A0A077ZBR5_TRITR Loading...

Glycogen synthase kinase 3 beta

AlphaFold DB , UniProt , Accession A0A077ZBR5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 486 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	65.8	Low	71.3	Confident	177 Å²	177	91.8 Å²	91.8	87%	0.872	48%	0.479	S	S	*	.				0	-54.3	0	-67.3	-52	-77.5	0	0	114.2	V3 V4 K5	M1-V3 PolarHBondContact O-N 3.46Å; M1-V4 PolarHBondContact O-N 3.08Å; M1-K5 PolarHBondContact O-N 3.37Å; M1-K5 VanDerWaalsContact O-N 3.08Å
2	S	71.4	Confident	71.6	Confident	79 Å²	79	95.9 Å²	95.9	55%	0.552	48%	0.483	S	S	*	.	H	α-helix	trans	-57.5	-47.7	179.4	179.5	0	0	0	0	113.1	V4 K5 K6	S2-V4 VanDerWaalsContact C-N 3.34Å; S2-V4 PolarHBondContact O-N 3.15Å; S2-K5 WeakPolarHBondContact O-CB 3.48Å; S2-K5 PolarHBondContact O-N 2.97Å; S2-K5 VanDerWaalsContact O-N 3.15Å; S2-K6 PolarHBondContact O-N 3.02Å
3	V	68.9	Low	71.5	Confident	116 Å²	116	89.4 Å²	89.4	70%	0.703	45%	0.452	S	S	*	.	H	α-helix	trans	-57.7	-43.8	177.4	-179.7	0	0	0	0	112.3	M1 K5 K6 F7	M1-V3 PolarHBondContact O-N 3.46Å; V3-K5 PolarHBondContact O-N 3.44Å; V3-K6 PolarHBondContact O-N 3.27Å; V3-F7 PolarHBondContact O-N 3.49Å
4	V	73.6	Confident	71.6	Confident	81 Å²	81	90.4 Å²	90.4	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-40.1	178.2	179.2	0	0	0	0	111.3	M1 S2 F7 L8	M1-V4 PolarHBondContact O-N 3.08Å; S2-V4 VanDerWaalsContact C-N 3.34Å; S2-V4 PolarHBondContact O-N 3.15Å; V4-F7 PolarHBondContact O-N 3.48Å; V4-L8 HydrophobicContact CG1-CD1 4.1Å; V4-L8 HydrophobicContact CG1-CG 4.42Å; V4-L8 WeakPolarHBondContact O-CB 3.33Å; V4-L8 WeakPolarHBondContact O-CG 3.24Å; V4-L8 PolarHBondContact O-N 3.31Å
5	K	72.5	Confident	71.9	Confident	149 Å²	149	89.2 Å²	89.2	65%	0.648	46%	0.456	S	S	*	.	H	α-helix	trans	-62.4	-43.8	174.7	-73.5	-174.6	177.8	-175.9	0	111.7	M1 S2 V3 L8 Q9	M1-K5 PolarHBondContact O-N 3.37Å; M1-K5 VanDerWaalsContact O-N 3.08Å; S2-K5 WeakPolarHBondContact O-CB 3.48Å; S2-K5 PolarHBondContact O-N 2.97Å; S2-K5 VanDerWaalsContact O-N 3.15Å; V3-K5 PolarHBondContact O-N 3.44Å; K5-L8 PolarHBondContact O-N 2.93Å; K5-Q9 WeakPolarHBondContact O-CB 3.49Å; K5-Q9 PolarHBondContact O-N 3.37Å
6	K	67.7	Low	71.9	Confident	56 Å²	56	84.4 Å²	84.4	24%	0.243	43%	0.434	C	S	.	.	H	α-helix	trans	-59.6	-51	175.4	-68.2	-175.8	179.9	-174.1	0	110.8	S2 V3 L8 Q9 S10 C448	S2-K6 PolarHBondContact O-N 3.02Å; V3-K6 PolarHBondContact O-N 3.27Å; K6-L8 PolarHBondContact O-N 3.34Å; K6-Q9 WeakPolarHBondContact O-CB 3.49Å; K6-Q9 PolarHBondContact O-N 2.91Å; K6-S10 PolarHBondContact O-N 3.04Å; K6-S10 PolarHBondContact O-OG 3.03Å; K6-C448 PolarHBondContact NZ-O 3.11Å
7	F	72.1	Confident	71.8	Confident	140 Å²	140	80.9 Å²	80.9	61%	0.614	42%	0.419	S	S	*	.	H	α-helix	trans	-57.2	-46.4	178.5	-180	-100.5	0	0	0	113.1	V3 V4 Q9 S10 L11	V3-F7 PolarHBondContact O-N 3.49Å; V4-F7 PolarHBondContact O-N 3.48Å; F7-Q9 VanDerWaalsContact C-N 3.27Å; F7-Q9 PolarHBondContact O-N 3.49Å; F7-S10 PolarHBondContact O-N 3.02Å; F7-L11 WeakPolarHBondContact O-CB 3.43Å; F7-L11 PolarHBondContact O-N 3.22Å
8	L	75.8	Confident	71.8	Confident	85 Å²	85	81.6 Å²	81.6	45%	0.445	43%	0.427	S	S	.	.	H	α-helix	trans	-63.8	-33.9	176.7	-71.6	174.1	0	0	0	112.2	V4 K5 K6 R12	V4-L8 HydrophobicContact CG1-CD1 4.1Å; V4-L8 HydrophobicContact CG1-CG 4.42Å; V4-L8 WeakPolarHBondContact O-CB 3.33Å; V4-L8 WeakPolarHBondContact O-CG 3.24Å; V4-L8 PolarHBondContact O-N 3.31Å; K5-L8 PolarHBondContact O-N 2.93Å; K6-L8 PolarHBondContact O-N 3.34Å; L8-R12 WeakPolarHBondContact O-CB 3.47Å; L8-R12 VanDerWaalsContact O-CG 3.24Å; L8-R12 WeakPolarHBondContact O-CG 3.45Å; L8-R12 PolarHBondContact O-N 3.39Å
9	Q	71	Confident	71.8	Confident	21 Å²	21	83.2 Å²	83.2	10%	0.098	43%	0.43	C	S	.	.	H	α-helix	trans	-70.9	-44.9	176.8	-168.7	57.6	38.2	0	0	111.7	K5 K6 F7 L11 R12 C13 V88	K5-Q9 WeakPolarHBondContact O-CB 3.49Å; K5-Q9 PolarHBondContact O-N 3.37Å; K6-Q9 WeakPolarHBondContact O-CB 3.49Å; K6-Q9 PolarHBondContact O-N 2.91Å; F7-Q9 VanDerWaalsContact C-N 3.27Å; F7-Q9 PolarHBondContact O-N 3.49Å; Q9-L11 VanDerWaalsContact C-N 3.32Å; Q9-L11 PolarHBondContact O-N 3.44Å; Q9-R12 WeakPolarHBondContact O-CB 3.43Å; Q9-R12 PolarHBondContact O-N 2.97Å; Q9-C13 PolarHBondContact O-N 3.22Å; Q9-C13 PolarHBondContact O-SG 3.39Å; Q9-V88 HydrophobicContact CG-CG1 4.35Å; Q9-V88 VanDerWaalsContact NE2-CG1 3.34Å
10	S	70.1	Confident	72	Confident	24 Å²	24	79.1 Å²	79.1	17%	0.168	41%	0.409	C	S	.	.	H	α-helix	trans	-59	-43.8	173.5	-50.5	0	0	0	0	111.1	K6 F7 R12 C13 I14 E85	K6-S10 PolarHBondContact O-N 3.04Å; K6-S10 PolarHBondContact O-OG 3.03Å; F7-S10 PolarHBondContact O-N 3.02Å; S10-R12 PolarHBondContact O-N 2.99Å; S10-C13 WeakPolarHBondContact O-CB 3.48Å; S10-C13 PolarHBondContact O-N 2.94Å; S10-I14 VanDerWaalsContact O-CG1 3.3Å; S10-I14 WeakPolarHBondContact O-CG1 3.3Å; S10-I14 PolarHBondContact O-N 3.17Å; S10-E85 PolarHBondContact OG-OE1 2.68Å; S10-E85 PolarHBondContact OG-OE2 2.92Å
11	L	74.8	Confident	71.9	Confident	82 Å²	82	77.1 Å²	77.1	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-61.5	-42.5	176.7	-171.9	69	0	0	0	111.9	F7 Q9 C13 I14 V15	F7-L11 WeakPolarHBondContact O-CB 3.43Å; F7-L11 PolarHBondContact O-N 3.22Å; Q9-L11 VanDerWaalsContact C-N 3.32Å; Q9-L11 PolarHBondContact O-N 3.44Å; L11-C13 VanDerWaalsContact C-N 3.35Å; L11-C13 PolarHBondContact O-N 3.44Å; L11-I14 PolarHBondContact O-N 3.22Å; L11-V15 WeakPolarHBondContact O-CG2 3.32Å; L11-V15 PolarHBondContact O-N 2.94Å
12	R	75.2	Confident	72.1	Confident	141 Å²	141	73.6 Å²	73.6	53%	0.532	39%	0.393	S	S	.	.	H	α-helix	trans	-61.1	-42.5	175	-77.6	172	176.3	176.1	-0.6	112.1	L8 Q9 S10 A16 L35	L8-R12 WeakPolarHBondContact O-CB 3.47Å; L8-R12 VanDerWaalsContact O-CG 3.24Å; L8-R12 WeakPolarHBondContact O-CG 3.45Å; L8-R12 PolarHBondContact O-N 3.39Å; Q9-R12 WeakPolarHBondContact O-CB 3.43Å; Q9-R12 PolarHBondContact O-N 2.97Å; S10-R12 PolarHBondContact O-N 2.99Å; R12-A16 WeakPolarHBondContact O-CB 3.39Å; R12-A16 PolarHBondContact O-N 3.45Å; R12-L35 HydrophobicContact CB-CD1 3.99Å
13	C	70.8	Confident	72.1	Confident	11 Å²	11	72.6 Å²	72.6	7%	0.074	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-48.6	174.9	-72.6	0	0	0	0	110.9	Q9 S10 L11 V15 A16 S17	Q9-C13 PolarHBondContact O-N 3.22Å; Q9-C13 PolarHBondContact O-SG 3.39Å; S10-C13 WeakPolarHBondContact O-CB 3.48Å; S10-C13 PolarHBondContact O-N 2.94Å; L11-C13 VanDerWaalsContact C-N 3.35Å; L11-C13 PolarHBondContact O-N 3.44Å; C13-V15 PolarHBondContact O-N 3.48Å; C13-A16 PolarHBondContact O-N 2.76Å; C13-S17 PolarHBondContact O-N 3.18Å; C13-S17 PolarHBondContact O-OG 3.23Å
14	I	73.1	Confident	72.1	Confident	103 Å²	103	70.5 Å²	70.5	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-58.5	-50.2	179.2	-67.6	164.2	0	0	0	111.5	S10 L11 A16 S17 V18	S10-I14 VanDerWaalsContact O-CG1 3.3Å; S10-I14 WeakPolarHBondContact O-CG1 3.3Å; S10-I14 PolarHBondContact O-N 3.17Å; L11-I14 PolarHBondContact O-N 3.22Å; I14-A16 VanDerWaalsContact C-N 3.31Å; I14-A16 PolarHBondContact O-N 3.19Å; I14-S17 WeakPolarHBondContact O-CB 3.41Å; I14-S17 PolarHBondContact O-N 3.09Å; I14-V18 PolarHBondContact O-N 2.92Å
15	V	75.6	Confident	72.1	Confident	73 Å²	73	67.9 Å²	67.9	44%	0.442	36%	0.358	S	S	.	.	H	α-helix	trans	-59.8	-44.9	178.9	172.3	0	0	0	0	110.4	L11 C13 S17 V18 F19	L11-V15 WeakPolarHBondContact O-CG2 3.32Å; L11-V15 PolarHBondContact O-N 2.94Å; C13-V15 PolarHBondContact O-N 3.48Å; V15-S17 VanDerWaalsContact C-N 3.33Å; V15-S17 PolarHBondContact O-N 3.41Å; V15-V18 PolarHBondContact O-N 3.31Å; V15-F19 HydrophobicContact CG1-CD2 4.04Å; V15-F19 HydrophobicContact CG1-CE2 3.73Å; V15-F19 WeakPolarHBondContact O-CD2 3.49Å; V15-F19 PolarHBondContact O-N 3.49Å
16	A	72.2	Confident	72.6	Confident	12 Å²	12	62.7 Å²	62.7	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-38.7	178.1	0	0	0	0	0	112.1	R12 C13 I14 V18 F19 T20 V28 L35	R12-A16 WeakPolarHBondContact O-CB 3.39Å; R12-A16 PolarHBondContact O-N 3.45Å; C13-A16 PolarHBondContact O-N 2.76Å; I14-A16 VanDerWaalsContact C-N 3.31Å; I14-A16 PolarHBondContact O-N 3.19Å; A16-V18 PolarHBondContact O-N 3.09Å; A16-F19 PolarHBondContact O-N 3.04Å; A16-T20 PolarHBondContact O-N 3.11Å; A16-V28 HydrophobicContact CB-CB 4.48Å; A16-V28 HydrophobicContact CB-CG1 4.01Å; A16-V28 HydrophobicContact CB-CG2 3.67Å; A16-L35 HydrophobicContact CB-CD1 4.49Å
17	S	70.6	Confident	73.7	Confident	26 Å²	26	60.2 Å²	60.2	18%	0.182	33%	0.326	C	S	.	.	H	α-helix	trans	-57.4	-47.2	176	-57	0	0	0	0	111.9	C13 I14 V15 F19 T20 V21 F103	C13-S17 PolarHBondContact O-N 3.18Å; C13-S17 PolarHBondContact O-OG 3.23Å; I14-S17 WeakPolarHBondContact O-CB 3.41Å; I14-S17 PolarHBondContact O-N 3.09Å; V15-S17 VanDerWaalsContact C-N 3.33Å; V15-S17 PolarHBondContact O-N 3.41Å; S17-F19 VanDerWaalsContact C-N 3.31Å; S17-F19 PolarHBondContact O-N 3.42Å; S17-T20 PolarHBondContact O-N 3.38Å; S17-T20 VanDerWaalsContact O-N 3.15Å; S17-T20 PolarHBondContact O-OG1 3.33Å; S17-V21 PolarHBondContact O-N 3.32Å; S17-F103 VanDerWaalsContact CB-CE2 3.41Å; S17-F103 WeakPolarHBondContact OG-CE2 3.49Å
18	V	71.6	Confident	74.5	Confident	93 Å²	93	53.6 Å²	53.6	56%	0.564	30%	0.297	S	S	*	.	H	α-helix	trans	-57.2	-44.1	179.2	175.9	0	0	0	0	111.3	I14 V15 A16 T20 V21	I14-V18 PolarHBondContact O-N 2.92Å; V15-V18 PolarHBondContact O-N 3.31Å; A16-V18 PolarHBondContact O-N 3.09Å; V18-T20 VanDerWaalsContact C-N 3.32Å; V18-T20 PolarHBondContact O-N 3.17Å; V18-V21 PolarHBondContact O-N 3.1Å
19	F	71.2	Confident	75.3	Confident	112 Å²	112	50 Å²	50	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-66.5	-30.4	179.8	-79.9	-71.9	0	0	0	114.1	V15 A16 S17 M37	V15-F19 HydrophobicContact CG1-CD2 4.04Å; V15-F19 HydrophobicContact CG1-CE2 3.73Å; V15-F19 WeakPolarHBondContact O-CD2 3.49Å; V15-F19 PolarHBondContact O-N 3.49Å; A16-F19 PolarHBondContact O-N 3.04Å; S17-F19 VanDerWaalsContact C-N 3.31Å; S17-F19 PolarHBondContact O-N 3.42Å; F19-M37 HydrophobicContact CB-CE 4.17Å; F19-M37 HydrophobicContact CB-SD 3.8Å; F19-M37 HydrophobicContact CD1-CE 4.44Å; F19-M37 HydrophobicContact CD2-CE 4.36Å; F19-M37 HydrophobicContact CG-CE 4.08Å; F19-M37 HydrophobicContact CG-SD 4.37Å
20	T	75	Confident	76.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-76.1	-33.3	180	58.9	0	0	0	0	113.4	A16 S17 V18 S22 N23 N26 V28 F103	A16-T20 PolarHBondContact O-N 3.11Å; S17-T20 PolarHBondContact O-N 3.38Å; S17-T20 VanDerWaalsContact O-N 3.15Å; S17-T20 PolarHBondContact O-OG1 3.33Å; V18-T20 VanDerWaalsContact C-N 3.32Å; V18-T20 PolarHBondContact O-N 3.17Å; T20-S22 PolarHBondContact O-N 2.89Å; T20-N23 CarbonylContact O-C 3.59Å; T20-N23 PolarHBondContact O-N 3.06Å; T20-N23 VanDerWaalsContact O-N 3.09Å; T20-N26 WeakPolarHBondContact CG2-O 3.18Å; T20-V28 HydrophobicContact CG2-CG2 3.51Å; T20-F103 CarbonylContact C-O 3.51Å; T20-F103 WeakPolarHBondContact OG1-CD2 3.34Å; T20-F103 PolarHBondContact OG1-N 3.44Å
21	V	71.1	Confident	76.9	Confident	39 Å²	39	51.8 Å²	51.8	24%	0.236	29%	0.285	C	S	.	.	H	α-helix	trans	-57.6	-40.2	175.3	178.4	0	0	0	0	110.3	S17 V18 N23 F103	S17-V21 PolarHBondContact O-N 3.32Å; V18-V21 PolarHBondContact O-N 3.1Å; V21-N23 VanDerWaalsContact C-N 3.31Å; V21-N23 PolarHBondContact O-N 3.22Å; V21-F103 WeakPolarHBondContact CA-O 3.49Å; V21-F103 HydrophobicContact CG2-CB 3.56Å; V21-F103 PolarHBondContact N-O 3.41Å
22	S	69.4	Low	77.1	Confident	103 Å²	103	53.9 Å²	53.9	72%	0.72	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-20	179.9	-49.9	0	0	0	0	114.7	T20	T20-S22 PolarHBondContact O-N 2.89Å
23	N	72.4	Confident	77	Confident	57 Å²	57	51 Å²	51	31%	0.305	29%	0.292	S	S	.	.			trans	-153	99.2	179.5	-168.9	-29.8	0	0	0	111	T20 V21 A25 N26	T20-N23 CarbonylContact O-C 3.59Å; T20-N23 PolarHBondContact O-N 3.06Å; T20-N23 VanDerWaalsContact O-N 3.09Å; V21-N23 VanDerWaalsContact C-N 3.31Å; V21-N23 PolarHBondContact O-N 3.22Å; N23-A25 PolarHBondContact O-N 3.25Å; N23-A25 VanDerWaalsContact O-N 3.08Å; N23-A25 WeakPolarHBondContact OD1-CB 3.18Å; N23-A25 PolarHBondContact OD1-N 2.94Å; N23-N26 WeakPolarHBondContact O-CB 3.45Å; N23-N26 PolarHBondContact O-N 3.48Å
24	P	67.9	Low	77.5	Confident	72 Å²	72	56.3 Å²	56.3	47%	0.468	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.4	-173.9	27.2	-35	0	0	0	113.7	N26 R104	P24-N26 PolarHBondContact O-N 3.4Å; P24-R104 HydrophobicContact CB-CB 4.2Å
25	A	73.1	Confident	78.1	Confident	27 Å²	27	53.3 Å²	53.3	22%	0.223	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-16.9	172.9	0	0	0	0	0	112.4	N23 R39 L40	N23-A25 PolarHBondContact O-N 3.25Å; N23-A25 VanDerWaalsContact O-N 3.08Å; N23-A25 WeakPolarHBondContact OD1-CB 3.18Å; N23-A25 PolarHBondContact OD1-N 2.94Å; A25-R39 HydrophobicContact CB-CG 4.16Å; A25-R39 WeakPolarHBondContact O-CA 3.35Å; A25-L40 PolarHBondContact O-N 3.43Å
26	N	84.8	Confident	78.6	Confident	40 Å²	40	56.5 Å²	56.5	21%	0.214	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	117.2	177.6	-69.4	-23	0	0	0	110.2	T20 N23 P24 Y102	T20-N26 WeakPolarHBondContact CG2-O 3.18Å; N23-N26 WeakPolarHBondContact O-CB 3.45Å; N23-N26 PolarHBondContact O-N 3.48Å; P24-N26 PolarHBondContact O-N 3.4Å; N26-Y102 WeakPolarHBondContact O-CB 3.29Å
27	V	89.1	Confident	79.3	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.018	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	133.3	174.4	-176.4	0	0	0	0	109.1	M29 M37 K38 L40 Y102 L118	V27-M29 HydrophobicContact CB-SD 4.24Å; V27-M29 HydrophobicContact CG1-SD 3.75Å; V27-M29 PolarHBondContact O-N 3.19Å; V27-M37 WeakPolarHBondContact O-CA 3.38Å; V27-K38 PolarHBondContact N-O 2.86Å; V27-K38 PolarHBondContact O-N 3.41Å; V27-L40 HydrophobicContact CB-CD1 4.05Å; V27-L40 HydrophobicContact CB-CG 4.2Å; V27-L40 HydrophobicContact CG1-CD1 4.15Å; V27-L40 HydrophobicContact CG2-CB 4.06Å; V27-L40 HydrophobicContact CG2-CD1 4.06Å; V27-L40 HydrophobicContact CG2-CG 4.14Å; V27-Y102 HydrophobicContact CG1-CD1 4.32Å; V27-Y102 HydrophobicContact CG2-CD1 3.86Å; V27-Y102 HydrophobicContact CG2-CE1 4.35Å; V27-Y102 HydrophobicContact CG2-CG 4.33Å; V27-L118 HydrophobicContact CG1-CD1 3.87Å
28	V	90.7	Very high	80.2	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	104.6	172.2	-178.1	0	0	0	0	107.5	A16 T20 L35 M37 G100 F101	A16-V28 HydrophobicContact CB-CB 4.48Å; A16-V28 HydrophobicContact CB-CG1 4.01Å; A16-V28 HydrophobicContact CB-CG2 3.67Å; T20-V28 HydrophobicContact CG2-CG2 3.51Å; V28-L35 HydrophobicContact CG1-CB 3.83Å; V28-L35 HydrophobicContact CG1-CD1 4.33Å; V28-L35 HydrophobicContact CG1-CD2 4.11Å; V28-L35 HydrophobicContact CG1-CG 4.31Å; V28-M37 HydrophobicContact CG2-CG 4.39Å; V28-G100 CarbonylContact O-C 3.57Å; V28-G100 WeakPolarHBondContact O-CA 3.37Å; V28-F101 HydrophobicContact CB-CD1 4.38Å; V28-F101 HydrophobicContact CB-CD2 4.35Å; V28-F101 HydrophobicContact CB-CE1 4.09Å; V28-F101 HydrophobicContact CB-CE2 4.05Å; V28-F101 HydrophobicContact CB-CZ 3.92Å; V28-F101 WeakPolarHBondContact CB-O 3.47Å; V28-F101 HydrophobicContact CG1-CE1 3.79Å; V28-F101 HydrophobicContact CG1-CE2 4.25Å; V28-F101 HydrophobicContact CG1-CZ 3.64Å; V28-F101 HydrophobicContact CG2-CE2 4.25Å; V28-F101 HydrophobicContact CG2-CZ 4.45Å; V28-F101 PolarHBondContact N-O 3.31Å; V28-F101 PolarHBondContact O-N 3.43Å
29	M	91.2	Very high	81	Confident	10 Å²	10	66 Å²	66	5%	0.049	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	138.6	176.6	-57.3	-54.8	-63.6	0	0	110.8	V27 E31 L35 R36 K38 L40 F99	V27-M29 HydrophobicContact CB-SD 4.24Å; V27-M29 HydrophobicContact CG1-SD 3.75Å; V27-M29 PolarHBondContact O-N 3.19Å; M29-E31 HydrophobicContact CB-CG 4.48Å; M29-L35 WeakPolarHBondContact O-CA 3.15Å; M29-R36 WeakPolarHBondContact CB-O 2.99Å; M29-R36 PolarHBondContact N-O 3.44Å; M29-R36 PolarHBondContact O-N 3.44Å; M29-K38 HydrophobicContact CG-CB 3.61Å; M29-K38 HydrophobicContact CG-CD 4.12Å; M29-L40 HydrophobicContact CE-CD1 4.33Å; M29-L40 HydrophobicContact SD-CD1 3.68Å; M29-L40 HydrophobicContact SD-CG 4.34Å; M29-F99 WeakPolarHBondContact CA-O 3.32Å; M29-F99 WeakPolarHBondContact CE-O 3.36Å
30	V	89.6	Confident	81.8	Confident	8 Å²	8	61.3 Å²	61.3	5%	0.048	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	100.4	177.1	-174.8	0	0	0	0	108.7	L35 V88 R97 L98 F99 F101	V30-L35 HydrophobicContact CG2-CD2 3.94Å; V30-V88 HydrophobicContact CG1-CG1 4.27Å; V30-V88 HydrophobicContact CG1-CG2 4.24Å; V30-V88 HydrophobicContact CG2-CG2 3.91Å; V30-R97 PolarHBondContact O-NH2 2.86Å; V30-L98 HydrophobicContact CG2-CD2 4.2Å; V30-L98 HydrophobicContact CG2-CG 4.16Å; V30-F99 PolarHBondContact N-O 2.78Å; V30-F101 HydrophobicContact CG2-CD1 4.23Å; V30-F101 HydrophobicContact CG2-CE1 4.12Å
31	E	85.6	Confident	82.5	Confident	75 Å²	75	65.4 Å²	65.4	35%	0.35	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	117.7	-178.1	-67.2	176.9	-177.4	0	0	109.1	M29 D33 K34 R36	M29-E31 HydrophobicContact CB-CG 4.48Å; E31-D33 PolarHBondContact O-N 3.24Å; E31-K34 PolarHBondContact N-O 3.28Å; E31-K34 WeakPolarHBondContact O-CA 3.22Å; E31-K34 VanDerWaalsContact O-CB 3.31Å; E31-K34 WeakPolarHBondContact O-CB 3.22Å; E31-K34 PolarHBondContact O-N 3.25Å; E31-K34 VanDerWaalsContact O-O 3.13Å; E31-R36 WeakPolarHBondContact OE2-CD 3.5Å; E31-R36 IonicContact OE2-NE 2.8Å
32	D	79.3	Confident	83.4	Confident	125 Å²	125	65.7 Å²	65.7	67%	0.668	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	48.6	172.7	-58.3	-31.2	0	0	0	115.4	K34 K91	D32-K34 PolarHBondContact O-N 2.89Å; D32-K91 VanDerWaalsContact C-NZ 3.31Å
33	D	72.1	Confident	84.4	Confident	82 Å²	82	63.6 Å²	63.6	44%	0.439	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	10.6	-177.4	-53.2	-48.7	0	0	0	114.4	E31 K91	E31-D33 PolarHBondContact O-N 3.24Å; D33-K91 WeakPolarHBondContact OD1-CE 3.27Å; D33-K91 IonicContact OD1-NZ 2.75Å; D33-K91 PolarHBondContact OD1-NZ 2.74Å; D33-K91 IonicContact OD2-NZ 3.18Å; D33-K91 PolarHBondContact OD2-NZ 3Å
34	K	81	Confident	85.2	Confident	122 Å²	122	65.8 Å²	65.8	53%	0.53	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	141.6	174.2	-60	177.4	-177.4	174.7	0	109.5	E31 D32	E31-K34 PolarHBondContact N-O 3.28Å; E31-K34 WeakPolarHBondContact O-CA 3.22Å; E31-K34 VanDerWaalsContact O-CB 3.31Å; E31-K34 WeakPolarHBondContact O-CB 3.22Å; E31-K34 PolarHBondContact O-N 3.25Å; E31-K34 VanDerWaalsContact O-O 3.13Å; D32-K34 PolarHBondContact O-N 2.89Å
35	L	86.2	Confident	86	Confident	39 Å²	39	64.3 Å²	64.3	20%	0.204	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.9	170.2	-57.7	-175.1	0	0	0	107.9	R12 A16 V28 M29 V30 V88 F101	R12-L35 HydrophobicContact CB-CD1 3.99Å; A16-L35 HydrophobicContact CB-CD1 4.49Å; V28-L35 HydrophobicContact CG1-CB 3.83Å; V28-L35 HydrophobicContact CG1-CD1 4.33Å; V28-L35 HydrophobicContact CG1-CD2 4.11Å; V28-L35 HydrophobicContact CG1-CG 4.31Å; M29-L35 WeakPolarHBondContact O-CA 3.15Å; V30-L35 HydrophobicContact CG2-CD2 3.94Å; L35-V88 HydrophobicContact CD2-CG1 4.23Å; L35-V88 HydrophobicContact CD2-CG2 4.23Å; L35-F101 HydrophobicContact CD1-CZ 4.48Å; L35-F101 HydrophobicContact CD2-CE1 4.25Å
36	R	86.9	Confident	86.3	Confident	141 Å²	141	67 Å²	67	53%	0.532	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.8	177.4	-68.5	-176.2	179.8	-97.4	6.5	109.7	M29 E31	M29-R36 WeakPolarHBondContact CB-O 2.99Å; M29-R36 PolarHBondContact N-O 3.44Å; M29-R36 PolarHBondContact O-N 3.44Å; E31-R36 WeakPolarHBondContact OE2-CD 3.5Å; E31-R36 IonicContact OE2-NE 2.8Å
37	M	87.2	Confident	86.1	Confident	103 Å²	103	70.8 Å²	70.8	51%	0.507	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.4	170.2	-77.8	-164.3	-80.9	0	0	110.3	F19 V27 V28	F19-M37 HydrophobicContact CB-CE 4.17Å; F19-M37 HydrophobicContact CB-SD 3.8Å; F19-M37 HydrophobicContact CD1-CE 4.44Å; F19-M37 HydrophobicContact CD2-CE 4.36Å; F19-M37 HydrophobicContact CG-CE 4.08Å; F19-M37 HydrophobicContact CG-SD 4.37Å; V27-M37 WeakPolarHBondContact O-CA 3.38Å; V28-M37 HydrophobicContact CG2-CG 4.39Å
38	K	88.4	Confident	85.4	Confident	82 Å²	82	73.9 Å²	73.9	36%	0.357	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	138.3	176.1	-169.5	175.2	-179.8	-179.4	0	109.6	V27 M29 L40	V27-K38 PolarHBondContact N-O 2.86Å; V27-K38 PolarHBondContact O-N 3.41Å; M29-K38 HydrophobicContact CG-CB 3.61Å; M29-K38 HydrophobicContact CG-CD 4.12Å; K38-L40 HydrophobicContact CD-CD2 3.93Å; K38-L40 HydrophobicContact CG-CD2 4.13Å; K38-L40 PolarHBondContact O-N 3.38Å
39	R	88	Confident	84.4	Confident	146 Å²	146	75.4 Å²	75.4	55%	0.551	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	115.8	169.8	-176.4	177.6	-105.5	-137.9	-5	109.9	A25	A25-R39 HydrophobicContact CB-CG 4.16Å; A25-R39 WeakPolarHBondContact O-CA 3.35Å
40	L	88.4	Confident	83.4	Confident	13 Å²	13	79.9 Å²	79.9	7%	0.068	40%	0.402	C	S	.	.			trans	-108.5	146.9	174.9	-64	-173.3	0	0	0	110.7	A25 V27 M29 K38 L42 L118	A25-L40 PolarHBondContact O-N 3.43Å; V27-L40 HydrophobicContact CB-CD1 4.05Å; V27-L40 HydrophobicContact CB-CG 4.2Å; V27-L40 HydrophobicContact CG1-CD1 4.15Å; V27-L40 HydrophobicContact CG2-CB 4.06Å; V27-L40 HydrophobicContact CG2-CD1 4.06Å; V27-L40 HydrophobicContact CG2-CG 4.14Å; M29-L40 HydrophobicContact CE-CD1 4.33Å; M29-L40 HydrophobicContact SD-CD1 3.68Å; M29-L40 HydrophobicContact SD-CG 4.34Å; K38-L40 HydrophobicContact CD-CD2 3.93Å; K38-L40 HydrophobicContact CG-CD2 4.13Å; K38-L40 PolarHBondContact O-N 3.38Å; L40-L42 HydrophobicContact CB-CD2 4.24Å; L40-L42 HydrophobicContact CB-CG 4.21Å; L40-L42 HydrophobicContact CD1-CD2 4.29Å; L40-L118 HydrophobicContact CD1-CD1 3.68Å
41	I	89	Confident	82.2	Confident	85 Å²	85	81.5 Å²	81.5	44%	0.436	42%	0.42	S	S	.	.			trans	-113.8	106.9	169.9	-56.3	175.2	0	0	0	105.8	D61 M62	I41-D61 WeakPolarHBondContact O-CA 3.22Å; I41-M62 HydrophobicContact CB-CB 4.3Å; I41-M62 HydrophobicContact CB-CG 4.47Å; I41-M62 HydrophobicContact CB-SD 4.48Å; I41-M62 HydrophobicContact CG2-CB 4.28Å; I41-M62 HydrophobicContact CG2-CG 4Å; I41-M62 HydrophobicContact CG2-SD 3.49Å; I41-M62 WeakPolarHBondContact CG2-SD 3.43Å; I41-M62 PolarHBondContact O-N 3.31Å
42	L	90.2	Very high	80.9	Confident	46 Å²	46	83.2 Å²	83.2	24%	0.241	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.6	-173.9	-61.2	176.3	0	0	0	109.7	L40 V59 R60 D61 L118	L40-L42 HydrophobicContact CB-CD2 4.24Å; L40-L42 HydrophobicContact CB-CG 4.21Å; L40-L42 HydrophobicContact CD1-CD2 4.29Å; L42-V59 HydrophobicContact CB-CB 4.44Å; L42-V59 HydrophobicContact CD1-CG2 4.41Å; L42-V59 HydrophobicContact CD2-CG2 4.35Å; L42-R60 CarbonylContact C-O 3.51Å; L42-R60 WeakPolarHBondContact CA-O 3.14Å; L42-D61 HydrophobicContact CD2-CB 4.12Å; L42-L118 HydrophobicContact CD1-CD1 4.24Å; L42-L118 HydrophobicContact CD1-CD2 3.8Å
43	T	90.9	Very high	80.3	Confident	58 Å²	58	82.1 Å²	82.1	36%	0.356	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	134.9	167.5	57.3	0	0	0	0	109.9	V59 R60 M62	T43-V59 CarbonylContact O-C 3.55Å; T43-V59 VanDerWaalsContact O-CA 3.24Å; T43-V59 WeakPolarHBondContact O-CA 3.45Å; T43-R60 PolarHBondContact N-O 3.49Å; T43-R60 PolarHBondContact O-N 3.29Å; T43-R60 PolarHBondContact OG1-O 3.48Å; T43-M62 HydrophobicContact CG2-CG 3.65Å; T43-M62 HydrophobicContact CG2-SD 3.57Å; T43-M62 VanDerWaalsContact CG2-SD 3.57Å
44	R	88.5	Confident	80.2	Confident	104 Å²	104	78.6 Å²	78.6	39%	0.392	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	135.8	175.1	-66.9	-174.9	-171.6	-174.2	6.5	110.1	V59 M70 D397	R44-V59 HydrophobicContact CG-CG1 4.38Å; R44-M70 HydrophobicContact CG-CE 4.49Å; R44-D397 IonicContact CZ-OD1 2.73Å; R44-D397 IonicContact NE-OD1 3.41Å; R44-D397 PolarHBondContact NE-OD1 3.39Å; R44-D397 IonicContact NH1-OD1 2.67Å; R44-D397 IonicContact NH2-OD1 2.72Å; R44-D397 PolarHBondContact NH2-OD1 3.33Å; R44-D397 IonicContact NH2-OD2 3.47Å; R44-D397 PolarHBondContact NH2-OD2 2.85Å; R44-D397 VanDerWaalsContact NH2-OD2 3.1Å
45	G	84.7	Confident	80.2	Confident	40 Å²	40	73.8 Å²	73.8	41%	0.412	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-149	170.1	0	0	0	0	0	110.7	T57 M58	G45-T57 WeakPolarHBondContact O-CG2 2.96Å; G45-M58 WeakPolarHBondContact CA-O 3.38Å; G45-M58 PolarHBondContact N-O 2.8Å
46	N	80.1	Confident	80.2	Confident	85 Å²	85	74 Å²	74	46%	0.455	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	148	-177.5	-60	-16.3	0	0	0	112.2	L48 M58	N46-L48 PolarHBondContact O-N 2.96Å; N46-M58 WeakPolarHBondContact O-CB 3.31Å; N46-M58 PolarHBondContact O-N 3.31Å
47	E	80.8	Confident	80.3	Confident	119 Å²	119	67.9 Å²	67.9	56%	0.556	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	130.7	165.3	-64.2	-175	175.5	0	0	110	I55	E47-I55 HydrophobicContact CG-CG2 4.46Å
48	L	74.1	Confident	80.4	Confident	67 Å²	67	63.5 Å²	63.5	35%	0.351	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-30.2	177.1	-65.4	177.6	0	0	0	111.4	N46 V56 M58 A69	N46-L48 PolarHBondContact O-N 2.96Å; L48-V56 HydrophobicContact CB-CB 4.48Å; L48-V56 HydrophobicContact CB-CG1 4.18Å; L48-V56 HydrophobicContact CD1-CG1 4.25Å; L48-V56 PolarHBondContact N-O 3.47Å; L48-M58 HydrophobicContact CD1-CB 4.02Å; L48-M58 HydrophobicContact CD2-CB 4.04Å; L48-M58 HydrophobicContact CD2-SD 4.5Å; L48-M58 HydrophobicContact CG-CB 3.93Å; L48-A69 HydrophobicContact CD1-CB 3.7Å
49	G	70.3	Confident	80.6	Confident	33 Å²	33	59.7 Å²	59.7	34%	0.34	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.7	153.3	175.7	0	0	0	0	0	112.7	V56	G49-V56 PolarHBondContact N-O 3.02Å; G49-V56 PolarHBondContact O-N 3.35Å
50	T	70.8	Confident	80.9	Confident	105 Å²	105	54.8 Å²	54.8	64%	0.644	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.4	172.9	58.1	0	0	0	0	108.6	I55	T50-I55 HydrophobicContact CG2-CG1 4.2Å; T50-I55 HydrophobicContact CG2-CG2 4.29Å
51	G	63.7	Low	81	Confident	41 Å²	41	54.2 Å²	54.2	42%	0.423	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	179.7	-179.2	0	0	0	0	0	112.4	Y53 G54	G51-Y53 PolarHBondContact O-N 3.1Å; G51-Y53 VanDerWaalsContact O-N 3.11Å; G51-G54 PolarHBondContact N-O 3.15Å; G51-G54 PolarHBondContact O-N 3.39Å
52	T	59.3	Low	81	Confident	111 Å²	111	54.8 Å²	54.8	68%	0.681	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.7	-179.7	-43.1	0	0	0	0	113
53	Y	65.7	Low	81	Confident	103 Å²	103	59 Å²	59	40%	0.404	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	1.6	-175.3	-57.3	-73.7	0	0	0	114.3	G51 S73 Q413	G51-Y53 PolarHBondContact O-N 3.1Å; G51-Y53 VanDerWaalsContact O-N 3.11Å; Y53-S73 PolarHBondContact O-OG 3.22Å; Y53-Q413 HydrophobicContact CE2-CB 4.11Å; Y53-Q413 WeakPolarHBondContact OH-CB 3.44Å; Y53-Q413 VanDerWaalsContact OH-CG 3.22Å; Y53-Q413 WeakPolarHBondContact OH-CG 3.39Å; Y53-Q413 PolarHBondContact OH-OE1 3.24Å
54	G	70.2	Confident	81	Confident	8 Å²	8	59 Å²	59	8%	0.082	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	131.7	-165.2	179	0	0	0	0	0	113.6	G51 V72	G51-G54 PolarHBondContact N-O 3.15Å; G51-G54 PolarHBondContact O-N 3.39Å; G54-V72 WeakPolarHBondContact CA-O 3.18Å
55	I	80.4	Confident	81.1	Confident	21 Å²	21	60.1 Å²	60.1	11%	0.108	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136	-177.5	-58.1	172.7	0	0	0	108.2	E47 T50 V72 A400 L402	E47-I55 HydrophobicContact CG-CG2 4.46Å; T50-I55 HydrophobicContact CG2-CG1 4.2Å; T50-I55 HydrophobicContact CG2-CG2 4.29Å; I55-V72 PolarHBondContact N-O 3Å; I55-V72 PolarHBondContact O-N 3.19Å; I55-A400 HydrophobicContact CD1-CB 3.96Å; I55-L402 HydrophobicContact CD1-CD2 4.36Å; I55-L402 HydrophobicContact CG1-CD2 4.27Å
56	V	86.3	Confident	81.4	Confident	43 Å²	43	63.5 Å²	63.5	26%	0.261	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.2	171.7	-173.1	0	0	0	0	108.2	L48 G49 A69 M70 K71	L48-V56 HydrophobicContact CB-CB 4.48Å; L48-V56 HydrophobicContact CB-CG1 4.18Å; L48-V56 HydrophobicContact CD1-CG1 4.25Å; L48-V56 PolarHBondContact N-O 3.47Å; G49-V56 PolarHBondContact N-O 3.02Å; G49-V56 PolarHBondContact O-N 3.35Å; V56-A69 HydrophobicContact CG1-CB 3.97Å; V56-M70 WeakPolarHBondContact CA-O 3.38Å; V56-K71 HydrophobicContact CG2-CB 4.32Å; V56-K71 HydrophobicContact CG2-CG 4.35Å
57	T	88.7	Confident	81.9	Confident	13 Å²	13	61.5 Å²	61.5	8%	0.08	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	141.6	-178.8	-49.5	0	0	0	0	109.6	G45 M70	G45-T57 WeakPolarHBondContact O-CG2 2.96Å; T57-M70 PolarHBondContact N-O 3.35Å; T57-M70 PolarHBondContact O-N 3.49Å
58	M	89.9	Confident	82.5	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.049	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	133.1	171.1	-172.1	156.3	57.9	0	0	109.2	G45 N46 L48 Y67 Y68 L372	G45-M58 WeakPolarHBondContact CA-O 3.38Å; G45-M58 PolarHBondContact N-O 2.8Å; N46-M58 WeakPolarHBondContact O-CB 3.31Å; N46-M58 PolarHBondContact O-N 3.31Å; L48-M58 HydrophobicContact CD1-CB 4.02Å; L48-M58 HydrophobicContact CD2-CB 4.04Å; L48-M58 HydrophobicContact CD2-SD 4.5Å; L48-M58 HydrophobicContact CG-CB 3.93Å; M58-Y67 HydrophobicContact CG-CD1 3.99Å; M58-Y67 HydrophobicContact SD-CD1 4.01Å; M58-Y68 WeakPolarHBondContact CA-O 3.41Å; M58-L372 HydrophobicContact SD-CD2 4.19Å
59	V	92.2	Very high	83.3	Confident	2 Å²	2	54 Å²	54	1%	0.012	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152.9	174.5	-62.1	0	0	0	0	110.5	L42 T43 R44 Y67 Y68 M70 L118	L42-V59 HydrophobicContact CB-CB 4.44Å; L42-V59 HydrophobicContact CD1-CG2 4.41Å; L42-V59 HydrophobicContact CD2-CG2 4.35Å; T43-V59 CarbonylContact O-C 3.55Å; T43-V59 VanDerWaalsContact O-CA 3.24Å; T43-V59 WeakPolarHBondContact O-CA 3.45Å; R44-V59 HydrophobicContact CG-CG1 4.38Å; V59-Y67 CarbonylContact O-C 3.53Å; V59-Y67 VanDerWaalsContact O-CA 3.28Å; V59-Y67 WeakPolarHBondContact O-CA 3.43Å; V59-Y68 HydrophobicContact CG2-CD2 4.47Å; V59-Y68 PolarHBondContact N-O 3.43Å; V59-Y68 PolarHBondContact O-N 3.34Å; V59-M70 HydrophobicContact CB-CB 4.44Å; V59-M70 HydrophobicContact CG1-CB 3.66Å; V59-M70 HydrophobicContact CG1-CE 3.64Å; V59-M70 HydrophobicContact CG1-CG 4.41Å; V59-M70 HydrophobicContact CG1-SD 3.92Å; V59-M70 HydrophobicContact CG2-CB 3.89Å; V59-L118 HydrophobicContact CG2-CD2 3.92Å
60	R	93.6	Very high	84.4	Confident	44 Å²	44	52.6 Å²	52.6	17%	0.166	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.9	177.5	-169.9	-173.5	-168	176.4	7.7	110.3	L42 T43 M62 Q66 Y67	L42-R60 CarbonylContact C-O 3.51Å; L42-R60 WeakPolarHBondContact CA-O 3.14Å; T43-R60 PolarHBondContact N-O 3.49Å; T43-R60 PolarHBondContact O-N 3.29Å; T43-R60 PolarHBondContact OG1-O 3.48Å; R60-M62 PolarHBondContact O-N 3.07Å; R60-Q66 CarbonylContact C-O 3.33Å; R60-Q66 WeakPolarHBondContact CA-O 3.39Å; R60-Y67 HydrophobicContact CB-CD1 3.96Å; R60-Y67 HydrophobicContact CB-CE1 3.94Å; R60-Y67 HydrophobicContact CB-CG 4.49Å; R60-Y67 HydrophobicContact CG-CD1 4.13Å; R60-Y67 HydrophobicContact CG-CD2 4.29Å; R60-Y67 HydrophobicContact CG-CE1 3.94Å; R60-Y67 HydrophobicContact CG-CE2 4.08Å; R60-Y67 HydrophobicContact CG-CG 4.32Å; R60-Y67 PolarHBondContact NE-OH 2.86Å
61	D	91.3	Very high	85.3	Confident	1 Å²	1	49 Å²	49	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	119.9	168.1	173.6	14.5	0	0	0	109.7	I41 L42 K63 T64 R65 Q66 Y68	I41-D61 WeakPolarHBondContact O-CA 3.22Å; L42-D61 HydrophobicContact CD2-CB 4.12Å; D61-K63 PolarHBondContact O-N 2.64Å; D61-K63 PolarHBondContact OD1-N 3.13Å; D61-T64 WeakPolarHBondContact CB-OG1 3.4Å; D61-T64 VanDerWaalsContact CG-OG1 3.29Å; D61-T64 WeakPolarHBondContact OD2-CB 3.22Å; D61-T64 VanDerWaalsContact OD2-CG2 3.24Å; D61-T64 WeakPolarHBondContact OD2-CG2 3.48Å; D61-T64 PolarHBondContact OD2-N 3.03Å; D61-T64 PolarHBondContact OD2-OG1 2.75Å; D61-R65 WeakPolarHBondContact O-CA 3.48Å; D61-R65 PolarHBondContact O-N 3.2Å; D61-Q66 PolarHBondContact N-O 3Å; D61-Y68 HydrophobicContact CB-CE2 4.08Å
