592 PolarHBondContact N-O 3.47Å; T584-V592 WeakPolarHBondContact O-CG2 3.39Å; T584-V592 PolarHBondContact O-N 3.44Å; L586-V592 HydrophobicContact CD1-CG1 4.35Å; L586-V592 HydrophobicContact CD1-CG2 3.9Å; L586-V592 HydrophobicContact CD2-CG2 4.2Å; L586-V592 HydrophobicContact CG-CG2 3.76Å; V592-A594 PolarHBondContact O-N 3.1Å
593	L	81	Confident	68.5	Low	74 Å²	74	108.9 Å²	108.9	39%	0.387	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.1	104.6	179.1	-170.4	74.8	0	0	0	109.5	H579 V582 L583 M595	H579-L593 WeakPolarHBondContact O-CD1 3.26Å; V582-L593 HydrophobicContact CB-CD1 3.84Å; V582-L593 HydrophobicContact CG1-CD1 3.68Å; V582-L593 HydrophobicContact CG1-CG 3.9Å; L583-L593 HydrophobicContact CD2-CB 4.41Å; L583-L593 HydrophobicContact CD2-CD1 4.15Å; L583-L593 HydrophobicContact CG-CD1 4.42Å; L593-M595 HydrophobicContact CD2-CG 3.8Å; L593-M595 HydrophobicContact CD2-SD 3.75Å; L593-M595 HydrophobicContact CG-CG 3.99Å; L593-M595 HydrophobicContact CG-SD 4.08Å; L593-M595 PolarHBondContact O-N 3.08Å
594	A	77.3	Confident	66.9	Low	60 Å²	60	111 Å²	111	50%	0.496	60%	0.595	S	S	.	*			trans	-80.9	60.9	-178.3	0	0	0	0	0	112.5	V582 V592	V582-A594 HydrophobicContact CG1-CB 4.28Å; V582-A594 VanDerWaalsContact CG1-N 3.34Å; V582-A594 VanDerWaalsContact CG1-O 3.28Å; V582-A594 WeakPolarHBondContact CG1-O 3.43Å; V582-A594 PolarHBondContact O-N 3.42Å; V592-A594 PolarHBondContact O-N 3.1Å
595	M	74	Confident	65.4	Low	103 Å²	103	114.3 Å²	114.3	51%	0.507	60%	0.603	S	S	.	*			trans	-55.4	126.1	178.9	-69.3	-65.7	-71.5	0	0	110.9	L593 Y597	L593-M595 HydrophobicContact CD2-CG 3.8Å; L593-M595 HydrophobicContact CD2-SD 3.75Å; L593-M595 HydrophobicContact CG-CG 3.99Å; L593-M595 HydrophobicContact CG-SD 4.08Å; L593-M595 PolarHBondContact O-N 3.08Å; M595-Y597 PolarHBondContact O-N 3.46Å
596	P	61.7	Low	63.6	Low	99 Å²	99	118 Å²	118	64%	0.643	62%	0.619	S	S	*	*			trans	-65.8	131.9	169	28	-32.8	0	0	0	109.1	V598	P596-V598 PolarHBondContact O-N 2.91Å
597	Y	52.6	Low	62	Low	196 Å²	196	122.9 Å²	122.9	77%	0.769	64%	0.64	S	S	*	*			trans	-70.7	97.1	179.2	-77.3	-89.3	0	0	0	110.7	M595	M595-Y597 PolarHBondContact O-N 3.46Å
598	V	47.6	Very low	60.4	Low	108 Å²	108	118.1 Å²	118.1	66%	0.655	62%	0.623	S	S	*	*			trans	-76.5	130.4	150	-167.6	0	0	0	0	106.2	P596 I600	P596-V598 PolarHBondContact O-N 2.91Å; V598-I600 HydrophobicContact CB-CD1 4.49Å; V598-I600 HydrophobicContact CB-CG1 4.37Å; V598-I600 HydrophobicContact CG1-CD1 4.04Å; V598-I600 HydrophobicContact CG1-CG1 3.91Å; V598-I600 PolarHBondContact O-N 3.43Å
599	D	45.5	Very low	58.4	Low	154 Å²	154	117.1 Å²	117.1	82%	0.824	64%	0.637	S	S	*	*	S	Bend	trans	-78.1	51.2	-170.3	-159	27.7	0	0	0	113
600	I	42.3	Very low	57	Low	137 Å²	137	119.9 Å²	119.9	70%	0.703	64%	0.638	S	S	*	*			trans	-92	146.2	169.7	-47.3	177.2	0	0	0	107.2	V598	V598-I600 HydrophobicContact CB-CD1 4.49Å; V598-I600 HydrophobicContact CB-CG1 4.37Å; V598-I600 HydrophobicContact CG1-CD1 4.04Å; V598-I600 HydrophobicContact CG1-CG1 3.91Å; V598-I600 PolarHBondContact O-N 3.43Å
601	G	47.1	Very low	55.6	Low	60 Å²	60	124.6 Å²	124.6	62%	0.619	66%	0.656	S	S	*	*			trans	-54.8	158.4	-176.2	0	0	0	0	0	114.5
