A0A3Q0KNL1_SCHMA Loading...

Putative smap1

AlphaFold DB , UniProt , Accession A0A3Q0KNL1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 503 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	59.5	Low	80.8	Confident	222 Å²	222	110.4 Å²	110.4	100%	1.094	57%	0.574	S	S	*	*				0	-5.1	0	-71.5	-171.6	167.6	0	0	115.1
2	T	66.8	Low	81.6	Confident	114 Å²	114	111 Å²	111	70%	0.699	57%	0.569	S	S	*	*			trans	-71.3	-34.3	-173.9	45.9	0	0	0	0	115.3	S4 S5 N6	T2-S4 VanDerWaalsContact C-N 3.28Å; T2-S4 PolarHBondContact O-N 3.27Å; T2-S5 PolarHBondContact O-N 3.14Å; T2-S5 VanDerWaalsContact O-N 3.09Å; T2-N6 PolarHBondContact O-N 2.92Å
3	S	75	Confident	82.3	Confident	70 Å²	70	106.8 Å²	106.8	49%	0.49	55%	0.547	S	S	.	.	H	α-helix	trans	-55.5	-38.6	-176.7	50.2	0	0	0	0	113.8	S5 R7	S3-S5 PolarHBondContact O-N 3.14Å; S3-R7 WeakPolarHBondContact O-CG 3.48Å; S3-R7 PolarHBondContact O-N 3.29Å
4	S	79.4	Confident	82.9	Confident	66 Å²	66	103.6 Å²	103.6	46%	0.462	53%	0.529	S	S	.	.	H	α-helix	trans	-73.7	-20.1	-179.4	-56.8	0	0	0	0	114	T2 R8	T2-S4 VanDerWaalsContact C-N 3.28Å; T2-S4 PolarHBondContact O-N 3.27Å; S4-R8 PolarHBondContact O-NE 3.38Å; S4-R8 PolarHBondContact O-NH2 3.49Å
5	S	83.3	Confident	83.5	Confident	53 Å²	53	99.8 Å²	99.8	37%	0.371	51%	0.511	S	S	.	.	H	α-helix	trans	-77.6	-55.5	169.3	-158	0	0	0	0	109.2	T2 S3 R7 R8 D9	T2-S5 PolarHBondContact O-N 3.14Å; T2-S5 VanDerWaalsContact O-N 3.09Å; S3-S5 PolarHBondContact O-N 3.14Å; S5-R7 PolarHBondContact O-N 3.46Å; S5-R8 WeakPolarHBondContact O-CA 3.5Å; S5-R8 WeakPolarHBondContact O-CB 3.34Å; S5-R8 PolarHBondContact O-N 3.43Å; S5-D9 VanDerWaalsContact C-OD2 3.29Å; S5-D9 PolarHBondContact O-N 3.37Å; S5-D9 PolarHBondContact OG-OD2 3.4Å
6	N	85.7	Confident	84.1	Confident	103 Å²	103	100.1 Å²	100.1	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-51.6	-39.3	-179.4	-74.3	8.4	0	0	0	112.7	T2 N10	T2-N6 PolarHBondContact O-N 2.92Å; N6-N10 WeakPolarHBondContact O-CB 3.31Å; N6-N10 PolarHBondContact O-N 2.95Å; N6-N10 PolarHBondContact O-ND2 3.29Å
7	R	85.7	Confident	84.6	Confident	193 Å²	193	94.3 Å²	94.3	73%	0.728	48%	0.48	S	S	*	.	H	α-helix	trans	-61.4	-47.7	174	-75.3	179.4	-179.9	-170.3	0.6	112.7	S3 S5 N10 T11	S3-R7 WeakPolarHBondContact O-CG 3.48Å; S3-R7 PolarHBondContact O-N 3.29Å; S5-R7 PolarHBondContact O-N 3.46Å; R7-N10 PolarHBondContact O-N 3.44Å; R7-T11 PolarHBondContact O-N 3.48Å; R7-T11 PolarHBondContact O-OG1 2.97Å; R7-T11 VanDerWaalsContact O-OG1 3.11Å