62	M	89.4	Confident	86.5	Confident	96 Å²	96	47.7 Å²	47.7	47%	0.473	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.1	-179.4	-66.3	-170.5	70.4	0	0	113	I41 T43 R60	I41-M62 HydrophobicContact CB-CB 4.3Å; I41-M62 HydrophobicContact CB-CG 4.47Å; I41-M62 HydrophobicContact CB-SD 4.48Å; I41-M62 HydrophobicContact CG2-CB 4.28Å; I41-M62 HydrophobicContact CG2-CG 4Å; I41-M62 HydrophobicContact CG2-SD 3.49Å; I41-M62 WeakPolarHBondContact CG2-SD 3.43Å; I41-M62 PolarHBondContact O-N 3.31Å; T43-M62 HydrophobicContact CG2-CG 3.65Å; T43-M62 HydrophobicContact CG2-SD 3.57Å; T43-M62 VanDerWaalsContact CG2-SD 3.57Å; R60-M62 PolarHBondContact O-N 3.07Å
63	K	90.6	Very high	87.8	Confident	136 Å²	136	43.1 Å²	43.1	59%	0.591	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-53	-178.1	-67.1	-175.2	178	179.7	0	111.9	D61	D61-K63 PolarHBondContact O-N 2.64Å; D61-K63 PolarHBondContact OD1-N 3.13Å
64	T	90.7	Very high	88.7	Confident	56 Å²	56	42.7 Å²	42.7	34%	0.344	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-9.7	-176.6	64.1	0	0	0	0	113.4	D61 Q66	D61-T64 WeakPolarHBondContact CB-OG1 3.4Å; D61-T64 VanDerWaalsContact CG-OG1 3.29Å; D61-T64 WeakPolarHBondContact OD2-CB 3.22Å; D61-T64 VanDerWaalsContact OD2-CG2 3.24Å; D61-T64 WeakPolarHBondContact OD2-CG2 3.48Å; D61-T64 PolarHBondContact OD2-N 3.03Å; D61-T64 PolarHBondContact OD2-OG1 2.75Å; T64-Q66 PolarHBondContact O-N 2.91Å; T64-Q66 VanDerWaalsContact O-N 3.1Å; T64-Q66 WeakPolarHBondContact OG1-CB 3.44Å; T64-Q66 VanDerWaalsContact OG1-CG 3.31Å; T64-Q66 WeakPolarHBondContact OG1-CG 3.31Å; T64-Q66 PolarHBondContact OG1-N 3.32Å
65	R	90.7	Very high	89.2	Confident	129 Å²	129	44 Å²	44	49%	0.487	21%	0.21	S	C	.	.			trans	58.8	14.4	-173.2	-54.1	-69.3	-99.3	-179	-6.8	113.6	D61	D61-R65 WeakPolarHBondContact O-CA 3.48Å; D61-R65 PolarHBondContact O-N 3.2Å
66	Q	91	Very high	88.8	Confident	111 Å²	111	46.9 Å²	46.9	52%	0.519	23%	0.225	S	C	.	.			trans	-77.5	148.2	177.4	-64.9	-63.3	-29.2	0	0	111.1	R60 D61 T64 Y68	R60-Q66 CarbonylContact C-O 3.33Å; R60-Q66 WeakPolarHBondContact CA-O 3.39Å; D61-Q66 PolarHBondContact N-O 3Å; T64-Q66 PolarHBondContact O-N 2.91Å; T64-Q66 VanDerWaalsContact O-N 3.1Å; T64-Q66 WeakPolarHBondContact OG1-CB 3.44Å; T64-Q66 VanDerWaalsContact OG1-CG 3.31Å; T64-Q66 WeakPolarHBondContact OG1-CG 3.31Å; T64-Q66 PolarHBondContact OG1-N 3.32Å; Q66-Y68 HydrophobicContact CB-CE2 3.99Å
67	Y	91.1	Very high	87.9	Confident	43 Å²	43	50 Å²	50	17%	0.169	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143.7	179.2	-68.7	-102.5	0	0	0	111	M58 V59 R60 R371 L372	M58-Y67 HydrophobicContact CG-CD1 3.99Å; M58-Y67 HydrophobicContact SD-CD1 4.01Å; V59-Y67 CarbonylContact O-C 3.53Å; V59-Y67 VanDerWaalsContact O-CA 3.28Å; V59-Y67 WeakPolarHBondContact O-CA 3.43Å; R60-Y67 HydrophobicContact CB-CD1 3.96Å; R60-Y67 HydrophobicContact CB-CE1 3.94Å; R60-Y67 HydrophobicContact CB-CG 4.49Å; R60-Y67 HydrophobicContact CG-CD1 4.13Å; R60-Y67 HydrophobicContact CG-CD2 4.29Å; R60-Y67 HydrophobicContact CG-CE1 3.94Å; R60-Y67 HydrophobicContact CG-CE2 4.08Å; R60-Y67 HydrophobicContact CG-CG 4.32Å; R60-Y67 PolarHBondContact NE-OH 2.86Å; Y67-R371 PolarHBondContact OH-O 2.93Å; Y67-L372 HydrophobicContact CD1-CD2 3.58Å; Y67-L372 HydrophobicContact CD2-CB 4.33Å; Y67-L372 HydrophobicContact CD2-CD2 3.3Å; Y67-L372 HydrophobicContact CD2-CG 4.41Å; Y67-L372 HydrophobicContact CE1-CD2 4.09Å; Y67-L372 HydrophobicContact CE2-CB 4.21Å; Y67-L372 HydrophobicContact CE2-CD2 3.88Å; Y67-L372 WeakPolarHBondContact CE2-O 3.35Å; Y67-L372 HydrophobicContact CG-CD2 3.12Å; Y67-L372 PolarHBondContact OH-O 3.45Å
68	Y	92.8	Very high	86.8	Confident	22 Å²	22	56.4 Å²	56.4	9%	0.086	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.8	177.7	-52	-79.8	0	0	0	110.4	M58 V59 D61 Q66 F99 L118 L119 C121	M58-Y68 WeakPolarHBondContact CA-O 3.41Å; V59-Y68 HydrophobicContact CG2-CD2 4.47Å; V59-Y68 PolarHBondContact N-O 3.43Å; V59-Y68 PolarHBondContact O-N 3.34Å; D61-Y68 HydrophobicContact CB-CE2 4.08Å; Q66-Y68 HydrophobicContact CB-CE2 3.99Å; Y68-F99 HydrophobicContact CD1-CB 3.89Å; Y68-F99 AromaticContact CD1-CD2 3.65Å; Y68-F99 HydrophobicContact CD1-CD2 3.65Å; Y68-F99 HydrophobicContact CD1-CE2 4.34Å; Y68-F99 AromaticContact CD1-CG 3.81Å; Y68-F99 HydrophobicContact CD1-CG 3.81Å; Y68-F99 HydrophobicContact CE1-CB 3.71Å; Y68-F99 HydrophobicContact CE1-CD1 4.03Å; Y68-F99 AromaticContact CE1-CD2 3.87Å; Y68-F99 HydrophobicContact CE1-CD2 3.87Å; Y68-F99 HydrophobicContact CE1-CE2 4.49Å; Y68-F99 AromaticContact CE1-CG 3.6Å; Y68-F99 HydrophobicContact CE1-CG 3.6Å; Y68-L118 HydrophobicContact CD1-CB 4.36Å; Y68-L118 HydrophobicContact CD2-CD1 4.48Å; Y68-L118 HydrophobicContact CG-CB 4.19Å; Y68-L119 WeakPolarHBondContact CA-O 3.5Å; Y68-C121 VanDerWaalsContact CA-SG 3.54Å
69	A	91.4	Very high	85.5	Confident	6 Å²	6	59.8 Å²	59.8	5%	0.05	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	108.3	166.2	0	0	0	0	0	107.8	L48 V56 K71 L119 C121	L48-A69 HydrophobicContact CD1-CB 3.7Å; V56-A69 HydrophobicContact CG1-CB 3.97Å; A69-K71 PolarHBondContact O-N 2.8Å; A69-L119 HydrophobicContact CB-CB 4.28Å; A69-L119 PolarHBondContact N-O 3.35Å; A69-L119 WeakPolarHBondContact O-CB 3.18Å; A69-L119 PolarHBondContact O-N 2.85Å; A69-C121 PolarHBondContact N-SG 2.73Å
70	M	92.9	Very high	84	Confident	4 Å²	4	68 Å²	68	2%	0.02	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	109.7	178.2	-173.1	169	71	0	0	109.9	R44 V56 T57 V59 V72 M117 L118	R44-M70 HydrophobicContact CG-CE 4.49Å; V56-M70 WeakPolarHBondContact CA-O 3.38Å; T57-M70 PolarHBondContact N-O 3.35Å; T57-M70 PolarHBondContact O-N 3.49Å; V59-M70 HydrophobicContact CB-CB 4.44Å; V59-M70 HydrophobicContact CG1-CB 3.66Å; V59-M70 HydrophobicContact CG1-CE 3.64Å; V59-M70 HydrophobicContact CG1-CG 4.41Å; V59-M70 HydrophobicContact CG1-SD 3.92Å; V59-M70 HydrophobicContact CG2-CB 3.89Å; M70-V72 HydrophobicContact CE-CG2 4.08Å; M70-V72 HydrophobicContact CG-CG2 4.12Å; M70-M117 CarbonylContact C-O 3.57Å; M70-M117 VanDerWaalsContact CA-O 3.28Å; M70-M117 WeakPolarHBondContact CA-O 3.33Å; M70-L118 HydrophobicContact CB-CD2 4.27Å; M70-L118 HydrophobicContact CG-CD2 4.22Å; M70-L118 HydrophobicContact SD-CD2 4.44Å
71	K	90.1	Very high	82.7	Confident	28 Å²	28	68.3 Å²	68.3	12%	0.122	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	123.5	170.1	-179.1	-172.4	-179	-170.4	0	109	V56 A69 E83 N116 M117 L119	V56-K71 HydrophobicContact CG2-CB 4.32Å; V56-K71 HydrophobicContact CG2-CG 4.35Å; A69-K71 PolarHBondContact O-N 2.8Å; K71-E83 IonicContact NZ-OE1 2.76Å; K71-E83 PolarHBondContact NZ-OE1 2.93Å; K71-E83 IonicContact NZ-OE2 3.76Å; K71-E83 PolarHBondContact NZ-OE2 3.32Å; K71-N116 WeakPolarHBondContact O-CA 3.42Å; K71-M117 HydrophobicContact CB-CB 4.41Å; K71-M117 HydrophobicContact CD-SD 4.31Å; K71-M117 PolarHBondContact N-O 2.93Å; K71-M117 PolarHBondContact O-N 2.74Å; K71-L119 HydrophobicContact CB-CD1 3.93Å; K71-L119 HydrophobicContact CD-CD1 4.33Å
72	V	88.9	Confident	81.9	Confident	14 Å²	14	75.5 Å²	75.5	9%	0.085	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.6	177	-173.5	0	0	0	0	109.3	G54 I55 M70 I114 Q115 N116 L402	G54-V72 WeakPolarHBondContact CA-O 3.18Å; I55-V72 PolarHBondContact N-O 3Å; I55-V72 PolarHBondContact O-N 3.19Å; M70-V72 HydrophobicContact CE-CG2 4.08Å; M70-V72 HydrophobicContact CG-CG2 4.12Å; V72-I114 HydrophobicContact CG1-CG2 3.5Å; V72-Q115 WeakPolarHBondContact CA-O 3.45Å; V72-N116 WeakPolarHBondContact CG2-OD1 3.4Å; V72-L402 HydrophobicContact CG1-CD1 4.47Å
73	S	85.5	Confident	81.4	Confident	15 Å²	15	73.2 Å²	73.2	11%	0.105	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	150.5	-177.9	-61.7	0	0	0	0	110.8	Y53 Q115	Y53-S73 PolarHBondContact O-OG 3.22Å; S73-Q115 PolarHBondContact N-O 2.81Å; S73-Q115 PolarHBondContact O-N 2.81Å
74	I	84.3	Confident	81	Confident	94 Å²	94	67.1 Å²	67.1	48%	0.482	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	124.6	170.4	-64.7	170.4	0	0	0	108.1	T112 L402	I74-T112 HydrophobicContact CB-CG2 4.45Å; I74-T112 HydrophobicContact CG1-CG2 4.31Å; I74-T112 HydrophobicContact CG2-CG2 3.45Å; I74-T112 VanDerWaalsContact CG2-CG2 3.45Å; I74-L402 HydrophobicContact CD1-CB 4.4Å; I74-L402 HydrophobicContact CD1-CD1 4.36Å; I74-L402 HydrophobicContact CG1-CD1 4.04Å
75	L	80.8	Confident	80.4	Confident	37 Å²	37	67.3 Å²	67.3	19%	0.194	33%	0.33	C	S	.	.			trans	-74.1	127.8	174.9	-178.9	67.8	0	0	0	109.2	P77 D81 F103 I113	L75-P77 WeakPolarHBondContact O-CD 3.48Å; L75-D81 HydrophobicContact CD1-CB 4.14Å; L75-F103 HydrophobicContact CD1-CE1 4.44Å; L75-F103 HydrophobicContact CD2-CD1 4.13Å; L75-F103 HydrophobicContact CD2-CE1 4.01Å; L75-I113 HydrophobicContact CB-CB 4.15Å; L75-I113 HydrophobicContact CB-CG2 4.13Å; L75-I113 WeakPolarHBondContact CB-O 3.4Å; L75-I113 HydrophobicContact CD2-CB 4.23Å; L75-I113 HydrophobicContact CD2-CD1 4.44Å; L75-I113 HydrophobicContact CD2-CG2 3.9Å; L75-I113 PolarHBondContact N-O 3Å
76	N	72.7	Confident	79.9	Confident	81 Å²	81	61.8 Å²	61.8	43%	0.433	31%	0.31	S	S	.	.			trans	-87.7	111.7	168.7	-173.5	-17.4	0	0	0	108.8	N78 V79	N76-N78 PolarHBondContact O-N 2.8Å; N76-N78 VanDerWaalsContact O-N 3.11Å; N76-N78 WeakPolarHBondContact OD1-CB 3.46Å; N76-N78 PolarHBondContact OD1-N 3.08Å; N76-V79 HydrophobicContact CB-CB 4.3Å; N76-V79 HydrophobicContact CB-CG2 4.21Å; N76-V79 PolarHBondContact O-N 3.36Å; N76-V79 VanDerWaalsContact O-N 3.09Å
77	P	67.8	Low	79.6	Confident	109 Å²	109	57 Å²	57	71%	0.708	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.3	-177.6	26.8	-35.2	0	0	0	113	L75 V79	L75-P77 WeakPolarHBondContact O-CD 3.48Å; P77-V79 VanDerWaalsContact C-N 3.31Å
78	N	64.7	Low	79.3	Confident	146 Å²	146	55 Å²	55	78%	0.781	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-2.2	-179.8	-58.6	-46.4	0	0	0	113.3	N76	N76-N78 PolarHBondContact O-N 2.8Å; N76-N78 VanDerWaalsContact O-N 3.11Å; N76-N78 WeakPolarHBondContact OD1-CB 3.46Å; N76-N78 PolarHBondContact OD1-N 3.08Å
79	V	63.3	Low	78.6	Confident	81 Å²	81	55.2 Å²	55.2	49%	0.491	29%	0.285	S	S	.	.	S	Bend	trans	-126.1	122.8	-176.5	-177.3	0	0	0	0	109.1	N76 P77 D81	N76-V79 HydrophobicContact CB-CB 4.3Å; N76-V79 HydrophobicContact CB-CG2 4.21Å; N76-V79 PolarHBondContact O-N 3.36Å; N76-V79 VanDerWaalsContact O-N 3.09Å; P77-V79 VanDerWaalsContact C-N 3.31Å; V79-D81 PolarHBondContact O-N 2.92Å; V79-D81 VanDerWaalsContact O-N 3.1Å
80	H	60.6	Low	77.9	Confident	174 Å²	174	55.2 Å²	55.2	81%	0.806	28%	0.284	S	S	*	.			trans	-61.6	114.1	169.6	-68.5	-58	0	0	0	109.8	R82	H80-R82 PolarHBondContact O-N 2.75Å
81	D	66.9	Low	77.1	Confident	52 Å²	52	59.5 Å²	59.5	28%	0.278	30%	0.303	S	S	.	.			trans	-73.1	99.2	175.1	-176	20.3	0	0	0	110.5	L75 V79 E83 Q115	L75-D81 HydrophobicContact CD1-CB 4.14Å; V79-D81 PolarHBondContact O-N 2.92Å; V79-D81 VanDerWaalsContact O-N 3.1Å; D81-E83 VanDerWaalsContact C-N 3.27Å; D81-E83 WeakPolarHBondContact OD1-CB 3.26Å; D81-E83 PolarHBondContact OD1-N 2.91Å; D81-Q115 PolarHBondContact OD2-NE2 3.32Å; D81-Q115 PolarHBondContact OD2-OE1 2.94Å
82	R	73.8	Confident	76.6	Confident	151 Å²	151	59.3 Å²	59.3	57%	0.57	30%	0.302	S	S	*	.	H	α-helix	trans	-77.5	-13.4	176.1	-70.2	-177.3	-80.7	-178.6	-5	112.3	H80 L86	H80-R82 PolarHBondContact O-N 2.75Å; R82-L86 HydrophobicContact CB-CD1 4.28Å; R82-L86 VanDerWaalsContact O-CB 3.29Å; R82-L86 WeakPolarHBondContact O-CB 3.47Å; R82-L86 WeakPolarHBondContact O-CD1 3.33Å; R82-L86 WeakPolarHBondContact O-CG 3.44Å; R82-L86 PolarHBondContact O-N 2.71Å
83	E	78.8	Confident	76.1	Confident	49 Å²	49	62.4 Å²	62.4	23%	0.229	32%	0.322	C	S	.	.	H	α-helix	trans	-66.3	-50.1	-173.5	-167	178.4	179.1	0	0	111.4	K71 D81 L86 L87 M117	K71-E83 IonicContact NZ-OE1 2.76Å; K71-E83 PolarHBondContact NZ-OE1 2.93Å; K71-E83 IonicContact NZ-OE2 3.76Å; K71-E83 PolarHBondContact NZ-OE2 3.32Å; D81-E83 VanDerWaalsContact C-N 3.27Å; D81-E83 WeakPolarHBondContact OD1-CB 3.26Å; D81-E83 PolarHBondContact OD1-N 2.91Å; E83-L86 PolarHBondContact O-N 3.26Å; E83-L87 HydrophobicContact CG-CD1 3.95Å; E83-L87 WeakPolarHBondContact O-CB 3.42Å; E83-L87 VanDerWaalsContact O-CG 3.31Å; E83-L87 WeakPolarHBondContact O-CG 3.45Å; E83-L87 PolarHBondContact O-N 3.32Å; E83-M117 HydrophobicContact CG-CE 3.99Å
84	I	81.7	Confident	75.9	Confident	8 Å²	8	62.3 Å²	62.3	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-61.4	-47.1	176.5	-70	168.4	0	0	0	110.7	L86 L87 V88 L98 F101 F103 Q115 M117	I84-L86 VanDerWaalsContact C-N 3.33Å; I84-L86 PolarHBondContact O-N 2.97Å; I84-L87 PolarHBondContact O-N 2.88Å; I84-V88 HydrophobicContact CG2-CG2 4.2Å; I84-V88 WeakPolarHBondContact O-CB 3.38Å; I84-V88 VanDerWaalsContact O-CG2 3.22Å; I84-V88 WeakPolarHBondContact O-CG2 3.46Å; I84-V88 PolarHBondContact O-N 2.96Å; I84-L98 HydrophobicContact CG2-CD2 4.23Å; I84-F101 HydrophobicContact CD1-CB 4.18Å; I84-F101 HydrophobicContact CD1-CD2 3.9Å; I84-F101 HydrophobicContact CD1-CE2 4.48Å; I84-F101 HydrophobicContact CD1-CG 4.02Å; I84-F101 HydrophobicContact CG1-CG 4.43Å; I84-F101 HydrophobicContact CG2-CD1 3.79Å; I84-F101 HydrophobicContact CG2-CD2 4.27Å; I84-F101 HydrophobicContact CG2-CE1 3.62Å; I84-F101 HydrophobicContact CG2-CE2 4.11Å; I84-F101 HydrophobicContact CG2-CG 4.11Å; I84-F101 HydrophobicContact CG2-CZ 3.78Å; I84-F103 HydrophobicContact CD1-CE1 4.39Å; I84-F103 HydrophobicContact CD1-CE2 4.2Å; I84-F103 HydrophobicContact CD1-CZ 3.55Å; I84-Q115 HydrophobicContact CD1-CG 4.22Å; I84-M117 HydrophobicContact CG1-CE 3.92Å; I84-M117 HydrophobicContact CG1-CG 4.31Å; I84-M117 HydrophobicContact CG1-SD 4.18Å
85	E	77.8	Confident	75.8	Confident	59 Å²	59	58 Å²	58	28%	0.276	30%	0.298	S	S	.	.	H	α-helix	trans	-57.9	-47.2	-179.6	-174.9	-178.6	141.8	0	0	111.5	S10 V88 C89	S10-E85 PolarHBondContact OG-OE1 2.68Å; S10-E85 PolarHBondContact OG-OE2 2.92Å; E85-V88 PolarHBondContact O-N 2.89Å; E85-C89 PolarHBondContact O-N 3.04Å; E85-C89 PolarHBondContact O-SG 3.08Å
86	L	81.5	Confident	76.1	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.073	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-47	178.6	-72.8	169.5	0	0	0	111.4	R82 E83 I84 V88 C89 L90 F414 Y449	R82-L86 HydrophobicContact CB-CD1 4.28Å; R82-L86 VanDerWaalsContact O-CB 3.29Å; R82-L86 WeakPolarHBondContact O-CB 3.47Å; R82-L86 WeakPolarHBondContact O-CD1 3.33Å; R82-L86 WeakPolarHBondContact O-CG 3.44Å; R82-L86 PolarHBondContact O-N 2.71Å; E83-L86 PolarHBondContact O-N 3.26Å; I84-L86 VanDerWaalsContact C-N 3.33Å; I84-L86 PolarHBondContact O-N 2.97Å; L86-V88 VanDerWaalsContact C-N 3.29Å; L86-V88 PolarHBondContact O-N 3.39Å; L86-C89 PolarHBondContact O-N 2.94Å; L86-C89 VanDerWaalsContact O-N 3.08Å; L86-L90 HydrophobicContact CB-CD1 4.02Å; L86-L90 WeakPolarHBondContact O-CB 3.45Å; L86-L90 WeakPolarHBondContact O-CG 3.41Å; L86-L90 PolarHBondContact O-N 3.09Å; L86-F414 HydrophobicContact CD1-CD1 4.14Å; L86-F414 HydrophobicContact CD1-CE1 3.39Å; L86-F414 HydrophobicContact CD1-CZ 4.15Å; L86-Y449 HydrophobicContact CD2-CG 4.49Å
87	L	84.9	Confident	76.9	Confident	9 Å²	9	58.9 Å²	58.9	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-27.5	-178.8	-71.9	171.6	0	0	0	113.6	E83 I84 C89 I95 I96 L98 M117 L119 I417	E83-L87 HydrophobicContact CG-CD1 3.95Å; E83-L87 WeakPolarHBondContact O-CB 3.42Å; E83-L87 VanDerWaalsContact O-CG 3.31Å; E83-L87 WeakPolarHBondContact O-CG 3.45Å; E83-L87 PolarHBondContact O-N 3.32Å; I84-L87 PolarHBondContact O-N 2.88Å; L87-C89 VanDerWaalsContact C-N 3.34Å; L87-I95 HydrophobicContact CD2-CG2 4.27Å; L87-I96 WeakPolarHBondContact CD2-O 3.15Å; L87-L98 HydrophobicContact CB-CB 3.72Å; L87-L98 HydrophobicContact CB-CD2 3.91Å; L87-L98 HydrophobicContact CB-CG 4.45Å; L87-L98 HydrophobicContact CD1-CB 4.34Å; L87-M117 HydrophobicContact CD1-CE 3.37Å; L87-L119 HydrophobicContact CD1-CD2 4.05Å; L87-I417 HydrophobicContact CD2-CD1 4.34Å; L87-I417 HydrophobicContact CD2-CG1 4.28Å; L87-I417 HydrophobicContact CD2-CG2 3.86Å
88	V	84.2	Confident	78	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-38	171.2	171.6	0	0	0	0	110.9	Q9 V30 L35 I84 E85 L86 L98 F101	Q9-V88 HydrophobicContact CG-CG1 4.35Å; Q9-V88 VanDerWaalsContact NE2-CG1 3.34Å; V30-V88 HydrophobicContact CG1-CG1 4.27Å; V30-V88 HydrophobicContact CG1-CG2 4.24Å; V30-V88 HydrophobicContact CG2-CG2 3.91Å; L35-V88 HydrophobicContact CD2-CG1 4.23Å; L35-V88 HydrophobicContact CD2-CG2 4.23Å; I84-V88 HydrophobicContact CG2-CG2 4.2Å; I84-V88 WeakPolarHBondContact O-CB 3.38Å; I84-V88 VanDerWaalsContact O-CG2 3.22Å; I84-V88 WeakPolarHBondContact O-CG2 3.46Å; I84-V88 PolarHBondContact O-N 2.96Å; E85-V88 PolarHBondContact O-N 2.89Å; L86-V88 VanDerWaalsContact C-N 3.29Å; L86-V88 PolarHBondContact O-N 3.39Å; V88-L98 HydrophobicContact CG2-CD2 4Å; V88-F101 HydrophobicContact CG2-CE1 4.34Å
89	C	78.1	Confident	79.3	Confident	26 Å²	26	49.5 Å²	49.5	18%	0.176	24%	0.236	C	C	.	.	H	α-helix	trans	-87.2	-26	-176.5	-60.3	0	0	0	0	113.9	E85 L86 L87 K91 Y449	E85-C89 PolarHBondContact O-N 3.04Å; E85-C89 PolarHBondContact O-SG 3.08Å; L86-C89 PolarHBondContact O-N 2.94Å; L86-C89 VanDerWaalsContact O-N 3.08Å; L87-C89 VanDerWaalsContact C-N 3.34Å; C89-K91 PolarHBondContact O-N 3.39Å; C89-Y449 HydrophobicContact CB-CD1 4.42Å; C89-Y449 HydrophobicContact CB-CE1 3.75Å; C89-Y449 HydrophobicContact CB-CE2 4.45Å
90	L	75.6	Confident	80.7	Confident	6 Å²	6	45.6 Å²	45.6	3%	0.031	21%	0.213	C	C	.	.			trans	-90.5	93.8	-174.8	-68.9	172.4	0	0	0	111	L86 I95 Q445 L446 Y449	L86-L90 HydrophobicContact CB-CD1 4.02Å; L86-L90 WeakPolarHBondContact O-CB 3.45Å; L86-L90 WeakPolarHBondContact O-CG 3.41Å; L86-L90 PolarHBondContact O-N 3.09Å; L90-I95 HydrophobicContact CB-CD1 3.9Å; L90-I95 HydrophobicContact CB-CG2 4.21Å; L90-I95 HydrophobicContact CD1-CD1 4.23Å; L90-I95 HydrophobicContact CD2-CD1 4.28Å; L90-I95 HydrophobicContact CG-CD1 4.37Å; L90-Q445 HydrophobicContact CD2-CB 4.1Å; L90-L446 HydrophobicContact CD1-CD2 3.61Å; L90-L446 HydrophobicContact CD1-CG 4.25Å; L90-L446 HydrophobicContact CD2-CG 4.47Å; L90-Y449 HydrophobicContact CD2-CD2 3.72Å; L90-Y449 HydrophobicContact CD2-CE2 4Å
91	K	77.3	Confident	82.1	Confident	94 Å²	94	37.3 Å²	37.3	41%	0.409	17%	0.174	S	C	.	.			trans	-100.9	100.3	171.5	-68.1	178.9	-180	170.2	0	110.6	D32 D33 C89	D32-K91 VanDerWaalsContact C-NZ 3.31Å; D33-K91 WeakPolarHBondContact OD1-CE 3.27Å; D33-K91 IonicContact OD1-NZ 2.75Å; D33-K91 PolarHBondContact OD1-NZ 2.74Å; D33-K91 IonicContact OD2-NZ 3.18Å; D33-K91 PolarHBondContact OD2-NZ 3Å; C89-K91 PolarHBondContact O-N 3.39Å
92	H	79.3	Confident	83.2	Confident	24 Å²	24	36 Å²	36	11%	0.111	17%	0.166	C	C	.	.			trans	-146	142.3	177.6	-164.8	-92.3	0	0	0	111.5	N94 I95 E438 A442	H92-N94 WeakPolarHBondContact ND1-CB 3.44Å; H92-N94 PolarHBondContact ND1-N 2.98Å; H92-N94 PolarHBondContact O-N 3.21Å; H92-I95 HydrophobicContact CB-CB 4.02Å; H92-I95 HydrophobicContact CB-CD1 3.78Å; H92-I95 HydrophobicContact CB-CG1 3.91Å; H92-I95 PolarHBondContact O-N 2.79Å; H92-E438 PolarHBondContact CE1-O 3Å; H92-E438 PolarHBondContact NE2-O 3.15Å; H92-A442 WeakPolarHBondContact ND1-CB 3.43Å
93	P	78.8	Confident	83.9	Confident	78 Å²	78	29.2 Å²	29.2	51%	0.506	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-33.1	176.9	20	-33.5	0	0	0	113.4	I95 K419	P93-I95 VanDerWaalsContact C-N 3.34Å; P93-K419 WeakPolarHBondContact O-CD 3.26Å; P93-K419 WeakPolarHBondContact O-CE 3.31Å; P93-K419 PolarHBondContact O-NZ 3.42Å; P93-K419 VanDerWaalsContact O-NZ 3.11Å
94	N	81.7	Confident	84.3	Confident	13 Å²	13	28.2 Å²	28.2	7%	0.07	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	15	177.1	-58.2	-34.1	0	0	0	114.3	H92 L418 K419 E438 G439	H92-N94 WeakPolarHBondContact ND1-CB 3.44Å; H92-N94 PolarHBondContact ND1-N 2.98Å; H92-N94 PolarHBondContact O-N 3.21Å; N94-L418 CarbonylContact O-C 3.19Å; N94-L418 WeakPolarHBondContact O-CA 3.39Å; N94-K419 PolarHBondContact O-N 2.75Å; N94-E438 WeakPolarHBondContact ND2-CB 3.43Å; N94-G439 PolarHBondContact ND2-N 3.36Å
95	I	82.3	Confident	84.5	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.015	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-120.7	130.1	176.2	-72.3	176.5	0	0	0	109	L87 L90 H92 P93 R97 I417 L418 K419 A442	L87-I95 HydrophobicContact CD2-CG2 4.27Å; L90-I95 HydrophobicContact CB-CD1 3.9Å; L90-I95 HydrophobicContact CB-CG2 4.21Å; L90-I95 HydrophobicContact CD1-CD1 4.23Å; L90-I95 HydrophobicContact CD2-CD1 4.28Å; L90-I95 HydrophobicContact CG-CD1 4.37Å; H92-I95 HydrophobicContact CB-CB 4.02Å; H92-I95 HydrophobicContact CB-CD1 3.78Å; H92-I95 HydrophobicContact CB-CG1 3.91Å; H92-I95 PolarHBondContact O-N 2.79Å; P93-I95 VanDerWaalsContact C-N 3.34Å; I95-R97 PolarHBondContact O-N 3.34Å; I95-I417 CarbonylContact C-O 3.6Å; I95-I417 VanDerWaalsContact CA-O 3.27Å; I95-I417 WeakPolarHBondContact CA-O 3.2Å; I95-I417 HydrophobicContact CB-CG2 4.22Å; I95-I417 HydrophobicContact CG1-CG2 4.14Å; I95-I417 HydrophobicContact CG2-CG2 3.43Å; I95-I417 VanDerWaalsContact CG2-CG2 3.43Å; I95-L418 HydrophobicContact CG1-CD2 4.18Å; I95-K419 VanDerWaalsContact C-CE 3.48Å; I95-K419 WeakPolarHBondContact O-CE 3.38Å; I95-A442 HydrophobicContact CD1-CB 4.45Å
96	I	86.2	Confident	84.9	Confident	30 Å²	30	29.5 Å²	29.5	15%	0.154	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-55.8	122.1	175.1	-66.3	-172.8	0	0	0	108.6	L87 L119 E120 M122 C416 I417 K419	L87-I96 WeakPolarHBondContact CD2-O 3.15Å; I96-L119 HydrophobicContact CG2-CB 3.98Å; I96-L119 HydrophobicContact CG2-CD2 4.26Å; I96-E120 HydrophobicContact CG2-CB 4.16Å; I96-M122 HydrophobicContact CD1-CG 3.98Å; I96-M122 HydrophobicContact CG1-CG 4.31Å; I96-C416 WeakPolarHBondContact CD1-O 2.93Å; I96-I417 PolarHBondContact N-O 2.68Å; I96-K419 HydrophobicContact CG1-CG 4.14Å
97	R	89	Confident	85.1	Confident	108 Å²	108	35.2 Å²	35.2	41%	0.408	17%	0.169	S	C	.	.	P	Polyproline II helix	trans	-76.2	132.2	-179.5	179.5	173.4	170.5	151.6	-0.3	110.8	V30 I95 F99 L119 E120	V30-R97 PolarHBondContact O-NH2 2.86Å; I95-R97 PolarHBondContact O-N 3.34Å; R97-F99 HydrophobicContact CB-CE2 4.32Å; R97-F99 HydrophobicContact CB-CZ 4.44Å; R97-F99 HydrophobicContact CG-CE1 4.32Å; R97-F99 HydrophobicContact CG-CE2 4.31Å; R97-F99 HydrophobicContact CG-CZ 4.22Å; R97-L119 CarbonylContact O-C 3.54Å; R97-L119 WeakPolarHBondContact O-CA 3.04Å; R97-E120 HydrophobicContact CB-CB 4.43Å; R97-E120 PolarHBondContact N-OE2 3.22Å; R97-E120 PolarHBondContact O-N 2.93Å
98	L	90.7	Very high	85.1	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119.7	162	179.8	65.6	0	0	0	109.3	V30 I84 L87 V88 G100 F101 M117 L119	V30-L98 HydrophobicContact CG2-CD2 4.2Å; V30-L98 HydrophobicContact CG2-CG 4.16Å; I84-L98 HydrophobicContact CG2-CD2 4.23Å; L87-L98 HydrophobicContact CB-CB 3.72Å; L87-L98 HydrophobicContact CB-CD2 3.91Å; L87-L98 HydrophobicContact CB-CG 4.45Å; L87-L98 HydrophobicContact CD1-CB 4.34Å; V88-L98 HydrophobicContact CG2-CD2 4Å; L98-G100 WeakPolarHBondContact CD1-O 3.46Å; L98-F101 HydrophobicContact CD2-CD1 4Å; L98-M117 HydrophobicContact CD1-CB 3.93Å; L98-M117 HydrophobicContact CD1-CE 4.02Å; L98-M117 HydrophobicContact CD1-CG 4.36Å; L98-L119 HydrophobicContact CB-CD2 4.27Å; L98-L119 HydrophobicContact CD1-CD2 3.77Å
99	F	92.7	Very high	85.1	Confident	55 Å²	55	44.7 Å²	44.7	24%	0.241	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-32.7	174.8	-70.9	-79.5	0	0	0	112.2	M29 V30 Y68 R97 L118 E120	M29-F99 WeakPolarHBondContact CA-O 3.32Å; M29-F99 WeakPolarHBondContact CE-O 3.36Å; V30-F99 PolarHBondContact N-O 2.78Å; Y68-F99 HydrophobicContact CD1-CB 3.89Å; Y68-F99 AromaticContact CD1-CD2 3.65Å; Y68-F99 HydrophobicContact CD1-CD2 3.65Å; Y68-F99 HydrophobicContact CD1-CE2 4.34Å; Y68-F99 AromaticContact CD1-CG 3.81Å; Y68-F99 HydrophobicContact CD1-CG 3.81Å; Y68-F99 HydrophobicContact CE1-CB 3.71Å; Y68-F99 HydrophobicContact CE1-CD1 4.03Å; Y68-F99 AromaticContact CE1-CD2 3.87Å; Y68-F99 HydrophobicContact CE1-CD2 3.87Å; Y68-F99 HydrophobicContact CE1-CE2 4.49Å; Y68-F99 AromaticContact CE1-CG 3.6Å; Y68-F99 HydrophobicContact CE1-CG 3.6Å; R97-F99 HydrophobicContact CB-CE2 4.32Å; R97-F99 HydrophobicContact CB-CZ 4.44Å; R97-F99 HydrophobicContact CG-CE1 4.32Å; R97-F99 HydrophobicContact CG-CE2 4.31Å; R97-F99 HydrophobicContact CG-CZ 4.22Å; F99-L118 HydrophobicContact CB-CB 4.39Å; F99-L118 WeakPolarHBondContact CB-O 3.35Å; F99-L118 PolarHBondContact N-O 2.82Å; F99-E120 HydrophobicContact CE2-CB 3.88Å; F99-E120 HydrophobicContact CE2-CG 4.44Å
100	G	91.9	Very high	85.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.7	171	175.8	0	0	0	0	0	113	V28 L98 L118	V28-G100 CarbonylContact O-C 3.57Å; V28-G100 WeakPolarHBondContact O-CA 3.37Å; L98-G100 WeakPolarHBondContact CD1-O 3.46Å; G100-L118 PolarHBondContact N-O 2.88Å; G100-L118 PolarHBondContact O-N 3.34Å
101	F	91.2	Very high	85.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	157.9	178.8	61.1	-86.7	0	0	0	111.1	V28 V30 L35 I84 V88 L98 F103 N116 M117	V28-F101 HydrophobicContact CB-CD1 4.38Å; V28-F101 HydrophobicContact CB-CD2 4.35Å; V28-F101 HydrophobicContact CB-CE1 4.09Å; V28-F101 HydrophobicContact CB-CE2 4.05Å; V28-F101 HydrophobicContact CB-CZ 3.92Å; V28-F101 WeakPolarHBondContact CB-O 3.47Å; V28-F101 HydrophobicContact CG1-CE1 3.79Å; V28-F101 HydrophobicContact CG1-CE2 4.25Å; V28-F101 HydrophobicContact CG1-CZ 3.64Å; V28-F101 HydrophobicContact CG2-CE2 4.25Å; V28-F101 HydrophobicContact CG2-CZ 4.45Å; V28-F101 PolarHBondContact N-O 3.31Å; V28-F101 PolarHBondContact O-N 3.43Å; V30-F101 HydrophobicContact CG2-CD1 4.23Å; V30-F101 HydrophobicContact CG2-CE1 4.12Å; L35-F101 HydrophobicContact CD1-CZ 4.48Å; L35-F101 HydrophobicContact CD2-CE1 4.25Å; I84-F101 HydrophobicContact CD1-CB 4.18Å; I84-F101 HydrophobicContact CD1-CD2 3.9Å; I84-F101 HydrophobicContact CD1-CE2 4.48Å; I84-F101 HydrophobicContact CD1-CG 4.02Å; I84-F101 HydrophobicContact CG1-CG 4.43Å; I84-F101 HydrophobicContact CG2-CD1 3.79Å; I84-F101 HydrophobicContact CG2-CD2 4.27Å; I84-F101 HydrophobicContact CG2-CE1 3.62Å; I84-F101 HydrophobicContact CG2-CE2 4.11Å; I84-F101 HydrophobicContact CG2-CG 4.11Å; I84-F101 HydrophobicContact CG2-CZ 3.78Å; V88-F101 HydrophobicContact CG2-CE1 4.34Å; L98-F101 HydrophobicContact CD2-CD1 4Å; F101-F103 HydrophobicContact CD2-CD2 4.41Å; F101-F103 AromaticContact CD2-CE2 3.66Å; F101-F103 HydrophobicContact CD2-CE2 3.66Å; F101-F103 HydrophobicContact CD2-CZ 4.39Å; F101-F103 AromaticContact CE2-CE2 3.94Å; F101-F103 HydrophobicContact CE2-CE2 3.94Å; F101-N116 CarbonylContact C-O 3.57Å; F101-N116 WeakPolarHBondContact CA-O 3.22Å; F101-N116 WeakPolarHBondContact CB-O 3.33Å; F101-M117 HydrophobicContact CB-CG 4.3Å
102	Y	89.9	Confident	86.1	Confident	23 Å²	23	49.7 Å²	49.7	9%	0.09	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	154.3	173.2	68.3	-80.1	0	0	0	111.2	N26 V27 N116	N26-Y102 WeakPolarHBondContact O-CB 3.29Å; V27-Y102 HydrophobicContact CG1-CD1 4.32Å; V27-Y102 HydrophobicContact CG2-CD1 3.86Å; V27-Y102 HydrophobicContact CG2-CE1 4.35Å; V27-Y102 HydrophobicContact CG2-CG 4.33Å; Y102-N116 HydrophobicContact CD1-CB 3.7Å; Y102-N116 HydrophobicContact CD2-CB 4.29Å; Y102-N116 HydrophobicContact CE1-CB 3.33Å; Y102-N116 HydrophobicContact CE2-CB 3.98Å; Y102-N116 HydrophobicContact CG-CB 4.16Å; Y102-N116 VanDerWaalsContact CZ-CB 3.48Å; Y102-N116 PolarHBondContact N-O 2.72Å; Y102-N116 WeakPolarHBondContact O-CB 3.47Å; Y102-N116 PolarHBondContact O-N 3.46Å; Y102-N116 PolarHBondContact O-ND2 3.32Å
103	F	88.4	Confident	86.4	Confident	10 Å²	10	51 Å²	51	4%	0.044	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	151	178.8	-59.3	-92.6	0	0	0	109.8	S17 T20 V21 L75 I84 F101 I113 I114 Q115	S17-F103 VanDerWaalsContact CB-CE2 3.41Å; S17-F103 WeakPolarHBondContact OG-CE2 3.49Å; T20-F103 CarbonylContact C-O 3.51Å; T20-F103 WeakPolarHBondContact OG1-CD2 3.34Å; T20-F103 PolarHBondContact OG1-N 3.44Å; V21-F103 WeakPolarHBondContact CA-O 3.49Å; V21-F103 HydrophobicContact CG2-CB 3.56Å; V21-F103 PolarHBondContact N-O 3.41Å; L75-F103 HydrophobicContact CD1-CE1 4.44Å; L75-F103 HydrophobicContact CD2-CD1 4.13Å; L75-F103 HydrophobicContact CD2-CE1 4.01Å; I84-F103 HydrophobicContact CD1-CE1 4.39Å; I84-F103 HydrophobicContact CD1-CE2 4.2Å; I84-F103 HydrophobicContact CD1-CZ 3.55Å; F101-F103 HydrophobicContact CD2-CD2 4.41Å; F101-F103 AromaticContact CD2-CE2 3.66Å; F101-F103 HydrophobicContact CD2-CE2 3.66Å; F101-F103 HydrophobicContact CD2-CZ 4.39Å; F101-F103 AromaticContact CE2-CE2 3.94Å; F101-F103 HydrophobicContact CE2-CE2 3.94Å; F103-I113 HydrophobicContact CB-CG2 3.99Å; F103-I113 HydrophobicContact CD1-CG2 3.93Å; F103-I113 HydrophobicContact CG-CG2 4.41Å; F103-I114 CarbonylContact C-O 3.19Å; F103-I114 VanDerWaalsContact CA-O 3.26Å; F103-I114 WeakPolarHBondContact CA-O 3.27Å; F103-Q115 HydrophobicContact CD1-CB 3.96Å; F103-Q115 HydrophobicContact CD1-CG 4.3Å; F103-Q115 HydrophobicContact CE1-CB 3.8Å; F103-Q115 HydrophobicContact CE1-CG 3.74Å; F103-Q115 HydrophobicContact CZ-CG 4.32Å
104	R	87.1	Confident	86.8	Confident	27 Å²	27	47.3 Å²	47.3	10%	0.102	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	159.3	173.6	67.6	172.5	-173.7	-89.8	-3	110.1	P24 I114 N116	P24-R104 HydrophobicContact CB-CB 4.2Å; R104-I114 HydrophobicContact CG-CB 3.94Å; R104-I114 PolarHBondContact N-O 2.79Å; R104-I114 PolarHBondContact O-N 3.36Å; R104-N116 PolarHBondContact NH1-ND2 2.79Å; R104-N116 PolarHBondContact NH1-OD1 3.47Å
105	D	86.8	Confident	87.1	Confident	78 Å²	78	47.1 Å²	47.1	42%	0.417	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	144.7	168.5	-60	-36.3	0	0	0	110.5
106	S	86.1	Confident	87.4	Confident	16 Å²	16	47 Å²	47	11%	0.112	24%	0.238	C	C	.	.			trans	-70	134.1	171.9	174.9	0	0	0	0	110.1	K108 N109 T112	S106-K108 PolarHBondContact O-N 3.3Å; S106-K108 PolarHBondContact OG-N 2.95Å; S106-N109 WeakPolarHBondContact CB-O 3.44Å; S106-N109 CarbonylContact O-C 3.58Å; S106-N109 PolarHBondContact O-N 3.31Å; S106-T112 WeakPolarHBondContact CB-O 3.44Å; S106-T112 PolarHBondContact N-O 3.05Å
107	K	84.4	Confident	87.6	Confident	134 Å²	134	45.6 Å²	45.6	58%	0.583	23%	0.231	S	C	*	.	S	Bend	trans	-62.5	-32	175.2	-63.9	-173.5	179	-174.8	0	112.2
108	K	85.3	Confident	87.8	Confident	140 Å²	140	40.4 Å²	40.4	61%	0.609	21%	0.211	S	C	*	.	S	Bend	trans	-81.8	-34.8	-178.3	-64.7	-177.9	-172.7	173.9	0	113.3	S106 E399	S106-K108 PolarHBondContact O-N 3.3Å; S106-K108 PolarHBondContact OG-N 2.95Å; K108-E399 PolarHBondContact NZ-O 2.84Å
109	N	84.9	Confident	87.9	Confident	72 Å²	72	41.3 Å²	41.3	39%	0.385	22%	0.216	S	C	.	.			trans	-140.9	103.2	177.1	-177	1.1	0	0	0	109.8	S106 S111 T112	S106-N109 WeakPolarHBondContact CB-O 3.44Å; S106-N109 CarbonylContact O-C 3.58Å; S106-N109 PolarHBondContact O-N 3.31Å; N109-S111 PolarHBondContact ND2-OG 3.16Å; N109-S111 PolarHBondContact O-N 3.21Å; N109-S111 PolarHBondContact OD1-N 2.98Å; N109-S111 VanDerWaalsContact OD1-N 3.13Å; N109-S111 PolarHBondContact OD1-OG 3.04Å; N109-T112 PolarHBondContact ND2-OG1 3.13Å; N109-T112 WeakPolarHBondContact O-CB 3.5Å; N109-T112 PolarHBondContact O-N 3.37Å
110	P	82.3	Confident	87.7	Confident	99 Å²	99	41.3 Å²	41.3	64%	0.643	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.3	-179.1	-25.4	34.4	0	0	0	114.7	T112	P110-T112 PolarHBondContact O-N 3.13Å
111	S	83.1	Confident	87.4	Confident	98 Å²	98	42.4 Å²	42.4	69%	0.685	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-9.7	173.7	65.5	0	0	0	0	113.7	N109	N109-S111 PolarHBondContact ND2-OG 3.16Å; N109-S111 PolarHBondContact O-N 3.21Å; N109-S111 PolarHBondContact OD1-N 2.98Å; N109-S111 VanDerWaalsContact OD1-N 3.13Å; N109-S111 PolarHBondContact OD1-OG 3.04Å