602	I	43.7	Very low	54.9	Low	160 Å²	160	122.5 Å²	122.5	82%	0.821	65%	0.649	S	S	*	*			trans	-42	120.1	-179.9	-59.2	170.8	0	0	0	110.2	D604	I602-D604 PolarHBondContact O-N 3.24Å
603	P	44.1	Very low	53.8	Low	80 Å²	80	124.1 Å²	124.1	52%	0.519	67%	0.665	S	S	.	*			trans	-65	129.3	178.2	-20.9	31.9	0	0	0	111	F605	P603-F605 VanDerWaalsContact C-N 3.29Å; P603-F605 HydrophobicContact CB-CD2 4.26Å; P603-F605 HydrophobicContact CB-CE1 4.33Å; P603-F605 HydrophobicContact CB-CE2 3.83Å; P603-F605 HydrophobicContact CB-CZ 3.87Å; P603-F605 HydrophobicContact CG-CE2 4.11Å; P603-F605 HydrophobicContact CG-CZ 4.03Å; P603-F605 WeakPolarHBondContact O-CD2 3.26Å; P603-F605 PolarHBondContact O-N 2.93Å
604	D	42.8	Very low	53.1	Low	128 Å²	128	128.5 Å²	128.5	68%	0.684	69%	0.689	S	S	*	*			trans	-73.7	85.1	170.8	-95.1	-48.1	0	0	0	110	I602 L606 E607	I602-D604 PolarHBondContact O-N 3.24Å; D604-L606 PolarHBondContact O-N 3.08Å; D604-E607 PolarHBondContact O-N 3.3Å
605	F	43.2	Very low	52.6	Low	141 Å²	141	132.5 Å²	132.5	62%	0.618	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-0.6	176.6	-67	-77	0	0	0	114.2	P603	P603-F605 VanDerWaalsContact C-N 3.29Å; P603-F605 HydrophobicContact CB-CD2 4.26Å; P603-F605 HydrophobicContact CB-CE1 4.33Å; P603-F605 HydrophobicContact CB-CE2 3.83Å; P603-F605 HydrophobicContact CB-CZ 3.87Å; P603-F605 HydrophobicContact CG-CE2 4.11Å; P603-F605 HydrophobicContact CG-CZ 4.03Å; P603-F605 WeakPolarHBondContact O-CD2 3.26Å; P603-F605 PolarHBondContact O-N 2.93Å
606	L	44.2	Very low	51.8	Low	164 Å²	164	134 Å²	134	86%	0.859	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-21.3	177.5	-76.7	165.9	0	0	0	114	D604	D604-L606 PolarHBondContact O-N 3.08Å
607	E	49.6	Very low	51.5	Low	174 Å²	174	133.3 Å²	133.3	81%	0.813	69%	0.693	S	S	*	*	S	Bend	trans	-88.8	-12.3	-176.7	-153.1	167.5	-136.9	0	0	113.3	D604	D604-E607 PolarHBondContact O-N 3.3Å
608	Y	44	Very low	51.8	Low	171 Å²	171	129.9 Å²	129.9	67%	0.671	69%	0.693	S	S	*	*	S	Bend	trans	-95.6	110.1	177.8	-68.3	-87.8	0	0	0	111.1	L610	Y608-L610 PolarHBondContact O-N 3.11Å
609	G	44.3	Very low	52	Low	84 Å²	84	128 Å²	128	87%	0.866	68%	0.684	S	S	*	*			trans	-68.2	44.2	-177.4	0	0	0	0	0	116.8	R611	G609-R611 PolarHBondContact O-N 3.47Å
610	L	59.1	Low	52.1	Low	115 Å²	115	130.2 Å²	130.2	60%	0.602	68%	0.681	S	S	*	*			trans	-71.5	105.1	176.2	-74.3	163.7	0	0	0	110.4	Y608 D612 A613	Y608-L610 PolarHBondContact O-N 3.11Å; L610-D612 PolarHBondContact O-N 2.79Å; L610-A613 PolarHBondContact O-N 3.03Å
611	R	55.6	Low	52.2	Low	252 Å²	252	128 Å²	128	95%	0.951	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-11.7	-179.6	-70.1	-175.5	171.8	-169.8	-3.1	115.6	G609	G609-R611 PolarHBondContact O-N 3.47Å
612	D	68.5	Low	51.9	Low	82 Å²	82	133.4 Å²	133.4	44%	0.439	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.8	27.7	-169.8	-92.3	-12.8	0	0	0	112.8	L610 D614 K615	L610-D612 PolarHBondContact O-N 2.79Å; D612-D614 PolarHBondContact O-N 3.45Å; D612-K615 HydrophobicContact CB-CD 4.01Å; D612-K615 HydrophobicContact CB-CG 4.46Å; D612-K615 WeakPolarHBondContact O-CB 3.36Å; D612-K615 PolarHBondContact O-N 3.27Å; D612-K615 WeakPolarHBondContact OD1-CE 3.41Å; D612-K615 IonicContact OD1-NZ 3.4Å; D612-K615 PolarHBondContact OD1-NZ 3.2Å; D612-K615 WeakPolarHBondContact OD2-CE 3.17Å; D612-K615 IonicContact OD2-NZ 2.71Å; D612-K615 PolarHBondContact OD2-NZ 3.06Å