8	R	88.1	Confident	85.2	Confident	158 Å²	158	89.9 Å²	89.9	60%	0.596	46%	0.457	S	S	*	.	H	α-helix	trans	-63.3	-42.3	178.1	-79.3	177.7	-81.8	167.4	-8.5	111.8	S4 S5 T11 K12	S4-R8 PolarHBondContact O-NE 3.38Å; S4-R8 PolarHBondContact O-NH2 3.49Å; S5-R8 WeakPolarHBondContact O-CA 3.5Å; S5-R8 WeakPolarHBondContact O-CB 3.34Å; S5-R8 PolarHBondContact O-N 3.43Å; R8-T11 PolarHBondContact O-N 3.36Å; R8-K12 WeakPolarHBondContact O-CG 3.48Å; R8-K12 PolarHBondContact O-N 3.36Å
9	D	88.7	Confident	85.7	Confident	64 Å²	64	87.2 Å²	87.2	34%	0.342	44%	0.442	S	S	.	.	H	α-helix	trans	-72	-34.7	-177.1	-57.7	-42.8	0	0	0	111.6	S5 K12 L13	S5-D9 VanDerWaalsContact C-OD2 3.29Å; S5-D9 PolarHBondContact O-N 3.37Å; S5-D9 PolarHBondContact OG-OD2 3.4Å; D9-K12 IonicContact OD1-NZ 2.71Å; D9-K12 PolarHBondContact OD1-NZ 3.39Å; D9-L13 WeakPolarHBondContact O-CB 2.96Å; D9-L13 PolarHBondContact O-N 3.18Å; D9-L13 VanDerWaalsContact O-N 3.11Å
10	N	88.2	Confident	86.1	Confident	89 Å²	89	86.6 Å²	86.6	48%	0.476	44%	0.44	S	S	.	.	H	α-helix	trans	-63.1	-43.8	167.5	-83.7	-81.2	0	0	0	112.5	N6 R7 K12 L13 Q14	N6-N10 WeakPolarHBondContact O-CB 3.31Å; N6-N10 PolarHBondContact O-N 2.95Å; N6-N10 PolarHBondContact O-ND2 3.29Å; R7-N10 PolarHBondContact O-N 3.44Å; N10-K12 PolarHBondContact O-N 3.5Å; N10-L13 PolarHBondContact O-N 2.9Å; N10-Q14 WeakPolarHBondContact O-CG 3.41Å; N10-Q14 PolarHBondContact O-N 3.27Å
11	T	88.9	Confident	86.5	Confident	82 Å²	82	82.7 Å²	82.7	50%	0.503	42%	0.42	S	S	.	.	H	α-helix	trans	-61.6	-42	177.8	-58.8	0	0	0	0	112.2	R7 R8 Q14 N15	R7-T11 PolarHBondContact O-N 3.48Å; R7-T11 PolarHBondContact O-OG1 2.97Å; R7-T11 VanDerWaalsContact O-OG1 3.11Å; R8-T11 PolarHBondContact O-N 3.36Å; T11-Q14 PolarHBondContact O-N 3.09Å; T11-N15 PolarHBondContact O-N 3.07Å
12	K	90	Very high	88.2	Confident	118 Å²	118	72.2 Å²	72.2	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-58.3	-49.6	173.9	-68.6	170.9	-170	161	0	111.3	R8 D9 N10 Q14 N15 E16	R8-K12 WeakPolarHBondContact O-CG 3.48Å; R8-K12 PolarHBondContact O-N 3.36Å; D9-K12 IonicContact OD1-NZ 2.71Å; D9-K12 PolarHBondContact OD1-NZ 3.39Å; N10-K12 PolarHBondContact O-N 3.5Å; K12-Q14 VanDerWaalsContact C-N 3.32Å; K12-Q14 PolarHBondContact O-N 3Å; K12-N15 CarbonylContact O-C 3.59Å; K12-N15 WeakPolarHBondContact O-CA 3.49Å; K12-N15 WeakPolarHBondContact O-CB 3.36Å; K12-N15 PolarHBondContact O-N 3.39Å; K12-E16 WeakPolarHBondContact O-CG 3.11Å; K12-E16 PolarHBondContact O-N 3.08Å