112	T	85.7	Confident	86.8	Confident	33 Å²	33	45 Å²	45	20%	0.202	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-99.9	122.5	-178.9	-59	0	0	0	0	110.2	I74 S106 N109 P110	I74-T112 HydrophobicContact CB-CG2 4.45Å; I74-T112 HydrophobicContact CG1-CG2 4.31Å; I74-T112 HydrophobicContact CG2-CG2 3.45Å; I74-T112 VanDerWaalsContact CG2-CG2 3.45Å; S106-T112 WeakPolarHBondContact CB-O 3.44Å; S106-T112 PolarHBondContact N-O 3.05Å; N109-T112 PolarHBondContact ND2-OG1 3.13Å; N109-T112 WeakPolarHBondContact O-CB 3.5Å; N109-T112 PolarHBondContact O-N 3.37Å; P110-T112 PolarHBondContact O-N 3.13Å
113	I	85.5	Confident	85.7	Confident	52 Å²	52	47.1 Å²	47.1	27%	0.267	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.8	173.1	-60.7	172.6	0	0	0	109.5	L75 F103	L75-I113 HydrophobicContact CB-CB 4.15Å; L75-I113 HydrophobicContact CB-CG2 4.13Å; L75-I113 WeakPolarHBondContact CB-O 3.4Å; L75-I113 HydrophobicContact CD2-CB 4.23Å; L75-I113 HydrophobicContact CD2-CD1 4.44Å; L75-I113 HydrophobicContact CD2-CG2 3.9Å; L75-I113 PolarHBondContact N-O 3Å; F103-I113 HydrophobicContact CB-CG2 3.99Å; F103-I113 HydrophobicContact CD1-CG2 3.93Å; F103-I113 HydrophobicContact CG-CG2 4.41Å
114	I	87.3	Confident	84.9	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.3	172.6	-57.6	178.4	0	0	0	109.1	V72 F103 R104 E399	V72-I114 HydrophobicContact CG1-CG2 3.5Å; F103-I114 CarbonylContact C-O 3.19Å; F103-I114 VanDerWaalsContact CA-O 3.26Å; F103-I114 WeakPolarHBondContact CA-O 3.27Å; R104-I114 HydrophobicContact CG-CB 3.94Å; R104-I114 PolarHBondContact N-O 2.79Å; R104-I114 PolarHBondContact O-N 3.36Å; I114-E399 WeakPolarHBondContact CD1-OE1 3.41Å
115	Q	87.6	Confident	84.1	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.037	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.6	173.1	175.2	173.5	-38.2	0	0	110.7	V72 S73 D81 I84 F103 M117	V72-Q115 WeakPolarHBondContact CA-O 3.45Å; S73-Q115 PolarHBondContact N-O 2.81Å; S73-Q115 PolarHBondContact O-N 2.81Å; D81-Q115 PolarHBondContact OD2-NE2 3.32Å; D81-Q115 PolarHBondContact OD2-OE1 2.94Å; I84-Q115 HydrophobicContact CD1-CG 4.22Å; F103-Q115 HydrophobicContact CD1-CB 3.96Å; F103-Q115 HydrophobicContact CD1-CG 4.3Å; F103-Q115 HydrophobicContact CE1-CB 3.8Å; F103-Q115 HydrophobicContact CE1-CG 3.74Å; F103-Q115 HydrophobicContact CZ-CG 4.32Å; Q115-M117 HydrophobicContact CG-CG 4.25Å; Q115-M117 PolarHBondContact NE2-SD 2.85Å
116	N	89.8	Confident	83.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.2	178.3	-54.8	-88.1	0	0	0	109.2	K71 V72 F101 Y102 R104	K71-N116 WeakPolarHBondContact O-CA 3.42Å; V72-N116 WeakPolarHBondContact CG2-OD1 3.4Å; F101-N116 CarbonylContact C-O 3.57Å; F101-N116 WeakPolarHBondContact CA-O 3.22Å; F101-N116 WeakPolarHBondContact CB-O 3.33Å; Y102-N116 HydrophobicContact CD1-CB 3.7Å; Y102-N116 HydrophobicContact CD2-CB 4.29Å; Y102-N116 HydrophobicContact CE1-CB 3.33Å; Y102-N116 HydrophobicContact CE2-CB 3.98Å; Y102-N116 HydrophobicContact CG-CB 4.16Å; Y102-N116 VanDerWaalsContact CZ-CB 3.48Å; Y102-N116 PolarHBondContact N-O 2.72Å; Y102-N116 WeakPolarHBondContact O-CB 3.47Å; Y102-N116 PolarHBondContact O-N 3.46Å; Y102-N116 PolarHBondContact O-ND2 3.32Å; R104-N116 PolarHBondContact NH1-ND2 2.79Å; R104-N116 PolarHBondContact NH1-OD1 3.47Å
117	M	90.8	Very high	82.8	Confident	1 Å²	1	57 Å²	57	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.9	-179.9	-62.4	166.1	74.3	0	0	109.6	M70 K71 E83 I84 L87 L98 F101 Q115 L119	M70-M117 CarbonylContact C-O 3.57Å; M70-M117 VanDerWaalsContact CA-O 3.28Å; M70-M117 WeakPolarHBondContact CA-O 3.33Å; K71-M117 HydrophobicContact CB-CB 4.41Å; K71-M117 HydrophobicContact CD-SD 4.31Å; K71-M117 PolarHBondContact N-O 2.93Å; K71-M117 PolarHBondContact O-N 2.74Å; E83-M117 HydrophobicContact CG-CE 3.99Å; I84-M117 HydrophobicContact CG1-CE 3.92Å; I84-M117 HydrophobicContact CG1-CG 4.31Å; I84-M117 HydrophobicContact CG1-SD 4.18Å; L87-M117 HydrophobicContact CD1-CE 3.37Å; L98-M117 HydrophobicContact CD1-CB 3.93Å; L98-M117 HydrophobicContact CD1-CE 4.02Å; L98-M117 HydrophobicContact CD1-CG 4.36Å; F101-M117 HydrophobicContact CB-CG 4.3Å; Q115-M117 HydrophobicContact CG-CG 4.25Å; Q115-M117 PolarHBondContact NE2-SD 2.85Å; M117-L119 HydrophobicContact CB-CD2 4.34Å; M117-L119 HydrophobicContact CB-CG 4.19Å; M117-L119 HydrophobicContact CE-CD2 4.21Å; M117-L119 PolarHBondContact O-N 3.45Å
118	L	92.9	Very high	82.1	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	101.1	171.6	-57	-176.3	0	0	0	108.7	V27 L40 L42 V59 Y68 M70 F99 G100	V27-L118 HydrophobicContact CG1-CD1 3.87Å; L40-L118 HydrophobicContact CD1-CD1 3.68Å; L42-L118 HydrophobicContact CD1-CD1 4.24Å; L42-L118 HydrophobicContact CD1-CD2 3.8Å; V59-L118 HydrophobicContact CG2-CD2 3.92Å; Y68-L118 HydrophobicContact CD1-CB 4.36Å; Y68-L118 HydrophobicContact CD2-CD1 4.48Å; Y68-L118 HydrophobicContact CG-CB 4.19Å; M70-L118 HydrophobicContact CB-CD2 4.27Å; M70-L118 HydrophobicContact CG-CD2 4.22Å; M70-L118 HydrophobicContact SD-CD2 4.44Å; F99-L118 HydrophobicContact CB-CB 4.39Å; F99-L118 WeakPolarHBondContact CB-O 3.35Å; F99-L118 PolarHBondContact N-O 2.82Å; G100-L118 PolarHBondContact N-O 2.88Å; G100-L118 PolarHBondContact O-N 3.34Å
119	L	92.3	Very high	81.4	Confident	20 Å²	20	48.9 Å²	48.9	11%	0.105	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	165.9	-178.1	-59.2	171.3	0	0	0	110.9	Y68 A69 K71 L87 I96 R97 L98 M117 C121	Y68-L119 WeakPolarHBondContact CA-O 3.5Å; A69-L119 HydrophobicContact CB-CB 4.28Å; A69-L119 PolarHBondContact N-O 3.35Å; A69-L119 WeakPolarHBondContact O-CB 3.18Å; A69-L119 PolarHBondContact O-N 2.85Å; K71-L119 HydrophobicContact CB-CD1 3.93Å; K71-L119 HydrophobicContact CD-CD1 4.33Å; L87-L119 HydrophobicContact CD1-CD2 4.05Å; I96-L119 HydrophobicContact CG2-CB 3.98Å; I96-L119 HydrophobicContact CG2-CD2 4.26Å; R97-L119 CarbonylContact O-C 3.54Å; R97-L119 WeakPolarHBondContact O-CA 3.04Å; L98-L119 HydrophobicContact CB-CD2 4.27Å; L98-L119 HydrophobicContact CD1-CD2 3.77Å; M117-L119 HydrophobicContact CB-CD2 4.34Å; M117-L119 HydrophobicContact CB-CG 4.19Å; M117-L119 HydrophobicContact CE-CD2 4.21Å; M117-L119 PolarHBondContact O-N 3.45Å; L119-C121 PolarHBondContact O-N 2.93Å
120	E	89.1	Confident	81.1	Confident	55 Å²	55	50 Å²	50	26%	0.257	29%	0.286	S	S	.	.			trans	-60.4	131.5	167.8	-172.5	177.7	171.8	0	0	112.2	I96 R97 F99 M122 K419	I96-E120 HydrophobicContact CG2-CB 4.16Å; R97-E120 HydrophobicContact CB-CB 4.43Å; R97-E120 PolarHBondContact N-OE2 3.22Å; R97-E120 PolarHBondContact O-N 2.93Å; F99-E120 HydrophobicContact CE2-CB 3.88Å; F99-E120 HydrophobicContact CE2-CG 4.44Å; E120-M122 PolarHBondContact O-N 2.95Å; E120-K419 WeakPolarHBondContact OE1-CE 3.41Å; E120-K419 IonicContact OE1-NZ 3.8Å; E120-K419 PolarHBondContact OE1-NZ 2.95Å; E120-K419 WeakPolarHBondContact OE2-CE 3.37Å; E120-K419 IonicContact OE2-NZ 2.68Å; E120-K419 PolarHBondContact OE2-NZ 3.4Å
121	C	84.9	Confident	80.7	Confident	24 Å²	24	46.8 Å²	46.8	16%	0.162	27%	0.267	C	S	.	.			trans	-69.6	112.4	172.2	-69.3	0	0	0	0	110.3	Y68 A69 L119	Y68-C121 VanDerWaalsContact CA-SG 3.54Å; A69-C121 PolarHBondContact N-SG 2.73Å; L119-C121 PolarHBondContact O-N 2.93Å
122	M	79	Confident	80.4	Confident	55 Å²	55	46.6 Å²	46.6	27%	0.271	26%	0.256	S	S	.	.			trans	-86.7	137.6	168.1	-64.5	-58	-66.8	0	0	109.9	I96 E120 G124 K419	I96-M122 HydrophobicContact CD1-CG 3.98Å; I96-M122 HydrophobicContact CG1-CG 4.31Å; E120-M122 PolarHBondContact O-N 2.95Å; M122-G124 PolarHBondContact O-N 2.92Å; M122-K419 HydrophobicContact CE-CB 4.17Å; M122-K419 HydrophobicContact CE-CD 4.24Å; M122-K419 HydrophobicContact CE-CG 4.12Å; M122-K419 HydrophobicContact SD-CD 4.05Å; M122-K419 HydrophobicContact SD-CG 4.16Å
123	P	66.3	Low	80.2	Confident	66 Å²	66	47.3 Å²	47.3	43%	0.429	26%	0.257	S	S	.	.	S	Bend	trans	-67.6	-18.1	178.8	27.8	-34.8	0	0	0	113.8	R365 L368	P123-R365 HydrophobicContact CB-CG 4.28Å; P123-L368 HydrophobicContact CB-CD2 4.12Å
124	G	71.2	Confident	80.1	Confident	43 Å²	43	50.8 Å²	50.8	44%	0.443	27%	0.266	S	S	.	.			trans	-178.8	174	176.1	0	0	0	0	0	109.8	M122	M122-G124 PolarHBondContact O-N 2.92Å
125	D	72	Confident	80	Confident	90 Å²	90	51.9 Å²	51.9	48%	0.481	27%	0.271	S	S	.	.			trans	-109.1	172.2	174.3	59.5	32	0	0	0	111.4	F127 S128 L129	D125-F127 PolarHBondContact O-N 2.77Å; D125-F127 WeakPolarHBondContact OD1-CB 2.98Å; D125-F127 PolarHBondContact OD1-N 2.93Å; D125-S128 PolarHBondContact O-N 3.47Å; D125-S128 VanDerWaalsContact OD1-CB 3.26Å; D125-S128 WeakPolarHBondContact OD1-CB 3.46Å; D125-S128 PolarHBondContact OD1-N 3.2Å; D125-S128 PolarHBondContact OD1-OG 3.04Å; D125-L129 PolarHBondContact O-N 2.69Å
126	L	72.5	Confident	79.8	Confident	62 Å²	62	53.9 Å²	53.9	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-63	-30.7	179.6	-175.5	61.4	0	0	0	112.1	L129 F130	L126-L129 HydrophobicContact CD1-CD2 4.15Å; L126-L129 PolarHBondContact O-N 2.95Å; L126-F130 HydrophobicContact CD1-CD2 4.16Å; L126-F130 HydrophobicContact CD1-CE1 4.23Å; L126-F130 HydrophobicContact CD1-CE2 3.63Å; L126-F130 HydrophobicContact CD1-CZ 3.65Å; L126-F130 HydrophobicContact CD2-CE2 3.66Å; L126-F130 HydrophobicContact CD2-CZ 4.14Å; L126-F130 HydrophobicContact CG-CD2 3.8Å; L126-F130 HydrophobicContact CG-CE2 3.35Å; L126-F130 HydrophobicContact CG-CZ 3.9Å; L126-F130 WeakPolarHBondContact O-CD2 3.49Å; L126-F130 WeakPolarHBondContact O-CG 3.18Å; L126-F130 PolarHBondContact O-N 3.11Å
127	F	71.2	Confident	79.6	Confident	145 Å²	145	56.2 Å²	56.2	64%	0.636	29%	0.291	S	S	*	.	H	α-helix	trans	-66.5	-45.9	178.7	-179.5	-93.3	0	0	0	111.2	D125 L129 F130 A131	D125-F127 PolarHBondContact O-N 2.77Å; D125-F127 WeakPolarHBondContact OD1-CB 2.98Å; D125-F127 PolarHBondContact OD1-N 2.93Å; F127-L129 VanDerWaalsContact C-N 3.34Å; F127-F130 PolarHBondContact O-N 3.22Å; F127-A131 WeakPolarHBondContact O-CB 3.19Å; F127-A131 PolarHBondContact O-N 3.1Å
128	S	69.8	Low	79.6	Confident	49 Å²	49	56.6 Å²	56.6	34%	0.343	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-43.9	175.6	-57.5	0	0	0	0	110.4	D125 F130 A131 E132	D125-S128 PolarHBondContact O-N 3.47Å; D125-S128 VanDerWaalsContact OD1-CB 3.26Å; D125-S128 WeakPolarHBondContact OD1-CB 3.46Å; D125-S128 PolarHBondContact OD1-N 3.2Å; D125-S128 PolarHBondContact OD1-OG 3.04Å; S128-F130 PolarHBondContact O-N 3.3Å; S128-A131 WeakPolarHBondContact O-CB 3.42Å; S128-A131 PolarHBondContact O-N 3.41Å; S128-E132 WeakPolarHBondContact O-CG 3.19Å; S128-E132 PolarHBondContact O-N 3.47Å
129	L	72.2	Confident	79.6	Confident	54 Å²	54	57 Å²	57	28%	0.283	30%	0.295	S	S	.	.	H	α-helix	trans	-59.2	-45.3	175.1	-177.2	67.9	0	0	0	112.2	D125 L126 F127 E132 Q133 F422	D125-L129 PolarHBondContact O-N 2.69Å; L126-L129 HydrophobicContact CD1-CD2 4.15Å; L126-L129 PolarHBondContact O-N 2.95Å; F127-L129 VanDerWaalsContact C-N 3.34Å; L129-E132 PolarHBondContact O-N 3.19Å; L129-Q133 PolarHBondContact O-N 3.4Å; L129-F422 HydrophobicContact CD2-CB 4.48Å; L129-F422 HydrophobicContact CD2-CD2 4.11Å; L129-F422 HydrophobicContact CD2-CG 4.23Å
130	F	77.5	Confident	79.4	Confident	96 Å²	96	56.9 Å²	56.9	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-68.7	-33.9	176.7	-72.1	-42.3	0	0	0	112.7	L126 F127 S128 Q133 R134	L126-F130 HydrophobicContact CD1-CD2 4.16Å; L126-F130 HydrophobicContact CD1-CE1 4.23Å; L126-F130 HydrophobicContact CD1-CE2 3.63Å; L126-F130 HydrophobicContact CD1-CZ 3.65Å; L126-F130 HydrophobicContact CD2-CE2 3.66Å; L126-F130 HydrophobicContact CD2-CZ 4.14Å; L126-F130 HydrophobicContact CG-CD2 3.8Å; L126-F130 HydrophobicContact CG-CE2 3.35Å; L126-F130 HydrophobicContact CG-CZ 3.9Å; L126-F130 WeakPolarHBondContact O-CD2 3.49Å; L126-F130 WeakPolarHBondContact O-CG 3.18Å; L126-F130 PolarHBondContact O-N 3.11Å; F127-F130 PolarHBondContact O-N 3.22Å; S128-F130 PolarHBondContact O-N 3.3Å; F130-Q133 PolarHBondContact O-N 3.42Å; F130-R134 WeakPolarHBondContact O-CB 3.47Å; F130-R134 VanDerWaalsContact O-CG 3.28Å; F130-R134 WeakPolarHBondContact O-CG 3.28Å; F130-R134 PolarHBondContact O-N 3.17Å; F130-R134 PolarHBondContact O-NE 2.72Å
131	A	75.1	Confident	79.4	Confident	31 Å²	31	56.9 Å²	56.9	26%	0.256	31%	0.306	S	S	.	.	H	α-helix	trans	-61.3	-48.1	171.9	0	0	0	0	0	110.8	F127 S128 Q133 R134 Q135	F127-A131 WeakPolarHBondContact O-CB 3.19Å; F127-A131 PolarHBondContact O-N 3.1Å; S128-A131 WeakPolarHBondContact O-CB 3.42Å; S128-A131 PolarHBondContact O-N 3.41Å; A131-Q133 PolarHBondContact O-N 2.82Å; A131-R134 PolarHBondContact O-N 2.77Å; A131-Q135 WeakPolarHBondContact O-CG 3.39Å; A131-Q135 PolarHBondContact O-N 2.65Å
132	E	76.5	Confident	79.8	Confident	94 Å²	94	55.8 Å²	55.8	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-43.6	175.8	-71.4	176.9	-166.5	0	0	112.8	S128 L129 Q135 R136	S128-E132 WeakPolarHBondContact O-CG 3.19Å; S128-E132 PolarHBondContact O-N 3.47Å; L129-E132 PolarHBondContact O-N 3.19Å; E132-Q135 PolarHBondContact O-N 2.97Å; E132-R136 WeakPolarHBondContact O-CG 3.43Å; E132-R136 PolarHBondContact O-N 3.17Å
133	Q	80	Confident	80.3	Confident	48 Å²	48	53.8 Å²	53.8	22%	0.224	29%	0.29	C	S	.	.	H	α-helix	trans	-62.4	-44.5	177.2	-177.3	57.7	40.4	0	0	111.5	L129 F130 A131 Q135 R136 D137	L129-Q133 PolarHBondContact O-N 3.4Å; F130-Q133 PolarHBondContact O-N 3.42Å; A131-Q133 PolarHBondContact O-N 2.82Å; Q133-Q135 VanDerWaalsContact C-N 3.33Å; Q133-Q135 PolarHBondContact O-N 3.49Å; Q133-R136 WeakPolarHBondContact O-CB 2.81Å; Q133-R136 PolarHBondContact O-N 3.26Å; Q133-R136 VanDerWaalsContact O-N 3.13Å; Q133-D137 PolarHBondContact NE2-OD1 2.96Å; Q133-D137 VanDerWaalsContact NE2-OD1 3.13Å; Q133-D137 PolarHBondContact NE2-OD2 2.81Å; Q133-D137 PolarHBondContact O-N 2.9Å
134	R	83.8	Confident	81.4	Confident	125 Å²	125	53.6 Å²	53.6	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-43.4	175.3	-74.8	179.3	-67.2	-179	1.5	111.8	F130 A131 R136 D137 V138	F130-R134 WeakPolarHBondContact O-CB 3.47Å; F130-R134 VanDerWaalsContact O-CG 3.28Å; F130-R134 WeakPolarHBondContact O-CG 3.28Å; F130-R134 PolarHBondContact O-N 3.17Å; F130-R134 PolarHBondContact O-NE 2.72Å; A131-R134 PolarHBondContact O-N 2.77Å; R134-R136 VanDerWaalsContact C-N 3.29Å; R134-R136 PolarHBondContact O-N 3.11Å; R134-D137 PolarHBondContact O-N 3.5Å; R134-V138 WeakPolarHBondContact O-CG2 3.47Å; R134-V138 PolarHBondContact O-N 2.96Å
135	Q	85.4	Confident	82.3	Confident	24 Å²	24	53 Å²	53	11%	0.112	27%	0.274	C	S	.	.	H	α-helix	trans	-69.6	-25.9	178	-61.5	-52.1	79.1	0	0	113.2	A131 E132 Q133 W139 P222 R225	A131-Q135 WeakPolarHBondContact O-CG 3.39Å; A131-Q135 PolarHBondContact O-N 2.65Å; E132-Q135 PolarHBondContact O-N 2.97Å; Q133-Q135 VanDerWaalsContact C-N 3.33Å; Q133-Q135 PolarHBondContact O-N 3.49Å; Q135-W139 PolarHBondContact O-N 2.83Å; Q135-P222 HydrophobicContact CB-CB 3.97Å; Q135-P222 HydrophobicContact CG-CB 4.18Å; Q135-P222 PolarHBondContact NE2-O 3.26Å; Q135-R225 PolarHBondContact NE2-O 3.18Å; Q135-R225 PolarHBondContact O-NH1 3.18Å
136	R	83.7	Confident	83.1	Confident	50 Å²	50	48.8 Å²	48.8	19%	0.189	25%	0.251	C	S	.	.	H	α-helix	trans	-70.1	-43	169.2	-76.9	-175.4	-82.6	165.5	-7.3	111.7	E132 Q133 R134 W139 A140 L354 F357	E132-R136 WeakPolarHBondContact O-CG 3.43Å; E132-R136 PolarHBondContact O-N 3.17Å; Q133-R136 WeakPolarHBondContact O-CB 2.81Å; Q133-R136 PolarHBondContact O-N 3.26Å; Q133-R136 VanDerWaalsContact O-N 3.13Å; R134-R136 VanDerWaalsContact C-N 3.29Å; R134-R136 PolarHBondContact O-N 3.11Å; R136-W139 WeakPolarHBondContact O-CB 3.33Å; R136-W139 PolarHBondContact O-N 2.98Å; R136-A140 PolarHBondContact O-N 2.98Å; R136-L354 HydrophobicContact CB-CD2 3.96Å; R136-L354 HydrophobicContact CB-CG 4.18Å; R136-F357 HydrophobicContact CG-CD1 4.41Å
137	D	86.5	Confident	83.8	Confident	48 Å²	48	46.9 Å²	46.9	26%	0.257	24%	0.241	S	C	.	.	H	α-helix	trans	-65.9	-38.7	178	-68.8	-34.7	0	0	0	111.8	Q133 R134 A140 A141 R350	Q133-D137 PolarHBondContact NE2-OD1 2.96Å; Q133-D137 VanDerWaalsContact NE2-OD1 3.13Å; Q133-D137 PolarHBondContact NE2-OD2 2.81Å; Q133-D137 PolarHBondContact O-N 2.9Å; R134-D137 PolarHBondContact O-N 3.5Å; D137-A140 PolarHBondContact O-N 2.85Å; D137-A141 WeakPolarHBondContact O-CB 3.31Å; D137-A141 PolarHBondContact O-N 3.48Å; D137-R350 IonicContact OD1-CZ 3.04Å; D137-R350 IonicContact OD1-NE 3.72Å; D137-R350 PolarHBondContact OD1-NE 2.89Å; D137-R350 IonicContact OD1-NH2 2.89Å; D137-R350 PolarHBondContact OD1-NH2 3.4Å; D137-R350 IonicContact OD2-NH2 3.24Å; D137-R350 PolarHBondContact OD2-NH2 3.3Å
138	V	89.8	Confident	84.5	Confident	10 Å²	10	42 Å²	42	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-43.6	173.5	172.4	0	0	0	0	111.6	R134 A140 A141 G142 I217 L226 A228 V231	R134-V138 WeakPolarHBondContact O-CG2 3.47Å; R134-V138 PolarHBondContact O-N 2.96Å; V138-A140 PolarHBondContact O-N 2.87Å; V138-A141 WeakPolarHBondContact O-CB 3.4Å; V138-A141 PolarHBondContact O-N 2.76Å; V138-G142 PolarHBondContact O-N 3.1Å; V138-I217 HydrophobicContact CG1-CB 4.5Å; V138-I217 HydrophobicContact CG1-CG1 4.16Å; V138-I217 HydrophobicContact CG1-CG2 3.87Å; V138-I217 WeakPolarHBondContact O-CG2 3.28Å; V138-L226 WeakPolarHBondContact CG1-O 3.48Å; V138-A228 HydrophobicContact CG2-CB 4.1Å; V138-V231 HydrophobicContact CG1-CG2 4.08Å
139	W	92.5	Very high	85.3	Confident	9 Å²	9	41.6 Å²	41.6	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-58	-48	174	174	-79.5	0	0	0	111.6	Q135 R136 A141 G142 C143 F155 I166 L170 L218 S219 F357	Q135-W139 PolarHBondContact O-N 2.83Å; R136-W139 WeakPolarHBondContact O-CB 3.33Å; R136-W139 PolarHBondContact O-N 2.98Å; W139-A141 VanDerWaalsContact C-N 3.31Å; W139-A141 PolarHBondContact O-N 3Å; W139-G142 WeakPolarHBondContact O-CA 3.21Å; W139-G142 PolarHBondContact O-N 2.89Å; W139-C143 PolarHBondContact NE1-SG 3.47Å; W139-C143 VanDerWaalsContact NE1-SG 3.35Å; W139-C143 PolarHBondContact O-N 2.98Å; W139-F155 HydrophobicContact CH2-CE2 4.23Å; W139-F155 HydrophobicContact CH2-CZ 4.38Å; W139-F155 HydrophobicContact CZ2-CD2 4.17Å; W139-F155 AromaticContact CZ2-CE2 3.49Å; W139-F155 HydrophobicContact CZ2-CE2 3.49Å; W139-F155 VanDerWaalsContact CZ2-CE2 3.49Å; W139-F155 HydrophobicContact CZ2-CZ 4.05Å; W139-I166 HydrophobicContact CH2-CG2 4.11Å; W139-I166 HydrophobicContact CZ2-CD1 4.27Å; W139-I166 HydrophobicContact CZ2-CG1 4.44Å; W139-I166 HydrophobicContact CZ2-CG2 4.3Å; W139-L170 HydrophobicContact CH2-CD1 3.56Å; W139-L170 HydrophobicContact CZ3-CD1 4.16Å; W139-L218 HydrophobicContact CD2-CD2 3.83Å; W139-L218 HydrophobicContact CE3-CB 4.44Å; W139-L218 HydrophobicContact CE3-CD2 3.99Å; W139-L218 HydrophobicContact CG-CD2 4.36Å; W139-L218 HydrophobicContact CH2-CB 4.37Å; W139-L218 HydrophobicContact CH2-CD2 4.39Å; W139-L218 HydrophobicContact CZ2-CD2 4.2Å; W139-L218 VanDerWaalsContact CZ3-CA 3.49Å; W139-L218 HydrophobicContact CZ3-CB 4.1Å; W139-L218 HydrophobicContact CZ3-CD2 4.28Å; W139-S219 WeakPolarHBondContact CZ3-O 3.34Å; W139-F357 HydrophobicContact CB-CE1 4.16Å; W139-F357 HydrophobicContact CB-CZ 4.25Å; W139-F357 HydrophobicContact CD2-CD2 4.07Å; W139-F357 HydrophobicContact CD2-CE1 4.01Å; W139-F357 AromaticContact CD2-CE2 3.35Å; W139-F357 HydrophobicContact CD2-CE2 3.35Å; W139-F357 AromaticContact CD2-CZ 3.25Å; W139-F357 HydrophobicContact CD2-CZ 3.25Å; W139-F357 AromaticContact CE2-CD2 3.55Å; W139-F357 AromaticContact CE2-CE2 3.13Å; W139-F357 AromaticContact CE2-CZ 3.61Å; W139-F357 HydrophobicContact CE3-CE1 4.41Å; W139-F357 AromaticContact CE3-CE2 3.7Å; W139-F357 HydrophobicContact CE3-CE2 3.7Å; W139-F357 AromaticContact CE3-CZ 3.42Å; W139-F357 HydrophobicContact CE3-CZ 3.42Å; W139-F357 VanDerWaalsContact CE3-CZ 3.42Å; W139-F357 HydrophobicContact CG-CD1 4.29Å; W139-F357 HydrophobicContact CG-CD2 4.35Å; W139-F357 AromaticContact CG-CE1 3.86Å; W139-F357 HydrophobicContact CG-CE1 3.86Å; W139-F357 AromaticContact CG-CE2 3.95Å; W139-F357 HydrophobicContact CG-CE2 3.95Å; W139-F357 HydrophobicContact CG-CG 4.48Å; W139-F357 AromaticContact CG-CZ 3.62Å; W139-F357 HydrophobicContact CG-CZ 3.62Å; W139-F357 AromaticContact CH2-CE2 3.59Å; W139-F357 HydrophobicContact CH2-CE2 3.59Å; W139-F357 HydrophobicContact CH2-CZ 4.16Å; W139-F357 AromaticContact CZ2-CD2 3.83Å; W139-F357 HydrophobicContact CZ2-CD2 3.83Å; W139-F357 AromaticContact CZ2-CE2 3.29Å; W139-F357 HydrophobicContact CZ2-CE2 3.29Å; W139-F357 HydrophobicContact CZ2-CZ 4.08Å; W139-F357 AromaticContact CZ3-CE2 3.78Å; W139-F357 HydrophobicContact CZ3-CE2 3.78Å; W139-F357 AromaticContact CZ3-CZ 3.86Å; W139-F357 HydrophobicContact CZ3-CZ 3.86Å; W139-F357 AromaticContact NE1-CD2 3.53Å; W139-F357 AromaticContact NE1-CE2 3.6Å; W139-F357 AromaticContact NE1-CG 3.99Å
140	A	87.6	Confident	85.9	Confident	16 Å²	16	40.4 Å²	40.4	13%	0.132	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-41.1	178.7	0	0	0	0	0	111.9	R136 D137 V138 G142 C143 V144 L354	R136-A140 PolarHBondContact O-N 2.98Å; D137-A140 PolarHBondContact O-N 2.85Å; V138-A140 PolarHBondContact O-N 2.87Å; A140-G142 VanDerWaalsContact C-N 3.29Å; A140-G142 PolarHBondContact O-N 2.89Å; A140-C143 WeakPolarHBondContact O-CB 3.4Å; A140-C143 PolarHBondContact O-N 2.92Å; A140-V144 WeakPolarHBondContact O-CG2 3.32Å; A140-V144 PolarHBondContact O-N 3.5Å; A140-L354 HydrophobicContact CB-CD1 3.58Å
141	A	89.8	Confident	86.3	Confident	56 Å²	56	37.8 Å²	37.8	46%	0.463	21%	0.205	S	C	.	.	H	α-helix	trans	-60	-39.4	172.9	0	0	0	0	0	111.9	D137 V138 W139 V144 L145	D137-A141 WeakPolarHBondContact O-CB 3.31Å; D137-A141 PolarHBondContact O-N 3.48Å; V138-A141 WeakPolarHBondContact O-CB 3.4Å; V138-A141 PolarHBondContact O-N 2.76Å; W139-A141 VanDerWaalsContact C-N 3.31Å; W139-A141 PolarHBondContact O-N 3Å; A141-V144 PolarHBondContact O-N 2.93Å; A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 PolarHBondContact O-N 2.86Å
142	G	92.5	Very high	86.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-42.9	172.3	0	0	0	0	0	113.5	V138 W139 A140 V144 L145 A146 L214	V138-G142 PolarHBondContact O-N 3.1Å; W139-G142 WeakPolarHBondContact O-CA 3.21Å; W139-G142 PolarHBondContact O-N 2.89Å; A140-G142 VanDerWaalsContact C-N 3.29Å; A140-G142 PolarHBondContact O-N 2.89Å; G142-V144 PolarHBondContact O-N 3.21Å; G142-L145 PolarHBondContact O-N 3.01Å; G142-A146 WeakPolarHBondContact O-CB 3.36Å; G142-A146 PolarHBondContact O-N 3Å; G142-L214 WeakPolarHBondContact O-CD2 3.24Å
143	C	90.3	Very high	87.2	Confident	14 Å²	14	37.6 Å²	37.6	10%	0.095	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-43.2	175.1	-68	0	0	0	0	112	W139 A140 A146 E147 I154	W139-C143 PolarHBondContact NE1-SG 3.47Å; W139-C143 VanDerWaalsContact NE1-SG 3.35Å; W139-C143 PolarHBondContact O-N 2.98Å; A140-C143 WeakPolarHBondContact O-CB 3.4Å; A140-C143 PolarHBondContact O-N 2.92Å; C143-A146 PolarHBondContact O-N 2.87Å; C143-E147 WeakPolarHBondContact O-CB 3.16Å; C143-E147 PolarHBondContact O-N 3.39Å; C143-I154 HydrophobicContact CB-CG2 4.4Å
144	V	89.6	Confident	87.6	Confident	61 Å²	61	35.8 Å²	35.8	37%	0.37	20%	0.202	S	C	.	.	H	α-helix	trans	-65.6	-43.6	176.6	175.3	0	0	0	0	110.9	A140 A141 G142 A146 E147 C148	A140-V144 WeakPolarHBondContact O-CG2 3.32Å; A140-V144 PolarHBondContact O-N 3.5Å; A141-V144 PolarHBondContact O-N 2.93Å; G142-V144 PolarHBondContact O-N 3.21Å; V144-A146 VanDerWaalsContact C-N 3.33Å; V144-A146 PolarHBondContact O-N 3.04Å; V144-E147 PolarHBondContact O-N 2.91Å; V144-E147 VanDerWaalsContact O-N 3.16Å; V144-C148 PolarHBondContact O-N 3.32Å; V144-C148 PolarHBondContact O-SG 3.41Å; V144-C148 VanDerWaalsContact O-SG 3.33Å
145	L	89.5	Confident	87.8	Confident	32 Å²	32	30.2 Å²	30.2	17%	0.168	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-46.4	176.1	179.1	62.4	0	0	0	110.8	A141 G142 E147 C148 F149 L213 L214 F236	A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 PolarHBondContact O-N 2.86Å; G142-L145 PolarHBondContact O-N 3.01Å; L145-E147 VanDerWaalsContact C-N 3.34Å; L145-E147 PolarHBondContact O-N 3.41Å; L145-C148 WeakPolarHBondContact O-CB 3.34Å; L145-C148 PolarHBondContact O-N 3.48Å; L145-F149 HydrophobicContact CD1-CE2 3.97Å; L145-F149 HydrophobicContact CG-CE2 4.27Å; L145-F149 WeakPolarHBondContact O-CD2 3.37Å; L145-L213 HydrophobicContact CD2-CD2 3.74Å; L145-L213 HydrophobicContact CD2-CG 4.28Å; L145-L214 HydrophobicContact CB-CD2 4.23Å; L145-L214 HydrophobicContact CD2-CD2 4.06Å; L145-L214 HydrophobicContact CD2-CG 4.43Å; L145-L214 HydrophobicContact CG-CD2 4.23Å; L145-F236 HydrophobicContact CD1-CE1 4.12Å; L145-F236 HydrophobicContact CD1-CZ 4.39Å
146	A	89.3	Confident	87.7	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-41.7	175	0	0	0	0	0	112.1	G142 C143 V144 C148 F149 T150 I154 M202 L214	G142-A146 WeakPolarHBondContact O-CB 3.36Å; G142-A146 PolarHBondContact O-N 3Å; C143-A146 PolarHBondContact O-N 2.87Å; V144-A146 VanDerWaalsContact C-N 3.33Å; V144-A146 PolarHBondContact O-N 3.04Å; A146-C148 VanDerWaalsContact C-N 3.29Å; A146-C148 PolarHBondContact O-N 2.85Å; A146-F149 WeakPolarHBondContact O-CB 3.28Å; A146-F149 PolarHBondContact O-N 3.39Å; A146-F149 VanDerWaalsContact O-N 3.09Å; A146-T150 PolarHBondContact O-N 2.86Å; A146-T150 PolarHBondContact O-OG1 3.1Å; A146-T150 VanDerWaalsContact O-OG1 3.11Å; A146-I154 HydrophobicContact CB-CB 3.8Å; A146-I154 HydrophobicContact CB-CD1 4.49Å; A146-I154 HydrophobicContact CB-CG1 4.07Å; A146-I154 HydrophobicContact CB-CG2 3.92Å; A146-M202 HydrophobicContact CB-CE 4.42Å; A146-M202 HydrophobicContact CB-SD 3.74Å; A146-L214 HydrophobicContact CB-CD1 3.99Å; A146-L214 HydrophobicContact CB-CD2 4.02Å
147	E	86.8	Confident	87.3	Confident	22 Å²	22	32.6 Å²	32.6	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-31.7	176.7	178.6	172.9	-168.4	0	0	112.7	C143 V144 L145 F149 C151 S152 R313 R349	C143-E147 WeakPolarHBondContact O-CB 3.16Å; C143-E147 PolarHBondContact O-N 3.39Å; V144-E147 PolarHBondContact O-N 2.91Å; V144-E147 VanDerWaalsContact O-N 3.16Å; L145-E147 VanDerWaalsContact C-N 3.34Å; L145-E147 PolarHBondContact O-N 3.41Å; E147-F149 PolarHBondContact O-N 3.14Å; E147-C151 WeakPolarHBondContact O-CA 3.45Å; E147-C151 PolarHBondContact O-N 2.57Å; E147-S152 WeakPolarHBondContact CA-O 3.39Å; E147-R313 IonicContact OE1-CZ 3.23Å; E147-R313 VanDerWaalsContact OE1-CZ 3.23Å; E147-R313 IonicContact OE1-NH1 2.63Å; E147-R313 PolarHBondContact OE1-NH1 2.97Å; E147-R313 IonicContact OE1-NH2 2.95Å; E147-R313 PolarHBondContact OE1-NH2 3.17Å; E147-R349 IonicContact OE1-NH1 3.02Å; E147-R349 PolarHBondContact OE1-NH1 3.42Å; E147-R349 IonicContact OE2-NH1 3.36Å
148	C	86.4	Confident	86.8	Confident	42 Å²	42	40.4 Å²	40.4	28%	0.284	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-30.7	173.8	-71.1	0	0	0	0	112.6	V144 L145 A146 V306	V144-C148 PolarHBondContact O-N 3.32Å; V144-C148 PolarHBondContact O-SG 3.41Å; V144-C148 VanDerWaalsContact O-SG 3.33Å; L145-C148 WeakPolarHBondContact O-CB 3.34Å; L145-C148 PolarHBondContact O-N 3.48Å; A146-C148 VanDerWaalsContact C-N 3.29Å; A146-C148 PolarHBondContact O-N 2.85Å; C148-V306 HydrophobicContact CB-CG2 3.94Å
149	F	86.4	Confident	85.8	Confident	41 Å²	41	47.9 Å²	47.9	18%	0.18	27%	0.267	C	S	.	.	H	α-helix	trans	-86.1	-48.3	179	-77.7	-70.9	0	0	0	112.3	L145 A146 E147 C151 M202 I204 E207 A210 F236	L145-F149 HydrophobicContact CD1-CE2 3.97Å; L145-F149 HydrophobicContact CG-CE2 4.27Å; L145-F149 WeakPolarHBondContact O-CD2 3.37Å; A146-F149 WeakPolarHBondContact O-CB 3.28Å; A146-F149 PolarHBondContact O-N 3.39Å; A146-F149 VanDerWaalsContact O-N 3.09Å; E147-F149 PolarHBondContact O-N 3.14Å; F149-C151 VanDerWaalsContact C-N 3.32Å; F149-M202 HydrophobicContact CB-CE 3.34Å; F149-M202 HydrophobicContact CD2-CE 3.56Å; F149-M202 HydrophobicContact CG-CE 3.63Å; F149-I204 HydrophobicContact CB-CD1 3.55Å; F149-I204 HydrophobicContact CD1-CD1 3.45Å; F149-I204 VanDerWaalsContact CD1-CD1 3.45Å; F149-I204 HydrophobicContact CE1-CD1 4.42Å; F149-I204 HydrophobicContact CG-CD1 3.8Å; F149-E207 HydrophobicContact CE1-CB 4.43Å; F149-E207 HydrophobicContact CE1-CG 4.27Å; F149-A210 HydrophobicContact CE1-CB 4.48Å; F149-A210 HydrophobicContact CE2-CB 3.76Å; F149-A210 HydrophobicContact CZ-CB 3.66Å; F149-F236 HydrophobicContact CE2-CZ 4.22Å; F149-F236 HydrophobicContact CZ-CE2 4.01Å; F149-F236 AromaticContact CZ-CZ 3.87Å; F149-F236 HydrophobicContact CZ-CZ 3.87Å
150	T	85.3	Confident	84.6	Confident	30 Å²	30	54 Å²	54	18%	0.184	30%	0.3	C	S	.	.	H	α-helix	trans	-84.4	-9.8	-175.8	60.5	0	0	0	0	113.3	A146 S152 I154 M202	A146-T150 PolarHBondContact O-N 2.86Å; A146-T150 PolarHBondContact O-OG1 3.1Å; A146-T150 VanDerWaalsContact O-OG1 3.11Å; T150-S152 PolarHBondContact O-N 3.28Å; T150-S152 PolarHBondContact O-OG 3.46Å; T150-S152 PolarHBondContact OG1-N 2.93Å; T150-S152 PolarHBondContact OG1-O 3.33Å; T150-I154 HydrophobicContact CG2-CD1 4.19Å; T150-M202 HydrophobicContact CG2-SD 3.69Å
151	C	85.2	Confident	84	Confident	41 Å²	41	60.1 Å²	60.1	28%	0.277	33%	0.326	S	S	.	.	S	Bend	trans	58.2	20.6	-178.7	-43.3	0	0	0	0	112.5	E147 F149 Q309 R313	E147-C151 WeakPolarHBondContact O-CA 3.45Å; E147-C151 PolarHBondContact O-N 2.57Å; F149-C151 VanDerWaalsContact C-N 3.32Å; C151-Q309 PolarHBondContact SG-NE2 3.03Å; C151-Q309 PolarHBondContact SG-OE1 2.83Å; C151-R313 PolarHBondContact O-NH2 3.17Å
152	S	84.5	Confident	83.6	Confident	55 Å²	55	57.9 Å²	57.9	39%	0.385	31%	0.305	S	S	.	.	S	Bend	trans	-154.5	154.2	-178.7	66.3	0	0	0	0	109.6	E147 T150 I154	E147-S152 WeakPolarHBondContact CA-O 3.39Å; T150-S152 PolarHBondContact O-N 3.28Å; T150-S152 PolarHBondContact O-OG 3.46Å; T150-S152 PolarHBondContact OG1-N 2.93Å; T150-S152 PolarHBondContact OG1-O 3.33Å; S152-I154 PolarHBondContact O-N 3.01Å
153	P	86.8	Confident	83	Confident	65 Å²	65	58 Å²	58	42%	0.422	31%	0.306	S	S	.	.			trans	-57.1	125.7	175.7	-25.1	34.8	0	0	0	110.7	F155 P156	P153-F155 PolarHBondContact O-N 3.44Å; P153-P156 WeakPolarHBondContact O-CD 3.36Å
154	I	87.8	Confident	82.6	Confident	11 Å²	11	59.3 Å²	59.3	6%	0.056	32%	0.322	C	S	.	.	S	Bend	trans	-61.9	-33.4	179.2	-169.3	64.9	0	0	0	111.3	C143 A146 T150 S152 P156 I169 A201 M202	C143-I154 HydrophobicContact CB-CG2 4.4Å; A146-I154 HydrophobicContact CB-CB 3.8Å; A146-I154 HydrophobicContact CB-CD1 4.49Å; A146-I154 HydrophobicContact CB-CG1 4.07Å; A146-I154 HydrophobicContact CB-CG2 3.92Å; T150-I154 HydrophobicContact CG2-CD1 4.19Å; S152-I154 PolarHBondContact O-N 3.01Å; I154-P156 VanDerWaalsContact O-CD 3.24Å; I154-P156 WeakPolarHBondContact O-CD 3.31Å; I154-I169 HydrophobicContact CD1-CD1 4.07Å; I154-I169 HydrophobicContact CG1-CD1 3.96Å; I154-I169 WeakPolarHBondContact O-CD1 3.49Å; I154-A201 HydrophobicContact CD1-CB 3.99Å; I154-M202 HydrophobicContact CD1-SD 3.99Å
155	F	89.1	Confident	82.4	Confident	8 Å²	8	57 Å²	57	4%	0.035	31%	0.31	C	S	.	.	S	Bend	trans	-113.5	85.3	173.7	-52.2	-56.7	0	0	0	110	W139 P153 G157 A165 I166 I169 L170 L218	W139-F155 HydrophobicContact CH2-CE2 4.23Å; W139-F155 HydrophobicContact CH2-CZ 4.38Å; W139-F155 HydrophobicContact CZ2-CD2 4.17Å; W139-F155 AromaticContact CZ2-CE2 3.49Å; W139-F155 HydrophobicContact CZ2-CE2 3.49Å; W139-F155 VanDerWaalsContact CZ2-CE2 3.49Å; W139-F155 HydrophobicContact CZ2-CZ 4.05Å; P153-F155 PolarHBondContact O-N 3.44Å; F155-G157 VanDerWaalsContact C-N 3.28Å; F155-G157 PolarHBondContact O-N 3.15Å; F155-A165 HydrophobicContact CB-CB 4.26Å; F155-I166 HydrophobicContact CB-CG1 4.27Å; F155-I166 HydrophobicContact CD1-CB 4.44Å; F155-I166 HydrophobicContact CD1-CG1 4.15Å; F155-I166 HydrophobicContact CD2-CG1 4.17Å; F155-I166 HydrophobicContact CG-CG1 3.94Å; F155-I169 HydrophobicContact CD1-CB 4.43Å; F155-I169 HydrophobicContact CD1-CD1 3.84Å; F155-I169 HydrophobicContact CD1-CG1 4.48Å; F155-I169 HydrophobicContact CE1-CB 3.9Å; F155-I169 HydrophobicContact CE1-CD1 3.92Å; F155-I169 HydrophobicContact CE1-CG1 4.39Å; F155-I169 HydrophobicContact CE1-CG2 4.13Å; F155-L170 HydrophobicContact CE1-CG 4.35Å; F155-L170 HydrophobicContact CZ-CD1 4.26Å; F155-L170 HydrophobicContact CZ-CG 4.31Å; F155-L218 HydrophobicContact CE2-CD1 4.23Å; F155-L218 HydrophobicContact CE2-CD2 4.14Å; F155-L218 HydrophobicContact CZ-CD1 4.06Å