613	A	61.5	Low	52.1	Low	64 Å²	64	130.2 Å²	130.2	53%	0.529	68%	0.675	S	S	.	*	G	3₁₀ helix	trans	-49.1	-37.8	-175.9	0	0	0	0	0	114.1	L610 K615 F616	L610-A613 PolarHBondContact O-N 3.03Å; A613-K615 PolarHBondContact O-N 2.96Å; A613-F616 PolarHBondContact O-N 3.14Å; A613-F616 VanDerWaalsContact O-N 3.12Å
614	D	65.7	Low	52	Low	166 Å²	166	130 Å²	130	89%	0.888	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-60.9	-14.1	179.3	-61.9	-36.7	0	0	0	114.8	D612	D612-D614 PolarHBondContact O-N 3.45Å
615	K	67.3	Low	51.9	Low	144 Å²	144	138.5 Å²	138.5	63%	0.626	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-83.1	-12.7	178.4	-62.6	-178.9	-171.4	166	0	113.1	D612 A613	D612-K615 HydrophobicContact CB-CD 4.01Å; D612-K615 HydrophobicContact CB-CG 4.46Å; D612-K615 WeakPolarHBondContact O-CB 3.36Å; D612-K615 PolarHBondContact O-N 3.27Å; D612-K615 WeakPolarHBondContact OD1-CE 3.41Å; D612-K615 IonicContact OD1-NZ 3.4Å; D612-K615 PolarHBondContact OD1-NZ 3.2Å; D612-K615 WeakPolarHBondContact OD2-CE 3.17Å; D612-K615 IonicContact OD2-NZ 2.71Å; D612-K615 PolarHBondContact OD2-NZ 3.06Å; A613-K615 PolarHBondContact O-N 2.96Å
616	F	56.4	Low	52.3	Low	135 Å²	135	138.4 Å²	138.4	59%	0.592	72%	0.715	S	S	*	*			trans	-108.1	129.9	-173.1	-58.8	-82.4	0	0	0	111.9	A613	A613-F616 PolarHBondContact O-N 3.14Å; A613-F616 VanDerWaalsContact O-N 3.12Å
617	V	56.8	Low	52.7	Low	84 Å²	84	137.1 Å²	137.1	51%	0.509	71%	0.707	S	S	.	*			trans	-122.9	119	177.2	178.8	0	0	0	0	109.1	S619	V617-S619 PolarHBondContact O-N 3.44Å
618	V	59.2	Low	52.9	Low	125 Å²	125	135 Å²	135	76%	0.758	70%	0.701	S	S	*	*			trans	-78.2	88.1	173.6	-176.7	0	0	0	0	109.1
619	S	50.2	Low	53.4	Low	69 Å²	69	132.9 Å²	132.9	48%	0.483	70%	0.703	S	S	.	*			trans	-89.2	104.8	175.6	56.2	0	0	0	0	111	V617 S621	V617-S619 PolarHBondContact O-N 3.44Å; S619-S621 PolarHBondContact O-N 3.03Å; S619-S621 VanDerWaalsContact O-N 3.13Å
620	R	48.2	Very low	54	Low	199 Å²	199	135.9 Å²	135.9	75%	0.751	69%	0.693	S	S	*	*			trans	-67.7	105.6	170.2	-176.3	-175.8	-172.9	171	3.5	109.7
621	S	43.8	Very low	53.6	Low	92 Å²	92	137.3 Å²	137.3	64%	0.643	70%	0.699	S	S	*	*			trans	-86.3	113.5	172.7	57.6	0	0	0	0	110.5	S619 V623	S619-S621 PolarHBondContact O-N 3.03Å; S619-S621 VanDerWaalsContact O-N 3.13Å; S621-V623 PolarHBondContact O-N 3.32Å
622	E	41.8	Very low	53.5	Low	173 Å²	173	129.1 Å²	129.1	81%	0.808	68%	0.681	S	S	*	*			trans	-76.6	78.7	168.4	-66	-176.9	163.1	0	0	109.3
623	V	47	Very low	52.3	Low	93 Å²	93	132.8 Å²	132.8	56%	0.564	70%	0.699	S	S	*	*			trans	-98.1	109.1	167.4	-175.6	0	0	0	0	107	S621	S621-V623 PolarHBondContact O-N 3.32Å
624	G	42.7	Very low	51.6	Low	76 Å²	76	138.5 Å²	138.5	78%	0.784	71%	0.714	S	S	*	*			trans	-68.3	137.1	169.5	0	0	0	0	0	110.4
625	W	39.9	Very low	50.3	Low	306 Å²	306	136 Å²	136	100%	1.159	70%	0.698	S	S	*	*			trans	-123.6	0	167.7	-71.9	89.4	0	0	0	107.5

Retrieved 625 of 625 residues in 1796.9 ms (Link to these results)

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