156	P	83.4	Confident	82.3	Confident	103 Å²	103	55.6 Å²	55.6	67%	0.669	30%	0.302	S	S	*	.			trans	-77	78.5	-179.7	32.3	-35.2	0	0	0	110.3	P153 I154	P153-P156 WeakPolarHBondContact O-CD 3.36Å; I154-P156 VanDerWaalsContact O-CD 3.24Å; I154-P156 WeakPolarHBondContact O-CD 3.31Å
157	G	74.6	Confident	82.2	Confident	21 Å²	21	56 Å²	56	22%	0.216	31%	0.305	C	S	.	.			trans	-126.3	166.6	173.7	0	0	0	0	0	112.2	F155 Q162	F155-G157 VanDerWaalsContact C-N 3.28Å; F155-G157 PolarHBondContact O-N 3.15Å; G157-Q162 PolarHBondContact O-OE1 2.85Å; G157-Q162 VanDerWaalsContact O-OE1 3.09Å
158	R	75.1	Confident	82.1	Confident	212 Å²	212	56.2 Å²	56.2	80%	0.8	31%	0.31	S	S	*	.			trans	-134.9	131.4	170.6	-65.7	-176.3	-179.6	176.1	0.6	108	D160 H161	R158-D160 PolarHBondContact O-N 3.26Å; R158-H161 PolarHBondContact O-N 3.39Å
159	K	69.7	Low	82.2	Confident	167 Å²	167	55.1 Å²	55.1	73%	0.726	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	43	-110.2	175.9	-60.5	-174.2	177.5	-172.8	0	111.2	H161 Q162	K159-H161 VanDerWaalsContact C-N 3.26Å; K159-H161 PolarHBondContact O-N 3.06Å; K159-Q162 VanDerWaalsContact O-CB 3.25Å; K159-Q162 WeakPolarHBondContact O-CB 3.2Å; K159-Q162 PolarHBondContact O-N 2.87Å
160	D	68	Low	82.4	Confident	138 Å²	138	55.2 Å²	55.2	74%	0.738	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-64.3	-24.8	-175.9	-54.8	-26.3	0	0	0	114.2	R158 Q162	R158-D160 PolarHBondContact O-N 3.26Å; D160-Q162 VanDerWaalsContact C-N 3.32Å
161	H	73.5	Confident	82.5	Confident	144 Å²	144	54.3 Å²	54.3	67%	0.667	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-82.5	-8.7	177.1	-59.3	-56.2	0	0	0	113.3	R158 K159 L163 G164 A165	R158-H161 PolarHBondContact O-N 3.39Å; K159-H161 VanDerWaalsContact C-N 3.26Å; K159-H161 PolarHBondContact O-N 3.06Å; H161-L163 PolarHBondContact O-N 3.4Å; H161-G164 PolarHBondContact O-N 2.93Å; H161-A165 PolarHBondContact O-N 3.32Å; H161-A165 VanDerWaalsContact O-N 3.1Å
162	Q	81.2	Confident	82.5	Confident	8 Å²	8	55.8 Å²	55.8	4%	0.037	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-44	-175.8	-167.3	70	0.5	0	0	112.3	G157 K159 D160 G164 A165 I166	G157-Q162 PolarHBondContact O-OE1 2.85Å; G157-Q162 VanDerWaalsContact O-OE1 3.09Å; K159-Q162 VanDerWaalsContact O-CB 3.25Å; K159-Q162 WeakPolarHBondContact O-CB 3.2Å; K159-Q162 PolarHBondContact O-N 2.87Å; D160-Q162 VanDerWaalsContact C-N 3.32Å; Q162-G164 VanDerWaalsContact C-N 3.28Å; Q162-G164 PolarHBondContact O-N 3.23Å; Q162-A165 PolarHBondContact O-N 3.33Å; Q162-A165 VanDerWaalsContact O-N 3.15Å; Q162-I166 HydrophobicContact CG-CD1 4.13Å; Q162-I166 WeakPolarHBondContact O-CG1 3.1Å; Q162-I166 PolarHBondContact O-N 2.87Å
163	L	80.6	Confident	82.4	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-60.3	-40.7	177.4	175.5	56.6	0	0	0	111.4	H161 A165 I166 C167 I188 L190 V360	H161-L163 PolarHBondContact O-N 3.4Å; L163-A165 VanDerWaalsContact C-N 3.34Å; L163-A165 PolarHBondContact O-N 2.88Å; L163-I166 PolarHBondContact O-N 2.9Å; L163-C167 WeakPolarHBondContact O-CB 3.49Å; L163-C167 PolarHBondContact O-N 2.78Å; L163-C167 PolarHBondContact O-SG 3.19Å; L163-I188 HydrophobicContact CD2-CD1 4.22Å; L163-L190 HydrophobicContact CD1-CD2 4.49Å; L163-L190 HydrophobicContact CD2-CD2 3.98Å; L163-L190 HydrophobicContact CG-CD2 3.96Å; L163-V360 HydrophobicContact CB-CG1 3.89Å; L163-V360 HydrophobicContact CB-CG2 3.81Å; L163-V360 HydrophobicContact CD1-CG1 3.52Å; L163-V360 HydrophobicContact CD2-CG1 4.45Å; L163-V360 HydrophobicContact CG-CG1 4.12Å
164	G	81.4	Confident	82.1	Confident	41 Å²	41	52.7 Å²	52.7	42%	0.423	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-39.3	176.3	0	0	0	0	0	113	H161 Q162 A168	H161-G164 PolarHBondContact O-N 2.93Å; Q162-G164 VanDerWaalsContact C-N 3.28Å; Q162-G164 PolarHBondContact O-N 3.23Å; G164-A168 WeakPolarHBondContact O-CB 3.24Å; G164-A168 PolarHBondContact O-N 3.32Å
165	A	85	Confident	81.7	Confident	14 Å²	14	56.9 Å²	56.9	12%	0.116	31%	0.31	C	S	.	.	H	α-helix	trans	-67	-41.9	176.6	0	0	0	0	0	112.1	F155 H161 Q162 L163 A168	F155-A165 HydrophobicContact CB-CB 4.26Å; H161-A165 PolarHBondContact O-N 3.32Å; H161-A165 VanDerWaalsContact O-N 3.1Å; Q162-A165 PolarHBondContact O-N 3.33Å; Q162-A165 VanDerWaalsContact O-N 3.15Å; L163-A165 VanDerWaalsContact C-N 3.34Å; L163-A165 PolarHBondContact O-N 2.88Å; A165-A168 PolarHBondContact O-N 3.49Å
166	I	88.7	Confident	81.1	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-49.5	175.6	-62.8	168.2	0	0	0	110.2	W139 F155 Q162 L163 A168 I169 L170 Y220 F357	W139-I166 HydrophobicContact CH2-CG2 4.11Å; W139-I166 HydrophobicContact CZ2-CD1 4.27Å; W139-I166 HydrophobicContact CZ2-CG1 4.44Å; W139-I166 HydrophobicContact CZ2-CG2 4.3Å; F155-I166 HydrophobicContact CB-CG1 4.27Å; F155-I166 HydrophobicContact CD1-CB 4.44Å; F155-I166 HydrophobicContact CD1-CG1 4.15Å; F155-I166 HydrophobicContact CD2-CG1 4.17Å; F155-I166 HydrophobicContact CG-CG1 3.94Å; Q162-I166 HydrophobicContact CG-CD1 4.13Å; Q162-I166 WeakPolarHBondContact O-CG1 3.1Å; Q162-I166 PolarHBondContact O-N 2.87Å; L163-I166 PolarHBondContact O-N 2.9Å; I166-A168 PolarHBondContact O-N 3.2Å; I166-I169 PolarHBondContact O-N 3.3Å; I166-I169 VanDerWaalsContact O-N 3.12Å; I166-L170 HydrophobicContact CG2-CD1 3.8Å; I166-L170 HydrophobicContact CG2-CG 4.35Å; I166-L170 PolarHBondContact O-N 2.91Å; I166-Y220 HydrophobicContact CG2-CE1 3.68Å; I166-F357 HydrophobicContact CD1-CD2 4.01Å; I166-F357 HydrophobicContact CD1-CE2 4.45Å
167	C	86.6	Confident	80.9	Confident	9 Å²	9	56.3 Å²	56.3	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-28.6	179.4	-69.2	0	0	0	0	113.5	L163 I169 G171 Y220	L163-C167 WeakPolarHBondContact O-CB 3.49Å; L163-C167 PolarHBondContact O-N 2.78Å; L163-C167 PolarHBondContact O-SG 3.19Å; C167-I169 PolarHBondContact O-N 2.83Å; C167-G171 WeakPolarHBondContact CA-O 3.26Å; C167-G171 CarbonylContact O-C 3.55Å; C167-G171 WeakPolarHBondContact O-CA 3.35Å; C167-G171 PolarHBondContact O-N 2.74Å; C167-Y220 WeakPolarHBondContact CA-OH 3.2Å; C167-Y220 PolarHBondContact SG-OH 3.37Å; C167-Y220 VanDerWaalsContact SG-OH 3.41Å
168	A	85.4	Confident	80.9	Confident	27 Å²	27	57.8 Å²	57.8	22%	0.223	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-28.4	177.6	0	0	0	0	0	112.8	G164 A165 I166 V196	G164-A168 WeakPolarHBondContact O-CB 3.24Å; G164-A168 PolarHBondContact O-N 3.32Å; A165-A168 PolarHBondContact O-N 3.49Å; I166-A168 PolarHBondContact O-N 3.2Å; A168-V196 PolarHBondContact O-N 3.4Å
169	I	88.2	Confident	80.6	Confident	18 Å²	18	55 Å²	55	9%	0.092	29%	0.294	C	S	.	.	H	α-helix	trans	-103.1	-44.9	-177.3	-64	-179.1	0	0	0	111.6	I154 F155 I166 C167 T197 L198 A201	I154-I169 HydrophobicContact CD1-CD1 4.07Å; I154-I169 HydrophobicContact CG1-CD1 3.96Å; I154-I169 WeakPolarHBondContact O-CD1 3.49Å; F155-I169 HydrophobicContact CD1-CB 4.43Å; F155-I169 HydrophobicContact CD1-CD1 3.84Å; F155-I169 HydrophobicContact CD1-CG1 4.48Å; F155-I169 HydrophobicContact CE1-CB 3.9Å; F155-I169 HydrophobicContact CE1-CD1 3.92Å; F155-I169 HydrophobicContact CE1-CG1 4.39Å; F155-I169 HydrophobicContact CE1-CG2 4.13Å; I166-I169 PolarHBondContact O-N 3.3Å; I166-I169 VanDerWaalsContact O-N 3.12Å; C167-I169 PolarHBondContact O-N 2.83Å; I169-T197 WeakPolarHBondContact O-CA 3.38Å; I169-T197 PolarHBondContact O-N 2.88Å; I169-L198 HydrophobicContact CG2-CD2 3.78Å; I169-L198 HydrophobicContact CG2-CG 4.13Å; I169-A201 HydrophobicContact CD1-CB 3.94Å; I169-A201 HydrophobicContact CG1-CB 4.19Å; I169-A201 HydrophobicContact CG2-CB 4.07Å
170	L	89.5	Confident	80.5	Confident	44 Å²	44	47.5 Å²	47.5	23%	0.23	26%	0.264	C	S	.	.	H	α-helix	trans	-91.4	-7.6	-176.4	-58.6	-175.4	0	0	0	113.9	W139 F155 I166 L198 L218 Y220	W139-L170 HydrophobicContact CH2-CD1 3.56Å; W139-L170 HydrophobicContact CZ3-CD1 4.16Å; F155-L170 HydrophobicContact CE1-CG 4.35Å; F155-L170 HydrophobicContact CZ-CD1 4.26Å; F155-L170 HydrophobicContact CZ-CG 4.31Å; I166-L170 HydrophobicContact CG2-CD1 3.8Å; I166-L170 HydrophobicContact CG2-CG 4.35Å; I166-L170 PolarHBondContact O-N 2.91Å; L170-L198 HydrophobicContact CD2-CD1 4Å; L170-L198 HydrophobicContact CD2-CD2 4.4Å; L170-L198 HydrophobicContact CD2-CG 4.04Å; L170-L218 WeakPolarHBondContact CD1-O 3.47Å; L170-Y220 HydrophobicContact CB-CE2 3.78Å; L170-Y220 HydrophobicContact CD1-CE2 4.41Å
171	G	87.9	Confident	80.3	Confident	11 Å²	11	41 Å²	41	11%	0.113	23%	0.229	C	C	.	.			trans	76.4	-177.8	-169.7	0	0	0	0	0	112.3	C167 Y220	C167-G171 WeakPolarHBondContact CA-O 3.26Å; C167-G171 CarbonylContact O-C 3.55Å; C167-G171 WeakPolarHBondContact O-CA 3.35Å; C167-G171 PolarHBondContact O-N 2.74Å; G171-Y220 WeakPolarHBondContact O-CE2 3.02Å; G171-Y220 PolarHBondContact O-OH 2.89Å
172	N	84.6	Confident	79.7	Confident	72 Å²	72	36 Å²	36	39%	0.385	21%	0.206	S	C	.	.	S	Bend	trans	-70.2	140.7	-179.3	-73.4	-15.5	0	0	0	111.2	L190	N172-L190 HydrophobicContact CB-CD1 4.46Å
173	P	83.1	Confident	78.7	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.032	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-59.6	145.6	172	22.6	-31.3	0	0	0	110.8	V177 L178 L190 Y220	P173-V177 HydrophobicContact CB-CB 4.14Å; P173-V177 HydrophobicContact CB-CG1 3.9Å; P173-L178 HydrophobicContact CB-CD2 4.47Å; P173-L178 HydrophobicContact CB-CG 4.28Å; P173-L178 HydrophobicContact CG-CD2 3.56Å; P173-L178 HydrophobicContact CG-CG 3.83Å; P173-L178 WeakPolarHBondContact O-CD1 3.47Å; P173-L190 HydrophobicContact CG-CD1 4.25Å; P173-Y220 HydrophobicContact CB-CD1 3.94Å; P173-Y220 HydrophobicContact CB-CD2 4.07Å; P173-Y220 HydrophobicContact CB-CE1 4.03Å; P173-Y220 HydrophobicContact CB-CE2 4.14Å; P173-Y220 HydrophobicContact CB-CG 3.97Å; P173-Y220 HydrophobicContact CG-CE1 4.38Å
174	P	80.9	Confident	77.6	Confident	50 Å²	50	41.8 Å²	41.8	33%	0.325	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-66.3	159.8	178	30.3	-36.4	0	0	0	111.1	N176 V177 L178	P174-N176 VanDerWaalsContact C-N 3.26Å; P174-N176 WeakPolarHBondContact CB-OD1 3.45Å; P174-N176 WeakPolarHBondContact CG-OD1 3.49Å; P174-N176 PolarHBondContact O-N 3.49Å; P174-V177 HydrophobicContact CG-CB 4.08Å; P174-V177 HydrophobicContact CG-CG2 3.68Å; P174-V177 PolarHBondContact O-N 2.74Å; P174-L178 PolarHBondContact O-N 3.45Å
175	V	79.1	Confident	76.7	Confident	99 Å²	99	40.6 Å²	40.6	60%	0.6	22%	0.224	S	C	*	.	H	α-helix	trans	-58.9	-35.7	-171.3	177.4	0	0	0	0	112.7	L178 R179	V175-L178 PolarHBondContact O-N 3.24Å; V175-R179 WeakPolarHBondContact O-CB 3.49Å; V175-R179 PolarHBondContact O-N 3.25Å
176	N	75.9	Confident	75.7	Confident	83 Å²	83	44.3 Å²	44.3	44%	0.444	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-45.5	174.3	60.4	-38	0	0	0	111.6	P174 R179 A180	P174-N176 VanDerWaalsContact C-N 3.26Å; P174-N176 WeakPolarHBondContact CB-OD1 3.45Å; P174-N176 WeakPolarHBondContact CG-OD1 3.49Å; P174-N176 PolarHBondContact O-N 3.49Å; N176-R179 PolarHBondContact O-N 2.74Å; N176-A180 PolarHBondContact O-N 2.89Å; N176-A180 VanDerWaalsContact O-N 3.17Å
177	V	79.1	Confident	74.4	Confident	15 Å²	15	53.9 Å²	53.9	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-67.3	-45.4	176.5	175.3	0	0	0	0	110.8	P173 P174 R179 A180 L181 E221 L361	P173-V177 HydrophobicContact CB-CB 4.14Å; P173-V177 HydrophobicContact CB-CG1 3.9Å; P174-V177 HydrophobicContact CG-CB 4.08Å; P174-V177 HydrophobicContact CG-CG2 3.68Å; P174-V177 PolarHBondContact O-N 2.74Å; V177-R179 PolarHBondContact O-N 3.19Å; V177-A180 WeakPolarHBondContact O-CA 3.44Å; V177-A180 WeakPolarHBondContact O-CB 3.41Å; V177-A180 PolarHBondContact O-N 2.79Å; V177-L181 HydrophobicContact CG1-CD2 4.33Å; V177-L181 WeakPolarHBondContact O-CG 3.26Å; V177-L181 PolarHBondContact O-N 2.85Å; V177-L181 VanDerWaalsContact O-N 3.1Å; V177-E221 HydrophobicContact CG2-CG 3.43Å; V177-E221 VanDerWaalsContact CG2-CG 3.43Å; V177-L361 HydrophobicContact CG1-CD2 4.09Å
178	L	75	Confident	73.4	Confident	52 Å²	52	56.7 Å²	56.7	27%	0.272	29%	0.285	S	S	.	.	H	α-helix	trans	-54	-39.6	175.5	-79.4	172.1	0	0	0	112.2	P173 P174 V175 L181 L190	P173-L178 HydrophobicContact CB-CD2 4.47Å; P173-L178 HydrophobicContact CB-CG 4.28Å; P173-L178 HydrophobicContact CG-CD2 3.56Å; P173-L178 HydrophobicContact CG-CG 3.83Å; P173-L178 WeakPolarHBondContact O-CD1 3.47Å; P174-L178 PolarHBondContact O-N 3.45Å; V175-L178 PolarHBondContact O-N 3.24Å; L178-L181 HydrophobicContact CD2-CD1 3.69Å; L178-L181 WeakPolarHBondContact O-CB 3.49Å; L178-L181 PolarHBondContact O-N 2.95Å; L178-L190 HydrophobicContact CD2-CD1 3.98Å
179	R	68.4	Low	72.4	Confident	153 Å²	153	66.7 Å²	66.7	58%	0.577	32%	0.317	S	S	*	.	H	α-helix	trans	-69.9	-31.6	177.2	-167	-178.4	-60.8	159.6	1.3	112.2	V175 N176 V177 L181 R186	V175-R179 WeakPolarHBondContact O-CB 3.49Å; V175-R179 PolarHBondContact O-N 3.25Å; N176-R179 PolarHBondContact O-N 2.74Å; V177-R179 PolarHBondContact O-N 3.19Å; R179-L181 VanDerWaalsContact C-N 3.32Å; R179-R186 PolarHBondContact O-NE 2.96Å; R179-R186 PolarHBondContact O-NH2 3.09Å
180	A	67.6	Low	71.4	Confident	11 Å²	11	68 Å²	68	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-76	-19.6	175.1	0	0	0	0	0	113.1	N176 V177 M363 S364 E367	N176-A180 PolarHBondContact O-N 2.89Å; N176-A180 VanDerWaalsContact O-N 3.17Å; V177-A180 WeakPolarHBondContact O-CA 3.44Å; V177-A180 WeakPolarHBondContact O-CB 3.41Å; V177-A180 PolarHBondContact O-N 2.79Å; A180-M363 HydrophobicContact CB-CG 4.24Å; A180-M363 WeakPolarHBondContact O-CA 3.5Å; A180-S364 PolarHBondContact O-N 3.43Å; A180-E367 WeakPolarHBondContact CB-OE1 3.23Å
181	L	65.4	Low	70.4	Confident	2 Å²	2	73.7 Å²	73.7	1%	0.01	35%	0.346	C	S	.	.	S	Bend	trans	-59.7	155.3	180	-58.4	-179.1	0	0	0	113.1	V177 L178 R179 L185 R186 V360 L361	V177-L181 HydrophobicContact CG1-CD2 4.33Å; V177-L181 WeakPolarHBondContact O-CG 3.26Å; V177-L181 PolarHBondContact O-N 2.85Å; V177-L181 VanDerWaalsContact O-N 3.1Å; L178-L181 HydrophobicContact CD2-CD1 3.69Å; L178-L181 WeakPolarHBondContact O-CB 3.49Å; L178-L181 PolarHBondContact O-N 2.95Å; R179-L181 VanDerWaalsContact C-N 3.32Å; L181-L185 HydrophobicContact CB-CB 4.46Å; L181-L185 HydrophobicContact CD1-CB 4.48Å; L181-R186 HydrophobicContact CB-CG 4.39Å; L181-R186 PolarHBondContact O-NE 2.84Å; L181-R186 PolarHBondContact O-NH2 2.74Å; L181-V360 WeakPolarHBondContact CD2-O 3.35Å; L181-L361 HydrophobicContact CD2-CD2 3.37Å
182	Q	59.9	Low	69	Low	39 Å²	39	84.8 Å²	84.8	18%	0.182	39%	0.385	C	S	.	.			trans	-54.4	139	169.8	-52.9	-167.6	-37	0	0	111.5	N184 L185 R186 S359 R362	Q182-N184 WeakPolarHBondContact CB-OD1 3.4Å; Q182-N184 PolarHBondContact O-N 3.15Å; Q182-N184 VanDerWaalsContact O-N 3.16Å; Q182-N184 PolarHBondContact OE1-ND2 3.01Å; Q182-N184 PolarHBondContact OE1-OD1 2.84Å; Q182-L185 HydrophobicContact CB-CD1 4.23Å; Q182-L185 HydrophobicContact CB-CG 4.47Å; Q182-L185 WeakPolarHBondContact O-CB 3.4Å; Q182-L185 PolarHBondContact O-N 3.13Å; Q182-R186 PolarHBondContact O-N 3.21Å; Q182-S359 PolarHBondContact OE1-O 2.77Å; Q182-R362 HydrophobicContact CG-CB 4.05Å
183	P	61	Low	68	Low	54 Å²	54	89.1 Å²	89.1	35%	0.351	40%	0.396	S	S	.	.	H	α-helix	trans	-56.5	-33.8	-175.2	-27.5	34	0	0	0	114.8	L185 R186 N366	P183-L185 VanDerWaalsContact C-N 3.27Å; P183-L185 PolarHBondContact O-N 2.72Å; P183-R186 PolarHBondContact O-N 2.79Å; P183-N366 WeakPolarHBondContact CD-ND2 3.37Å; P183-N366 WeakPolarHBondContact CG-ND2 3.48Å
184	N	57.8	Low	67.1	Low	77 Å²	77	97.8 Å²	97.8	41%	0.412	44%	0.436	S	S	.	.	H	α-helix	trans	-59.7	-34.6	174.2	48.3	-46.3	0	0	0	112.7	Q182	Q182-N184 WeakPolarHBondContact CB-OD1 3.4Å; Q182-N184 PolarHBondContact O-N 3.15Å; Q182-N184 VanDerWaalsContact O-N 3.16Å; Q182-N184 PolarHBondContact OE1-ND2 3.01Å; Q182-N184 PolarHBondContact OE1-OD1 2.84Å
185	L	61.1	Low	66.9	Low	17 Å²	17	97 Å²	97	9%	0.089	43%	0.434	C	S	.	.	H	α-helix	trans	-83.7	-27.4	-179.2	-61.6	172	0	0	0	113.2	L181 Q182 P183 R187 I188 S359 V360	L181-L185 HydrophobicContact CB-CB 4.46Å; L181-L185 HydrophobicContact CD1-CB 4.48Å; Q182-L185 HydrophobicContact CB-CD1 4.23Å; Q182-L185 HydrophobicContact CB-CG 4.47Å; Q182-L185 WeakPolarHBondContact O-CB 3.4Å; Q182-L185 PolarHBondContact O-N 3.13Å; P183-L185 VanDerWaalsContact C-N 3.27Å; P183-L185 PolarHBondContact O-N 2.72Å; L185-R187 PolarHBondContact O-N 3.43Å; L185-R187 VanDerWaalsContact O-N 3.12Å; L185-I188 HydrophobicContact CD2-CD1 3.53Å; L185-I188 WeakPolarHBondContact O-CB 3.07Å; L185-I188 PolarHBondContact O-N 3.31Å; L185-S359 WeakPolarHBondContact CD1-O 3.3Å; L185-V360 HydrophobicContact CD1-CB 4.48Å; L185-V360 WeakPolarHBondContact CD1-O 3.3Å
186	R	64.1	Low	67	Low	91 Å²	91	95.8 Å²	95.8	34%	0.343	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-23.3	172.5	-57.9	-174.4	-162.6	175.8	6.4	112.2	R179 L181 Q182 P183	R179-R186 PolarHBondContact O-NE 2.96Å; R179-R186 PolarHBondContact O-NH2 3.09Å; L181-R186 HydrophobicContact CB-CG 4.39Å; L181-R186 PolarHBondContact O-NE 2.84Å; L181-R186 PolarHBondContact O-NH2 2.74Å; Q182-R186 PolarHBondContact O-N 3.21Å; P183-R186 PolarHBondContact O-N 2.79Å
187	R	62.3	Low	67.4	Low	202 Å²	202	94.9 Å²	94.9	76%	0.762	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-17.6	176.7	-68.4	-172.3	-78.2	162	-5.4	113.8	L185 R189	L185-R187 PolarHBondContact O-N 3.43Å; L185-R187 VanDerWaalsContact O-N 3.12Å; R187-R189 PolarHBondContact O-N 3.12Å; R187-R189 VanDerWaalsContact O-N 3.11Å
188	I	65.7	Low	67.7	Low	69 Å²	69	94.5 Å²	94.5	35%	0.354	42%	0.421	S	S	.	.	S	Bend	trans	-68.8	113	178	-61.5	177.2	0	0	0	107.5	L163 L185 L190	L163-I188 HydrophobicContact CD2-CD1 4.22Å; L185-I188 HydrophobicContact CD2-CD1 3.53Å; L185-I188 WeakPolarHBondContact O-CB 3.07Å; L185-I188 PolarHBondContact O-N 3.31Å; I188-L190 PolarHBondContact O-N 3.41Å
189	R	63.2	Low	68.3	Low	237 Å²	237	94.5 Å²	94.5	89%	0.894	42%	0.424	S	S	*	.			trans	-65.8	97.8	171.9	-69.9	-174.1	-178.4	-177.7	0.8	108.7	R187 K191	R187-R189 PolarHBondContact O-N 3.12Å; R187-R189 VanDerWaalsContact O-N 3.11Å; R189-K191 PolarHBondContact O-N 2.86Å; R189-K191 VanDerWaalsContact O-N 3.07Å
190	L	67.5	Low	69.1	Low	45 Å²	45	91.7 Å²	91.7	24%	0.236	42%	0.424	C	S	.	.			trans	-64.2	109	170.1	-65.2	177.7	0	0	0	108.1	L163 N172 P173 L178 I188 R192	L163-L190 HydrophobicContact CD1-CD2 4.49Å; L163-L190 HydrophobicContact CD2-CD2 3.98Å; L163-L190 HydrophobicContact CG-CD2 3.96Å; N172-L190 HydrophobicContact CB-CD1 4.46Å; P173-L190 HydrophobicContact CG-CD1 4.25Å; L178-L190 HydrophobicContact CD2-CD1 3.98Å; I188-L190 PolarHBondContact O-N 3.41Å; L190-R192 PolarHBondContact O-N 3.19Å
191	K	68.1	Low	69.9	Low	163 Å²	163	92.6 Å²	92.6	71%	0.709	43%	0.432	S	S	*	.			trans	-60.1	125.7	170.8	-67.4	-176	179.6	-177.9	0	107.1	R189 R193	R189-K191 PolarHBondContact O-N 2.86Å; R189-K191 VanDerWaalsContact O-N 3.07Å; K191-R193 VanDerWaalsContact C-N 3.27Å; K191-R193 HydrophobicContact CB-CG 4.4Å; K191-R193 PolarHBondContact O-N 2.63Å
192	R	59.4	Low	70.7	Confident	244 Å²	244	92.8 Å²	92.8	92%	0.921	43%	0.433	S	S	*	.			trans	-65.5	90	175.4	-162.4	178.5	177	-177.9	-1.5	107.9	L190	L190-R192 PolarHBondContact O-N 3.19Å
193	R	63.3	Low	71.5	Confident	163 Å²	163	94 Å²	94	62%	0.615	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-102.8	141.7	172.8	-70.3	-176	171.9	179.4	-3.9	108	K191 A195	K191-R193 VanDerWaalsContact C-N 3.27Å; K191-R193 HydrophobicContact CB-CG 4.4Å; K191-R193 PolarHBondContact O-N 2.63Å; R193-A195 PolarHBondContact O-N 3.1Å
194	Q	64.8	Low	71.7	Confident	188 Å²	188	93.2 Å²	93.2	88%	0.879	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-68.4	127.3	168.2	-167.6	165.4	15.4	0	0	107.7
195	A	76.5	Confident	71.8	Confident	33 Å²	33	95.7 Å²	95.7	27%	0.273	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-62	135.9	179.5	0	0	0	0	0	109.9	R193 T197	R193-A195 PolarHBondContact O-N 3.1Å; A195-T197 PolarHBondContact O-N 3.46Å
196	V	81.3	Confident	71.8	Confident	73 Å²	73	103.2 Å²	103.2	44%	0.442	50%	0.5	S	S	.	.			trans	-67.8	-19.3	174.7	175.4	0	0	0	0	111.1	A168 T200 A201	A168-V196 PolarHBondContact O-N 3.4Å; V196-T200 HydrophobicContact CG1-CG2 3.73Å; V196-T200 WeakPolarHBondContact O-CB 3.39Å; V196-T200 PolarHBondContact O-OG1 2.73Å; V196-A201 HydrophobicContact CG1-CB 4.35Å
197	T	84.5	Confident	72.4	Confident	65 Å²	65	103 Å²	103	40%	0.399	50%	0.503	S	S	.	.			trans	66.5	151.5	-172.1	75.4	0	0	0	0	112.9	I169 A195 T200 A201	I169-T197 WeakPolarHBondContact O-CA 3.38Å; I169-T197 PolarHBondContact O-N 2.88Å; A195-T197 PolarHBondContact O-N 3.46Å; T197-T200 PolarHBondContact O-N 2.8Å; T197-T200 PolarHBondContact OG1-OG1 3.15Å; T197-A201 WeakPolarHBondContact O-CB 3.08Å; T197-A201 PolarHBondContact O-N 2.75Å
198	L	85.9	Confident	73.6	Confident	7 Å²	7	99.3 Å²	99.3	4%	0.037	49%	0.494	C	S	.	.	H	α-helix	trans	-60.2	-44.9	179.5	-79.1	168.7	0	0	0	113.6	I169 L170 T200 A201 M202 L214 E215 L218	I169-L198 HydrophobicContact CG2-CD2 3.78Å; I169-L198 HydrophobicContact CG2-CG 4.13Å; L170-L198 HydrophobicContact CD2-CD1 4Å; L170-L198 HydrophobicContact CD2-CD2 4.4Å; L170-L198 HydrophobicContact CD2-CG 4.04Å; L198-T200 VanDerWaalsContact C-N 3.34Å; L198-T200 PolarHBondContact O-N 3.35Å; L198-A201 PolarHBondContact O-N 3.37Å; L198-M202 VanDerWaalsContact O-CB 3.32Å; L198-M202 WeakPolarHBondContact O-CB 3.25Å; L198-M202 WeakPolarHBondContact O-CG 3.26Å; L198-M202 PolarHBondContact O-N 2.82Å; L198-L214 HydrophobicContact CD1-CB 4.38Å; L198-E215 HydrophobicContact CB-CG 4.46Å; L198-E215 HydrophobicContact CD1-CB 4.38Å; L198-E215 HydrophobicContact CD1-CG 3.65Å; L198-L218 HydrophobicContact CD1-CB 4.47Å; L198-L218 HydrophobicContact CD1-CD1 4.47Å; L198-L218 HydrophobicContact CD2-CD1 3.93Å
199	P	86.3	Confident	74.8	Confident	52 Å²	52	99.7 Å²	99.7	34%	0.338	50%	0.496	S	S	.	.	H	α-helix	trans	-53.1	-48.2	177.3	-22.2	25.7	0	0	0	113.4	M202 G203 I211	P199-M202 PolarHBondContact O-N 3.41Å; P199-G203 PolarHBondContact O-N 3.26Å; P199-I211 HydrophobicContact CG-CG2 3.86Å
200	T	85.9	Confident	76.1	Confident	93 Å²	93	88.4 Å²	88.4	57%	0.571	45%	0.454	S	S	*	.	H	α-helix	trans	-68.4	-43.4	-179.8	-45.9	0	0	0	0	111.4	V196 T197 L198 M202 G203	V196-T200 HydrophobicContact CG1-CG2 3.73Å; V196-T200 WeakPolarHBondContact O-CB 3.39Å; V196-T200 PolarHBondContact O-OG1 2.73Å; T197-T200 PolarHBondContact O-N 2.8Å; T197-T200 PolarHBondContact OG1-OG1 3.15Å; L198-T200 VanDerWaalsContact C-N 3.34Å; L198-T200 PolarHBondContact O-N 3.35Å; T200-M202 VanDerWaalsContact C-N 3.26Å; T200-M202 PolarHBondContact O-N 3.15Å; T200-G203 PolarHBondContact O-N 3.42Å; T200-G203 VanDerWaalsContact O-N 3.14Å
201	A	84	Confident	77.2	Confident	31 Å²	31	86.9 Å²	86.9	26%	0.256	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-31.8	-179.9	0	0	0	0	0	112.6	I154 I169 V196 T197 L198 G203	I154-A201 HydrophobicContact CD1-CB 3.99Å; I169-A201 HydrophobicContact CD1-CB 3.94Å; I169-A201 HydrophobicContact CG1-CB 4.19Å; I169-A201 HydrophobicContact CG2-CB 4.07Å; V196-A201 HydrophobicContact CG1-CB 4.35Å; T197-A201 WeakPolarHBondContact O-CB 3.08Å; T197-A201 PolarHBondContact O-N 2.75Å; L198-A201 PolarHBondContact O-N 3.37Å; A201-G203 VanDerWaalsContact C-N 3.29Å
202	M	81.7	Confident	78.4	Confident	6 Å²	6	81.9 Å²	81.9	3%	0.03	43%	0.427	C	S	.	.	H	α-helix	trans	-74.6	-19.5	177	-69.6	-72.3	-68.1	0	0	112.7	A146 F149 T150 I154 L198 P199 T200 I204 I211 L214	A146-M202 HydrophobicContact CB-CE 4.42Å; A146-M202 HydrophobicContact CB-SD 3.74Å; F149-M202 HydrophobicContact CB-CE 3.34Å; F149-M202 HydrophobicContact CD2-CE 3.56Å; F149-M202 HydrophobicContact CG-CE 3.63Å; T150-M202 HydrophobicContact CG2-SD 3.69Å; I154-M202 HydrophobicContact CD1-SD 3.99Å; L198-M202 VanDerWaalsContact O-CB 3.32Å; L198-M202 WeakPolarHBondContact O-CB 3.25Å; L198-M202 WeakPolarHBondContact O-CG 3.26Å; L198-M202 PolarHBondContact O-N 2.82Å; P199-M202 PolarHBondContact O-N 3.41Å; T200-M202 VanDerWaalsContact C-N 3.26Å; T200-M202 PolarHBondContact O-N 3.15Å; M202-I204 HydrophobicContact CE-CD1 4.48Å; M202-I204 WeakPolarHBondContact O-CG1 3.4Å; M202-I204 PolarHBondContact O-N 3.36Å; M202-I211 HydrophobicContact CB-CD1 3.78Å; M202-I211 HydrophobicContact CG-CD1 3.66Å; M202-L214 HydrophobicContact CE-CD1 3.43Å; M202-L214 VanDerWaalsContact CE-CD1 3.43Å; M202-L214 HydrophobicContact CG-CD1 4.38Å; M202-L214 HydrophobicContact SD-CD1 3.76Å
203	G	76.2	Confident	80	Confident	63 Å²	63	70.3 Å²	70.3	65%	0.649	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	14.6	178.3	0	0	0	0	0	114.5	P199 T200 A201	P199-G203 PolarHBondContact O-N 3.26Å; T200-G203 PolarHBondContact O-N 3.42Å; T200-G203 VanDerWaalsContact O-N 3.14Å; A201-G203 VanDerWaalsContact C-N 3.29Å
204	I	67	Low	81.5	Confident	39 Å²	39	62.5 Å²	62.5	20%	0.2	35%	0.354	C	S	.	.			trans	-119	118.8	-170.9	-67.3	162.7	0	0	0	110.1	F149 M202 E207	F149-I204 HydrophobicContact CB-CD1 3.55Å; F149-I204 HydrophobicContact CD1-CD1 3.45Å; F149-I204 VanDerWaalsContact CD1-CD1 3.45Å; F149-I204 HydrophobicContact CE1-CD1 4.42Å; F149-I204 HydrophobicContact CG-CD1 3.8Å; M202-I204 HydrophobicContact CE-CD1 4.48Å; M202-I204 WeakPolarHBondContact O-CG1 3.4Å; M202-I204 PolarHBondContact O-N 3.36Å; I204-E207 HydrophobicContact CG2-CB 4.32Å; I204-E207 WeakPolarHBondContact CG2-OE2 3.48Å
205	P	59.3	Low	82.9	Confident	128 Å²	128	58 Å²	58	83%	0.831	33%	0.332	S	S	*	.	S	Bend	trans	-80.7	-12.9	171.3	-3.8	17.6	0	0	0	114.6
206	K	60.3	Low	83.7	Confident	176 Å²	176	60.5 Å²	60.5	77%	0.765	34%	0.339	S	S	*	.	S	Bend	trans	-107.3	-28.7	-158.3	-67.1	-174	178.7	180	0	116.8	H208	K206-H208 PolarHBondContact O-N 2.68Å
207	E	78.3	Confident	84.3	Confident	85 Å²	85	57.1 Å²	57.1	40%	0.397	32%	0.318	S	S	.	.			trans	-97.4	66.6	-178.5	-77.3	68.1	-147.1	0	0	112.2	F149 I204 L209 A210 I211	F149-E207 HydrophobicContact CE1-CB 4.43Å; F149-E207 HydrophobicContact CE1-CG 4.27Å; I204-E207 HydrophobicContact CG2-CB 4.32Å; I204-E207 WeakPolarHBondContact CG2-OE2 3.48Å; E207-L209 PolarHBondContact O-N 3.42Å; E207-A210 HydrophobicContact CB-CB 3.89Å; E207-A210 WeakPolarHBondContact O-CB 3.43Å; E207-A210 PolarHBondContact O-N 3.27Å; E207-I211 PolarHBondContact O-N 3.45Å
208	H	86.9	Confident	84.8	Confident	126 Å²	126	54.2 Å²	54.2	58%	0.583	30%	0.3	S	S	*	.	H	α-helix	trans	-53.2	-39.1	180	-177.1	64	0	0	0	113.1	K206 A210 I211 L212	K206-H208 PolarHBondContact O-N 2.68Å; H208-A210 VanDerWaalsContact C-N 3.29Å; H208-A210 PolarHBondContact O-N 2.96Å; H208-I211 PolarHBondContact O-N 3.06Å; H208-L212 WeakPolarHBondContact O-CG 3.35Å; H208-L212 PolarHBondContact O-N 3.13Å
209	L	89.9	Confident	85	Confident	76 Å²	76	55.1 Å²	55.1	40%	0.398	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-32.3	176.3	-65.7	179	0	0	0	113.2	E207 L212 L213 H234 D235 F236	E207-L209 PolarHBondContact O-N 3.42Å; L209-L212 HydrophobicContact CD2-CD1 4.45Å; L209-L213 WeakPolarHBondContact O-CB 3.44Å; L209-L213 PolarHBondContact O-N 3.26Å; L209-H234 PolarHBondContact O-CE1 3.34Å; L209-D235 HydrophobicContact CD1-CB 4.48Å; L209-D235 HydrophobicContact CD2-CB 4.31Å; L209-F236 HydrophobicContact CB-CB 4.19Å; L209-F236 HydrophobicContact CB-CD2 4.19Å
210	A	90.4	Very high	85.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-70.2	-39.8	176	0	0	0	0	0	111	F149 E207 H208 L213 L214 F236	F149-A210 HydrophobicContact CE1-CB 4.48Å; F149-A210 HydrophobicContact CE2-CB 3.76Å; F149-A210 HydrophobicContact CZ-CB 3.66Å; E207-A210 HydrophobicContact CB-CB 3.89Å; E207-A210 WeakPolarHBondContact O-CB 3.43Å; E207-A210 PolarHBondContact O-N 3.27Å; H208-A210 VanDerWaalsContact C-N 3.29Å; H208-A210 PolarHBondContact O-N 2.96Å; A210-L213 PolarHBondContact O-N 3.18Å; A210-L214 WeakPolarHBondContact O-CB 3.35Å; A210-L214 VanDerWaalsContact O-CG 3.25Å; A210-L214 WeakPolarHBondContact O-CG 3.22Å; A210-L214 PolarHBondContact O-N 2.94Å; A210-F236 HydrophobicContact CB-CD2 3.93Å; A210-F236 HydrophobicContact CB-CE2 3.65Å; A210-F236 HydrophobicContact CB-CZ 4.37Å
211	I	91.6	Very high	84.9	Confident	13 Å²	13	51.1 Å²	51.1	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-48.8	175.4	-61.9	-56.1	0	0	0	110.8	P199 M202 E207 H208 L213 L214 E215	P199-I211 HydrophobicContact CG-CG2 3.86Å; M202-I211 HydrophobicContact CB-CD1 3.78Å; M202-I211 HydrophobicContact CG-CD1 3.66Å; E207-I211 PolarHBondContact O-N 3.45Å; H208-I211 PolarHBondContact O-N 3.06Å; I211-L213 VanDerWaalsContact C-N 3.32Å; I211-L213 PolarHBondContact O-N 2.85Å; I211-L214 PolarHBondContact O-N 2.86Å; I211-L214 VanDerWaalsContact O-N 3.15Å; I211-E215 HydrophobicContact CG2-CG 4.36Å; I211-E215 WeakPolarHBondContact O-CG 3.47Å; I211-E215 PolarHBondContact O-N 3.34Å
212	L	92.1	Very high	84.9	Confident	58 Å²	58	51.5 Å²	51.5	30%	0.304	28%	0.277	S	S	.	.	H	α-helix	trans	-57.3	-45.5	177	-70	178.3	0	0	0	111.7	H208 L209 L214 E215 Q216	H208-L212 WeakPolarHBondContact O-CG 3.35Å; H208-L212 PolarHBondContact O-N 3.13Å; L209-L212 HydrophobicContact CD2-CD1 4.45Å; L212-L214 PolarHBondContact O-N 3.39Å; L212-E215 PolarHBondContact O-N 3.21Å; L212-Q216 WeakPolarHBondContact O-CG 3.41Å; L212-Q216 PolarHBondContact O-N 3.09Å; L212-Q216 VanDerWaalsContact O-N 3.11Å
213	L	94.7	Very high	85	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-46.6	176.2	179.7	54.2	0	0	0	111.5	L145 L209 A210 I211 Q216 I217 L226 V231 H234 F236 F237	L145-L213 HydrophobicContact CD2-CD2 3.74Å; L145-L213 HydrophobicContact CD2-CG 4.28Å; L209-L213 WeakPolarHBondContact O-CB 3.44Å; L209-L213 PolarHBondContact O-N 3.26Å; A210-L213 PolarHBondContact O-N 3.18Å; I211-L213 VanDerWaalsContact C-N 3.32Å; I211-L213 PolarHBondContact O-N 2.85Å; L213-Q216 PolarHBondContact O-N 2.91Å; L213-I217 HydrophobicContact CD1-CD1 3.6Å; L213-I217 HydrophobicContact CD1-CG1 4.08Å; L213-I217 HydrophobicContact CD2-CD1 4.47Å; L213-I217 HydrophobicContact CG-CD1 3.74Å; L213-I217 VanDerWaalsContact O-CG1 3.32Å; L213-I217 WeakPolarHBondContact O-CG1 3.16Å; L213-I217 PolarHBondContact O-N 2.92Å; L213-L226 HydrophobicContact CD1-CD1 3.92Å; L213-V231 HydrophobicContact CD1-CG1 4.31Å; L213-V231 HydrophobicContact CD1-CG2 4.46Å; L213-H234 HydrophobicContact CD1-CB 3.88Å; L213-F236 HydrophobicContact CD2-CB 3.95Å; L213-F236 HydrophobicContact CD2-CD1 3.56Å; L213-F236 HydrophobicContact CD2-CE1 4.37Å; L213-F236 HydrophobicContact CD2-CG 3.95Å; L213-F237 HydrophobicContact CD2-CD2 4.5Å; L213-F237 HydrophobicContact CD2-CE2 3.71Å; L213-F237 HydrophobicContact CD2-CZ 4.07Å
214	L	94.3	Very high	85.5	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-37.5	179.9	-73.8	171.7	0	0	0	112.4	G142 L145 A146 L198 M202 A210 I211 L212 Q216 I217 L218	G142-L214 WeakPolarHBondContact O-CD2 3.24Å; L145-L214 HydrophobicContact CB-CD2 4.23Å; L145-L214 HydrophobicContact CD2-CD2 4.06Å; L145-L214 HydrophobicContact CD2-CG 4.43Å; L145-L214 HydrophobicContact CG-CD2 4.23Å; A146-L214 HydrophobicContact CB-CD1 3.99Å; A146-L214 HydrophobicContact CB-CD2 4.02Å; L198-L214 HydrophobicContact CD1-CB 4.38Å; M202-L214 HydrophobicContact CE-CD1 3.43Å; M202-L214 VanDerWaalsContact CE-CD1 3.43Å; M202-L214 HydrophobicContact CG-CD1 4.38Å; M202-L214 HydrophobicContact SD-CD1 3.76Å; A210-L214 WeakPolarHBondContact O-CB 3.35Å; A210-L214 VanDerWaalsContact O-CG 3.25Å; A210-L214 WeakPolarHBondContact O-CG 3.22Å; A210-L214 PolarHBondContact O-N 2.94Å; I211-L214 PolarHBondContact O-N 2.86Å; I211-L214 VanDerWaalsContact O-N 3.15Å; L212-L214 PolarHBondContact O-N 3.39Å; L214-Q216 VanDerWaalsContact C-N 3.28Å; L214-Q216 PolarHBondContact O-N 2.88Å; L214-I217 PolarHBondContact O-N 2.79Å; L214-L218 HydrophobicContact CB-CD1 4.44Å; L214-L218 HydrophobicContact CD2-CD1 4.15Å; L214-L218 WeakPolarHBondContact O-CA 3.15Å; L214-L218 VanDerWaalsContact O-CB 3.23Å; L214-L218 WeakPolarHBondContact O-CB 3.13Å; L214-L218 WeakPolarHBondContact O-CG 3.28Å; L214-L218 PolarHBondContact O-N 3.47Å
215	E	93.1	Very high	86.8	Confident	92 Å²	92	61.1 Å²	61.1	43%	0.43	31%	0.306	S	S	.	.	H	α-helix	trans	-63.1	-36	174.5	-76.4	175.8	165.6	0	0	111.9	L198 I211 L212	L198-E215 HydrophobicContact CB-CG 4.46Å; L198-E215 HydrophobicContact CD1-CB 4.38Å; L198-E215 HydrophobicContact CD1-CG 3.65Å; I211-E215 HydrophobicContact CG2-CG 4.36Å; I211-E215 WeakPolarHBondContact O-CG 3.47Å; I211-E215 PolarHBondContact O-N 3.34Å; L212-E215 PolarHBondContact O-N 3.21Å
216	Q	94.5	Very high	88.4	Confident	87 Å²	87	56.2 Å²	56.2	41%	0.407	27%	0.272	S	S	.	.	H	α-helix	trans	-81	-18.3	176.7	-63.8	178.8	-27	0	0	113.6	L212 L213 L214 R225 L226	L212-Q216 WeakPolarHBondContact O-CG 3.41Å; L212-Q216 PolarHBondContact O-N 3.09Å; L212-Q216 VanDerWaalsContact O-N 3.11Å; L213-Q216 PolarHBondContact O-N 2.91Å; L214-Q216 VanDerWaalsContact C-N 3.28Å; L214-Q216 PolarHBondContact O-N 2.88Å; Q216-R225 VanDerWaalsContact O-CA 3.25Å; Q216-R225 WeakPolarHBondContact O-CA 3.28Å; Q216-L226 HydrophobicContact CB-CD1 4.03Å; Q216-L226 HydrophobicContact CB-CD2 4.36Å; Q216-L226 HydrophobicContact CB-CG 3.82Å; Q216-L226 PolarHBondContact O-N 3.33Å; Q216-L226 VanDerWaalsContact O-N 3.15Å
217	I	94.5	Very high	89.9	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-91.7	-45.5	174.6	-70	171.2	0	0	0	111.5	V138 L213 L214 S219 R225 V231	V138-I217 HydrophobicContact CG1-CB 4.5Å; V138-I217 HydrophobicContact CG1-CG1 4.16Å; V138-I217 HydrophobicContact CG1-CG2 3.87Å; V138-I217 WeakPolarHBondContact O-CG2 3.28Å; L213-I217 HydrophobicContact CD1-CD1 3.6Å; L213-I217 HydrophobicContact CD1-CG1 4.08Å; L213-I217 HydrophobicContact CD2-CD1 4.47Å; L213-I217 HydrophobicContact CG-CD1 3.74Å; L213-I217 VanDerWaalsContact O-CG1 3.32Å; L213-I217 WeakPolarHBondContact O-CG1 3.16Å; L213-I217 PolarHBondContact O-N 2.92Å; L214-I217 PolarHBondContact O-N 2.79Å; I217-S219 PolarHBondContact O-N 2.91Å; I217-R225 VanDerWaalsContact O-CD 3.25Å; I217-R225 WeakPolarHBondContact O-CD 3.43Å; I217-R225 VanDerWaalsContact O-CG 3.29Å; I217-R225 WeakPolarHBondContact O-CG 3.42Å; I217-V231 HydrophobicContact CD1-CG1 4.05Å; I217-V231 HydrophobicContact CD1-CG2 3.78Å; I217-V231 HydrophobicContact CG1-CG2 3.81Å
218	L	93.9	Very high	90.5	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	25%	0.253	C	S	.	.	S	Bend	trans	-88.6	51.6	-173.5	-59.4	178	0	0	0	111.5	W139 F155 L170 L198 L214	W139-L218 HydrophobicContact CD2-CD2 3.83Å; W139-L218 HydrophobicContact CE3-CB 4.44Å; W139-L218 HydrophobicContact CE3-CD2 3.99Å; W139-L218 HydrophobicContact CG-CD2 4.36Å; W139-L218 HydrophobicContact CH2-CB 4.37Å; W139-L218 HydrophobicContact CH2-CD2 4.39Å; W139-L218 HydrophobicContact CZ2-CD2 4.2Å; W139-L218 VanDerWaalsContact CZ3-CA 3.49Å; W139-L218 HydrophobicContact CZ3-CB 4.1Å; W139-L218 HydrophobicContact CZ3-CD2 4.28Å; F155-L218 HydrophobicContact CE2-CD1 4.23Å; F155-L218 HydrophobicContact CE2-CD2 4.14Å; F155-L218 HydrophobicContact CZ-CD1 4.06Å; L170-L218 WeakPolarHBondContact CD1-O 3.47Å; L198-L218 HydrophobicContact CD1-CB 4.47Å; L198-L218 HydrophobicContact CD1-CD1 4.47Å; L198-L218 HydrophobicContact CD2-CD1 3.93Å; L214-L218 HydrophobicContact CB-CD1 4.44Å; L214-L218 HydrophobicContact CD2-CD1 4.15Å; L214-L218 WeakPolarHBondContact O-CA 3.15Å; L214-L218 VanDerWaalsContact O-CB 3.23Å; L214-L218 WeakPolarHBondContact O-CB 3.13Å; L214-L218 WeakPolarHBondContact O-CG 3.28Å; L214-L218 PolarHBondContact O-N 3.47Å
219	S	90.9	Very high	90.7	Very high	26 Å²	26	45.1 Å²	45.1	18%	0.182	23%	0.234	C	C	.	.			trans	-98.2	140.3	174.9	-176	0	0	0	0	111.9	W139 I217 E221 R225	W139-S219 WeakPolarHBondContact CZ3-O 3.34Å; I217-S219 PolarHBondContact O-N 2.91Å; S219-E221 VanDerWaalsContact C-N 3.28Å; S219-E221 PolarHBondContact O-N 2.76Å; S219-R225 PolarHBondContact O-NE 3.13Å; S219-R225 PolarHBondContact O-NH2 2.74Å; S219-R225 VanDerWaalsContact O-NH2 3.09Å
220	Y	87.1	Confident	90.8	Very high	18 Å²	18	45 Å²	45	7%	0.071	23%	0.232	C	C	.	.	S	Bend	trans	-57.2	-42.8	175.1	-78.4	-62.9	0	0	0	112.1	I166 C167 L170 G171 P173 P222 R225 L361	I166-Y220 HydrophobicContact CG2-CE1 3.68Å; C167-Y220 WeakPolarHBondContact CA-OH 3.2Å; C167-Y220 PolarHBondContact SG-OH 3.37Å; C167-Y220 VanDerWaalsContact SG-OH 3.41Å; L170-Y220 HydrophobicContact CB-CE2 3.78Å; L170-Y220 HydrophobicContact CD1-CE2 4.41Å; G171-Y220 WeakPolarHBondContact O-CE2 3.02Å; G171-Y220 PolarHBondContact O-OH 2.89Å; P173-Y220 HydrophobicContact CB-CD1 3.94Å; P173-Y220 HydrophobicContact CB-CD2 4.07Å; P173-Y220 HydrophobicContact CB-CE1 4.03Å; P173-Y220 HydrophobicContact CB-CE2 4.14Å; P173-Y220 HydrophobicContact CB-CG 3.97Å; P173-Y220 HydrophobicContact CG-CE1 4.38Å; Y220-P222 WeakPolarHBondContact O-CD 3.09Å; Y220-R225 PolarHBondContact O-NH2 3.36Å; Y220-R225 VanDerWaalsContact O-NH2 3.09Å; Y220-L361 HydrophobicContact CD1-CD1 4.02Å; Y220-L361 HydrophobicContact CD1-CD2 4.16Å; Y220-L361 WeakPolarHBondContact O-CD1 3.39Å
221	E	83.4	Confident	90.9	Very high	43 Å²	43	46 Å²	46	20%	0.201	24%	0.238	C	C	.	.	S	Bend	trans	-81	116.5	-178.4	-70.2	172.2	-103.5	0	0	110.3	V177 S219 L223 K224 R225	V177-E221 HydrophobicContact CG2-CG 3.43Å; V177-E221 VanDerWaalsContact CG2-CG 3.43Å; S219-E221 VanDerWaalsContact C-N 3.28Å; S219-E221 PolarHBondContact O-N 2.76Å; E221-L223 PolarHBondContact O-N 2.85Å; E221-K224 HydrophobicContact CB-CB 4.09Å; E221-K224 HydrophobicContact CB-CD 3.98Å; E221-K224 HydrophobicContact CB-CG 3.89Å; E221-K224 VanDerWaalsContact CD-CE 3.4Å; E221-K224 VanDerWaalsContact CD-NZ 3.35Å; E221-K224 HydrophobicContact CG-CD 4.39Å; E221-K224 PolarHBondContact O-N 3.04Å; E221-K224 WeakPolarHBondContact OE1-CD 3.39Å; E221-K224 WeakPolarHBondContact OE1-CE 3.45Å; E221-K224 IonicContact OE1-NZ 2.8Å; E221-K224 PolarHBondContact OE1-NZ 2.95Å; E221-K224 VanDerWaalsContact OE2-CE 3.23Å; E221-K224 WeakPolarHBondContact OE2-CE 3.45Å; E221-K224 IonicContact OE2-NZ 2.57Å; E221-K224 PolarHBondContact OE2-NZ 3.32Å; E221-R225 PolarHBondContact O-N 3.02Å
222	P	83.7	Confident	90.8	Very high	39 Å²	39	46.6 Å²	46.6	25%	0.253	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-57.6	-36.2	-179	-24.9	34.5	0	0	0	113.2	Q135 Y220 K224 R225	Q135-P222 HydrophobicContact CB-CB 3.97Å; Q135-P222 HydrophobicContact CG-CB 4.18Å; Q135-P222 PolarHBondContact NE2-O 3.26Å; Y220-P222 WeakPolarHBondContact O-CD 3.09Å; P222-K224 VanDerWaalsContact C-N 3.27Å; P222-K224 PolarHBondContact O-N 2.87Å; P222-R225 WeakPolarHBondContact O-CB 3.44Å; P222-R225 PolarHBondContact O-N 3.5Å
223	L	82.1	Confident	90.7	Very high	170 Å²	170	44.2 Å²	44.2	89%	0.89	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-70.8	-20.5	-179.8	-62.3	177.4	0	0	0	113.7	E221 R225	E221-L223 PolarHBondContact O-N 2.85Å; L223-R225 VanDerWaalsContact C-N 3.35Å
224	K	87.7	Confident	90.5	Very high	130 Å²	130	45.2 Å²	45.2	57%	0.565	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-85.5	-11.9	174.9	-67	-173.1	178.2	170.2	0	112.5	E221 P222	E221-K224 HydrophobicContact CB-CB 4.09Å; E221-K224 HydrophobicContact CB-CD 3.98Å; E221-K224 HydrophobicContact CB-CG 3.89Å; E221-K224 VanDerWaalsContact CD-CE 3.4Å; E221-K224 VanDerWaalsContact CD-NZ 3.35Å; E221-K224 HydrophobicContact CG-CD 4.39Å; E221-K224 PolarHBondContact O-N 3.04Å; E221-K224 WeakPolarHBondContact OE1-CD 3.39Å; E221-K224 WeakPolarHBondContact OE1-CE 3.45Å; E221-K224 IonicContact OE1-NZ 2.8Å; E221-K224 PolarHBondContact OE1-NZ 2.95Å; E221-K224 VanDerWaalsContact OE2-CE 3.23Å; E221-K224 WeakPolarHBondContact OE2-CE 3.45Å; E221-K224 IonicContact OE2-NZ 2.57Å; E221-K224 PolarHBondContact OE2-NZ 3.32Å; P222-K224 VanDerWaalsContact C-N 3.27Å; P222-K224 PolarHBondContact O-N 2.87Å
225	R	93.2	Very high	90.3	Very high	10 Å²	10	48.8 Å²	48.8	4%	0.038	26%	0.255	C	S	.	.	S	Bend	trans	-73.9	143.5	176.5	-56.5	-179.3	-165.2	138.7	18.5	109.9	Q135 Q216 I217 S219 Y220 E221 P222 L223 F357	Q135-R225 PolarHBondContact NE2-O 3.18Å; Q135-R225 PolarHBondContact O-NH1 3.18Å; Q216-R225 VanDerWaalsContact O-CA 3.25Å; Q216-R225 WeakPolarHBondContact O-CA 3.28Å; I217-R225 VanDerWaalsContact O-CD 3.25Å; I217-R225 WeakPolarHBondContact O-CD 3.43Å; I217-R225 VanDerWaalsContact O-CG 3.29Å; I217-R225 WeakPolarHBondContact O-CG 3.42Å; S219-R225 PolarHBondContact O-NE 3.13Å; S219-R225 PolarHBondContact O-NH2 2.74Å; S219-R225 VanDerWaalsContact O-NH2 3.09Å; Y220-R225 PolarHBondContact O-NH2 3.36Å; Y220-R225 VanDerWaalsContact O-NH2 3.09Å; E221-R225 PolarHBondContact O-N 3.02Å; P222-R225 WeakPolarHBondContact O-CB 3.44Å; P222-R225 PolarHBondContact O-N 3.5Å; L223-R225 VanDerWaalsContact C-N 3.35Å; R225-F357 VanDerWaalsContact NH2-CZ 3.27Å
226	L	93.6	Very high	90.1	Very high	25 Å²	25	47 Å²	47	13%	0.131	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-56.1	144.2	166.5	-63.9	-174.5	0	0	0	110.6	V138 L213 Q216 Q230 V231	V138-L226 WeakPolarHBondContact CG1-O 3.48Å; L213-L226 HydrophobicContact CD1-CD1 3.92Å; Q216-L226 HydrophobicContact CB-CD1 4.03Å; Q216-L226 HydrophobicContact CB-CD2 4.36Å; Q216-L226 HydrophobicContact CB-CG 3.82Å; Q216-L226 PolarHBondContact O-N 3.33Å; Q216-L226 VanDerWaalsContact O-N 3.15Å; L226-Q230 HydrophobicContact CB-CB 3.98Å; L226-Q230 HydrophobicContact CD1-CB 4.43Å; L226-Q230 HydrophobicContact CD2-CB 4.01Å; L226-Q230 HydrophobicContact CG-CB 4.35Å; L226-V231 HydrophobicContact CB-CG2 3.64Å; L226-V231 HydrophobicContact CD1-CG2 4.16Å
227	T	91.3	Very high	89.8	Confident	48 Å²	48	44.8 Å²	44.8	29%	0.294	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-70	158.7	163.9	60.4	0	0	0	0	110.1	W229 Q230 V231	T227-W229 PolarHBondContact O-N 3.14Å; T227-W229 VanDerWaalsContact O-N 3.14Å; T227-Q230 PolarHBondContact O-N 3.19Å; T227-Q230 WeakPolarHBondContact OG1-CG 3.36Å; T227-Q230 PolarHBondContact OG1-N 3.13Å; T227-Q230 PolarHBondContact OG1-OE1 3.1Å; T227-V231 WeakPolarHBondContact O-CG2 3.46Å; T227-V231 PolarHBondContact O-N 3.13Å
228	A	91.3	Very high	89.2	Confident	56 Å²	56	48 Å²	48	46%	0.463	25%	0.25	S	S	.	.	H	α-helix	trans	-53.5	-35.8	174.6	0	0	0	0	0	112.6	V138 V231 C232	V138-A228 HydrophobicContact CG2-CB 4.1Å; A228-V231 PolarHBondContact O-N 2.87Å; A228-C232 PolarHBondContact O-N 3.3Å; A228-C232 PolarHBondContact O-SG 2.96Å
229	W	91.5	Very high	88.2	Confident	50 Å²	50	51.9 Å²	51.9	19%	0.189	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-50.8	174	-61.4	133.2	0	0	0	112.2	T227 V231 C232 A233 F252 E256 M260 V264	T227-W229 PolarHBondContact O-N 3.14Å; T227-W229 VanDerWaalsContact O-N 3.14Å; W229-V231 VanDerWaalsContact C-N 3.31Å; W229-V231 PolarHBondContact O-N 3.36Å; W229-C232 PolarHBondContact O-N 2.74Å; W229-A233 PolarHBondContact O-N 3.01Å; W229-A233 VanDerWaalsContact O-N 3.1Å; W229-F252 HydrophobicContact CE3-CE1 4.35Å; W229-F252 HydrophobicContact CH2-CD1 4.27Å; W229-F252 HydrophobicContact CH2-CE1 4.32Å; W229-F252 AromaticContact CZ3-CD1 3.83Å; W229-F252 HydrophobicContact CZ3-CD1 3.83Å; W229-F252 AromaticContact CZ3-CE1 3.48Å; W229-F252 HydrophobicContact CZ3-CE1 3.48Å; W229-F252 VanDerWaalsContact CZ3-CE1 3.48Å; W229-F252 HydrophobicContact CZ3-CZ 4.04Å; W229-E256 HydrophobicContact CH2-CB 3.7Å; W229-E256 HydrophobicContact CH2-CG 3.89Å; W229-E256 HydrophobicContact CZ2-CB 4.17Å; W229-E256 HydrophobicContact CZ2-CG 4.33Å; W229-M260 HydrophobicContact CD2-CG 3.64Å; W229-M260 HydrophobicContact CE3-CE 4.03Å; W229-M260 HydrophobicContact CE3-CG 3.75Å; W229-M260 HydrophobicContact CE3-SD 4.17Å; W229-M260 HydrophobicContact CG-CG 4.19Å; W229-M260 HydrophobicContact CH2-CE 3.79Å; W229-M260 HydrophobicContact CH2-CG 4.23Å; W229-M260 HydrophobicContact CZ2-CE 4.47Å; W229-M260 HydrophobicContact CZ2-CG 4.06Å; W229-M260 HydrophobicContact CZ3-CE 3.52Å; W229-M260 HydrophobicContact CZ3-CG 4.06Å; W229-M260 HydrophobicContact CZ3-SD 4.27Å; W229-V264 HydrophobicContact CB-CG1 3.78Å; W229-V264 WeakPolarHBondContact O-CG1 3.1Å
230	Q	92.7	Very high	87.2	Confident	73 Å²	73	54.5 Å²	54.5	34%	0.341	28%	0.279	S	S	.	.	H	α-helix	trans	-64.8	-35.7	178.4	-71.3	164.5	-48.1	0	0	112.1	L226 T227 A233 H234 V264	L226-Q230 HydrophobicContact CB-CB 3.98Å; L226-Q230 HydrophobicContact CD1-CB 4.43Å; L226-Q230 HydrophobicContact CD2-CB 4.01Å; L226-Q230 HydrophobicContact CG-CB 4.35Å; T227-Q230 PolarHBondContact O-N 3.19Å; T227-Q230 WeakPolarHBondContact OG1-CG 3.36Å; T227-Q230 PolarHBondContact OG1-N 3.13Å; T227-Q230 PolarHBondContact OG1-OE1 3.1Å; Q230-A233 CarbonylContact O-C 3.47Å; Q230-A233 PolarHBondContact O-N 3.42Å; Q230-H234 PolarHBondContact O-N 3Å; Q230-V264 HydrophobicContact CG-CG2 3.88Å
231	V	92.6	Very high	86.4	Confident	22 Å²	22	55.9 Å²	55.9	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-49.1	173.3	171.4	0	0	0	0	110.4	V138 L213 I217 L226 T227 A228 W229 A233 H234 F237	V138-V231 HydrophobicContact CG1-CG2 4.08Å; L213-V231 HydrophobicContact CD1-CG1 4.31Å; L213-V231 HydrophobicContact CD1-CG2 4.46Å; I217-V231 HydrophobicContact CD1-CG1 4.05Å; I217-V231 HydrophobicContact CD1-CG2 3.78Å; I217-V231 HydrophobicContact CG1-CG2 3.81Å; L226-V231 HydrophobicContact CB-CG2 3.64Å; L226-V231 HydrophobicContact CD1-CG2 4.16Å; T227-V231 WeakPolarHBondContact O-CG2 3.46Å; T227-V231 PolarHBondContact O-N 3.13Å; A228-V231 PolarHBondContact O-N 2.87Å; W229-V231 VanDerWaalsContact C-N 3.31Å; W229-V231 PolarHBondContact O-N 3.36Å; V231-A233 PolarHBondContact O-N 3.41Å; V231-H234 VanDerWaalsContact O-CB 3.27Å; V231-H234 WeakPolarHBondContact O-CB 3.39Å; V231-H234 PolarHBondContact O-N 2.92Å; V231-H234 VanDerWaalsContact O-N 3.13Å; V231-F237 HydrophobicContact CG1-CE2 4.01Å; V231-F237 WeakPolarHBondContact O-CD2 3.26Å; V231-F237 VanDerWaalsContact O-CE2 3.28Å; V231-F237 WeakPolarHBondContact O-CE2 3.4Å
232	C	88.7	Confident	85.5	Confident	26 Å²	26	58.5 Å²	58.5	18%	0.176	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-29.6	178.2	-64.3	0	0	0	0	112.6	A228 W229 F250 L268	A228-C232 PolarHBondContact O-N 3.3Å; A228-C232 PolarHBondContact O-SG 2.96Å; W229-C232 PolarHBondContact O-N 2.74Å; C232-F250 HydrophobicContact CB-CE2 4.1Å; C232-F250 HydrophobicContact CB-CZ 3.98Å; C232-L268 HydrophobicContact CB-CD1 4.28Å; C232-L268 HydrophobicContact CB-CD2 4.17Å
233	A	89	Confident	84	Confident	7 Å²	7	58.5 Å²	58.5	6%	0.058	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	4.2	180	0	0	0	0	0	113.9	W229 Q230 V231 V264 K267 L268	W229-A233 PolarHBondContact O-N 3.01Å; W229-A233 VanDerWaalsContact O-N 3.1Å; Q230-A233 CarbonylContact O-C 3.47Å; Q230-A233 PolarHBondContact O-N 3.42Å; V231-A233 PolarHBondContact O-N 3.41Å; A233-V264 HydrophobicContact CB-CG1 3.83Å; A233-K267 HydrophobicContact CB-CD 4.26Å; A233-K267 WeakPolarHBondContact O-CD 3.05Å; A233-K267 WeakPolarHBondContact O-CE 3.38Å; A233-K267 PolarHBondContact O-NZ 3.47Å; A233-L268 HydrophobicContact CB-CD1 4.39Å; A233-L268 HydrophobicContact CB-CD2 3.96Å; A233-L268 HydrophobicContact CB-CG 3.95Å
234	H	91.4	Very high	82.4	Confident	21 Å²	21	58.6 Å²	58.6	10%	0.097	31%	0.308	C	S	.	.	S	Bend	trans	-69.9	146.1	179.5	-170.9	-90.2	0	0	0	111.3	L209 L213 Q230 V231 F236 F237	L209-H234 PolarHBondContact O-CE1 3.34Å; L213-H234 HydrophobicContact CD1-CB 3.88Å; Q230-H234 PolarHBondContact O-N 3Å; V231-H234 VanDerWaalsContact O-CB 3.27Å; V231-H234 WeakPolarHBondContact O-CB 3.39Å; V231-H234 PolarHBondContact O-N 2.92Å; V231-H234 VanDerWaalsContact O-N 3.13Å; H234-F236 WeakPolarHBondContact ND1-CB 3.47Å; H234-F236 PolarHBondContact ND1-N 3.15Å; H234-F236 VanDerWaalsContact ND1-N 3.11Å; H234-F236 PolarHBondContact O-N 3.37Å; H234-F237 PolarHBondContact O-N 3.01Å
235	D	90.6	Very high	80.1	Confident	75 Å²	75	54.2 Å²	54.2	40%	0.401	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-59.7	-24.3	-176.3	-62.5	-19.3	0	0	0	113.2	L209 F237 E238 K267	L209-D235 HydrophobicContact CD1-CB 4.48Å; L209-D235 HydrophobicContact CD2-CB 4.31Å; D235-F237 PolarHBondContact O-N 3.27Å; D235-F237 VanDerWaalsContact O-N 3.14Å; D235-E238 VanDerWaalsContact O-CB 3.26Å; D235-E238 WeakPolarHBondContact O-CB 3.33Å; D235-E238 PolarHBondContact O-N 3.18Å; D235-K267 IonicContact OD1-NZ 3.1Å; D235-K267 PolarHBondContact OD1-NZ 3.26Å
236	F	88.8	Confident	77.7	Confident	54 Å²	54	61.7 Å²	61.7	24%	0.237	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-52	-32.8	170.1	177.7	-106.7	0	0	0	113	L145 F149 L209 A210 L213 H234	L145-F236 HydrophobicContact CD1-CE1 4.12Å; L145-F236 HydrophobicContact CD1-CZ 4.39Å; F149-F236 HydrophobicContact CE2-CZ 4.22Å; F149-F236 HydrophobicContact CZ-CE2 4.01Å; F149-F236 AromaticContact CZ-CZ 3.87Å; F149-F236 HydrophobicContact CZ-CZ 3.87Å; L209-F236 HydrophobicContact CB-CB 4.19Å; L209-F236 HydrophobicContact CB-CD2 4.19Å; A210-F236 HydrophobicContact CB-CD2 3.93Å; A210-F236 HydrophobicContact CB-CE2 3.65Å; A210-F236 HydrophobicContact CB-CZ 4.37Å; L213-F236 HydrophobicContact CD2-CB 3.95Å; L213-F236 HydrophobicContact CD2-CD1 3.56Å; L213-F236 HydrophobicContact CD2-CE1 4.37Å; L213-F236 HydrophobicContact CD2-CG 3.95Å; H234-F236 WeakPolarHBondContact ND1-CB 3.47Å; H234-F236 PolarHBondContact ND1-N 3.15Å; H234-F236 VanDerWaalsContact ND1-N 3.11Å; H234-F236 PolarHBondContact O-N 3.37Å
237	F	87.3	Confident	75.4	Confident	42 Å²	42	62.6 Å²	62.6	18%	0.184	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-100.3	6.6	178.1	-58.7	-65.2	0	0	0	113.4	L213 V231 H234 D235 E239 L240 L241	L213-F237 HydrophobicContact CD2-CD2 4.5Å; L213-F237 HydrophobicContact CD2-CE2 3.71Å; L213-F237 HydrophobicContact CD2-CZ 4.07Å; V231-F237 HydrophobicContact CG1-CE2 4.01Å; V231-F237 WeakPolarHBondContact O-CD2 3.26Å; V231-F237 VanDerWaalsContact O-CE2 3.28Å; V231-F237 WeakPolarHBondContact O-CE2 3.4Å; H234-F237 PolarHBondContact O-N 3.01Å; D235-F237 PolarHBondContact O-N 3.27Å; D235-F237 VanDerWaalsContact O-N 3.14Å; F237-E239 VanDerWaalsContact C-N 3.25Å; F237-E239 PolarHBondContact O-N 2.95Å; F237-L240 HydrophobicContact CD1-CD1 3.77Å; F237-L240 WeakPolarHBondContact O-CA 3.33Å; F237-L240 WeakPolarHBondContact O-CB 3.01Å; F237-L240 PolarHBondContact O-N 2.81Å; F237-L241 WeakPolarHBondContact O-CG 3.41Å; F237-L241 PolarHBondContact O-N 3.26Å; F237-L241 VanDerWaalsContact O-N 3.16Å
238	E	82	Confident	73.4	Confident	70 Å²	70	65.8 Å²	65.8	33%	0.327	36%	0.361	S	S	.	.	H	α-helix	trans	-56.3	-39.9	-177.9	-175.6	171.2	-153.9	0	0	112.1	D235 L240 L241 E242 K272	D235-E238 VanDerWaalsContact O-CB 3.26Å; D235-E238 WeakPolarHBondContact O-CB 3.33Å; D235-E238 PolarHBondContact O-N 3.18Å; E238-L240 PolarHBondContact O-N 3.02Å; E238-L241 CarbonylContact O-C 3.58Å; E238-L241 WeakPolarHBondContact O-CA 3.11Å; E238-L241 WeakPolarHBondContact O-CB 3.17Å; E238-L241 PolarHBondContact O-N 3.45Å; E238-E242 HydrophobicContact CG-CG 4.3Å; E238-E242 PolarHBondContact O-N 3.26Å; E238-K272 IonicContact OE1-NZ 2.86Å; E238-K272 PolarHBondContact OE1-NZ 3.23Å
239	E	73.2	Confident	72	Confident	84 Å²	84	69.7 Å²	69.7	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-63.3	-27.9	176	-170.1	178.8	160	0	0	113	F237 K295	F237-E239 VanDerWaalsContact C-N 3.25Å; F237-E239 PolarHBondContact O-N 2.95Å; E239-K295 VanDerWaalsContact OE1-CB 3.24Å; E239-K295 WeakPolarHBondContact OE1-CB 3.3Å
240	L	70.2	Confident	70.7	Confident	81 Å²	81	71.5 Å²	71.5	42%	0.424	38%	0.377	S	S	.	.	H	α-helix	trans	-78	-23.7	173.1	-63.3	179.4	0	0	0	112.3	F237 E238 M248	F237-L240 HydrophobicContact CD1-CD1 3.77Å; F237-L240 WeakPolarHBondContact O-CA 3.33Å; F237-L240 WeakPolarHBondContact O-CB 3.01Å; F237-L240 PolarHBondContact O-N 2.81Å; E238-L240 PolarHBondContact O-N 3.02Å; L240-M248 HydrophobicContact CD1-CE 4.04Å
241	L	70.3	Confident	69.8	Low	47 Å²	47	77.9 Å²	77.9	25%	0.246	40%	0.403	C	S	.	.	H	α-helix	trans	-81.9	-32	176.3	-59.5	174.6	0	0	0	111.2	F237 E238 F250 L268	F237-L241 WeakPolarHBondContact O-CG 3.41Å; F237-L241 PolarHBondContact O-N 3.26Å; F237-L241 VanDerWaalsContact O-N 3.16Å; E238-L241 CarbonylContact O-C 3.58Å; E238-L241 WeakPolarHBondContact O-CA 3.11Å; E238-L241 WeakPolarHBondContact O-CB 3.17Å; E238-L241 PolarHBondContact O-N 3.45Å; L241-F250 HydrophobicContact CD2-CE2 4.31Å; L241-L268 HydrophobicContact CD1-CD2 4.22Å; L241-L268 HydrophobicContact CD2-CD2 3.94Å
242	E	64.1	Low	69.3	Low	98 Å²	98	78.7 Å²	78.7	46%	0.458	41%	0.405	S	S	.	.	S	Bend	trans	-89.7	96.2	176.6	-65.9	-171.6	157.9	0	0	112.8	E238 K272	E238-E242 HydrophobicContact CG-CG 4.3Å; E238-E242 PolarHBondContact O-N 3.26Å; E242-K272 HydrophobicContact CG-CD 4Å; E242-K272 VanDerWaalsContact OE1-CD 3.3Å; E242-K272 WeakPolarHBondContact OE1-CD 3.27Å; E242-K272 WeakPolarHBondContact OE1-CE 3.32Å; E242-K272 IonicContact OE1-NZ 2.65Å; E242-K272 PolarHBondContact OE1-NZ 3.1Å
243	G	52.6	Low	69.1	Low	39 Å²	39	81.1 Å²	81.1	40%	0.402	42%	0.419	S	S	.	.			trans	168.2	150	165.1	0	0	0	0	0	117.5
244	D	47.9	Very low	68.8	Low	172 Å²	172	88.3 Å²	88.3	92%	0.92	45%	0.452	S	S	*	.	S	Bend	trans	-90.7	25	174.9	-86.6	-19.6	0	0	0	114.7
245	G	40.2	Very low	68.4	Low	39 Å²	39	91.6 Å²	91.6	40%	0.402	48%	0.477	S	S	.	.	S	Bend	trans	154.9	110.9	176	0	0	0	0	0	109.3
246	I	41.6	Very low	68.1	Low	167 Å²	167	91.5 Å²	91.5	86%	0.856	47%	0.474	S	S	*	.	S	Bend	cis	-110	81.5	24.1	-61.8	144.4	0	0	0	106.1	M248	I246-M248 VanDerWaalsContact C-N 3.3Å; I246-M248 PolarHBondContact O-N 3.14Å
247	S	46.5	Very low	67.9	Low	43 Å²	43	90.7 Å²	90.7	30%	0.301	47%	0.474	S	S	.	.			trans	-63.3	96	-177.7	-165.2	0	0	0	0	108	K249	S247-K249 PolarHBondContact O-N 3.42Å; S247-K249 VanDerWaalsContact OG-CD 3.26Å; S247-K249 WeakPolarHBondContact OG-CD 3.21Å; S247-K249 WeakPolarHBondContact OG-CE 3.16Å; S247-K249 WeakPolarHBondContact OG-CG 2.97Å; S247-K249 PolarHBondContact OG-N 3.02Å
248	M	49.6	Very low	67.9	Low	116 Å²	116	96.6 Å²	96.6	57%	0.571	50%	0.499	S	S	*	.			trans	-68.1	55.1	153.4	-71.8	-159.2	-59.5	0	0	107.2	L240 I246 F250	L240-M248 HydrophobicContact CD1-CE 4.04Å; I246-M248 VanDerWaalsContact C-N 3.3Å; I246-M248 PolarHBondContact O-N 3.14Å; M248-F250 PolarHBondContact O-N 3.44Å
249	K	60.7	Low	68	Low	138 Å²	138	96.7 Å²	96.7	60%	0.6	51%	0.508	S	S	*	.			trans	-55.4	101.4	157.8	-98.6	161.6	-165.4	175.6	0	103.2	S247 K251	S247-K249 PolarHBondContact O-N 3.42Å; S247-K249 VanDerWaalsContact OG-CD 3.26Å; S247-K249 WeakPolarHBondContact OG-CD 3.21Å; S247-K249 WeakPolarHBondContact OG-CE 3.16Å; S247-K249 WeakPolarHBondContact OG-CG 2.97Å; S247-K249 PolarHBondContact OG-N 3.02Å; K249-K251 PolarHBondContact O-N 2.92Å
250	F	65.4	Low	68.6	Low	88 Å²	88	93 Å²	93	39%	0.386	49%	0.49	S	S	.	.			trans	-46.4	115.9	172.2	-66.8	-83.3	0	0	0	106.8	C232 L241 M248 F252	C232-F250 HydrophobicContact CB-CE2 4.1Å; C232-F250 HydrophobicContact CB-CZ 3.98Å; L241-F250 HydrophobicContact CD2-CE2 4.31Å; M248-F250 PolarHBondContact O-N 3.44Å; F250-F252 HydrophobicContact CB-CD1 3.87Å; F250-F252 HydrophobicContact CB-CD2 3.81Å; F250-F252 HydrophobicContact CB-CE1 3.33Å; F250-F252 HydrophobicContact CB-CE2 3.33Å; F250-F252 HydrophobicContact CB-CG 4.09Å; F250-F252 HydrophobicContact CB-CZ 3.07Å; F250-F252 HydrophobicContact CD1-CE1 4.12Å; F250-F252 HydrophobicContact CD1-CZ 4.07Å; F250-F252 HydrophobicContact CD2-CE2 4.22Å; F250-F252 AromaticContact CD2-CZ 3.79Å; F250-F252 HydrophobicContact CD2-CZ 3.79Å; F250-F252 AromaticContact CG-CE1 3.82Å; F250-F252 HydrophobicContact CG-CE1 3.82Å; F250-F252 HydrophobicContact CG-CE2 4.01Å; F250-F252 AromaticContact CG-CZ 3.41Å; F250-F252 HydrophobicContact CG-CZ 3.41Å; F250-F252 VanDerWaalsContact CG-CZ 3.41Å; F250-F252 PolarHBondContact O-N 2.8Å
251	K	73.5	Confident	69.4	Low	206 Å²	206	91.9 Å²	91.9	90%	0.896	49%	0.488	S	S	*	.			trans	-78	74.7	177.5	-71	-172.5	-179.5	-178.5	0	107.5	K249	K249-K251 PolarHBondContact O-N 2.92Å
252	F	82.2	Confident	70.3	Confident	40 Å²	40	94.3 Å²	94.3	18%	0.175	50%	0.501	C	S	.	.			trans	-69.5	132.6	177.1	-59.1	-55.9	0	0	0	109.9	W229 F250 E256 V257 M260 L268 L269	W229-F252 HydrophobicContact CE3-CE1 4.35Å; W229-F252 HydrophobicContact CH2-CD1 4.27Å; W229-F252 HydrophobicContact CH2-CE1 4.32Å; W229-F252 AromaticContact CZ3-CD1 3.83Å; W229-F252 HydrophobicContact CZ3-CD1 3.83Å; W229-F252 AromaticContact CZ3-CE1 3.48Å; W229-F252 HydrophobicContact CZ3-CE1 3.48Å; W229-F252 VanDerWaalsContact CZ3-CE1 3.48Å; W229-F252 HydrophobicContact CZ3-CZ 4.04Å; F250-F252 HydrophobicContact CB-CD1 3.87Å; F250-F252 HydrophobicContact CB-CD2 3.81Å; F250-F252 HydrophobicContact CB-CE1 3.33Å; F250-F252 HydrophobicContact CB-CE2 3.33Å; F250-F252 HydrophobicContact CB-CG 4.09Å; F250-F252 HydrophobicContact CB-CZ 3.07Å; F250-F252 HydrophobicContact CD1-CE1 4.12Å; F250-F252 HydrophobicContact CD1-CZ 4.07Å; F250-F252 HydrophobicContact CD2-CE2 4.22Å; F250-F252 AromaticContact CD2-CZ 3.79Å; F250-F252 HydrophobicContact CD2-CZ 3.79Å; F250-F252 AromaticContact CG-CE1 3.82Å; F250-F252 HydrophobicContact CG-CE1 3.82Å; F250-F252 HydrophobicContact CG-CE2 4.01Å; F250-F252 AromaticContact CG-CZ 3.41Å; F250-F252 HydrophobicContact CG-CZ 3.41Å; F250-F252 VanDerWaalsContact CG-CZ 3.41Å; F250-F252 PolarHBondContact O-N 2.8Å; F252-E256 WeakPolarHBondContact CA-OE2 3.15Å; F252-E256 HydrophobicContact CB-CB 4.24Å; F252-V257 HydrophobicContact CB-CG2 3.72Å; F252-M260 HydrophobicContact CB-CE 3.69Å; F252-M260 HydrophobicContact CD1-CE 3.69Å; F252-M260 HydrophobicContact CD2-CE 3.44Å; F252-M260 VanDerWaalsContact CD2-CE 3.44Å; F252-M260 HydrophobicContact CD2-SD 4.5Å; F252-M260 HydrophobicContact CE1-CE 4.12Å; F252-M260 HydrophobicContact CE2-CE 3.85Å; F252-M260 HydrophobicContact CG-CE 3.32Å; F252-M260 HydrophobicContact CZ-CE 4.16Å; F252-L268 HydrophobicContact CE2-CB 4.26Å; F252-L268 HydrophobicContact CE2-CD1 4.04Å; F252-L268 HydrophobicContact CZ-CD1 4.02Å; F252-L269 HydrophobicContact CD2-CD2 4.26Å
253	T	84.4	Confident	71.5	Confident	77 Å²	77	94.7 Å²	94.7	47%	0.472	51%	0.507	S	S	.	.			trans	-64.7	158.2	167.8	64	0	0	0	0	110.3	S255 E256 V257	T253-S255 PolarHBondContact O-N 3.48Å; T253-E256 WeakPolarHBondContact CB-OE2 3.24Å; T253-E256 WeakPolarHBondContact CG2-OE2 2.95Å; T253-E256 PolarHBondContact N-OE2 2.99Å; T253-E256 WeakPolarHBondContact O-CB 3.28Å; T253-E256 PolarHBondContact O-N 2.95Å; T253-E256 VanDerWaalsContact O-N 3.13Å; T253-E256 WeakPolarHBondContact OG1-CB 3.34Å; T253-E256 VanDerWaalsContact OG1-CG 3.26Å; T253-E256 WeakPolarHBondContact OG1-CG 3.49Å; T253-E256 PolarHBondContact OG1-N 2.76Å; T253-E256 PolarHBondContact OG1-OE2 3.46Å; T253-V257 WeakPolarHBondContact O-CG2 2.9Å; T253-V257 PolarHBondContact O-N 3.42Å
254	Q	82	Confident	73.2	Confident	157 Å²	157	93.1 Å²	93.1	73%	0.734	49%	0.489	S	S	*	.	H	α-helix	trans	-60	-31.4	176	-65.4	-176.1	7.7	0	0	112.5	K258	Q254-K258 WeakPolarHBondContact O-CB 3.05Å; Q254-K258 VanDerWaalsContact O-CG 3.28Å; Q254-K258 WeakPolarHBondContact O-CG 2.9Å; Q254-K258 PolarHBondContact O-N 3.27Å
255	S	83	Confident	75	Confident	91 Å²	91	88.3 Å²	88.3	64%	0.636	46%	0.458	S	S	*	.	H	α-helix	trans	-67.1	-43	176.4	-170.9	0	0	0	0	111.5	T253 K258 S259	T253-S255 PolarHBondContact O-N 3.48Å; S255-K258 PolarHBondContact O-N 3.14Å; S255-S259 WeakPolarHBondContact O-CB 3.33Å; S255-S259 PolarHBondContact O-N 2.81Å; S255-S259 VanDerWaalsContact O-N 3.09Å
256	E	85.8	Confident	77.2	Confident	72 Å²	72	93 Å²	93	34%	0.336	47%	0.47	S	S	.	.	H	α-helix	trans	-61.7	-48.8	175.5	-76.5	165.9	141.3	0	0	110.6	W229 F252 T253 K258 S259 M260	W229-E256 HydrophobicContact CH2-CB 3.7Å; W229-E256 HydrophobicContact CH2-CG 3.89Å; W229-E256 HydrophobicContact CZ2-CB 4.17Å; W229-E256 HydrophobicContact CZ2-CG 4.33Å; F252-E256 WeakPolarHBondContact CA-OE2 3.15Å; F252-E256 HydrophobicContact CB-CB 4.24Å; T253-E256 WeakPolarHBondContact CB-OE2 3.24Å; T253-E256 WeakPolarHBondContact CG2-OE2 2.95Å; T253-E256 PolarHBondContact N-OE2 2.99Å; T253-E256 WeakPolarHBondContact O-CB 3.28Å; T253-E256 PolarHBondContact O-N 2.95Å; T253-E256 VanDerWaalsContact O-N 3.13Å; T253-E256 WeakPolarHBondContact OG1-CB 3.34Å; T253-E256 VanDerWaalsContact OG1-CG 3.26Å; T253-E256 WeakPolarHBondContact OG1-CG 3.49Å; T253-E256 PolarHBondContact OG1-N 2.76Å; T253-E256 PolarHBondContact OG1-OE2 3.46Å; E256-K258 VanDerWaalsContact C-N 3.3Å; E256-K258 PolarHBondContact O-N 2.83Å; E256-S259 WeakPolarHBondContact O-CA 3.47Å; E256-S259 PolarHBondContact O-N 3Å; E256-S259 PolarHBondContact O-OG 3.12Å; E256-M260 HydrophobicContact CB-CE 4.17Å; E256-M260 WeakPolarHBondContact O-CG 3.12Å; E256-M260 PolarHBondContact O-N 3.3Å; E256-M260 VanDerWaalsContact O-N 3.12Å
257	V	84.5	Confident	79.2	Confident	38 Å²	38	89 Å²	89	23%	0.23	45%	0.446	C	S	.	.	H	α-helix	trans	-57	-42.4	178.4	174.7	0	0	0	0	111.9	F252 T253 S259 M260 R265 L269	F252-V257 HydrophobicContact CB-CG2 3.72Å; T253-V257 WeakPolarHBondContact O-CG2 2.9Å; T253-V257 PolarHBondContact O-N 3.42Å; V257-S259 VanDerWaalsContact C-N 3.28Å; V257-S259 PolarHBondContact O-N 3.23Å; V257-M260 HydrophobicContact CB-CE 4.44Å; V257-M260 HydrophobicContact CG2-CE 4.01Å; V257-M260 PolarHBondContact O-N 2.63Å; V257-R265 HydrophobicContact CG1-CG 4.32Å; V257-R265 WeakPolarHBondContact O-CD 3.46Å; V257-L269 HydrophobicContact CG1-CD1 3.83Å; V257-L269 HydrophobicContact CG2-CD1 4.34Å
258	K	85.6	Confident	80.9	Confident	166 Å²	166	88 Å²	88	72%	0.722	44%	0.437	S	S	*	.	H	α-helix	trans	-66	-29.8	175.9	-74.9	174.7	-179	-179.5	0	113.2	Q254 S255 E256	Q254-K258 WeakPolarHBondContact O-CB 3.05Å; Q254-K258 VanDerWaalsContact O-CG 3.28Å; Q254-K258 WeakPolarHBondContact O-CG 2.9Å; Q254-K258 PolarHBondContact O-N 3.27Å; S255-K258 PolarHBondContact O-N 3.14Å; E256-K258 VanDerWaalsContact C-N 3.3Å; E256-K258 PolarHBondContact O-N 2.83Å
259	S	84.1	Confident	82.5	Confident	72 Å²	72	86.4 Å²	86.4	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-84.5	-11.1	-179.7	75.3	0	0	0	0	114.2	S255 E256 V257	S255-S259 WeakPolarHBondContact O-CB 3.33Å; S255-S259 PolarHBondContact O-N 2.81Å; S255-S259 VanDerWaalsContact O-N 3.09Å; E256-S259 WeakPolarHBondContact O-CA 3.47Å; E256-S259 PolarHBondContact O-N 3Å; E256-S259 PolarHBondContact O-OG 3.12Å; V257-S259 VanDerWaalsContact C-N 3.28Å; V257-S259 PolarHBondContact O-N 3.23Å
260	M	86	Confident	83.1	Confident	5 Å²	5	82.8 Å²	82.8	3%	0.025	43%	0.427	C	S	.	.	S	Bend	trans	-76	138.2	-180	-72	172.2	-146	0	0	111.4	W229 F252 E256 V257 R265 L268	W229-M260 HydrophobicContact CD2-CG 3.64Å; W229-M260 HydrophobicContact CE3-CE 4.03Å; W229-M260 HydrophobicContact CE3-CG 3.75Å; W229-M260 HydrophobicContact CE3-SD 4.17Å; W229-M260 HydrophobicContact CG-CG 4.19Å; W229-M260 HydrophobicContact CH2-CE 3.79Å; W229-M260 HydrophobicContact CH2-CG 4.23Å; W229-M260 HydrophobicContact CZ2-CE 4.47Å; W229-M260 HydrophobicContact CZ2-CG 4.06Å; W229-M260 HydrophobicContact CZ3-CE 3.52Å; W229-M260 HydrophobicContact CZ3-CG 4.06Å; W229-M260 HydrophobicContact CZ3-SD 4.27Å; F252-M260 HydrophobicContact CB-CE 3.69Å; F252-M260 HydrophobicContact CD1-CE 3.69Å; F252-M260 HydrophobicContact CD2-CE 3.44Å; F252-M260 VanDerWaalsContact CD2-CE 3.44Å; F252-M260 HydrophobicContact CD2-SD 4.5Å; F252-M260 HydrophobicContact CE1-CE 4.12Å; F252-M260 HydrophobicContact CE2-CE 3.85Å; F252-M260 HydrophobicContact CG-CE 3.32Å; F252-M260 HydrophobicContact CZ-CE 4.16Å; E256-M260 HydrophobicContact CB-CE 4.17Å; E256-M260 WeakPolarHBondContact O-CG 3.12Å; E256-M260 PolarHBondContact O-N 3.3Å; E256-M260 VanDerWaalsContact O-N 3.12Å; V257-M260 HydrophobicContact CB-CE 4.44Å; V257-M260 HydrophobicContact CG2-CE 4.01Å; V257-M260 PolarHBondContact O-N 2.63Å; M260-R265 HydrophobicContact CB-CB 3.99Å; M260-R265 PolarHBondContact O-NH1 2.74Å; M260-R265 HydrophobicContact SD-CB 4.44Å; M260-R265 HydrophobicContact SD-CG 4.48Å; M260-L268 HydrophobicContact SD-CD1 4.45Å
261	P	88.7	Confident	82.7	Confident	59 Å²	59	87.2 Å²	87.2	38%	0.383	45%	0.446	S	S	.	.			trans	-56.6	142.6	165.9	-23.7	34.5	0	0	0	111.7	N263 V264 R265	P261-N263 WeakPolarHBondContact CB-OD1 3.48Å; P261-N263 PolarHBondContact O-N 3.01Å; P261-V264 HydrophobicContact CB-CG2 4.44Å; P261-V264 PolarHBondContact O-N 3.18Å; P261-V264 VanDerWaalsContact O-N 3.09Å; P261-R265 WeakPolarHBondContact O-CB 3.48Å; P261-R265 PolarHBondContact O-N 3.44Å
262	D	88.5	Confident	81.6	Confident	97 Å²	97	83.8 Å²	83.8	52%	0.519	43%	0.431	S	S	.	.	H	α-helix	trans	-56.9	-46.5	-171.5	-63	-16.5	0	0	0	112.8	V264 R265 E266	D262-V264 VanDerWaalsContact C-N 3.29Å; D262-V264 PolarHBondContact O-N 2.77Å; D262-R265 VanDerWaalsContact CG-NH2 3.33Å; D262-R265 PolarHBondContact O-N 3.46Å; D262-R265 IonicContact OD1-CZ 2.65Å; D262-R265 IonicContact OD1-NH1 3.1Å; D262-R265 PolarHBondContact OD1-NH1 3.38Å; D262-R265 IonicContact OD1-NH2 3.61Å; D262-R265 PolarHBondContact OD1-NH2 2.83Å; D262-E266 WeakPolarHBondContact O-CG 3.33Å; D262-E266 PolarHBondContact O-N 3.43Å
263	N	88.6	Confident	79.5	Confident	107 Å²	107	89.7 Å²	89.7	57%	0.572	46%	0.459	S	S	*	.	H	α-helix	trans	-59.9	-36.6	178.5	66.4	-42	0	0	0	113.3	P261 K267	P261-N263 WeakPolarHBondContact CB-OD1 3.48Å; P261-N263 PolarHBondContact O-N 3.01Å; N263-K267 PolarHBondContact O-N 3.49Å
264	V	88.5	Confident	77.4	Confident	6 Å²	6	91.3 Å²	91.3	4%	0.036	47%	0.472	C	S	.	.	H	α-helix	trans	-77.3	-41.3	177.9	175.6	0	0	0	0	110.7	W229 Q230 A233 P261 D262 E266 K267 L268	W229-V264 HydrophobicContact CB-CG1 3.78Å; W229-V264 WeakPolarHBondContact O-CG1 3.1Å; Q230-V264 HydrophobicContact CG-CG2 3.88Å; A233-V264 HydrophobicContact CB-CG1 3.83Å; P261-V264 HydrophobicContact CB-CG2 4.44Å; P261-V264 PolarHBondContact O-N 3.18Å; P261-V264 VanDerWaalsContact O-N 3.09Å; D262-V264 VanDerWaalsContact C-N 3.29Å; D262-V264 PolarHBondContact O-N 2.77Å; V264-E266 VanDerWaalsContact C-N 3.34Å; V264-E266 PolarHBondContact O-N 3.32Å; V264-K267 PolarHBondContact O-N 3.37Å; V264-L268 HydrophobicContact CG1-CD1 3.62Å; V264-L268 HydrophobicContact CG1-CG 4.16Å; V264-L268 WeakPolarHBondContact O-CB 3.39Å; V264-L268 WeakPolarHBondContact O-CG 3.45Å; V264-L268 PolarHBondContact O-N 2.82Å
265	R	86.7	Confident	75	Confident	71 Å²	71	88.4 Å²	88.4	27%	0.268	47%	0.469	S	S	.	.	H	α-helix	trans	-59.8	-45	177.7	-174.8	173.7	65.5	-125.9	0.8	111.1	V257 M260 P261 D262 L268 L269	V257-R265 HydrophobicContact CG1-CG 4.32Å; V257-R265 WeakPolarHBondContact O-CD 3.46Å; M260-R265 HydrophobicContact CB-CB 3.99Å; M260-R265 PolarHBondContact O-NH1 2.74Å; M260-R265 HydrophobicContact SD-CB 4.44Å; M260-R265 HydrophobicContact SD-CG 4.48Å; P261-R265 WeakPolarHBondContact O-CB 3.48Å; P261-R265 PolarHBondContact O-N 3.44Å; D262-R265 VanDerWaalsContact CG-NH2 3.33Å; D262-R265 PolarHBondContact O-N 3.46Å; D262-R265 IonicContact OD1-CZ 2.65Å; D262-R265 IonicContact OD1-NH1 3.1Å; D262-R265 PolarHBondContact OD1-NH1 3.38Å; D262-R265 IonicContact OD1-NH2 3.61Å; D262-R265 PolarHBondContact OD1-NH2 2.83Å; R265-L268 PolarHBondContact O-N 3.16Å; R265-L269 HydrophobicContact CG-CD1 3.6Å; R265-L269 HydrophobicContact CG-CG 4.23Å; R265-L269 VanDerWaalsContact O-CB 3.22Å; R265-L269 WeakPolarHBondContact O-CB 3.28Å; R265-L269 WeakPolarHBondContact O-CG 3.15Å; R265-L269 PolarHBondContact O-N 3.4Å
266	E	85.7	Confident	72.7	Confident	137 Å²	137	90.4 Å²	90.4	64%	0.64	47%	0.472	S	S	*	.	H	α-helix	trans	-58.9	-48.4	175.6	-75.5	175.6	-175	0	0	111.3	D262 V264 L268 A270	D262-E266 WeakPolarHBondContact O-CG 3.33Å; D262-E266 PolarHBondContact O-N 3.43Å; V264-E266 VanDerWaalsContact C-N 3.34Å; V264-E266 PolarHBondContact O-N 3.32Å; E266-L268 PolarHBondContact O-N 3.22Å; E266-A270 WeakPolarHBondContact O-CA 3.49Å; E266-A270 WeakPolarHBondContact O-CB 3.38Å; E266-A270 PolarHBondContact O-N 2.86Å
267	K	83.9	Confident	69.9	Low	84 Å²	84	95.4 Å²	95.4	37%	0.365	50%	0.495	S	S	.	.	H	α-helix	trans	-65.2	-39.7	-179.4	-169.6	170.6	-177.8	-173.1	0	113.4	A233 D235 N263 V264	A233-K267 HydrophobicContact CB-CD 4.26Å; A233-K267 WeakPolarHBondContact O-CD 3.05Å; A233-K267 WeakPolarHBondContact O-CE 3.38Å; A233-K267 PolarHBondContact O-NZ 3.47Å; D235-K267 IonicContact OD1-NZ 3.1Å; D235-K267 PolarHBondContact OD1-NZ 3.26Å; N263-K267 PolarHBondContact O-N 3.49Å; V264-K267 PolarHBondContact O-N 3.37Å
268	L	82.8	Confident	67.2	Low	21 Å²	21	97.2 Å²	97.2	11%	0.11	52%	0.521	C	S	.	.	H	α-helix	trans	-78.5	-30.6	-178.7	-70.4	177.1	0	0	0	113.6	C232 A233 L241 F252 M260 V264 R265 E266	C232-L268 HydrophobicContact CB-CD1 4.28Å; C232-L268 HydrophobicContact CB-CD2 4.17Å; A233-L268 HydrophobicContact CB-CD1 4.39Å; A233-L268 HydrophobicContact CB-CD2 3.96Å; A233-L268 HydrophobicContact CB-CG 3.95Å; L241-L268 HydrophobicContact CD1-CD2 4.22Å; L241-L268 HydrophobicContact CD2-CD2 3.94Å; F252-L268 HydrophobicContact CE2-CB 4.26Å; F252-L268 HydrophobicContact CE2-CD1 4.04Å; F252-L268 HydrophobicContact CZ-CD1 4.02Å; M260-L268 HydrophobicContact SD-CD1 4.45Å; V264-L268 HydrophobicContact CG1-CD1 3.62Å; V264-L268 HydrophobicContact CG1-CG 4.16Å; V264-L268 WeakPolarHBondContact O-CB 3.39Å; V264-L268 WeakPolarHBondContact O-CG 3.45Å; V264-L268 PolarHBondContact O-N 2.82Å; R265-L268 PolarHBondContact O-N 3.16Å; E266-L268 PolarHBondContact O-N 3.22Å
269	L	81.4	Confident	64.8	Low	82 Å²	82	92.2 Å²	92.2	43%	0.429	52%	0.518	S	S	.	.	H	α-helix	trans	-101.8	-8.8	-178.2	-58.5	-175.7	0	0	0	113.6	F252 V257 R265 K271	F252-L269 HydrophobicContact CD2-CD2 4.26Å; V257-L269 HydrophobicContact CG1-CD1 3.83Å; V257-L269 HydrophobicContact CG2-CD1 4.34Å; R265-L269 HydrophobicContact CG-CD1 3.6Å; R265-L269 HydrophobicContact CG-CG 4.23Å; R265-L269 VanDerWaalsContact O-CB 3.22Å; R265-L269 WeakPolarHBondContact O-CB 3.28Å; R265-L269 WeakPolarHBondContact O-CG 3.15Å; R265-L269 PolarHBondContact O-N 3.4Å; L269-K271 PolarHBondContact O-N 3.36Å
270	A	74.7	Confident	62.5	Low	63 Å²	63	97.7 Å²	97.7	52%	0.521	54%	0.535	S	S	.	.			trans	-54.7	110.2	173.1	0	0	0	0	0	108.8	E266 K272	E266-A270 WeakPolarHBondContact O-CA 3.49Å; E266-A270 WeakPolarHBondContact O-CB 3.38Å; E266-A270 PolarHBondContact O-N 2.86Å; A270-K272 VanDerWaalsContact C-N 3.29Å; A270-K272 PolarHBondContact O-N 2.9Å
271	K	56.6	Low	60.5	Low	181 Å²	181	101.8 Å²	101.8	79%	0.787	55%	0.554	S	S	*	*			trans	-66.5	99.8	156.9	-64.8	-178.9	-177.5	178.8	0	104.3	L269 Q273	L269-K271 PolarHBondContact O-N 3.36Å; K271-Q273 PolarHBondContact O-N 2.86Å
272	K	51	Low	58.6	Low	133 Å²	133	103.7 Å²	103.7	58%	0.578	57%	0.569	S	S	*	*			trans	-58.9	95.2	158	-88.7	-179.8	172	172.6	0	105	E238 E242 A270 C274	E238-K272 IonicContact OE1-NZ 2.86Å; E238-K272 PolarHBondContact OE1-NZ 3.23Å; E242-K272 HydrophobicContact CG-CD 4Å; E242-K272 VanDerWaalsContact OE1-CD 3.3Å; E242-K272 WeakPolarHBondContact OE1-CD 3.27Å; E242-K272 WeakPolarHBondContact OE1-CE 3.32Å; E242-K272 IonicContact OE1-NZ 2.65Å; E242-K272 PolarHBondContact OE1-NZ 3.1Å; A270-K272 VanDerWaalsContact C-N 3.29Å; A270-K272 PolarHBondContact O-N 2.9Å; K272-C274 PolarHBondContact O-N 2.71Å; K272-C274 VanDerWaalsContact O-N 3.14Å
273	Q	37.9	Very low	56.7	Low	165 Å²	165	103.8 Å²	103.8	77%	0.771	57%	0.573	S	S	*	*			trans	-60.5	114.8	163.7	-77.9	175.5	-24.8	0	0	103.9	K271 S275	K271-Q273 PolarHBondContact O-N 2.86Å; Q273-S275 PolarHBondContact O-N 2.83Å
274	C	39	Very low	54.8	Low	111 Å²	111	102.9 Å²	102.9	75%	0.75	57%	0.571	S	S	*	*			trans	-63.6	95.5	162.2	-165.9	0	0	0	0	104.7	K272 L276	K272-C274 PolarHBondContact O-N 2.71Å; K272-C274 VanDerWaalsContact O-N 3.14Å; C274-L276 PolarHBondContact O-N 2.83Å
275	S	33	Very low	52.8	Low	95 Å²	95	106.1 Å²	106.1	66%	0.664	59%	0.586	S	S	*	*			trans	-62.6	93.4	172.2	-61.8	0	0	0	0	107	Q273 E277	Q273-S275 PolarHBondContact O-N 2.83Å; S275-E277 PolarHBondContact O-N 2.69Å
276	L	35.2	Very low	51.3	Low	133 Å²	133	105 Å²	105	70%	0.696	59%	0.591	S	S	*	*			trans	-73.3	73.1	165.1	-76.9	158.2	0	0	0	107.1	C274	C274-L276 PolarHBondContact O-N 2.83Å
277	E	26.9	Very low	50.1	Low	177 Å²	177	103.1 Å²	103.1	83%	0.827	59%	0.586	S	S	*	*			trans	-116.9	103.2	168.1	-73.2	-166.6	170.8	0	0	109.4	S275	S275-E277 PolarHBondContact O-N 2.69Å
278	G	27.6	Very low	49	Very low	76 Å²	76	105.3 Å²	105.3	78%	0.784	60%	0.595	S	S	*	*	S	Bend	trans	78.6	98.2	139.3	0	0	0	0	0	118.3
279	G	34.9	Very low	48.1	Very low	62 Å²	62	108.5 Å²	108.5	64%	0.639	61%	0.612	S	S	*	*	S	Bend	trans	95.2	117.3	138	0	0	0	0	0	116.9
280	Q	34.5	Very low	47.6	Very low	186 Å²	186	110.9 Å²	110.9	87%	0.869	62%	0.621	S	S	*	*			trans	87.3	62	170.9	-48.3	-174.3	6.5	0	0	115.7
281	H	45.3	Very low	47.2	Very low	91 Å²	91	112.9 Å²	112.9	42%	0.421	62%	0.621	S	S	.	*			trans	-101.8	8.7	-162.6	-111.8	-88.5	0	0	0	118.4	E285	H281-E285 VanDerWaalsContact CE1-CD 3.49Å; H281-E285 IonicContact CE1-OE1 3.55Å; H281-E285 PolarHBondContact CE1-OE1 2.83Å; H281-E285 IonicContact CE1-OE2 2.63Å; H281-E285 PolarHBondContact CE1-OE2 2.91Å; H281-E285 IonicContact CG-OE2 3.01Å; H281-E285 IonicContact ND1-OE1 2.74Å; H281-E285 PolarHBondContact ND1-OE1 3.06Å; H281-E285 IonicContact ND1-OE2 3.38Å; H281-E285 PolarHBondContact ND1-OE2 3.18Å; H281-E285 WeakPolarHBondContact O-CB 3.42Å
282	S	47.5	Very low	47.3	Very low	99 Å²	99	107.6 Å²	107.6	69%	0.692	60%	0.601	S	S	*	*	S	Bend	trans	-90.8	-44.9	-177.8	63.5	0	0	0	0	115.1
283	V	50.3	Low	48	Very low	100 Å²	100	106.6 Å²	106.6	61%	0.606	60%	0.599	S	S	*	*	H	α-helix	trans	-87.4	-38.8	-170.9	-177.1	0	0	0	0	112.6	E285 N287	V283-E285 VanDerWaalsContact C-N 3.31Å; V283-E285 PolarHBondContact O-N 2.91Å; V283-N287 PolarHBondContact O-N 3.2Å
284	V	48.7	Very low	49.4	Very low	88 Å²	88	103.1 Å²	103.1	53%	0.533	59%	0.585	S	S	.	*	H	α-helix	trans	-69.1	-33.8	-179	-179	0	0	0	0	111.3	K288	V284-K288 WeakPolarHBondContact O-CG 3.49Å; V284-K288 PolarHBondContact O-N 3Å
285	E	46.2	Very low	50.2	Low	74 Å²	74	102.1 Å²	102.1	35%	0.346	57%	0.568	S	S	.	*	H	α-helix	trans	-76.4	-35.2	-178.7	-151.8	134.7	-114.3	0	0	112.7	H281 V283 K288 N289	H281-E285 VanDerWaalsContact CE1-CD 3.49Å; H281-E285 IonicContact CE1-OE1 3.55Å; H281-E285 PolarHBondContact CE1-OE1 2.83Å; H281-E285 IonicContact CE1-OE2 2.63Å; H281-E285 PolarHBondContact CE1-OE2 2.91Å; H281-E285 IonicContact CG-OE2 3.01Å; H281-E285 IonicContact ND1-OE1 2.74Å; H281-E285 PolarHBondContact ND1-OE1 3.06Å; H281-E285 IonicContact ND1-OE2 3.38Å; H281-E285 PolarHBondContact ND1-OE2 3.18Å; H281-E285 WeakPolarHBondContact O-CB 3.42Å; V283-E285 VanDerWaalsContact C-N 3.31Å; V283-E285 PolarHBondContact O-N 2.91Å; E285-K288 PolarHBondContact O-N 3.31Å; E285-N289 VanDerWaalsContact O-CB 3.28Å; E285-N289 WeakPolarHBondContact O-CB 3.38Å; E285-N289 VanDerWaalsContact O-CG 3.23Å; E285-N289 PolarHBondContact O-N 2.89Å; E285-N289 PolarHBondContact O-ND2 2.9Å
286	A	53.9	Low	51.5	Low	47 Å²	47	104.6 Å²	104.6	39%	0.388	56%	0.562	S	S	.	*	H	α-helix	trans	-60.4	-47.4	170.2	0	0	0	0	0	111.1	K288 N289 E290	A286-K288 PolarHBondContact O-N 3.31Å; A286-N289 PolarHBondContact O-N 3.39Å; A286-E290 PolarHBondContact O-N 3.24Å
287	N	61	Low	53	Low	98 Å²	98	105.1 Å²	105.1	52%	0.524	56%	0.559	S	S	.	*	H	α-helix	trans	-63.6	-40.1	177.2	-75.1	-14.4	0	0	0	112.6	V283 M291	V283-N287 PolarHBondContact O-N 3.2Å; N287-M291 VanDerWaalsContact O-CB 3.26Å; N287-M291 WeakPolarHBondContact O-CB 3.45Å; N287-M291 PolarHBondContact O-N 3.24Å
288	K	60.6	Low	54.6	Low	130 Å²	130	102.9 Å²	102.9	57%	0.565	55%	0.547	S	S	*	.	H	α-helix	trans	-63.1	-44.2	173.4	-80.5	-179.1	179.2	177	0	111.3	V284 E285 A286 M291 L292	V284-K288 WeakPolarHBondContact O-CG 3.49Å; V284-K288 PolarHBondContact O-N 3Å; E285-K288 PolarHBondContact O-N 3.31Å; A286-K288 PolarHBondContact O-N 3.31Å; K288-M291 PolarHBondContact O-N 2.75Å; K288-L292 VanDerWaalsContact O-CB 3.29Å; K288-L292 WeakPolarHBondContact O-CB 3.13Å; K288-L292 WeakPolarHBondContact O-CD1 3.42Å; K288-L292 WeakPolarHBondContact O-CG 3.37Å; K288-L292 PolarHBondContact O-N 3.38Å
289	N	63.3	Low	55.8	Low	87 Å²	87	101.6 Å²	101.6	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-66.4	-41.6	179.6	-77.1	-26	0	0	0	112.5	E285 A286 L292 Q293	E285-N289 VanDerWaalsContact O-CB 3.28Å; E285-N289 WeakPolarHBondContact O-CB 3.38Å; E285-N289 VanDerWaalsContact O-CG 3.23Å; E285-N289 PolarHBondContact O-N 2.89Å; E285-N289 PolarHBondContact O-ND2 2.9Å; A286-N289 PolarHBondContact O-N 3.39Å; N289-L292 PolarHBondContact O-N 3.05Å; N289-Q293 WeakPolarHBondContact O-CB 3.44Å; N289-Q293 WeakPolarHBondContact O-CG 3.3Å; N289-Q293 PolarHBondContact O-N 3.21Å
290	E	71.7	Confident	57.1	Low	133 Å²	133	101.9 Å²	101.9	62%	0.621	52%	0.521	S	S	*	.	H	α-helix	trans	-63.8	-44	173.9	-76.8	-170.8	168	0	0	111.8	A286 Q293 L294	A286-E290 PolarHBondContact O-N 3.24Å; E290-Q293 PolarHBondContact O-N 3.19Å; E290-L294 WeakPolarHBondContact O-CB 3.44Å; E290-L294 PolarHBondContact O-N 3.13Å
291	M	65.7	Low	58.3	Low	104 Å²	104	97.3 Å²	97.3	51%	0.512	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-45.5	174.9	-175	64.4	67.4	0	0	111	N287 K288 Q293 L294 K295	N287-M291 VanDerWaalsContact O-CB 3.26Å; N287-M291 WeakPolarHBondContact O-CB 3.45Å; N287-M291 PolarHBondContact O-N 3.24Å; K288-M291 PolarHBondContact O-N 2.75Å; M291-Q293 PolarHBondContact O-N 3.24Å; M291-L294 PolarHBondContact O-N 2.89Å; M291-K295 HydrophobicContact CG-CD 4.26Å; M291-K295 WeakPolarHBondContact O-CB 3.39Å; M291-K295 WeakPolarHBondContact O-CG 3.36Å; M291-K295 PolarHBondContact O-N 3.16Å
292	L	60.1	Low	58.7	Low	71 Å²	71	96.2 Å²	96.2	37%	0.372	51%	0.506	S	S	.	.	H	α-helix	trans	-60.1	-41.8	174.1	-89.3	153.7	0	0	0	111.9	K288 N289 K295 R296	K288-L292 VanDerWaalsContact O-CB 3.29Å; K288-L292 WeakPolarHBondContact O-CB 3.13Å; K288-L292 WeakPolarHBondContact O-CD1 3.42Å; K288-L292 WeakPolarHBondContact O-CG 3.37Å; K288-L292 PolarHBondContact O-N 3.38Å; N289-L292 PolarHBondContact O-N 3.05Å; L292-K295 PolarHBondContact O-N 2.96Å; L292-R296 WeakPolarHBondContact O-CB 2.99Å; L292-R296 VanDerWaalsContact O-CG 3.24Å; L292-R296 WeakPolarHBondContact O-CG 3.48Å; L292-R296 PolarHBondContact O-N 3.23Å
293	Q	64.9	Low	59.3	Low	112 Å²	112	96.3 Å²	96.3	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-42	176	-77	-171.7	14.5	0	0	112.3	N289 E290 M291 K295 R296 K297	N289-Q293 WeakPolarHBondContact O-CB 3.44Å; N289-Q293 WeakPolarHBondContact O-CG 3.3Å; N289-Q293 PolarHBondContact O-N 3.21Å; E290-Q293 PolarHBondContact O-N 3.19Å; M291-Q293 PolarHBondContact O-N 3.24Å; Q293-K295 VanDerWaalsContact C-N 3.32Å; Q293-R296 PolarHBondContact O-N 3.23Å; Q293-K297 WeakPolarHBondContact O-CG 3.35Å; Q293-K297 PolarHBondContact O-N 2.9Å
294	L	67.3	Low	59.8	Low	92 Å²	92	97.5 Å²	97.5	48%	0.482	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-41.6	176	-177	63	0	0	0	110.9	E290 M291 K297 K298	E290-L294 WeakPolarHBondContact O-CB 3.44Å; E290-L294 PolarHBondContact O-N 3.13Å; M291-L294 PolarHBondContact O-N 2.89Å; L294-K297 PolarHBondContact O-N 2.63Å; L294-K298 WeakPolarHBondContact O-CG 3.31Å; L294-K298 PolarHBondContact O-N 2.8Å; L294-K298 VanDerWaalsContact O-N 3.11Å
295	K	56.5	Low	60.3	Low	90 Å²	90	96.8 Å²	96.8	39%	0.391	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-44.2	175.2	-69.8	175.8	173.5	-169.7	0	112.3	E239 M291 L292 Q293 K297 K298 A299	E239-K295 VanDerWaalsContact OE1-CB 3.24Å; E239-K295 WeakPolarHBondContact OE1-CB 3.3Å; M291-K295 HydrophobicContact CG-CD 4.26Å; M291-K295 WeakPolarHBondContact O-CB 3.39Å; M291-K295 WeakPolarHBondContact O-CG 3.36Å; M291-K295 PolarHBondContact O-N 3.16Å; L292-K295 PolarHBondContact O-N 2.96Å; Q293-K295 VanDerWaalsContact C-N 3.32Å; K295-K297 VanDerWaalsContact C-N 3.33Å; K295-K297 PolarHBondContact O-N 2.57Å; K295-K298 WeakPolarHBondContact O-CA 3.33Å; K295-K298 WeakPolarHBondContact O-CB 2.97Å; K295-K298 PolarHBondContact O-N 2.89Å; K295-A299 PolarHBondContact O-N 3.36Å
296	R	59.5	Low	60.8	Low	146 Å²	146	95.6 Å²	95.6	55%	0.551	49%	0.491	S	S	*	.	H	α-helix	trans	-56.1	-43.6	171.7	-76.9	172.7	177.9	-178.6	0.1	112.5	L292 Q293 K298 A299 S300	L292-R296 WeakPolarHBondContact O-CB 2.99Å; L292-R296 VanDerWaalsContact O-CG 3.24Å; L292-R296 WeakPolarHBondContact O-CG 3.48Å; L292-R296 PolarHBondContact O-N 3.23Å; Q293-R296 PolarHBondContact O-N 3.23Å; R296-K298 VanDerWaalsContact C-N 3.31Å; R296-K298 PolarHBondContact O-N 3.05Å; R296-A299 PolarHBondContact O-N 2.77Å; R296-S300 VanDerWaalsContact O-CB 3.27Å; R296-S300 WeakPolarHBondContact O-CB 3Å; R296-S300 PolarHBondContact O-N 3.02Å
297	K	65.8	Low	61	Low	145 Å²	145	101.7 Å²	101.7	63%	0.63	50%	0.504	S	S	*	.	H	α-helix	trans	-60.6	-41	175.2	-78.1	-179.8	-178.9	176.5	0	111.2	Q293 L294 K295 T301	Q293-K297 WeakPolarHBondContact O-CG 3.35Å; Q293-K297 PolarHBondContact O-N 2.9Å; L294-K297 PolarHBondContact O-N 2.63Å; K295-K297 VanDerWaalsContact C-N 3.33Å; K295-K297 PolarHBondContact O-N 2.57Å; K297-T301 VanDerWaalsContact O-CB 3.31Å; K297-T301 WeakPolarHBondContact O-CB 3.19Å; K297-T301 PolarHBondContact O-N 2.76Å; K297-T301 PolarHBondContact O-OG1 2.92Å
298	K	61.6	Low	61.1	Low	129 Å²	129	98.8 Å²	98.8	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-64.8	-51.1	175.8	-70.2	177.7	178.6	-177.9	0	112.1	L294 K295 R296 S300 T301 V302	L294-K298 WeakPolarHBondContact O-CG 3.31Å; L294-K298 PolarHBondContact O-N 2.8Å; L294-K298 VanDerWaalsContact O-N 3.11Å; K295-K298 WeakPolarHBondContact O-CA 3.33Å; K295-K298 WeakPolarHBondContact O-CB 2.97Å; K295-K298 PolarHBondContact O-N 2.89Å; R296-K298 VanDerWaalsContact C-N 3.31Å; R296-K298 PolarHBondContact O-N 3.05Å; K298-S300 PolarHBondContact O-N 2.63Å; K298-T301 WeakPolarHBondContact O-CA 3.48Å; K298-T301 WeakPolarHBondContact O-CB 3.07Å; K298-T301 PolarHBondContact O-N 3.47Å; K298-V302 WeakPolarHBondContact O-CG2 3.3Å; K298-V302 PolarHBondContact O-N 3.2Å
299	A	53	Low	60.8	Low	50 Å²	50	94.3 Å²	94.3	41%	0.413	47%	0.472	S	S	.	.	H	α-helix	trans	-59.7	-44.4	178.9	0	0	0	0	0	112.2	K295 R296 T301 V302 V303	K295-A299 PolarHBondContact O-N 3.36Å; R296-A299 PolarHBondContact O-N 2.77Å; A299-T301 VanDerWaalsContact C-N 3.32Å; A299-T301 PolarHBondContact O-N 3.16Å; A299-V302 PolarHBondContact O-N 3.38Å; A299-V303 WeakPolarHBondContact O-CG2 2.95Å; A299-V303 PolarHBondContact O-N 3.47Å
300	S	61.7	Low	60.5	Low	67 Å²	67	92.8 Å²	92.8	47%	0.469	47%	0.472	S	S	.	.	H	α-helix	trans	-60.9	-40.4	173.4	-179.1	0	0	0	0	111.9	R296 K298 V303 Q304	R296-S300 VanDerWaalsContact O-CB 3.27Å; R296-S300 WeakPolarHBondContact O-CB 3Å; R296-S300 PolarHBondContact O-N 3.02Å; K298-S300 PolarHBondContact O-N 2.63Å; S300-V303 PolarHBondContact O-N 3.18Å; S300-Q304 VanDerWaalsContact O-CB 3.24Å; S300-Q304 WeakPolarHBondContact O-CB 2.97Å; S300-Q304 WeakPolarHBondContact O-CG 3.5Å; S300-Q304 PolarHBondContact O-N 3.16Å
301	T	59.7	Low	60.2	Low	90 Å²	90	91.4 Å²	91.4	55%	0.552	47%	0.469	S	S	*	.	H	α-helix	trans	-63.7	-40.8	177	-58.9	0	0	0	0	111.2	K297 K298 A299 Q304 L305	K297-T301 VanDerWaalsContact O-CB 3.31Å; K297-T301 WeakPolarHBondContact O-CB 3.19Å; K297-T301 PolarHBondContact O-N 2.76Å; K297-T301 PolarHBondContact O-OG1 2.92Å; K298-T301 WeakPolarHBondContact O-CA 3.48Å; K298-T301 WeakPolarHBondContact O-CB 3.07Å; K298-T301 PolarHBondContact O-N 3.47Å; A299-T301 VanDerWaalsContact C-N 3.32Å; A299-T301 PolarHBondContact O-N 3.16Å; T301-Q304 PolarHBondContact O-N 3.13Å; T301-L305 WeakPolarHBondContact O-CB 3.4Å; T301-L305 PolarHBondContact O-N 3.05Å
302	V	54.6	Low	60	Low	69 Å²	69	94 Å²	94	42%	0.418	47%	0.472	S	S	.	.	H	α-helix	trans	-63.1	-49	175.4	175.2	0	0	0	0	110.8	K298 A299 Q304 L305 V306	K298-V302 WeakPolarHBondContact O-CG2 3.3Å; K298-V302 PolarHBondContact O-N 3.2Å; A299-V302 PolarHBondContact O-N 3.38Å; V302-Q304 VanDerWaalsContact C-N 3.33Å; V302-Q304 PolarHBondContact O-N 3.14Å; V302-L305 WeakPolarHBondContact O-CB 3.2Å; V302-L305 PolarHBondContact O-N 3.3Å; V302-V306 HydrophobicContact CG1-CG2 4.46Å; V302-V306 VanDerWaalsContact O-CG2 3.3Å; V302-V306 WeakPolarHBondContact O-CG2 3.48Å; V302-V306 PolarHBondContact O-N 2.96Å
303	V	60.2	Low	59.5	Low	100 Å²	100	94.1 Å²	94.1	61%	0.606	47%	0.468	S	S	*	.	H	α-helix	trans	-61.2	-42.2	177.6	174.5	0	0	0	0	111.4	A299 S300 R307	A299-V303 WeakPolarHBondContact O-CG2 2.95Å; A299-V303 PolarHBondContact O-N 3.47Å; S300-V303 PolarHBondContact O-N 3.18Å; V303-R307 VanDerWaalsContact O-CB 3.3Å; V303-R307 WeakPolarHBondContact O-CB 3.38Å; V303-R307 PolarHBondContact O-N 2.82Å
304	Q	59.5	Low	59.2	Low	125 Å²	125	91.7 Å²	91.7	58%	0.584	47%	0.467	S	S	*	.	H	α-helix	trans	-64.8	-40.5	175.9	-72.9	-107.7	-42.2	0	0	111.9	S300 T301 V302 R307 S308	S300-Q304 VanDerWaalsContact O-CB 3.24Å; S300-Q304 WeakPolarHBondContact O-CB 2.97Å; S300-Q304 WeakPolarHBondContact O-CG 3.5Å; S300-Q304 PolarHBondContact O-N 3.16Å; T301-Q304 PolarHBondContact O-N 3.13Å; V302-Q304 VanDerWaalsContact C-N 3.33Å; V302-Q304 PolarHBondContact O-N 3.14Å; Q304-R307 PolarHBondContact O-N 2.82Å; Q304-S308 VanDerWaalsContact O-CB 3.28Å; Q304-S308 WeakPolarHBondContact O-CB 3.49Å; Q304-S308 PolarHBondContact O-N 2.79Å; Q304-S308 PolarHBondContact O-OG 2.64Å
305	L	59.5	Low	59	Low	73 Å²	73	90 Å²	90	38%	0.382	47%	0.466	S	S	.	.	H	α-helix	trans	-62.1	-52	177.1	-176.4	66	0	0	0	110.1	T301 V302 R307 S308 Q309	T301-L305 WeakPolarHBondContact O-CB 3.4Å; T301-L305 PolarHBondContact O-N 3.05Å; V302-L305 WeakPolarHBondContact O-CB 3.2Å; V302-L305 PolarHBondContact O-N 3.3Å; L305-R307 VanDerWaalsContact C-N 3.33Å; L305-R307 PolarHBondContact O-N 2.86Å; L305-S308 PolarHBondContact O-N 3.48Å; L305-S308 PolarHBondContact O-OG 2.78Å; L305-Q309 HydrophobicContact CD1-CG 4.4Å; L305-Q309 WeakPolarHBondContact O-CB 3.48Å; L305-Q309 VanDerWaalsContact O-CG 3.24Å; L305-Q309 WeakPolarHBondContact O-CG 3.49Å; L305-Q309 PolarHBondContact O-N 3.48Å
306	V	57.8	Low	58.9	Low	49 Å²	49	90.9 Å²	90.9	30%	0.297	48%	0.476	S	S	.	.	H	α-helix	trans	-56.9	-46.3	176.7	173.1	0	0	0	0	110.7	C148 V302 Q309 A310	C148-V306 HydrophobicContact CB-CG2 3.94Å; V302-V306 HydrophobicContact CG1-CG2 4.46Å; V302-V306 VanDerWaalsContact O-CG2 3.3Å; V302-V306 WeakPolarHBondContact O-CG2 3.48Å; V302-V306 PolarHBondContact O-N 2.96Å; V306-Q309 PolarHBondContact O-N 2.69Å; V306-A310 WeakPolarHBondContact O-CB 3.35Å; V306-A310 PolarHBondContact O-N 3.32Å
307	R	56.6	Low	58.5	Low	175 Å²	175	89 Å²	89	66%	0.66	48%	0.476	S	S	*	.	H	α-helix	trans	-62.9	-46.9	177	-170.6	177.9	-174.8	174.1	1.8	112.2	V303 Q304 L305 Q309 A310 L311	V303-R307 VanDerWaalsContact O-CB 3.3Å; V303-R307 WeakPolarHBondContact O-CB 3.38Å; V303-R307 PolarHBondContact O-N 2.82Å; Q304-R307 PolarHBondContact O-N 2.82Å; L305-R307 VanDerWaalsContact C-N 3.33Å; L305-R307 PolarHBondContact O-N 2.86Å; R307-Q309 VanDerWaalsContact C-N 3.25Å; R307-Q309 PolarHBondContact O-N 3.08Å; R307-A310 PolarHBondContact O-N 3.26Å; R307-L311 HydrophobicContact CG-CD1 4.4Å; R307-L311 VanDerWaalsContact O-CG 3.3Å; R307-L311 WeakPolarHBondContact O-CG 3.22Å; R307-L311 PolarHBondContact O-N 2.68Å
308	S	62.8	Low	57.9	Low	38 Å²	38	90.6 Å²	90.6	27%	0.266	48%	0.478	S	S	.	.	H	α-helix	trans	-63.4	-33.4	-179.7	81.3	0	0	0	0	112.1	Q304 L305 R312	Q304-S308 VanDerWaalsContact O-CB 3.28Å; Q304-S308 WeakPolarHBondContact O-CB 3.49Å; Q304-S308 PolarHBondContact O-N 2.79Å; Q304-S308 PolarHBondContact O-OG 2.64Å; L305-S308 PolarHBondContact O-N 3.48Å; L305-S308 PolarHBondContact O-OG 2.78Å; S308-R312 WeakPolarHBondContact O-CB 3.43Å; S308-R312 WeakPolarHBondContact O-CG 3.35Å; S308-R312 PolarHBondContact O-N 3.35Å; S308-R312 PolarHBondContact OG-NH2 3.39Å; S308-R312 VanDerWaalsContact OG-NH2 3.1Å
309	Q	55.7	Low	57.4	Low	35 Å²	35	86.6 Å²	86.6	16%	0.164	47%	0.467	C	S	.	.	H	α-helix	trans	-80.8	-38.3	180	-72	172.9	-9.7	0	0	111.9	C151 L305 V306 R307 L311 R312 R313	C151-Q309 PolarHBondContact SG-NE2 3.03Å; C151-Q309 PolarHBondContact SG-OE1 2.83Å; L305-Q309 HydrophobicContact CD1-CG 4.4Å; L305-Q309 WeakPolarHBondContact O-CB 3.48Å; L305-Q309 VanDerWaalsContact O-CG 3.24Å; L305-Q309 WeakPolarHBondContact O-CG 3.49Å; L305-Q309 PolarHBondContact O-N 3.48Å; V306-Q309 PolarHBondContact O-N 2.69Å; R307-Q309 VanDerWaalsContact C-N 3.25Å; R307-Q309 PolarHBondContact O-N 3.08Å; Q309-L311 VanDerWaalsContact C-N 3.25Å; Q309-L311 PolarHBondContact O-N 3.42Å; Q309-R312 PolarHBondContact O-N 3.1Å; Q309-R313 WeakPolarHBondContact O-CB 3.5Å; Q309-R313 VanDerWaalsContact O-CG 3.3Å; Q309-R313 WeakPolarHBondContact O-CG 3.41Å; Q309-R313 PolarHBondContact O-N 3.35Å
310	A	55.9	Low	57.3	Low	56 Å²	56	88.3 Å²	88.3	46%	0.463	47%	0.472	S	S	.	.	H	α-helix	trans	-56.6	-43.6	169.1	0	0	0	0	0	110.7	V306 R307 R313 A314	V306-A310 WeakPolarHBondContact O-CB 3.35Å; V306-A310 PolarHBondContact O-N 3.32Å; R307-A310 PolarHBondContact O-N 3.26Å; A310-R313 PolarHBondContact O-N 3.01Å; A310-A314 WeakPolarHBondContact O-CB 3.17Å; A310-A314 PolarHBondContact O-N 3.38Å
311	L	66.7	Low	56.4	Low	104 Å²	104	91.7 Å²	91.7	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-64.7	-45.8	174.4	-69.9	171.6	0	0	0	112.6	R307 Q309 R313 A314 A315	R307-L311 HydrophobicContact CG-CD1 4.4Å; R307-L311 VanDerWaalsContact O-CG 3.3Å; R307-L311 WeakPolarHBondContact O-CG 3.22Å; R307-L311 PolarHBondContact O-N 2.68Å; Q309-L311 VanDerWaalsContact C-N 3.25Å; Q309-L311 PolarHBondContact O-N 3.42Å; L311-R313 VanDerWaalsContact C-N 3.28Å; L311-R313 PolarHBondContact O-N 3.24Å; L311-A314 PolarHBondContact O-N 3.2Å; L311-A315 PolarHBondContact O-N 3.3Å
312	R	60.7	Low	55.8	Low	157 Å²	157	92.7 Å²	92.7	59%	0.592	47%	0.473	S	S	*	.	H	α-helix	trans	-60.3	-36.9	175.9	-82.8	-176.1	-95.5	-157.4	-4.6	112.7	S308 Q309 A315 N316	S308-R312 WeakPolarHBondContact O-CB 3.43Å; S308-R312 WeakPolarHBondContact O-CG 3.35Å; S308-R312 PolarHBondContact O-N 3.35Å; S308-R312 PolarHBondContact OG-NH2 3.39Å; S308-R312 VanDerWaalsContact OG-NH2 3.1Å; Q309-R312 PolarHBondContact O-N 3.1Å; R312-A315 PolarHBondContact O-N 2.85Å; R312-N316 PolarHBondContact O-N 3.41Å
313	R	50.4	Low	55.2	Low	74 Å²	74	96.9 Å²	96.9	28%	0.279	49%	0.485	S	S	.	.	H	α-helix	trans	-71.8	-39.6	175.6	-73.5	166.5	168.3	-165.2	-12.1	112.4	E147 C151 Q309 A310 L311 A315 N316 N317	E147-R313 IonicContact OE1-CZ 3.23Å; E147-R313 VanDerWaalsContact OE1-CZ 3.23Å; E147-R313 IonicContact OE1-NH1 2.63Å; E147-R313 PolarHBondContact OE1-NH1 2.97Å; E147-R313 IonicContact OE1-NH2 2.95Å; E147-R313 PolarHBondContact OE1-NH2 3.17Å; C151-R313 PolarHBondContact O-NH2 3.17Å; Q309-R313 WeakPolarHBondContact O-CB 3.5Å; Q309-R313 VanDerWaalsContact O-CG 3.3Å; Q309-R313 WeakPolarHBondContact O-CG 3.41Å; Q309-R313 PolarHBondContact O-N 3.35Å; A310-R313 PolarHBondContact O-N 3.01Å; L311-R313 VanDerWaalsContact C-N 3.28Å; L311-R313 PolarHBondContact O-N 3.24Å; R313-A315 VanDerWaalsContact C-N 3.25Å; R313-A315 PolarHBondContact O-N 3.37Å; R313-N316 PolarHBondContact O-N 3.28Å; R313-N317 WeakPolarHBondContact O-CB 3.41Å; R313-N317 PolarHBondContact O-N 3.19Å
314	A	58.7	Low	54.2	Low	61 Å²	61	96.5 Å²	96.5	50%	0.504	48%	0.483	S	S	.	.	H	α-helix	trans	-58.8	-41.3	171.7	0	0	0	0	0	110.8	A310 L311 R318	A310-A314 WeakPolarHBondContact O-CB 3.17Å; A310-A314 PolarHBondContact O-N 3.38Å; L311-A314 PolarHBondContact O-N 3.2Å; A314-R318 PolarHBondContact O-N 3.42Å; A314-R318 VanDerWaalsContact O-N 3.1Å
315	A	61.9	Low	53	Low	56 Å²	56	96.2 Å²	96.2	46%	0.463	48%	0.482	S	S	.	.	H	α-helix	trans	-65.3	-44.8	174.3	0	0	0	0	0	113	L311 R312 R313 R318 S319	L311-A315 PolarHBondContact O-N 3.3Å; R312-A315 PolarHBondContact O-N 2.85Å; R313-A315 VanDerWaalsContact C-N 3.25Å; R313-A315 PolarHBondContact O-N 3.37Å; A315-R318 VanDerWaalsContact O-CB 3.31Å; A315-R318 WeakPolarHBondContact O-CB 3.32Å; A315-R318 PolarHBondContact O-N 3.04Å; A315-S319 PolarHBondContact O-N 3.46Å
316	N	54.2	Low	51.9	Low	110 Å²	110	97.9 Å²	97.9	59%	0.588	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-39.7	176.9	-92.3	8.8	0	0	0	112.8	R312 R313 R318 S319 V320	R312-N316 PolarHBondContact O-N 3.41Å; R313-N316 PolarHBondContact O-N 3.28Å; N316-R318 PolarHBondContact O-N 2.95Å; N316-S319 PolarHBondContact O-N 2.96Å; N316-S319 PolarHBondContact O-OG 3.01Å; N316-S319 VanDerWaalsContact O-OG 3.11Å; N316-V320 WeakPolarHBondContact O-CG2 3.25Å; N316-V320 PolarHBondContact O-N 2.78Å; N316-V320 VanDerWaalsContact O-N 3.09Å
317	N	50.7	Low	50.8	Low	105 Å²	105	102.7 Å²	102.7	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-65.3	-32.3	175.1	-76.1	-14.5	0	0	0	111.7	R313 R321	R313-N317 WeakPolarHBondContact O-CB 3.41Å; R313-N317 PolarHBondContact O-N 3.19Å; N317-R321 PolarHBondContact O-N 3.09Å; N317-R321 VanDerWaalsContact O-N 3.14Å
318	R	54.9	Low	49.5	Very low	179 Å²	179	98.3 Å²	98.3	68%	0.675	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-45.4	173	-153	179.6	-164.1	177	3.9	111.7	A314 A315 N316 V320 R321 E322	A314-R318 PolarHBondContact O-N 3.42Å; A314-R318 VanDerWaalsContact O-N 3.1Å; A315-R318 VanDerWaalsContact O-CB 3.31Å; A315-R318 WeakPolarHBondContact O-CB 3.32Å; A315-R318 PolarHBondContact O-N 3.04Å; N316-R318 PolarHBondContact O-N 2.95Å; R318-V320 VanDerWaalsContact C-N 3.34Å; R318-V320 PolarHBondContact O-N 3.09Å; R318-R321 WeakPolarHBondContact O-CB 3.29Å; R318-R321 PolarHBondContact O-N 3.38Å; R318-R321 VanDerWaalsContact O-N 3.13Å; R318-E322 PolarHBondContact O-N 3.25Å
319	S	50.9	Low	47.9	Very low	45 Å²	45	103.6 Å²	103.6	32%	0.315	54%	0.539	S	S	.	.	H	α-helix	trans	-67.5	-31.3	179.2	84.1	0	0	0	0	113.5	A315 N316 K323	A315-S319 PolarHBondContact O-N 3.46Å; N316-S319 PolarHBondContact O-N 2.96Å; N316-S319 PolarHBondContact O-OG 3.01Å; N316-S319 VanDerWaalsContact O-OG 3.11Å; S319-K323 WeakPolarHBondContact O-CG 3.25Å; S319-K323 PolarHBondContact O-N 2.97Å
320	V	50.7	Low	46.9	Very low	87 Å²	87	106.7 Å²	106.7	53%	0.527	57%	0.571	S	S	.	*	H	α-helix	trans	-68.7	-36.9	172.3	175.7	0	0	0	0	111	N316 R318 K323 T324	N316-V320 WeakPolarHBondContact O-CG2 3.25Å; N316-V320 PolarHBondContact O-N 2.78Å; N316-V320 VanDerWaalsContact O-N 3.09Å; R318-V320 VanDerWaalsContact C-N 3.34Å; R318-V320 PolarHBondContact O-N 3.09Å; V320-K323 PolarHBondContact O-N 3.15Å; V320-T324 PolarHBondContact O-N 3.41Å; V320-T324 PolarHBondContact O-OG1 3.27Å
321	R	43.3	Very low	45.6	Very low	137 Å²	137	107.1 Å²	107.1	52%	0.517	58%	0.58	S	S	.	*	H	α-helix	trans	-66.9	-43.7	175.2	-117.5	178.7	-178.1	173.9	0.4	112.1	N317 R318 K323 T324 Q325 D340	N317-R321 PolarHBondContact O-N 3.09Å; N317-R321 VanDerWaalsContact O-N 3.14Å; R318-R321 WeakPolarHBondContact O-CB 3.29Å; R318-R321 PolarHBondContact O-N 3.38Å; R318-R321 VanDerWaalsContact O-N 3.13Å; R321-K323 VanDerWaalsContact C-N 3.29Å; R321-K323 PolarHBondContact O-N 3.5Å; R321-T324 PolarHBondContact O-N 2.67Å; R321-Q325 PolarHBondContact O-N 2.97Å; R321-D340 IonicContact NH1-OD1 2.63Å; R321-D340 PolarHBondContact NH1-OD1 2.99Å; R321-D340 IonicContact NH1-OD2 3.18Å; R321-D340 PolarHBondContact NH1-OD2 3.06Å
322	E	45.5	Very low	43.6	Very low	112 Å²	112	108.6 Å²	108.6	52%	0.523	59%	0.594	S	S	.	*	H	α-helix	trans	-60.3	-38.7	176.3	-73.3	167.9	-172.5	0	0	111.6	R318 T324 T326	R318-E322 PolarHBondContact O-N 3.25Å; E322-T324 VanDerWaalsContact C-N 3.29Å; E322-T324 PolarHBondContact O-N 3.27Å; E322-T326 PolarHBondContact O-N 3.14Å
323	K	42.4	Very low	42	Very low	157 Å²	157	107.9 Å²	107.9	68%	0.683	61%	0.607	S	S	*	*	H	α-helix	trans	-69.9	-21.5	173.7	-74.9	-179.5	179	-177.8	0	114.7	S319 V320 R321 T326	S319-K323 WeakPolarHBondContact O-CG 3.25Å; S319-K323 PolarHBondContact O-N 2.97Å; V320-K323 PolarHBondContact O-N 3.15Å; R321-K323 VanDerWaalsContact C-N 3.29Å; R321-K323 PolarHBondContact O-N 3.5Å; K323-T326 PolarHBondContact O-OG1 2.88Å
324	T	39.1	Very low	40.7	Very low	92 Å²	92	111.8 Å²	111.8	56%	0.564	63%	0.63	S	S	*	*	H	α-helix	trans	-90.9	-29.9	180	-43.7	0	0	0	0	111.1	V320 R321 E322	V320-T324 PolarHBondContact O-N 3.41Å; V320-T324 PolarHBondContact O-OG1 3.27Å; R321-T324 PolarHBondContact O-N 2.67Å; E322-T324 VanDerWaalsContact C-N 3.29Å; E322-T324 PolarHBondContact O-N 3.27Å
325	Q	35.1	Very low	39	Very low	119 Å²	119	113.8 Å²	113.8	56%	0.556	64%	0.637	S	S	*	*	H	α-helix	trans	-74.4	-28.3	177.8	-79.2	178.4	-27.2	0	0	113.6	R321 I327 S328	R321-Q325 PolarHBondContact O-N 2.97Å; Q325-I327 PolarHBondContact O-N 3.06Å; Q325-S328 PolarHBondContact O-N 3.11Å; Q325-S328 PolarHBondContact O-OG 3.36Å
326	T	35	Very low	37.5	Very low	108 Å²	108	118 Å²	118	66%	0.663	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-7.5	176.7	50.5	0	0	0	0	114.6	E322 K323	E322-T326 PolarHBondContact O-N 3.14Å; K323-T326 PolarHBondContact O-OG1 2.88Å
327	I	34.9	Very low	36.1	Very low	150 Å²	150	120.8 Å²	120.8	77%	0.769	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-9.3	178.7	-58.9	178.2	0	0	0	112	Q325	Q325-I327 PolarHBondContact O-N 3.06Å
328	S	30	Very low	35	Very low	82 Å²	82	122.9 Å²	122.9	57%	0.573	68%	0.679	S	S	*	*			trans	-117.6	14	-172	56.6	0	0	0	0	116.4	Q325 A330	Q325-S328 PolarHBondContact O-N 3.11Å; Q325-S328 PolarHBondContact O-OG 3.36Å; S328-A330 PolarHBondContact O-N 3.27Å
329	D	29.2	Very low	33.7	Very low	150 Å²	150	122.8 Å²	122.8	80%	0.802	68%	0.684	S	S	*	*			trans	-82.3	47	178.1	-71.9	-23.4	0	0	0	113.6
330	A	34.9	Very low	32.8	Very low	100 Å²	100	126 Å²	126	83%	0.826	70%	0.698	S	S	*	*	S	Bend	trans	-107.8	80.2	160.9	0	0	0	0	0	109.8	S328	S328-A330 PolarHBondContact O-N 3.27Å
331	G	28	Very low	31.9	Very low	64 Å²	64	133.2 Å²	133.2	66%	0.66	72%	0.717	S	S	*	*	S	Bend	trans	84.5	82.7	140.6	0	0	0	0	0	120
332	T	25.2	Very low	31.3	Very low	135 Å²	135	129.8 Å²	129.8	83%	0.828	71%	0.714	S	S	*	*			trans	78	101.5	140.7	-42.8	0	0	0	0	119.4
333	T	26.1	Very low	30.7	Very low	142 Å²	142	128.8 Å²	128.8	87%	0.871	72%	0.718	S	S	*	*				-158.9	135.1	120.1	-57.4	0	0	0	0	109.4
334	M	23.1	Very low	30	Very low	156 Å²	156	122.5 Å²	122.5	77%	0.768	70%	0.697	S	S	*	*			trans	-71.9	140.2	-169.5	-69.3	-153.5	71	0	0	115.9
335	T	24.3	Very low	29.7	Very low	103 Å²	103	122 Å²	122	63%	0.632	69%	0.694	S	S	*	*			trans	45.8	107.3	138.4	60.8	0	0	0	0	120.3
336	T	29.4	Very low	29.7	Very low	146 Å²	146	123.5 Å²	123.5	90%	0.896	70%	0.699	S	S	*	*			trans	-124.5	111	137.6	55.5	0	0	0	0	108.9
337	M	26.2	Very low	29.6	Very low	168 Å²	168	124.2 Å²	124.2	83%	0.828	69%	0.694	S	S	*	*			trans	-61	135.4	176	-69.3	-172.7	178.3	0	0	112.2
338	D	27.4	Very low	29.7	Very low	148 Å²	148	122.9 Å²	122.9	79%	0.791	69%	0.685	S	S	*	*			trans	38	101.3	143.8	-67	-34.1	0	0	0	119.7
339	K	28.2	Very low	30.3	Very low	177 Å²	177	123.4 Å²	123.4	77%	0.77	67%	0.674	S	S	*	*			trans	-135.9	24	162.2	-75.2	-167.3	179.1	179.2	0	114.9	Y341 S342	K339-Y341 PolarHBondContact O-N 2.86Å; K339-Y341 VanDerWaalsContact O-N 3.12Å; K339-S342 WeakPolarHBondContact O-CB 3.23Å; K339-S342 PolarHBondContact O-N 3.4Å
340	D	29.9	Very low	30.7	Very low	113 Å²	113	121.3 Å²	121.3	60%	0.604	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	5.2	-175.7	-76.1	-13.5	0	0	0	115.1	R321	R321-D340 IonicContact NH1-OD1 2.63Å; R321-D340 PolarHBondContact NH1-OD1 2.99Å; R321-D340 IonicContact NH1-OD2 3.18Å; R321-D340 PolarHBondContact NH1-OD2 3.06Å
341	Y	32.9	Very low	30.9	Very low	239 Å²	239	119.1 Å²	119.1	94%	0.937	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	27.3	167.7	-100.5	-85.3	0	0	0	112.7	K339	K339-Y341 PolarHBondContact O-N 2.86Å; K339-Y341 VanDerWaalsContact O-N 3.12Å
342	S	29.8	Very low	31.8	Very low	65 Å²	65	122.6 Å²	122.6	46%	0.455	63%	0.627	S	S	.	*	S	Bend	trans	-90.6	141.8	178.8	-172.8	0	0	0	0	111.8	K339 G344	K339-S342 WeakPolarHBondContact O-CB 3.23Å; K339-S342 PolarHBondContact O-N 3.4Å; S342-G344 PolarHBondContact O-N 3.46Å
343	P	33.4	Very low	32.6	Very low	91 Å²	91	119.1 Å²	119.1	59%	0.591	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.4	-14.2	173.4	-27.4	33.4	0	0	0	116.1	V345 F346 E347	P343-V345 VanDerWaalsContact C-N 3.28Å; P343-V345 PolarHBondContact O-N 3Å; P343-F346 PolarHBondContact O-N 3.05Å; P343-F346 VanDerWaalsContact O-N 3.16Å; P343-E347 PolarHBondContact O-N 3.4Å
344	G	28.5	Very low	33.4	Very low	24 Å²	24	113.1 Å²	113.1	25%	0.247	57%	0.566	C	S	.	*	H	α-helix	trans	-56.9	-26.8	-179.4	0	0	0	0	0	116	S342 F346 E347 E348	S342-G344 PolarHBondContact O-N 3.46Å; G344-F346 VanDerWaalsContact C-N 3.33Å; G344-F346 PolarHBondContact O-N 2.93Å; G344-E347 CarbonylContact O-C 3.51Å; G344-E347 PolarHBondContact O-N 3.24Å; G344-E348 WeakPolarHBondContact O-CB 3.46Å; G344-E348 WeakPolarHBondContact O-CG 3.44Å; G344-E348 PolarHBondContact O-N 3Å
345	V	33.1	Very low	34.3	Very low	83 Å²	83	110.7 Å²	110.7	50%	0.503	55%	0.553	S	S	.	*	H	α-helix	trans	-69.4	-33.6	178.4	-179.6	0	0	0	0	111.7	P343 R349	P343-V345 VanDerWaalsContact C-N 3.28Å; P343-V345 PolarHBondContact O-N 3Å; V345-R349 PolarHBondContact O-N 3.22Å; V345-R349 VanDerWaalsContact O-N 3.13Å
346	F	35.1	Very low	35.3	Very low	150 Å²	150	106.4 Å²	106.4	66%	0.658	53%	0.527	S	S	*	.	H	α-helix	trans	-72.8	-39.8	175	-146.3	-86.3	0	0	0	110.1	P343 G344 R349 R350	P343-F346 PolarHBondContact O-N 3.05Å; P343-F346 VanDerWaalsContact O-N 3.16Å; G344-F346 VanDerWaalsContact C-N 3.33Å; G344-F346 PolarHBondContact O-N 2.93Å; F346-R349 PolarHBondContact O-N 3.4Å; F346-R350 WeakPolarHBondContact O-CB 3.2Å; F346-R350 PolarHBondContact O-N 3.12Å
347	E	32.9	Very low	36	Very low	122 Å²	122	99.7 Å²	99.7	57%	0.57	49%	0.485	S	S	*	.	H	α-helix	trans	-64.8	-41.6	173.7	-85.1	163.5	155.4	0	0	112.7	P343 G344 R349 R350 S351	P343-E347 PolarHBondContact O-N 3.4Å; G344-E347 CarbonylContact O-C 3.51Å; G344-E347 PolarHBondContact O-N 3.24Å; E347-R349 PolarHBondContact O-N 2.93Å; E347-R350 PolarHBondContact O-N 3.09Å; E347-S351 VanDerWaalsContact O-CB 3.3Å; E347-S351 WeakPolarHBondContact O-CB 3.38Å; E347-S351 PolarHBondContact O-N 2.65Å
348	E	36.2	Very low	37	Very low	123 Å²	123	92.1 Å²	92.1	58%	0.575	45%	0.449	S	S	*	.	H	α-helix	trans	-67.7	-33.4	175.7	-82.6	-177.9	173.5	0	0	113.1	G344 R352	G344-E348 WeakPolarHBondContact O-CB 3.46Å; G344-E348 WeakPolarHBondContact O-CG 3.44Å; G344-E348 PolarHBondContact O-N 3Å; E348-R352 WeakPolarHBondContact O-CB 3.21Å; E348-R352 WeakPolarHBondContact O-CG 3.24Å; E348-R352 PolarHBondContact O-N 3.46Å; E348-R352 PolarHBondContact O-NE 3.35Å; E348-R352 VanDerWaalsContact O-NE 3.16Å
349	R	42.2	Very low	37.9	Very low	92 Å²	92	87 Å²	87	35%	0.347	43%	0.425	S	S	.	.	H	α-helix	trans	-72.9	-47	172.1	-83.3	-173.2	-175.8	-137.9	0.6	111.4	E147 V345 F346 E347 S351 R352 D353	E147-R349 IonicContact OE1-NH1 3.02Å; E147-R349 PolarHBondContact OE1-NH1 3.42Å; E147-R349 IonicContact OE2-NH1 3.36Å; V345-R349 PolarHBondContact O-N 3.22Å; V345-R349 VanDerWaalsContact O-N 3.13Å; F346-R349 PolarHBondContact O-N 3.4Å; E347-R349 PolarHBondContact O-N 2.93Å; R349-S351 VanDerWaalsContact C-N 3.27Å; R349-S351 PolarHBondContact O-N 2.95Å; R349-R352 PolarHBondContact O-N 2.9Å; R349-R352 VanDerWaalsContact O-N 3.14Å; R349-D353 PolarHBondContact O-N 3.42Å
350	R	37.7	Very low	38.7	Very low	107 Å²	107	78.7 Å²	78.7	40%	0.404	39%	0.389	S	S	.	.	H	α-helix	trans	-53.6	-48.1	172.9	-172.9	-176.9	-177.9	-159.4	3.1	109.5	D137 F346 E347 L354	D137-R350 IonicContact OD1-CZ 3.04Å; D137-R350 IonicContact OD1-NE 3.72Å; D137-R350 PolarHBondContact OD1-NE 2.89Å; D137-R350 IonicContact OD1-NH2 2.89Å; D137-R350 PolarHBondContact OD1-NH2 3.4Å; D137-R350 IonicContact OD2-NH2 3.24Å; D137-R350 PolarHBondContact OD2-NH2 3.3Å; F346-R350 WeakPolarHBondContact O-CB 3.2Å; F346-R350 PolarHBondContact O-N 3.12Å; E347-R350 PolarHBondContact O-N 3.09Å; R350-L354 HydrophobicContact CG-CD1 3.91Å; R350-L354 WeakPolarHBondContact O-CA 3.44Å; R350-L354 WeakPolarHBondContact O-CB 3.29Å; R350-L354 PolarHBondContact O-N 3.41Å
351	S	40.3	Very low	39.2	Very low	54 Å²	54	74.2 Å²	74.2	38%	0.378	37%	0.365	S	S	.	.	H	α-helix	trans	-61	-46.7	177	-126.8	0	0	0	0	111.2	E347 R349 E355	E347-S351 VanDerWaalsContact O-CB 3.3Å; E347-S351 WeakPolarHBondContact O-CB 3.38Å; E347-S351 PolarHBondContact O-N 2.65Å; R349-S351 VanDerWaalsContact C-N 3.27Å; R349-S351 PolarHBondContact O-N 2.95Å; S351-E355 WeakPolarHBondContact CB-OE1 3.34Å; S351-E355 WeakPolarHBondContact O-CA 3.47Å; S351-E355 WeakPolarHBondContact O-CB 3.28Å; S351-E355 VanDerWaalsContact O-CD 3.31Å; S351-E355 WeakPolarHBondContact O-CG 3.45Å; S351-E355 PolarHBondContact O-N 2.91Å; S351-E355 PolarHBondContact OG-OE1 2.95Å
352	R	46.7	Very low	40.1	Very low	136 Å²	136	67.3 Å²	67.3	51%	0.513	34%	0.337	S	S	.	.	H	α-helix	trans	-64.8	-45.1	-179.5	-79	179.8	-67.9	-178	-5.2	114.5	E348 R349 S356	E348-R352 WeakPolarHBondContact O-CB 3.21Å; E348-R352 WeakPolarHBondContact O-CG 3.24Å; E348-R352 PolarHBondContact O-N 3.46Å; E348-R352 PolarHBondContact O-NE 3.35Å; E348-R352 VanDerWaalsContact O-NE 3.16Å; R349-R352 PolarHBondContact O-N 2.9Å; R349-R352 VanDerWaalsContact O-N 3.14Å; R352-S356 VanDerWaalsContact O-CB 3.3Å; R352-S356 WeakPolarHBondContact O-CB 3.26Å; R352-S356 PolarHBondContact O-N 3.21Å; R352-S356 VanDerWaalsContact O-N 3.08Å; R352-S356 PolarHBondContact O-OG 2.79Å
353	D	41.4	Very low	40.6	Very low	63 Å²	63	68.6 Å²	68.6	34%	0.337	34%	0.337	S	S	.	.	H	α-helix	trans	-76.4	-39.3	-178.6	-68.7	-27.3	0	0	0	111.2	R349 F357	R349-D353 PolarHBondContact O-N 3.42Å; D353-F357 WeakPolarHBondContact O-CB 3.24Å; D353-F357 PolarHBondContact O-N 3.39Å
354	L	42.2	Very low	40.9	Very low	15 Å²	15	64.7 Å²	64.7	8%	0.079	31%	0.312	C	S	.	.	H	α-helix	trans	-71.7	-36.1	171.9	-98.5	77.1	0	0	0	112.6	R136 A140 R350 S356 F357 S358	R136-L354 HydrophobicContact CB-CD2 3.96Å; R136-L354 HydrophobicContact CB-CG 4.18Å; A140-L354 HydrophobicContact CB-CD1 3.58Å; R350-L354 HydrophobicContact CG-CD1 3.91Å; R350-L354 WeakPolarHBondContact O-CA 3.44Å; R350-L354 WeakPolarHBondContact O-CB 3.29Å; R350-L354 PolarHBondContact O-N 3.41Å; L354-S356 VanDerWaalsContact C-N 3.35Å; L354-F357 PolarHBondContact O-N 2.93Å; L354-S358 VanDerWaalsContact O-CA 3.31Å; L354-S358 WeakPolarHBondContact O-CA 3.46Å; L354-S358 WeakPolarHBondContact O-CB 3.25Å; L354-S358 PolarHBondContact O-N 3.33Å; L354-S358 PolarHBondContact O-OG 3.16Å
355	E	42.9	Very low	41.6	Very low	105 Å²	105	70.6 Å²	70.6	49%	0.491	33%	0.327	S	S	.	.	H	α-helix	trans	-67	-43.3	178.4	-78.8	164.8	-156.3	0	0	109.3	S351 S358 S359	S351-E355 WeakPolarHBondContact CB-OE1 3.34Å; S351-E355 WeakPolarHBondContact O-CA 3.47Å; S351-E355 WeakPolarHBondContact O-CB 3.28Å; S351-E355 VanDerWaalsContact O-CD 3.31Å; S351-E355 WeakPolarHBondContact O-CG 3.45Å; S351-E355 PolarHBondContact O-N 2.91Å; S351-E355 PolarHBondContact OG-OE1 2.95Å; E355-S358 PolarHBondContact O-N 3.45Å; E355-S358 PolarHBondContact O-OG 2.9Å; E355-S359 WeakPolarHBondContact O-CB 3.49Å; E355-S359 PolarHBondContact O-N 3.34Å; E355-S359 PolarHBondContact O-OG 3.49Å
356	S	44.3	Very low	41.8	Very low	13 Å²	13	69 Å²	69	9%	0.091	32%	0.315	C	S	.	.	H	α-helix	trans	-69.8	-37.5	175.8	-55.8	0	0	0	0	111.8	R352 L354 S359 V360	R352-S356 VanDerWaalsContact O-CB 3.3Å; R352-S356 WeakPolarHBondContact O-CB 3.26Å; R352-S356 PolarHBondContact O-N 3.21Å; R352-S356 VanDerWaalsContact O-N 3.08Å; R352-S356 PolarHBondContact O-OG 2.79Å; L354-S356 VanDerWaalsContact C-N 3.35Å; S356-S359 PolarHBondContact O-OG 3.42Å; S356-V360 WeakPolarHBondContact O-CB 3.48Å; S356-V360 WeakPolarHBondContact O-CG2 3.44Å; S356-V360 PolarHBondContact O-N 3.39Å
357	F	45.2	Very low	42.1	Very low	6 Å²	6	64.5 Å²	64.5	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-74.3	-34.1	174.6	-171	-104.5	0	0	0	112.8	R136 W139 I166 R225 D353 L354 V360 L361	R136-F357 HydrophobicContact CG-CD1 4.41Å; W139-F357 HydrophobicContact CB-CE1 4.16Å; W139-F357 HydrophobicContact CB-CZ 4.25Å; W139-F357 HydrophobicContact CD2-CD2 4.07Å; W139-F357 HydrophobicContact CD2-CE1 4.01Å; W139-F357 AromaticContact CD2-CE2 3.35Å; W139-F357 HydrophobicContact CD2-CE2 3.35Å; W139-F357 AromaticContact CD2-CZ 3.25Å; W139-F357 HydrophobicContact CD2-CZ 3.25Å; W139-F357 AromaticContact CE2-CD2 3.55Å; W139-F357 AromaticContact CE2-CE2 3.13Å; W139-F357 AromaticContact CE2-CZ 3.61Å; W139-F357 HydrophobicContact CE3-CE1 4.41Å; W139-F357 AromaticContact CE3-CE2 3.7Å; W139-F357 HydrophobicContact CE3-CE2 3.7Å; W139-F357 AromaticContact CE3-CZ 3.42Å; W139-F357 HydrophobicContact CE3-CZ 3.42Å; W139-F357 VanDerWaalsContact CE3-CZ 3.42Å; W139-F357 HydrophobicContact CG-CD1 4.29Å; W139-F357 HydrophobicContact CG-CD2 4.35Å; W139-F357 AromaticContact CG-CE1 3.86Å; W139-F357 HydrophobicContact CG-CE1 3.86Å; W139-F357 AromaticContact CG-CE2 3.95Å; W139-F357 HydrophobicContact CG-CE2 3.95Å; W139-F357 HydrophobicContact CG-CG 4.48Å; W139-F357 AromaticContact CG-CZ 3.62Å; W139-F357 HydrophobicContact CG-CZ 3.62Å; W139-F357 AromaticContact CH2-CE2 3.59Å; W139-F357 HydrophobicContact CH2-CE2 3.59Å; W139-F357 HydrophobicContact CH2-CZ 4.16Å; W139-F357 AromaticContact CZ2-CD2 3.83Å; W139-F357 HydrophobicContact CZ2-CD2 3.83Å; W139-F357 AromaticContact CZ2-CE2 3.29Å; W139-F357 HydrophobicContact CZ2-CE2 3.29Å; W139-F357 HydrophobicContact CZ2-CZ 4.08Å; W139-F357 AromaticContact CZ3-CE2 3.78Å; W139-F357 HydrophobicContact CZ3-CE2 3.78Å; W139-F357 AromaticContact CZ3-CZ 3.86Å; W139-F357 HydrophobicContact CZ3-CZ 3.86Å; W139-F357 AromaticContact NE1-CD2 3.53Å; W139-F357 AromaticContact NE1-CE2 3.6Å; W139-F357 AromaticContact NE1-CG 3.99Å; I166-F357 HydrophobicContact CD1-CD2 4.01Å; I166-F357 HydrophobicContact CD1-CE2 4.45Å; R225-F357 VanDerWaalsContact NH2-CZ 3.27Å; D353-F357 WeakPolarHBondContact O-CB 3.24Å; D353-F357 PolarHBondContact O-N 3.39Å; L354-F357 PolarHBondContact O-N 2.93Å; F357-V360 PolarHBondContact O-N 3.38Å; F357-L361 HydrophobicContact CD2-CD1 4.3Å; F357-L361 HydrophobicContact CD2-CG 4.47Å; F357-L361 HydrophobicContact CE1-CB 4.49Å; F357-L361 HydrophobicContact CE1-CD1 4.13Å; F357-L361 HydrophobicContact CE2-CD1 3.39Å; F357-L361 HydrophobicContact CE2-CG 3.99Å; F357-L361 HydrophobicContact CZ-CB 4.44Å; F357-L361 HydrophobicContact CZ-CD1 3.33Å; F357-L361 HydrophobicContact CZ-CG 4.17Å; F357-L361 PolarHBondContact O-N 3.25Å
358	S	47.6	Very low	42.4	Very low	9 Å²	9	60 Å²	60	6%	0.063	28%	0.276	C	S	.	.	H	α-helix	trans	-72.4	-37.5	175.6	87.6	0	0	0	0	110.6	L354 E355 V360 R362	L354-S358 VanDerWaalsContact O-CA 3.31Å; L354-S358 WeakPolarHBondContact O-CA 3.46Å; L354-S358 WeakPolarHBondContact O-CB 3.25Å; L354-S358 PolarHBondContact O-N 3.33Å; L354-S358 PolarHBondContact O-OG 3.16Å; E355-S358 PolarHBondContact O-N 3.45Å; E355-S358 PolarHBondContact O-OG 2.9Å; S358-V360 VanDerWaalsContact C-N 3.31Å; S358-R362 WeakPolarHBondContact O-CA 3.46Å; S358-R362 WeakPolarHBondContact O-CB 3.42Å; S358-R362 VanDerWaalsContact O-CD 3.24Å; S358-R362 WeakPolarHBondContact O-CD 3.19Å; S358-R362 WeakPolarHBondContact O-CG 3.2Å; S358-R362 PolarHBondContact O-N 2.9Å; S358-R362 PolarHBondContact OG-NE 3.48Å
359	S	45.8	Very low	42.4	Very low	40 Å²	40	56.9 Å²	56.9	28%	0.28	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-48.1	171	65	0	0	0	0	108.6	Q182 L185 E355 S356	Q182-S359 PolarHBondContact OE1-O 2.77Å; L185-S359 WeakPolarHBondContact CD1-O 3.3Å; E355-S359 WeakPolarHBondContact O-CB 3.49Å; E355-S359 PolarHBondContact O-N 3.34Å; E355-S359 PolarHBondContact O-OG 3.49Å; S356-S359 PolarHBondContact O-OG 3.42Å
360	V	44.3	Very low	42.3	Very low	3 Å²	3	55.8 Å²	55.8	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-46.3	-176.3	175.1	0	0	0	0	114.4	L163 L181 L185 S356 F357 S358	L163-V360 HydrophobicContact CB-CG1 3.89Å; L163-V360 HydrophobicContact CB-CG2 3.81Å; L163-V360 HydrophobicContact CD1-CG1 3.52Å; L163-V360 HydrophobicContact CD2-CG1 4.45Å; L163-V360 HydrophobicContact CG-CG1 4.12Å; L181-V360 WeakPolarHBondContact CD2-O 3.35Å; L185-V360 HydrophobicContact CD1-CB 4.48Å; L185-V360 WeakPolarHBondContact CD1-O 3.3Å; S356-V360 WeakPolarHBondContact O-CB 3.48Å; S356-V360 WeakPolarHBondContact O-CG2 3.44Å; S356-V360 PolarHBondContact O-N 3.39Å; F357-V360 PolarHBondContact O-N 3.38Å; S358-V360 VanDerWaalsContact C-N 3.31Å
361	L	41.3	Very low	42.3	Very low	19 Å²	19	56.7 Å²	56.7	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-122.6	16.7	-173.9	-62.3	-168.7	0	0	0	114.2	V177 L181 Y220 F357 M363	V177-L361 HydrophobicContact CG1-CD2 4.09Å; L181-L361 HydrophobicContact CD2-CD2 3.37Å; Y220-L361 HydrophobicContact CD1-CD1 4.02Å; Y220-L361 HydrophobicContact CD1-CD2 4.16Å; Y220-L361 WeakPolarHBondContact O-CD1 3.39Å; F357-L361 HydrophobicContact CD2-CD1 4.3Å; F357-L361 HydrophobicContact CD2-CG 4.47Å; F357-L361 HydrophobicContact CE1-CB 4.49Å; F357-L361 HydrophobicContact CE1-CD1 4.13Å; F357-L361 HydrophobicContact CE2-CD1 3.39Å; F357-L361 HydrophobicContact CE2-CG 3.99Å; F357-L361 HydrophobicContact CZ-CB 4.44Å; F357-L361 HydrophobicContact CZ-CD1 3.33Å; F357-L361 HydrophobicContact CZ-CG 4.17Å; F357-L361 PolarHBondContact O-N 3.25Å; L361-M363 PolarHBondContact O-N 3.2Å
362	R	50.5	Low	42.4	Very low	93 Å²	93	56 Å²	56	35%	0.351	26%	0.257	S	S	.	.			trans	-53	111.1	163	-96.5	164.9	-164.7	-149.7	5.8	105.6	Q182 S358 S364 G424	Q182-R362 HydrophobicContact CG-CB 4.05Å; S358-R362 WeakPolarHBondContact O-CA 3.46Å; S358-R362 WeakPolarHBondContact O-CB 3.42Å; S358-R362 VanDerWaalsContact O-CD 3.24Å; S358-R362 WeakPolarHBondContact O-CD 3.19Å; S358-R362 WeakPolarHBondContact O-CG 3.2Å; S358-R362 PolarHBondContact O-N 2.9Å; S358-R362 PolarHBondContact OG-NE 3.48Å; R362-S364 VanDerWaalsContact C-N 3.28Å; R362-S364 PolarHBondContact O-N 2.84Å; R362-G424 PolarHBondContact NH1-O 3.17Å
363	M	40.9	Very low	41.7	Very low	93 Å²	93	57.1 Å²	57.1	46%	0.458	27%	0.266	S	S	.	.			trans	-53.3	107.6	159.5	-72.9	-174.5	62.3	0	0	104.1	A180 L361 R365 E367	A180-M363 HydrophobicContact CB-CG 4.24Å; A180-M363 WeakPolarHBondContact O-CA 3.5Å; L361-M363 PolarHBondContact O-N 3.2Å; M363-R365 PolarHBondContact O-N 3.4Å; M363-E367 WeakPolarHBondContact CE-OE2 3.36Å
364	S	38.9	Very low	41.1	Very low	8 Å²	8	56.3 Å²	56.3	6%	0.056	27%	0.265	C	S	.	.			trans	-66.3	139.1	-170.9	84.5	0	0	0	0	107	A180 R362 N366 E367	A180-S364 PolarHBondContact O-N 3.43Å; R362-S364 VanDerWaalsContact C-N 3.28Å; R362-S364 PolarHBondContact O-N 2.84Å; S364-N366 WeakPolarHBondContact CB-ND2 3.22Å; S364-N366 PolarHBondContact O-N 2.76Å; S364-N366 WeakPolarHBondContact OG-CA 3.2Å; S364-N366 WeakPolarHBondContact OG-CB 3.18Å; S364-N366 PolarHBondContact OG-N 3.44Å; S364-N366 PolarHBondContact OG-ND2 3.43Å; S364-E367 PolarHBondContact O-N 3.06Å
365	R	43.1	Very low	40.5	Very low	149 Å²	149	59.4 Å²	59.4	56%	0.562	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-17.9	164.5	-172.6	176.5	176.4	175.5	0.3	112.3	P123 M363 E367 L368 D369 D423	P123-R365 HydrophobicContact CB-CG 4.28Å; M363-R365 PolarHBondContact O-N 3.4Å; R365-E367 PolarHBondContact O-N 2.92Å; R365-L368 PolarHBondContact O-N 3.4Å; R365-D369 PolarHBondContact O-N 3.2Å; R365-D369 VanDerWaalsContact O-N 3.13Å; R365-D423 IonicContact NH1-OD1 3.3Å
366	N	39	Very low	39.7	Very low	49 Å²	49	62.5 Å²	62.5	26%	0.262	30%	0.3	S	S	.	.	H	α-helix	trans	-64.1	-7.1	170.3	-43.8	-63.1	0	0	0	114.6	P183 S364 Q370	P183-N366 WeakPolarHBondContact CD-ND2 3.37Å; P183-N366 WeakPolarHBondContact CG-ND2 3.48Å; S364-N366 WeakPolarHBondContact CB-ND2 3.22Å; S364-N366 PolarHBondContact O-N 2.76Å; S364-N366 WeakPolarHBondContact OG-CA 3.2Å; S364-N366 WeakPolarHBondContact OG-CB 3.18Å; S364-N366 PolarHBondContact OG-N 3.44Å; S364-N366 PolarHBondContact OG-ND2 3.43Å; N366-Q370 HydrophobicContact CB-CG 4.07Å; N366-Q370 VanDerWaalsContact O-CA 3.28Å; N366-Q370 WeakPolarHBondContact O-CA 3.08Å; N366-Q370 WeakPolarHBondContact O-CB 3.24Å; N366-Q370 WeakPolarHBondContact O-CG 3.3Å; N366-Q370 PolarHBondContact O-N 2.93Å
367	E	41	Very low	38.8	Very low	55 Å²	55	71.9 Å²	71.9	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-68.1	-38.3	164.1	-82	-167.2	166.2	0	0	111.1	A180 M363 S364 R365 R371	A180-E367 WeakPolarHBondContact CB-OE1 3.23Å; M363-E367 WeakPolarHBondContact CE-OE2 3.36Å; S364-E367 PolarHBondContact O-N 3.06Å; R365-E367 PolarHBondContact O-N 2.92Å; E367-R371 WeakPolarHBondContact O-CB 3.46Å; E367-R371 WeakPolarHBondContact O-CD 3.4Å; E367-R371 WeakPolarHBondContact O-CG 3.25Å; E367-R371 PolarHBondContact O-N 2.92Å
368	L	39.2	Very low	37.8	Very low	27 Å²	27	79.8 Å²	79.8	14%	0.141	37%	0.372	C	S	.	.	H	α-helix	trans	-71.9	-51.7	171.8	-156.1	89.9	0	0	0	110	P123 R365 Q370 R371 L372	P123-L368 HydrophobicContact CB-CD2 4.12Å; R365-L368 PolarHBondContact O-N 3.4Å; L368-Q370 VanDerWaalsContact C-N 3.31Å; L368-Q370 PolarHBondContact O-N 2.91Å; L368-R371 CarbonylContact O-C 3.41Å; L368-R371 PolarHBondContact O-N 3.15Å; L368-R371 VanDerWaalsContact O-N 3.1Å; L368-L372 HydrophobicContact CD2-CD1 3.83Å; L368-L372 HydrophobicContact CG-CD1 3.97Å; L368-L372 HydrophobicContact CG-CG 4.28Å; L368-L372 VanDerWaalsContact O-CB 3.28Å; L368-L372 WeakPolarHBondContact O-CB 3.48Å; L368-L372 WeakPolarHBondContact O-CG 3.41Å; L368-L372 PolarHBondContact O-N 3.47Å
369	D	36.8	Very low	36.7	Very low	59 Å²	59	86.6 Å²	86.6	32%	0.316	41%	0.405	S	S	.	.	H	α-helix	trans	-63.6	-32.4	179.9	-93.1	11.1	0	0	0	113.2	R365 K373	R365-D369 PolarHBondContact O-N 3.2Å; R365-D369 VanDerWaalsContact O-N 3.13Å; D369-K373 WeakPolarHBondContact O-CB 3.49Å; D369-K373 WeakPolarHBondContact O-CG 3.27Å; D369-K373 PolarHBondContact O-N 3.42Å
370	Q	40.3	Very low	35.6	Very low	68 Å²	68	93.6 Å²	93.6	32%	0.318	43%	0.433	S	S	.	.	H	α-helix	trans	-75.4	-38.9	171.4	-68	165.4	11.6	0	0	110.8	N366 L368 L372 K373 S374	N366-Q370 HydrophobicContact CB-CG 4.07Å; N366-Q370 VanDerWaalsContact O-CA 3.28Å; N366-Q370 WeakPolarHBondContact O-CA 3.08Å; N366-Q370 WeakPolarHBondContact O-CB 3.24Å; N366-Q370 WeakPolarHBondContact O-CG 3.3Å; N366-Q370 PolarHBondContact O-N 2.93Å; L368-Q370 VanDerWaalsContact C-N 3.31Å; L368-Q370 PolarHBondContact O-N 2.91Å; Q370-L372 PolarHBondContact O-N 3.39Å; Q370-K373 CarbonylContact O-C 3.6Å; Q370-K373 PolarHBondContact O-N 3.07Å; Q370-K373 VanDerWaalsContact O-N 3.14Å; Q370-S374 WeakPolarHBondContact O-CA 3.46Å; Q370-S374 WeakPolarHBondContact O-CB 3.38Å; Q370-S374 PolarHBondContact O-N 3.01Å; Q370-S374 PolarHBondContact O-OG 3.26Å
371	R	37.8	Very low	34.6	Very low	127 Å²	127	99.5 Å²	99.5	48%	0.479	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-30.3	171.5	-76.7	171	177	-175.5	0.8	112.8	Y67 E367 L368	Y67-R371 PolarHBondContact OH-O 2.93Å; E367-R371 WeakPolarHBondContact O-CB 3.46Å; E367-R371 WeakPolarHBondContact O-CD 3.4Å; E367-R371 WeakPolarHBondContact O-CG 3.25Å; E367-R371 PolarHBondContact O-N 2.92Å; L368-R371 CarbonylContact O-C 3.41Å; L368-R371 PolarHBondContact O-N 3.15Å; L368-R371 VanDerWaalsContact O-N 3.1Å
372	L	41	Very low	33.8	Very low	38 Å²	38	104.5 Å²	104.5	20%	0.199	50%	0.503	C	S	.	.	H	α-helix	trans	-76.7	-28.3	174.1	-67.5	170.1	0	0	0	111.9	M58 Y67 L368 Q370	M58-L372 HydrophobicContact SD-CD2 4.19Å; Y67-L372 HydrophobicContact CD1-CD2 3.58Å; Y67-L372 HydrophobicContact CD2-CB 4.33Å; Y67-L372 HydrophobicContact CD2-CD2 3.3Å; Y67-L372 HydrophobicContact CD2-CG 4.41Å; Y67-L372 HydrophobicContact CE1-CD2 4.09Å; Y67-L372 HydrophobicContact CE2-CB 4.21Å; Y67-L372 HydrophobicContact CE2-CD2 3.88Å; Y67-L372 WeakPolarHBondContact CE2-O 3.35Å; Y67-L372 HydrophobicContact CG-CD2 3.12Å; Y67-L372 PolarHBondContact OH-O 3.45Å; L368-L372 HydrophobicContact CD2-CD1 3.83Å; L368-L372 HydrophobicContact CG-CD1 3.97Å; L368-L372 HydrophobicContact CG-CG 4.28Å; L368-L372 VanDerWaalsContact O-CB 3.28Å; L368-L372 WeakPolarHBondContact O-CB 3.48Å; L368-L372 WeakPolarHBondContact O-CG 3.41Å; L368-L372 PolarHBondContact O-N 3.47Å; Q370-L372 PolarHBondContact O-N 3.39Å
373	K	33.2	Very low	32.6	Very low	160 Å²	160	105.2 Å²	105.2	70%	0.696	52%	0.523	S	S	*	.	H	α-helix	trans	-107.4	-15.8	-175.4	-68.3	175.1	-175.3	173.6	0	115.4	D369 Q370 P375	D369-K373 WeakPolarHBondContact O-CB 3.49Å; D369-K373 WeakPolarHBondContact O-CG 3.27Å; D369-K373 PolarHBondContact O-N 3.42Å; Q370-K373 CarbonylContact O-C 3.6Å; Q370-K373 PolarHBondContact O-N 3.07Å; Q370-K373 VanDerWaalsContact O-N 3.14Å; K373-P375 VanDerWaalsContact O-CD 3.32Å; K373-P375 WeakPolarHBondContact O-CD 3.39Å
374	S	27.3	Very low	31.9	Very low	47 Å²	47	106.3 Å²	106.3	33%	0.329	54%	0.54	S	S	.	.			trans	-89.4	114.1	-178.8	65.2	0	0	0	0	110.3	Q370 Q376	Q370-S374 WeakPolarHBondContact O-CA 3.46Å; Q370-S374 WeakPolarHBondContact O-CB 3.38Å; Q370-S374 PolarHBondContact O-N 3.01Å; Q370-S374 PolarHBondContact O-OG 3.26Å; S374-Q376 VanDerWaalsContact C-N 3.26Å; S374-Q376 PolarHBondContact O-N 2.98Å
375	P	31	Very low	31.2	Very low	80 Å²	80	111.1 Å²	111.1	52%	0.519	58%	0.579	S	S	.	*			trans	-77.6	84.2	162.9	26.5	-16.1	0	0	0	106.9	K373	K373-P375 VanDerWaalsContact O-CD 3.32Å; K373-P375 WeakPolarHBondContact O-CD 3.39Å
376	Q	25.2	Very low	30.4	Very low	169 Å²	169	107.3 Å²	107.3	79%	0.79	59%	0.586	S	S	*	*			trans	-83.4	127	164.8	-71.5	-153.6	-49.5	0	0	107.5	S374	S374-Q376 VanDerWaalsContact C-N 3.26Å; S374-Q376 PolarHBondContact O-N 2.98Å
377	Y	26	Very low	29.6	Very low	211 Å²	211	111 Å²	111	83%	0.827	62%	0.616	S	S	*	*			trans	82	63.5	-167.8	-87.9	-95.2	0	0	0	115.5
378	E	23.4	Very low	28.7	Very low	171 Å²	171	114.1 Å²	114.1	80%	0.799	64%	0.639	S	S	*	*			trans	-75.9	104.5	133.9	-83.6	177.1	179.7	0	0	105.9	E380	E378-E380 PolarHBondContact O-N 2.85Å
379	M	24.1	Very low	28	Very low	153 Å²	153	121.6 Å²	121.6	75%	0.754	67%	0.673	S	S	*	*			trans	-62.1	116.3	167.2	-143.1	-177.5	-59.8	0	0	105.8	T381	M379-T381 PolarHBondContact O-N 3.11Å
380	E	23.3	Very low	27.3	Very low	186 Å²	186	130 Å²	130	87%	0.869	70%	0.702	S	S	*	*			trans	-52.8	107	173.3	-68.1	180	168.4	0	0	107.9	E378 P382	E378-E380 PolarHBondContact O-N 2.85Å; E380-P382 VanDerWaalsContact O-CD 3.22Å; E380-P382 WeakPolarHBondContact O-CD 3.48Å
381	T	22.9	Very low	26.5	Very low	128 Å²	128	132.4 Å²	132.4	79%	0.785	72%	0.722	S	S	*	*			trans	-71.9	115.7	173	47.8	0	0	0	0	107.8	M379 S383	M379-T381 PolarHBondContact O-N 3.11Å; T381-S383 PolarHBondContact O-N 3.37Å
382	P	25.6	Very low	25.8	Very low	123 Å²	123	133.8 Å²	133.8	80%	0.799	74%	0.738	S	S	*	*			trans	-67.6	125.8	163.4	-8.5	26.3	0	0	0	107.1	E380	E380-P382 VanDerWaalsContact O-CD 3.22Å; E380-P382 WeakPolarHBondContact O-CD 3.48Å
383	S	23.9	Very low	24.9	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	77%	0.769	S	S	*	*			trans	-49.3	138.9	169.9	50.5	0	0	0	0	112.5	T381	T381-S383 PolarHBondContact O-N 3.37Å
384	S	26.2	Very low	24.5	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	78%	0.776	S	S	*	*			trans	95.7	128.2	154.2	84.4	0	0	0	0	119.4
385	A	26.1	Very low	24.4	Very low	108 Å²	108	148.4 Å²	148.4	89%	0.893	80%	0.8	S	S	*	*			trans	82.1	113	155.2	0	0	0	0	0	119
386	G	25.3	Very low	24.2	Very low	69 Å²	69	152.6 Å²	152.6	71%	0.711	81%	0.813	S	S	*	*			trans	122.1	92.8	152.4	0	0	0	0	0	114.5	T388	G386-T388 PolarHBondContact O-N 3.41Å; G386-T388 VanDerWaalsContact O-N 3.15Å
387	S	22.1	Very low	24.7	Very low	127 Å²	127	147.8 Å²	147.8	89%	0.888	79%	0.792	S	S	*	*			trans	-54.9	111.6	160	48.1	0	0	0	0	110
388	T	23.3	Very low	25.2	Very low	120 Å²	120	144.2 Å²	144.2	74%	0.736	79%	0.787	S	S	*	*			trans	-136.7	120.1	160.7	-34.5	0	0	0	0	107	G386 Y390	G386-T388 PolarHBondContact O-N 3.41Å; G386-T388 VanDerWaalsContact O-N 3.15Å; T388-Y390 PolarHBondContact O-N 2.93Å; T388-Y390 VanDerWaalsContact O-N 3.13Å
389	E	22.9	Very low	26	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	76%	0.757	S	S	*	*			trans	-50.2	115.4	178.2	-70.5	171.2	145.1	0	0	109.7	V391	E389-V391 VanDerWaalsContact C-N 3.3Å; E389-V391 PolarHBondContact O-N 3.45Å
390	Y	22.7	Very low	26.6	Very low	236 Å²	236	132.9 Å²	132.9	93%	0.925	74%	0.741	S	S	*	*			trans	-70.2	93.5	168.3	-95.4	-95.7	0	0	0	107.7	T388 D392	T388-Y390 PolarHBondContact O-N 2.93Å; T388-Y390 VanDerWaalsContact O-N 3.13Å; Y390-D392 PolarHBondContact O-N 3.35Å
391	V	23.8	Very low	27.5	Very low	119 Å²	119	131.7 Å²	131.7	72%	0.721	74%	0.736	S	S	*	*			trans	-60.6	128.9	163.7	175.9	0	0	0	0	107.9	E389 K393	E389-V391 VanDerWaalsContact C-N 3.3Å; E389-V391 PolarHBondContact O-N 3.45Å; V391-K393 PolarHBondContact O-N 3.44Å
392	D	22.7	Very low	28.4	Very low	156 Å²	156	127.4 Å²	127.4	83%	0.834	71%	0.708	S	S	*	*			trans	-45	97.5	173.8	-72.5	-49.4	0	0	0	110.6	Y390 E394	Y390-D392 PolarHBondContact O-N 3.35Å; D392-E394 PolarHBondContact O-N 3.03Å
393	K	22.3	Very low	28.9	Very low	195 Å²	195	125 Å²	125	85%	0.848	69%	0.693	S	S	*	*			trans	-79.4	101.2	161.2	-77.7	-174.4	176.7	179.3	0	105.9	V391 E395	V391-K393 PolarHBondContact O-N 3.44Å; K393-E395 VanDerWaalsContact C-N 3.33Å; K393-E395 PolarHBondContact O-N 2.92Å
394	E	24.6	Very low	29.2	Very low	180 Å²	180	128.9 Å²	128.9	84%	0.841	70%	0.696	S	S	*	*			trans	-51.6	101.2	162	-65.3	-174.3	164.5	0	0	107.5	D392 E396	D392-E394 PolarHBondContact O-N 3.03Å; E394-E396 PolarHBondContact O-N 2.93Å; E394-E396 VanDerWaalsContact O-N 3.15Å
395	E	25.4	Very low	29.3	Very low	176 Å²	176	127.8 Å²	127.8	82%	0.822	69%	0.694	S	S	*	*			trans	-57.6	121.4	168.5	-80.6	-175.9	156.4	0	0	107.2	K393 D397	K393-E395 VanDerWaalsContact C-N 3.33Å; K393-E395 PolarHBondContact O-N 2.92Å; E395-D397 VanDerWaalsContact C-N 3.34Å; E395-D397 PolarHBondContact O-N 3.36Å
396	E	27.3	Very low	29.2	Very low	169 Å²	169	127.7 Å²	127.7	79%	0.79	69%	0.687	S	S	*	*			trans	-55.4	97.5	174.7	-76.2	-179.8	149.6	0	0	109.2	E394 N398	E394-E396 PolarHBondContact O-N 2.93Å; E394-E396 VanDerWaalsContact O-N 3.15Å; E396-N398 PolarHBondContact O-N 3.43Å
397	D	35.2	Very low	29.2	Very low	68 Å²	68	128.3 Å²	128.3	36%	0.364	69%	0.693	S	S	.	*			trans	-55.6	92.1	163.6	-95.1	-24.7	0	0	0	108	R44 E395 E399	R44-D397 IonicContact CZ-OD1 2.73Å; R44-D397 IonicContact NE-OD1 3.41Å; R44-D397 PolarHBondContact NE-OD1 3.39Å; R44-D397 IonicContact NH1-OD1 2.67Å; R44-D397 IonicContact NH2-OD1 2.72Å; R44-D397 PolarHBondContact NH2-OD1 3.33Å; R44-D397 IonicContact NH2-OD2 3.47Å; R44-D397 PolarHBondContact NH2-OD2 2.85Å; R44-D397 VanDerWaalsContact NH2-OD2 3.1Å; E395-D397 VanDerWaalsContact C-N 3.34Å; E395-D397 PolarHBondContact O-N 3.36Å; D397-E399 VanDerWaalsContact C-N 3.3Å; D397-E399 PolarHBondContact O-N 3.2Å
398	N	35.9	Very low	29.3	Very low	135 Å²	135	129.1 Å²	129.1	72%	0.722	69%	0.687	S	S	*	*			trans	-61.7	95.5	166.4	-81.4	-47	0	0	0	107.4	E396 A400	E396-N398 PolarHBondContact O-N 3.43Å; N398-A400 VanDerWaalsContact C-N 3.25Å; N398-A400 PolarHBondContact O-N 2.88Å
399	E	40.8	Very low	29.3	Very low	34 Å²	34	134 Å²	134	16%	0.159	70%	0.699	C	S	.	*			trans	-65.1	89.3	169.8	-74.9	-170.2	162.9	0	0	108.3	K108 I114 D397 E401	K108-E399 PolarHBondContact NZ-O 2.84Å; I114-E399 WeakPolarHBondContact CD1-OE1 3.41Å; D397-E399 VanDerWaalsContact C-N 3.3Å; D397-E399 PolarHBondContact O-N 3.2Å; E399-E401 PolarHBondContact O-N 3.32Å
400	A	37.3	Very low	29.4	Very low	52 Å²	52	128.2 Å²	128.2	43%	0.43	68%	0.678	S	S	.	*			trans	-45.7	135.4	164.2	0	0	0	0	0	108.7	I55 N398 L402	I55-A400 HydrophobicContact CD1-CB 3.96Å; N398-A400 VanDerWaalsContact C-N 3.25Å; N398-A400 PolarHBondContact O-N 2.88Å; A400-L402 PolarHBondContact O-N 3.24Å
401	E	40.6	Very low	29.6	Very low	162 Å²	162	121.6 Å²	121.6	76%	0.757	67%	0.667	S	S	*	*			trans	-58.5	104.2	-173.7	-152.3	177.3	-176.4	0	0	110.1	E399	E399-E401 PolarHBondContact O-N 3.32Å
402	L	43.3	Very low	29.8	Very low	38 Å²	38	119.9 Å²	119.9	20%	0.199	66%	0.66	C	S	.	*	P	Polyproline II helix	trans	-63.7	129.8	175.3	-76	161.2	0	0	0	108.3	I55 V72 I74 A400 K404	I55-L402 HydrophobicContact CD1-CD2 4.36Å; I55-L402 HydrophobicContact CG1-CD2 4.27Å; V72-L402 HydrophobicContact CG1-CD1 4.47Å; I74-L402 HydrophobicContact CD1-CB 4.4Å; I74-L402 HydrophobicContact CD1-CD1 4.36Å; I74-L402 HydrophobicContact CG1-CD1 4.04Å; A400-L402 PolarHBondContact O-N 3.24Å; L402-K404 PolarHBondContact O-N 2.82Å
403	P	34.7	Very low	30.1	Very low	73 Å²	73	116.5 Å²	116.5	47%	0.474	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-59	127.4	-179.2	9.4	-15.2	0	0	0	110.8	A405	P403-A405 PolarHBondContact O-N 3.48Å
404	K	31	Very low	30.6	Very low	189 Å²	189	111.5 Å²	111.5	82%	0.822	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-65.2	121.8	173.1	-67.3	177.4	-177.5	172	0	108.1	L402 S406	L402-K404 PolarHBondContact O-N 2.82Å; K404-S406 PolarHBondContact O-N 2.83Å
405	A	28	Very low	30.9	Very low	94 Å²	94	108.8 Å²	108.8	78%	0.777	61%	0.606	S	S	*	*			trans	-60.1	100.7	175.5	0	0	0	0	0	109.6	P403 G407	P403-A405 PolarHBondContact O-N 3.48Å; A405-G407 PolarHBondContact O-N 3.39Å
406	S	24.9	Very low	31.8	Very low	106 Å²	106	105.4 Å²	105.4	74%	0.741	60%	0.601	S	S	*	*			trans	-69.9	126.5	169.2	60.3	0	0	0	0	107.9	K404 N408	K404-S406 PolarHBondContact O-N 2.83Å; S406-N408 VanDerWaalsContact C-N 3.29Å; S406-N408 PolarHBondContact O-N 3.41Å
407	G	23.5	Very low	33.2	Very low	82 Å²	82	98 Å²	98	85%	0.845	57%	0.566	S	S	*	*			trans	-66.3	81.6	-174.5	0	0	0	0	0	112.5	A405	A405-G407 PolarHBondContact O-N 3.39Å
408	N	24.1	Very low	34.3	Very low	144 Å²	144	99 Å²	99	77%	0.77	57%	0.572	S	S	*	*			trans	-109.2	127.6	151.8	-90.1	-23.7	0	0	0	107.4	S406 S410	S406-N408 VanDerWaalsContact C-N 3.29Å; S406-N408 PolarHBondContact O-N 3.41Å; N408-S410 PolarHBondContact O-N 2.85Å
409	K	24.7	Very low	35.5	Very low	223 Å²	223	94.5 Å²	94.5	97%	0.97	55%	0.545	S	S	*	.			trans	-62.6	68.8	173.2	-68.8	178.1	177	177.3	0	109.9	S411	K409-S411 PolarHBondContact O-N 3Å
410	S	25.6	Very low	36.2	Very low	61 Å²	61	95.8 Å²	95.8	43%	0.427	56%	0.556	S	S	.	*			trans	-80.5	113.4	165.9	-177.5	0	0	0	0	105.7	N408 S412 Q413	N408-S410 PolarHBondContact O-N 2.85Å; S410-S412 PolarHBondContact O-N 3.46Å; S410-Q413 PolarHBondContact OG-NE2 3.21Å
411	S	26.5	Very low	36.4	Very low	98 Å²	98	95.7 Å²	95.7	69%	0.685	55%	0.551	S	S	*	*			trans	-37.6	125	170.5	54.3	0	0	0	0	109.4	K409 Q413	K409-S411 PolarHBondContact O-N 3Å; S411-Q413 WeakPolarHBondContact O-CA 3.32Å; S411-Q413 WeakPolarHBondContact O-CG 3.47Å; S411-Q413 PolarHBondContact O-N 2.98Å
412	S	27	Very low	36.4	Very low	83 Å²	83	94.7 Å²	94.7	58%	0.58	54%	0.544	S	S	*	.			trans	-37.3	100.2	176.8	-69.7	0	0	0	0	110.2	S410 F414	S410-S412 PolarHBondContact O-N 3.46Å; S412-F414 WeakPolarHBondContact O-CD2 3.2Å; S412-F414 PolarHBondContact O-N 2.95Å
413	Q	29.4	Very low	35.8	Very low	85 Å²	85	97 Å²	97	40%	0.397	56%	0.557	S	S	.	*			trans	-73.6	101.4	-171.8	-80.3	-177.4	-0.9	0	0	107.5	Y53 S410 S411 M415	Y53-Q413 HydrophobicContact CE2-CB 4.11Å; Y53-Q413 WeakPolarHBondContact OH-CB 3.44Å; Y53-Q413 VanDerWaalsContact OH-CG 3.22Å; Y53-Q413 WeakPolarHBondContact OH-CG 3.39Å; Y53-Q413 PolarHBondContact OH-OE1 3.24Å; S410-Q413 PolarHBondContact OG-NE2 3.21Å; S411-Q413 WeakPolarHBondContact O-CA 3.32Å; S411-Q413 WeakPolarHBondContact O-CG 3.47Å; S411-Q413 PolarHBondContact O-N 2.98Å; Q413-M415 HydrophobicContact CB-CB 4.21Å; Q413-M415 PolarHBondContact O-N 3.17Å
414	F	32.8	Very low	35.9	Very low	90 Å²	90	95.8 Å²	95.8	40%	0.395	56%	0.557	S	S	.	*			trans	-68.6	23.6	164.9	-70.5	-76.6	0	0	0	112.5	L86 S412 C416 I417	L86-F414 HydrophobicContact CD1-CD1 4.14Å; L86-F414 HydrophobicContact CD1-CE1 3.39Å; L86-F414 HydrophobicContact CD1-CZ 4.15Å; S412-F414 WeakPolarHBondContact O-CD2 3.2Å; S412-F414 PolarHBondContact O-N 2.95Å; F414-C416 PolarHBondContact O-N 3.38Å; F414-I417 HydrophobicContact CD1-CD1 4.31Å
415	M	31.3	Very low	35.9	Very low	123 Å²	123	92.8 Å²	92.8	61%	0.606	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-0.8	-154.9	-128.4	-145.4	-56.6	0	0	116.2	Q413	Q413-M415 HydrophobicContact CB-CB 4.21Å; Q413-M415 PolarHBondContact O-N 3.17Å
416	C	44.7	Very low	36.2	Very low	105 Å²	105	90.5 Å²	90.5	71%	0.709	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	11.4	-176.8	-60.1	0	0	0	0	115.2	I96 F414	I96-C416 WeakPolarHBondContact CD1-O 2.93Å; F414-C416 PolarHBondContact O-N 3.38Å
417	I	55.8	Low	36.6	Very low	12 Å²	12	94.2 Å²	94.2	6%	0.062	53%	0.532	C	S	.	.	S	Bend	trans	-77.7	-31.3	-178.5	-60.9	-179.3	0	0	0	111.5	L87 I95 I96 F414 K419	L87-I417 HydrophobicContact CD2-CD1 4.34Å; L87-I417 HydrophobicContact CD2-CG1 4.28Å; L87-I417 HydrophobicContact CD2-CG2 3.86Å; I95-I417 CarbonylContact C-O 3.6Å; I95-I417 VanDerWaalsContact CA-O 3.27Å; I95-I417 WeakPolarHBondContact CA-O 3.2Å; I95-I417 HydrophobicContact CB-CG2 4.22Å; I95-I417 HydrophobicContact CG1-CG2 4.14Å; I95-I417 HydrophobicContact CG2-CG2 3.43Å; I95-I417 VanDerWaalsContact CG2-CG2 3.43Å; I96-I417 PolarHBondContact N-O 2.68Å; F414-I417 HydrophobicContact CD1-CD1 4.31Å; I417-K419 PolarHBondContact O-N 3.05Å
418	L	58.7	Low	37	Very low	91 Å²	91	93.3 Å²	93.3	48%	0.476	51%	0.511	S	S	.	.	B	Isolated β-bridge	trans	-80.9	121.4	-174.9	-64	174.9	0	0	0	111.5	N94 I95 A442 L446	N94-L418 CarbonylContact O-C 3.19Å; N94-L418 WeakPolarHBondContact O-CA 3.39Å; I95-L418 HydrophobicContact CG1-CD2 4.18Å; L418-A442 HydrophobicContact CD2-CB 4.36Å; L418-L446 HydrophobicContact CD2-CD1 4.05Å
419	K	62	Low	37.6	Very low	39 Å²	39	90.8 Å²	90.8	17%	0.17	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-68.8	132.7	162.7	-51.1	-171.1	-157.9	172.7	0	107.8	P93 N94 I95 I96 E120 M122 I417 P421	P93-K419 WeakPolarHBondContact O-CD 3.26Å; P93-K419 WeakPolarHBondContact O-CE 3.31Å; P93-K419 PolarHBondContact O-NZ 3.42Å; P93-K419 VanDerWaalsContact O-NZ 3.11Å; N94-K419 PolarHBondContact O-N 2.75Å; I95-K419 VanDerWaalsContact C-CE 3.48Å; I95-K419 WeakPolarHBondContact O-CE 3.38Å; I96-K419 HydrophobicContact CG1-CG 4.14Å; E120-K419 WeakPolarHBondContact OE1-CE 3.41Å; E120-K419 IonicContact OE1-NZ 3.8Å; E120-K419 PolarHBondContact OE1-NZ 2.95Å; E120-K419 WeakPolarHBondContact OE2-CE 3.37Å; E120-K419 IonicContact OE2-NZ 2.68Å; E120-K419 PolarHBondContact OE2-NZ 3.4Å; M122-K419 HydrophobicContact CE-CB 4.17Å; M122-K419 HydrophobicContact CE-CD 4.24Å; M122-K419 HydrophobicContact CE-CG 4.12Å; M122-K419 HydrophobicContact SD-CD 4.05Å; M122-K419 HydrophobicContact SD-CG 4.16Å; I417-K419 PolarHBondContact O-N 3.05Å; K419-P421 WeakPolarHBondContact O-CD 3.4Å
420	T	53.5	Low	38.3	Very low	62 Å²	62	83.9 Å²	83.9	38%	0.38	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-80.8	122.8	162.5	59.5	0	0	0	0	107.1	F422	T420-F422 PolarHBondContact O-N 3.02Å
421	P	41.7	Very low	39	Very low	50 Å²	50	83.7 Å²	83.7	33%	0.325	48%	0.478	S	S	.	.			trans	-76.8	79.1	173.5	31.3	-32.8	0	0	0	108.2	K419 L435	K419-P421 WeakPolarHBondContact O-CD 3.4Å; P421-L435 HydrophobicContact CB-CB 4.38Å; P421-L435 HydrophobicContact CB-CD1 3.71Å; P421-L435 HydrophobicContact CB-CD2 3.28Å; P421-L435 HydrophobicContact CB-CG 3.93Å; P421-L435 HydrophobicContact CG-CB 3.99Å; P421-L435 HydrophobicContact CG-CD1 3.98Å; P421-L435 HydrophobicContact CG-CD2 3.78Å; P421-L435 HydrophobicContact CG-CG 4.1Å
422	F	42.4	Very low	39.7	Very low	140 Å²	140	84 Å²	84	61%	0.614	47%	0.471	S	S	*	.			trans	-109.9	80.8	162.6	-78.5	-76.7	0	0	0	107.2	L129 T420 G424	L129-F422 HydrophobicContact CD2-CB 4.48Å; L129-F422 HydrophobicContact CD2-CD2 4.11Å; L129-F422 HydrophobicContact CD2-CG 4.23Å; T420-F422 PolarHBondContact O-N 3.02Å; F422-G424 PolarHBondContact O-N 3.21Å
423	D	30.1	Very low	40.7	Very low	88 Å²	88	84 Å²	84	47%	0.471	47%	0.465	S	S	.	.			trans	-74.3	112	155.2	-149.4	3.6	0	0	0	105.5	R365 N425 T426	R365-D423 IonicContact NH1-OD1 3.3Å; D423-N425 PolarHBondContact O-N 3.38Å; D423-T426 HydrophobicContact CB-CG2 4.28Å; D423-T426 PolarHBondContact O-N 3.47Å; D423-T426 PolarHBondContact O-OG1 2.98Å
424	G	35.5	Very low	41.6	Very low	47 Å²	47	86 Å²	86	49%	0.485	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	12.5	-176.1	0	0	0	0	0	115.2	R362 F422	R362-G424 PolarHBondContact NH1-O 3.17Å; F422-G424 PolarHBondContact O-N 3.21Å
425	N	31.8	Very low	42.1	Very low	126 Å²	126	83.6 Å²	83.6	67%	0.674	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	3.4	176.6	-73.9	-6.8	0	0	0	113.4	D423 E427	D423-N425 PolarHBondContact O-N 3.38Å; N425-E427 PolarHBondContact O-N 3.13Å
426	T	34.2	Very low	43	Very low	46 Å²	46	84.7 Å²	84.7	28%	0.282	46%	0.461	S	S	.	.			trans	-74.6	78.2	174.1	58.1	0	0	0	0	110.5	D423 T428 D431 L435	D423-T426 HydrophobicContact CB-CG2 4.28Å; D423-T426 PolarHBondContact O-N 3.47Å; D423-T426 PolarHBondContact O-OG1 2.98Å; T426-T428 PolarHBondContact O-N 3.14Å; T426-D431 HydrophobicContact CG2-CB 3.7Å; T426-L435 HydrophobicContact CG2-CD1 4.42Å
427	E	33.2	Very low	43.4	Very low	183 Å²	183	86.8 Å²	86.8	86%	0.855	46%	0.457	S	S	*	.			trans	-79.8	1.6	170.2	-73.6	-174.1	170.8	0	0	112.5	N425	N425-E427 PolarHBondContact O-N 3.13Å
428	T	32.5	Very low	43.3	Very low	64 Å²	64	88.5 Å²	88.5	39%	0.393	47%	0.465	S	S	.	.	S	Bend	trans	-114.5	136.1	-176.2	87	0	0	0	0	114.2	T426 S430 D431	T426-T428 PolarHBondContact O-N 3.14Å; T428-S430 PolarHBondContact O-N 3.41Å; T428-S430 VanDerWaalsContact O-N 3.1Å; T428-S430 PolarHBondContact OG1-OG 3.06Å; T428-D431 PolarHBondContact O-N 3.41Å; T428-D431 VanDerWaalsContact O-N 3.15Å; T428-D431 PolarHBondContact OG1-N 3.18Å; T428-D431 PolarHBondContact OG1-OD2 3.1Å
429	S	36.2	Very low	43	Very low	91 Å²	91	85.3 Å²	85.3	64%	0.636	46%	0.455	S	S	*	.	H	α-helix	trans	-54.4	-25	170.5	-177.5	0	0	0	0	112.9	N433	S429-N433 PolarHBondContact O-N 2.74Å; S429-N433 PolarHBondContact O-ND2 2.98Å
430	S	39.4	Very low	42.7	Very low	78 Å²	78	86.3 Å²	86.3	55%	0.545	46%	0.464	S	S	.	.	H	α-helix	trans	-68.1	-39.6	178.8	80.6	0	0	0	0	112.7	T428 N433 K434	T428-S430 PolarHBondContact O-N 3.41Å; T428-S430 VanDerWaalsContact O-N 3.1Å; T428-S430 PolarHBondContact OG1-OG 3.06Å; S430-N433 PolarHBondContact O-N 3.09Å; S430-K434 PolarHBondContact O-N 3.28Å; S430-K434 VanDerWaalsContact O-N 3.14Å
431	D	40.1	Very low	42.7	Very low	57 Å²	57	89.3 Å²	89.3	31%	0.305	47%	0.472	S	S	.	.	H	α-helix	trans	-69.8	-40.3	-179.8	-62.7	-48	0	0	0	111	T426 T428 N433 K434 L435	T426-D431 HydrophobicContact CG2-CB 3.7Å; T428-D431 PolarHBondContact O-N 3.41Å; T428-D431 VanDerWaalsContact O-N 3.15Å; T428-D431 PolarHBondContact OG1-N 3.18Å; T428-D431 PolarHBondContact OG1-OD2 3.1Å; D431-N433 VanDerWaalsContact C-N 3.29Å; D431-N433 PolarHBondContact O-N 3.11Å; D431-K434 PolarHBondContact O-N 2.91Å; D431-K434 VanDerWaalsContact O-N 3.17Å; D431-L435 WeakPolarHBondContact O-CB 3.48Å; D431-L435 WeakPolarHBondContact O-CG 3.3Å; D431-L435 PolarHBondContact O-N 3.43Å
432	I	42.6	Very low	43.1	Very low	103 Å²	103	87 Å²	87	53%	0.528	46%	0.457	S	S	.	.	H	α-helix	trans	-58.2	-42.5	176.9	-62.9	175.5	0	0	0	111.2	L435 R436	I432-L435 PolarHBondContact O-N 2.88Å; I432-R436 WeakPolarHBondContact O-CB 3.41Å; I432-R436 PolarHBondContact O-N 2.88Å
433	N	46.2	Very low	43.7	Very low	85 Å²	85	85.1 Å²	85.1	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-69.4	-38.5	178.5	-78.1	-37.1	0	0	0	112.4	S429 S430 D431 R436 K437	S429-N433 PolarHBondContact O-N 2.74Å; S429-N433 PolarHBondContact O-ND2 2.98Å; S430-N433 PolarHBondContact O-N 3.09Å; D431-N433 VanDerWaalsContact C-N 3.29Å; D431-N433 PolarHBondContact O-N 3.11Å; N433-R436 PolarHBondContact O-N 2.89Å; N433-K437 WeakPolarHBondContact O-CG 3.24Å; N433-K437 PolarHBondContact O-N 3.11Å; N433-K437 VanDerWaalsContact O-N 3.1Å
434	K	48.1	Very low	44.8	Very low	127 Å²	127	86.9 Å²	86.9	55%	0.552	46%	0.455	S	S	*	.	H	α-helix	trans	-62	-47.4	173.7	-173.3	-178.6	174.6	-172.1	0	110.8	S430 D431 R436 K437 E438	S430-K434 PolarHBondContact O-N 3.28Å; S430-K434 VanDerWaalsContact O-N 3.14Å; D431-K434 PolarHBondContact O-N 2.91Å; D431-K434 VanDerWaalsContact O-N 3.17Å; K434-R436 VanDerWaalsContact C-N 3.33Å; K434-R436 PolarHBondContact O-N 3.29Å; K434-K437 WeakPolarHBondContact O-CB 3.49Å; K434-K437 PolarHBondContact O-N 3.42Å; K434-K437 VanDerWaalsContact O-N 3.17Å; K434-E438 VanDerWaalsContact CE-OE1 3.27Å; K434-E438 WeakPolarHBondContact CE-OE1 3.47Å; K434-E438 WeakPolarHBondContact O-CG 3.41Å; K434-E438 PolarHBondContact O-N 2.94Å
435	L	45	Very low	45.7	Very low	39 Å²	39	87.9 Å²	87.9	20%	0.204	45%	0.447	C	S	.	.	H	α-helix	trans	-61.8	-38.3	176.8	-68.7	174.5	0	0	0	112.5	P421 T426 D431 I432 E438 G439	P421-L435 HydrophobicContact CB-CB 4.38Å; P421-L435 HydrophobicContact CB-CD1 3.71Å; P421-L435 HydrophobicContact CB-CD2 3.28Å; P421-L435 HydrophobicContact CB-CG 3.93Å; P421-L435 HydrophobicContact CG-CB 3.99Å; P421-L435 HydrophobicContact CG-CD1 3.98Å; P421-L435 HydrophobicContact CG-CD2 3.78Å; P421-L435 HydrophobicContact CG-CG 4.1Å; T426-L435 HydrophobicContact CG2-CD1 4.42Å; D431-L435 WeakPolarHBondContact O-CB 3.48Å; D431-L435 WeakPolarHBondContact O-CG 3.3Å; D431-L435 PolarHBondContact O-N 3.43Å; I432-L435 PolarHBondContact O-N 2.88Å; L435-E438 PolarHBondContact O-N 3.5Å; L435-G439 PolarHBondContact O-N 3.1Å
436	R	49.3	Very low	46.7	Very low	146 Å²	146	83.5 Å²	83.5	55%	0.551	42%	0.424	S	S	*	.	H	α-helix	trans	-61.4	-44.2	174.2	-172.7	178	-177.7	164.6	-1	111.8	I432 N433 K434 E438 G439 T440	I432-R436 WeakPolarHBondContact O-CB 3.41Å; I432-R436 PolarHBondContact O-N 2.88Å; N433-R436 PolarHBondContact O-N 2.89Å; K434-R436 VanDerWaalsContact C-N 3.33Å; K434-R436 PolarHBondContact O-N 3.29Å; R436-E438 VanDerWaalsContact C-N 3.31Å; R436-G439 PolarHBondContact O-N 3.27Å; R436-T440 PolarHBondContact O-N 3.36Å; R436-T440 VanDerWaalsContact O-N 3.16Å; R436-T440 PolarHBondContact O-OG1 3.26Å
437	K	53.9	Low	47.5	Very low	148 Å²	148	84.6 Å²	84.6	64%	0.643	43%	0.432	S	S	*	.	H	α-helix	trans	-65.9	-33	176.2	-70.6	179.1	-178.7	-177.4	0	112.4	N433 K434 T440 K441	N433-K437 WeakPolarHBondContact O-CG 3.24Å; N433-K437 PolarHBondContact O-N 3.11Å; N433-K437 VanDerWaalsContact O-N 3.1Å; K434-K437 WeakPolarHBondContact O-CB 3.49Å; K434-K437 PolarHBondContact O-N 3.42Å; K434-K437 VanDerWaalsContact O-N 3.17Å; K437-T440 PolarHBondContact O-OG1 2.68Å; K437-K441 WeakPolarHBondContact O-CG 3.4Å; K437-K441 PolarHBondContact O-N 3.3Å
438	E	52.6	Low	48.5	Very low	48 Å²	48	80 Å²	80	22%	0.224	42%	0.42	C	S	.	.	H	α-helix	trans	-75.6	-38.2	175.9	-69.7	174.6	-174.5	0	0	111.7	H92 N94 K434 L435 R436 K441 A442	H92-E438 PolarHBondContact CE1-O 3Å; H92-E438 PolarHBondContact NE2-O 3.15Å; N94-E438 WeakPolarHBondContact ND2-CB 3.43Å; K434-E438 VanDerWaalsContact CE-OE1 3.27Å; K434-E438 WeakPolarHBondContact CE-OE1 3.47Å; K434-E438 WeakPolarHBondContact O-CG 3.41Å; K434-E438 PolarHBondContact O-N 2.94Å; L435-E438 PolarHBondContact O-N 3.5Å; R436-E438 VanDerWaalsContact C-N 3.31Å; E438-K441 PolarHBondContact O-N 3.36Å; E438-A442 PolarHBondContact O-N 3.28Å; E438-A442 VanDerWaalsContact O-N 3.13Å
439	G	53.3	Low	49.4	Very low	25 Å²	25	81.1 Å²	81.1	26%	0.258	42%	0.417	S	S	.	.	H	α-helix	trans	-59.6	-46.4	174.4	0	0	0	0	0	112.7	N94 L435 R436 K441 A442 E443	N94-G439 PolarHBondContact ND2-N 3.36Å; L435-G439 PolarHBondContact O-N 3.1Å; R436-G439 PolarHBondContact O-N 3.27Å; G439-K441 VanDerWaalsContact C-N 3.29Å; G439-K441 PolarHBondContact O-N 3.38Å; G439-A442 WeakPolarHBondContact O-CB 3.4Å; G439-A442 PolarHBondContact O-N 3.41Å; G439-A442 VanDerWaalsContact O-N 3.13Å; G439-E443 PolarHBondContact O-N 2.89Å
440	T	54.5	Low	49.9	Very low	60 Å²	60	79.5 Å²	79.5	37%	0.368	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-35.9	177.1	51.1	0	0	0	0	112.4	R436 K437 E443 E444	R436-T440 PolarHBondContact O-N 3.36Å; R436-T440 VanDerWaalsContact O-N 3.16Å; R436-T440 PolarHBondContact O-OG1 3.26Å; K437-T440 PolarHBondContact O-OG1 2.68Å; T440-E443 PolarHBondContact O-N 2.87Å; T440-E444 WeakPolarHBondContact O-CG 3.28Å; T440-E444 PolarHBondContact O-N 2.95Å
441	K	54.5	Low	50.1	Low	125 Å²	125	79.8 Å²	79.8	54%	0.543	41%	0.407	S	S	.	.	H	α-helix	trans	-65.7	-37.1	174.6	-75.3	178.8	178.8	-173.8	0	112.7	K437 E438 G439 E444 Q445	K437-K441 WeakPolarHBondContact O-CG 3.4Å; K437-K441 PolarHBondContact O-N 3.3Å; E438-K441 PolarHBondContact O-N 3.36Å; G439-K441 VanDerWaalsContact C-N 3.29Å; G439-K441 PolarHBondContact O-N 3.38Å; K441-E444 PolarHBondContact O-N 3.45Å; K441-Q445 WeakPolarHBondContact O-CG 3.39Å; K441-Q445 PolarHBondContact O-N 3.1Å
442	A	49.6	Very low	50.1	Low	0 Å²	0	85.3 Å²	85.3	0%	0	44%	0.437	C	S	.	.	H	α-helix	trans	-64.5	-43.3	173.7	0	0	0	0	0	111.5	H92 I95 L418 E438 G439 Q445 L446	H92-A442 WeakPolarHBondContact ND1-CB 3.43Å; I95-A442 HydrophobicContact CD1-CB 4.45Å; L418-A442 HydrophobicContact CD2-CB 4.36Å; E438-A442 PolarHBondContact O-N 3.28Å; E438-A442 VanDerWaalsContact O-N 3.13Å; G439-A442 WeakPolarHBondContact O-CB 3.4Å; G439-A442 PolarHBondContact O-N 3.41Å; G439-A442 VanDerWaalsContact O-N 3.13Å; A442-Q445 PolarHBondContact O-N 3.47Å; A442-L446 PolarHBondContact O-N 3.01Å
443	E	54.4	Low	49.5	Very low	102 Å²	102	82.5 Å²	82.5	48%	0.477	43%	0.433	S	S	.	.	H	α-helix	trans	-61.2	-45.3	174.7	-70.3	175.5	171.5	0	0	111.5	G439 T440 Q445 L446 C447	G439-E443 PolarHBondContact O-N 2.89Å; T440-E443 PolarHBondContact O-N 2.87Å; E443-Q445 VanDerWaalsContact C-N 3.35Å; E443-Q445 PolarHBondContact O-N 3.07Å; E443-L446 PolarHBondContact O-N 2.92Å; E443-C447 WeakPolarHBondContact O-CB 3.21Å; E443-C447 PolarHBondContact O-N 3.49Å; E443-C447 PolarHBondContact O-SG 3.33Å; E443-C447 VanDerWaalsContact O-SG 3.33Å
444	E	54.8	Low	48.6	Very low	124 Å²	124	84.7 Å²	84.7	58%	0.579	45%	0.452	S	S	*	.	H	α-helix	trans	-58.8	-43.2	175	-75.9	170.5	-175	0	0	112.2	T440 K441 C447 C448	T440-E444 WeakPolarHBondContact O-CG 3.28Å; T440-E444 PolarHBondContact O-N 2.95Å; K441-E444 PolarHBondContact O-N 3.45Å; E444-C447 PolarHBondContact O-N 2.93Å; E444-C448 PolarHBondContact O-N 2.89Å; E444-C448 VanDerWaalsContact O-N 3.09Å; E444-C448 PolarHBondContact O-SG 2.94Å
445	Q	53.2	Low	47.7	Very low	68 Å²	68	84.6 Å²	84.6	32%	0.318	46%	0.456	S	S	.	.	H	α-helix	trans	-59.7	-49.8	174.1	-77.2	-176.1	-9.8	0	0	111.2	L90 K441 A442 E443 C447 C448 Y449	L90-Q445 HydrophobicContact CD2-CB 4.1Å; K441-Q445 WeakPolarHBondContact O-CG 3.39Å; K441-Q445 PolarHBondContact O-N 3.1Å; A442-Q445 PolarHBondContact O-N 3.47Å; E443-Q445 VanDerWaalsContact C-N 3.35Å; E443-Q445 PolarHBondContact O-N 3.07Å; Q445-C447 VanDerWaalsContact C-N 3.34Å; Q445-C447 PolarHBondContact O-N 2.82Å; Q445-C448 WeakPolarHBondContact O-CB 2.91Å; Q445-C448 PolarHBondContact O-N 3.2Å; Q445-C448 VanDerWaalsContact O-N 3.17Å; Q445-Y449 WeakPolarHBondContact O-CD2 3.24Å; Q445-Y449 PolarHBondContact O-N 3.12Å
446	L	52.7	Low	46.7	Very low	35 Å²	35	88.3 Å²	88.3	18%	0.183	48%	0.48	C	S	.	.	H	α-helix	trans	-57.8	-44.2	177.8	-81.7	155.4	0	0	0	112.1	L90 L418 A442 E443 C448 Y449 C450	L90-L446 HydrophobicContact CD1-CD2 3.61Å; L90-L446 HydrophobicContact CD1-CG 4.25Å; L90-L446 HydrophobicContact CD2-CG 4.47Å; L418-L446 HydrophobicContact CD2-CD1 4.05Å; A442-L446 PolarHBondContact O-N 3.01Å; E443-L446 PolarHBondContact O-N 2.92Å; L446-C448 VanDerWaalsContact C-N 3.31Å; L446-C448 PolarHBondContact O-N 2.76Å; L446-Y449 PolarHBondContact O-N 2.59Å; L446-Y449 VanDerWaalsContact O-N 3.1Å; L446-C450 PolarHBondContact O-N 3.02Å
447	C	51.6	Low	45.6	Very low	68 Å²	68	85.5 Å²	85.5	46%	0.459	48%	0.481	S	S	.	.	H	α-helix	trans	-60.6	-37	176.9	-73.5	0	0	0	0	112.8	E443 E444 Q445 Y449	E443-C447 WeakPolarHBondContact O-CB 3.21Å; E443-C447 PolarHBondContact O-N 3.49Å; E443-C447 PolarHBondContact O-SG 3.33Å; E443-C447 VanDerWaalsContact O-SG 3.33Å; E444-C447 PolarHBondContact O-N 2.93Å; Q445-C447 VanDerWaalsContact C-N 3.34Å; Q445-C447 PolarHBondContact O-N 2.82Å; C447-Y449 PolarHBondContact O-N 2.97Å
448	C	53.2	Low	44.4	Very low	88 Å²	88	85.4 Å²	85.4	60%	0.595	49%	0.485	S	S	*	.	H	α-helix	trans	-68.1	-20.2	176.9	-66.9	0	0	0	0	113.7	K6 E444 Q445 L446	K6-C448 PolarHBondContact NZ-O 3.11Å; E444-C448 PolarHBondContact O-N 2.89Å; E444-C448 VanDerWaalsContact O-N 3.09Å; E444-C448 PolarHBondContact O-SG 2.94Å; Q445-C448 WeakPolarHBondContact O-CB 2.91Å; Q445-C448 PolarHBondContact O-N 3.2Å; Q445-C448 VanDerWaalsContact O-N 3.17Å; L446-C448 VanDerWaalsContact C-N 3.31Å; L446-C448 PolarHBondContact O-N 2.76Å
449	Y	51.7	Low	43.1	Very low	87 Å²	87	88.7 Å²	88.7	34%	0.341	51%	0.508	S	S	.	.	H	α-helix	trans	-96.5	-32.4	178.7	-75.5	-78.2	0	0	0	113.1	L86 C89 L90 Q445 L446 C447 S451	L86-Y449 HydrophobicContact CD2-CG 4.49Å; C89-Y449 HydrophobicContact CB-CD1 4.42Å; C89-Y449 HydrophobicContact CB-CE1 3.75Å; C89-Y449 HydrophobicContact CB-CE2 4.45Å; L90-Y449 HydrophobicContact CD2-CD2 3.72Å; L90-Y449 HydrophobicContact CD2-CE2 4Å; Q445-Y449 WeakPolarHBondContact O-CD2 3.24Å; Q445-Y449 PolarHBondContact O-N 3.12Å; L446-Y449 PolarHBondContact O-N 2.59Å; L446-Y449 VanDerWaalsContact O-N 3.1Å; C447-Y449 PolarHBondContact O-N 2.97Å; Y449-S451 PolarHBondContact O-N 2.78Å
450	C	47.9	Very low	42	Very low	56 Å²	56	89.4 Å²	89.4	38%	0.378	52%	0.515	S	S	.	.			trans	-94.3	65.1	-177.2	-62.8	0	0	0	0	112.5	L446 D452	L446-C450 PolarHBondContact O-N 3.02Å; C450-D452 PolarHBondContact O-N 3Å
451	S	43.8	Very low	40.6	Very low	85 Å²	85	91.2 Å²	91.2	59%	0.594	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	1.2	-172.4	-53.8	0	0	0	0	117	Y449	Y449-S451 PolarHBondContact O-N 2.78Å
452	D	38.9	Very low	39.4	Very low	173 Å²	173	88.8 Å²	88.8	93%	0.925	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	36.5	-173.9	-71.5	-44.1	0	0	0	115.5	C450	C450-D452 PolarHBondContact O-N 3Å
453	G	30.2	Very low	38.3	Very low	44 Å²	44	96.9 Å²	96.9	45%	0.454	56%	0.559	S	S	.	*	S	Bend	trans	-144.3	148.1	171.8	0	0	0	0	0	112.7	I455	G453-I455 PolarHBondContact O-N 3.09Å
454	P	27.2	Very low	36.9	Very low	130 Å²	130	94.2 Å²	94.2	84%	0.844	55%	0.554	S	S	*	*			trans	-58.1	115.1	172.2	24	-30.8	0	0	0	108.4	V456	P454-V456 PolarHBondContact O-N 2.64Å
455	I	28.9	Very low	35.5	Very low	125 Å²	125	92.8 Å²	92.8	64%	0.641	55%	0.554	S	S	*	*			trans	-65.4	100.7	174	-59.8	167.5	0	0	0	105.6	G453 P457	G453-I455 PolarHBondContact O-N 3.09Å; I455-P457 WeakPolarHBondContact O-CD 3.17Å
456	V	25.5	Very low	34.2	Very low	117 Å²	117	95 Å²	95	71%	0.709	57%	0.572	S	S	*	*			trans	-66.2	113	157.6	-179.1	0	0	0	0	104	P454 M458	P454-V456 PolarHBondContact O-N 2.64Å; V456-M458 PolarHBondContact O-N 3.2Å
457	P	24.7	Very low	32.8	Very low	87 Å²	87	95.2 Å²	95.2	57%	0.565	58%	0.583	S	S	*	*			trans	-56.3	117	172.1	23.6	-30.6	0	0	0	105.8	I455 T459	I455-P457 WeakPolarHBondContact O-CD 3.17Å; P457-T459 HydrophobicContact CB-CG2 4.35Å; P457-T459 PolarHBondContact O-N 3.11Å
458	M	30.1	Very low	31.5	Very low	147 Å²	147	96.7 Å²	96.7	72%	0.724	58%	0.583	S	S	*	*			trans	-67.7	63.3	164.6	-75.4	-83.6	-134.8	0	0	106.6	V456 G460	V456-M458 PolarHBondContact O-N 3.2Å; M458-G460 PolarHBondContact O-N 3.26Å
459	T	25.3	Very low	30.2	Very low	116 Å²	116	96.7 Å²	96.7	71%	0.712	58%	0.58	S	S	*	*			trans	-61.8	92.3	153.5	50.4	0	0	0	0	103.7	P457 S461	P457-T459 HydrophobicContact CB-CG2 4.35Å; P457-T459 PolarHBondContact O-N 3.11Å; T459-S461 PolarHBondContact O-N 3.31Å
460	G	28.4	Very low	29	Very low	40 Å²	40	95.5 Å²	95.5	41%	0.412	59%	0.588	S	S	.	*			trans	-45.8	116.7	177.2	0	0	0	0	0	107.6	M458 C462 R463 A464	M458-G460 PolarHBondContact O-N 3.26Å; G460-C462 PolarHBondContact O-N 3.28Å; G460-R463 PolarHBondContact O-N 3.07Å; G460-A464 PolarHBondContact O-N 3.04Å
461	S	26.9	Very low	28	Very low	98 Å²	98	94.9 Å²	94.9	69%	0.685	59%	0.587	S	S	*	*	H	α-helix	trans	-58.2	-6.4	175.9	36.3	0	0	0	0	112	T459 V465	T459-S461 PolarHBondContact O-N 3.31Å; S461-V465 WeakPolarHBondContact O-CG2 3.19Å
462	C	29.1	Very low	27.2	Very low	74 Å²	74	96.1 Å²	96.1	50%	0.5	58%	0.583	S	S	.	*	H	α-helix	trans	-90.7	-22.4	170.6	-56.4	0	0	0	0	114.7	G460 V466	G460-C462 PolarHBondContact O-N 3.28Å; C462-V466 PolarHBondContact O-N 2.8Å
463	R	26.4	Very low	26.7	Very low	170 Å²	170	91.5 Å²	91.5	64%	0.642	56%	0.564	S	S	*	*	H	α-helix	trans	-80.2	-31	173.4	-136.7	-179.5	-165.2	174.8	8.1	111.5	G460 G467	G460-R463 PolarHBondContact O-N 3.07Å; R463-G467 WeakPolarHBondContact O-CA 3.47Å; R463-G467 PolarHBondContact O-N 3.24Å
464	A	25	Very low	26.6	Very low	46 Å²	46	93.6 Å²	93.6	38%	0.38	57%	0.571	S	S	.	*	H	α-helix	trans	-64.6	-43.2	171.8	0	0	0	0	0	110.9	G460 Q468	G460-A464 PolarHBondContact O-N 3.04Å; A464-Q468 WeakPolarHBondContact O-CA 3.32Å; A464-Q468 WeakPolarHBondContact O-CB 3.31Å; A464-Q468 PolarHBondContact O-N 3.24Å
465	V	25.5	Very low	26.7	Very low	95 Å²	95	92.7 Å²	92.7	58%	0.576	56%	0.559	S	S	*	*	H	α-helix	trans	-76.4	-38.6	-176.2	-179.4	0	0	0	0	113.1	S461 V469	S461-V465 WeakPolarHBondContact O-CG2 3.19Å; V465-V469 HydrophobicContact CG1-CG2 4.42Å; V465-V469 VanDerWaalsContact O-CB 3.26Å; V465-V469 WeakPolarHBondContact O-CB 3.08Å; V465-V469 WeakPolarHBondContact O-CG2 3.45Å; V465-V469 PolarHBondContact O-N 2.96Å
466	V	25.5	Very low	26.7	Very low	113 Å²	113	92.6 Å²	92.6	69%	0.685	56%	0.559	S	S	*	*	H	α-helix	trans	-83	-34.2	-179.1	-176.5	0	0	0	0	112.2	C462 A470	C462-V466 PolarHBondContact O-N 2.8Å; V466-A470 WeakPolarHBondContact O-CB 3.11Å; V466-A470 PolarHBondContact O-N 3.38Å
467	G	22.6	Very low	26.9	Very low	40 Å²	40	93 Å²	93	41%	0.412	56%	0.557	S	S	.	*	H	α-helix	trans	-74.7	-34.9	175.8	0	0	0	0	0	113.2	R463 A471	R463-G467 WeakPolarHBondContact O-CA 3.47Å; R463-G467 PolarHBondContact O-N 3.24Å; G467-A471 WeakPolarHBondContact O-CB 3.47Å; G467-A471 PolarHBondContact O-N 3.29Å
468	Q	24.4	Very low	27.2	Very low	100 Å²	100	92.2 Å²	92.2	47%	0.467	55%	0.553	S	S	.	*	H	α-helix	trans	-84.8	-31.8	-177.4	-157.9	159.8	-10.6	0	0	112.1	A464 A470 A471 E472	A464-Q468 WeakPolarHBondContact O-CA 3.32Å; A464-Q468 WeakPolarHBondContact O-CB 3.31Å; A464-Q468 PolarHBondContact O-N 3.24Å; Q468-A470 VanDerWaalsContact C-N 3.35Å; Q468-A471 PolarHBondContact O-N 3.33Å; Q468-E472 HydrophobicContact CG-CG 4Å; Q468-E472 WeakPolarHBondContact CG-OE1 3.45Å; Q468-E472 PolarHBondContact NE2-OE1 3.14Å; Q468-E472 WeakPolarHBondContact O-CB 3.41Å; Q468-E472 VanDerWaalsContact O-CG 3.31Å; Q468-E472 WeakPolarHBondContact O-CG 3.44Å; Q468-E472 PolarHBondContact O-N 3.37Å
469	V	26.9	Very low	27.1	Very low	88 Å²	88	92.1 Å²	92.1	53%	0.533	55%	0.551	S	S	.	*	H	α-helix	trans	-68.6	-34.9	170	174.9	0	0	0	0	111.4	V465 S473	V465-V469 HydrophobicContact CG1-CG2 4.42Å; V465-V469 VanDerWaalsContact O-CB 3.26Å; V465-V469 WeakPolarHBondContact O-CB 3.08Å; V465-V469 WeakPolarHBondContact O-CG2 3.45Å; V465-V469 PolarHBondContact O-N 2.96Å; V469-S473 VanDerWaalsContact O-CB 3.25Å; V469-S473 WeakPolarHBondContact O-CB 3.37Å; V469-S473 PolarHBondContact O-N 3.19Å; V469-S473 PolarHBondContact O-OG 3.38Å
470	A	26.9	Very low	27.3	Very low	61 Å²	61	95.6 Å²	95.6	50%	0.504	56%	0.556	S	S	.	*	H	α-helix	trans	-72.8	-36.7	173.3	0	0	0	0	0	112.7	V466 Q468 C474	V466-A470 WeakPolarHBondContact O-CB 3.11Å; V466-A470 PolarHBondContact O-N 3.38Å; Q468-A470 VanDerWaalsContact C-N 3.35Å; A470-C474 WeakPolarHBondContact O-CB 3.46Å; A470-C474 PolarHBondContact O-N 2.89Å; A470-C474 PolarHBondContact O-SG 3.48Å
471	A	26.9	Very low	27.4	Very low	44 Å²	44	102.4 Å²	102.4	36%	0.364	57%	0.574	S	S	.	*	H	α-helix	trans	-76.9	-42	179	0	0	0	0	0	113.3	G467 Q468 C474 L475	G467-A471 WeakPolarHBondContact O-CB 3.47Å; G467-A471 PolarHBondContact O-N 3.29Å; Q468-A471 PolarHBondContact O-N 3.33Å; A471-C474 PolarHBondContact O-N 3.44Å; A471-L475 WeakPolarHBondContact O-CB 3.36Å; A471-L475 WeakPolarHBondContact O-CG 3.06Å; A471-L475 PolarHBondContact O-N 3.25Å
472	E	26.3	Very low	27.6	Very low	111 Å²	111	101.8 Å²	101.8	52%	0.519	57%	0.57	S	S	.	*	H	α-helix	trans	-73.4	-29.3	-178.9	-69.7	179.3	-179.2	0	0	112.1	Q468	Q468-E472 HydrophobicContact CG-CG 4Å; Q468-E472 WeakPolarHBondContact CG-OE1 3.45Å; Q468-E472 PolarHBondContact NE2-OE1 3.14Å; Q468-E472 WeakPolarHBondContact O-CB 3.41Å; Q468-E472 VanDerWaalsContact O-CG 3.31Å; Q468-E472 WeakPolarHBondContact O-CG 3.44Å; Q468-E472 PolarHBondContact O-N 3.37Å
473	S	28.7	Very low	27.7	Very low	75 Å²	75	105.1 Å²	105.1	52%	0.524	58%	0.582	S	S	.	*	H	α-helix	trans	-73.4	-28.9	171.7	-52.8	0	0	0	0	112.6	V469	V469-S473 VanDerWaalsContact O-CB 3.25Å; V469-S473 WeakPolarHBondContact O-CB 3.37Å; V469-S473 PolarHBondContact O-N 3.19Å; V469-S473 PolarHBondContact O-OG 3.38Å
474	C	28.1	Very low	27.9	Very low	89 Å²	89	108 Å²	108	60%	0.601	59%	0.593	S	S	*	*	H	α-helix	trans	-86.3	-31.8	178.3	-69.3	0	0	0	0	113.2	A470 A471 I477	A470-C474 WeakPolarHBondContact O-CB 3.46Å; A470-C474 PolarHBondContact O-N 2.89Å; A470-C474 PolarHBondContact O-SG 3.48Å; A471-C474 PolarHBondContact O-N 3.44Å; C474-I477 PolarHBondContact O-N 3.49Å
475	L	28.5	Very low	28.1	Very low	110 Å²	110	117.1 Å²	117.1	58%	0.576	62%	0.618	S	S	*	*	H	α-helix	trans	-76.1	-27.2	-178.9	-74.6	169.2	0	0	0	113.1	A471 I477 S478	A471-L475 WeakPolarHBondContact O-CB 3.36Å; A471-L475 WeakPolarHBondContact O-CG 3.06Å; A471-L475 PolarHBondContact O-N 3.25Å; L475-I477 PolarHBondContact O-N 3.05Å; L475-I477 VanDerWaalsContact O-N 3.15Å; L475-S478 PolarHBondContact O-N 3.33Å; L475-S478 PolarHBondContact O-OG 3.23Å
476	N	29	Very low	28.2	Very low	123 Å²	123	125.4 Å²	125.4	66%	0.658	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-4.3	173.7	-96.7	-31.5	0	0	0	114.9
477	I	30	Very low	28.3	Very low	127 Å²	127	126.1 Å²	126.1	65%	0.651	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-18	171.5	-59.8	176.8	0	0	0	111.2	C474 L475	C474-I477 PolarHBondContact O-N 3.49Å; L475-I477 PolarHBondContact O-N 3.05Å; L475-I477 VanDerWaalsContact O-N 3.15Å
478	S	30.1	Very low	28.6	Very low	69 Å²	69	130.6 Å²	130.6	48%	0.483	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	-29.8	-178.2	70.8	0	0	0	0	114.4	L475 K480	L475-S478 PolarHBondContact O-N 3.33Å; L475-S478 PolarHBondContact O-OG 3.23Å; S478-K480 PolarHBondContact O-N 3.31Å
479	E	28.7	Very low	28.8	Very low	145 Å²	145	132.3 Å²	132.3	68%	0.678	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-10.1	-176.4	-80.7	-171.8	158.3	0	0	115.3
480	K	30.1	Very low	29	Very low	190 Å²	190	134.9 Å²	134.9	83%	0.826	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	4.9	174.4	-80.2	-170.5	177.1	179.6	0	115.4	S478	S478-K480 PolarHBondContact O-N 3.31Å
481	K	31	Very low	29.1	Very low	183 Å²	183	139.5 Å²	139.5	80%	0.796	69%	0.686	S	S	*	*	S	Bend	trans	-103.1	-8.6	174.5	-84.1	-171.2	176.6	-178.9	0	115
482	S	31.1	Very low	29.2	Very low	84 Å²	84	145.9 Å²	145.9	59%	0.587	71%	0.707	S	S	*	*	S	Bend	trans	-85	-19.4	175	51.8	0	0	0	0	114.6	R484	S482-R484 PolarHBondContact O-N 2.97Å
483	D	30	Very low	29.4	Very low	144 Å²	144	148.4 Å²	148.4	77%	0.77	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	20.4	-177.4	-83.7	-9.8	0	0	0	115.5
484	R	31.9	Very low	29.5	Very low	230 Å²	230	154 Å²	154	87%	0.868	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	18.2	168.4	-79.2	-169.4	174.4	-172.4	-1.5	114.5	S482	S482-R484 PolarHBondContact O-N 2.97Å
485	R	28.6	Very low	29.6	Very low	239 Å²	239	159.4 Å²	159.4	90%	0.902	75%	0.747	S	S	*	*			trans	-125.3	57.3	165.2	-73.7	-171.7	177.3	-178.4	-0.7	111.1
486	K	26.7	Very low	29.7	Very low	269 Å²	269	163.9 Å²	163.9	100%	1.17	76%	0.763	S	S	*	*			trans	-138.3	0	143.1	-77.9	-174.7	179.8	175.3	0	105.7

Retrieved 486 of 486 residues in 169.7 ms (Link to these results)

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