13	L	90.8	Very high	89.6	Confident	56 Å²	56	71 Å²	71	29%	0.293	36%	0.355	S	S	.	.	H	α-helix	trans	-64.8	-33.1	-177.6	-171.4	64.4	0	0	0	113	D9 N10 E16 R17	D9-L13 WeakPolarHBondContact O-CB 2.96Å; D9-L13 PolarHBondContact O-N 3.18Å; D9-L13 VanDerWaalsContact O-N 3.11Å; N10-L13 PolarHBondContact O-N 2.9Å; L13-E16 WeakPolarHBondContact CD1-OE2 3.45Å; L13-R17 WeakPolarHBondContact O-CG 3.36Å; L13-R17 PolarHBondContact O-N 2.93Å
14	Q	90.5	Very high	90.5	Very high	62 Å²	62	72.1 Å²	72.1	29%	0.29	35%	0.352	S	S	.	.	H	α-helix	trans	-69.3	-41.2	170.5	-64.6	-62	1.2	0	0	111.7	N10 T11 K12 E16 R17 H18 E152	N10-Q14 WeakPolarHBondContact O-CG 3.41Å; N10-Q14 PolarHBondContact O-N 3.27Å; T11-Q14 PolarHBondContact O-N 3.09Å; K12-Q14 VanDerWaalsContact C-N 3.32Å; K12-Q14 PolarHBondContact O-N 3Å; Q14-E16 VanDerWaalsContact C-N 3.33Å; Q14-E16 PolarHBondContact O-N 3.22Å; Q14-R17 PolarHBondContact O-N 3.14Å; Q14-H18 PolarHBondContact O-N 3.4Å; Q14-H18 PolarHBondContact O-ND1 3.15Å; Q14-E152 PolarHBondContact NE2-OE2 3.25Å
15	N	92	Very high	91.3	Very high	47 Å²	47	69.8 Å²	69.8	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-38.3	175.4	-74.7	-2.4	0	0	0	112.4	T11 K12 R17 H18 Q19 T78	T11-N15 PolarHBondContact O-N 3.07Å; K12-N15 CarbonylContact O-C 3.59Å; K12-N15 WeakPolarHBondContact O-CA 3.49Å; K12-N15 WeakPolarHBondContact O-CB 3.36Å; K12-N15 PolarHBondContact O-N 3.39Å; N15-R17 VanDerWaalsContact C-N 3.35Å; N15-R17 PolarHBondContact O-N 2.72Å; N15-H18 WeakPolarHBondContact O-CB 3.41Å; N15-H18 PolarHBondContact O-N 3.02Å; N15-Q19 PolarHBondContact O-N 3.01Å; N15-T78 PolarHBondContact ND2-OG1 3.44Å; N15-T78 WeakPolarHBondContact OD1-CG2 3.48Å
16	E	92.5	Very high	91.9	Very high	104 Å²	104	68.6 Å²	68.6	49%	0.486	32%	0.324	S	S	.	.	H	α-helix	trans	-59.8	-42.4	173.1	-72.8	164.7	-160.6	0	0	111.9	K12 L13 Q14 Q19 L20	K12-E16 WeakPolarHBondContact O-CG 3.11Å; K12-E16 PolarHBondContact O-N 3.08Å; L13-E16 WeakPolarHBondContact CD1-OE2 3.45Å; Q14-E16 VanDerWaalsContact C-N 3.33Å; Q14-E16 PolarHBondContact O-N 3.22Å; E16-Q19 WeakPolarHBondContact O-CB 3.46Å; E16-Q19 PolarHBondContact O-N 2.95Å; E16-L20 WeakPolarHBondContact O-CG 3.45Å; E16-L20 PolarHBondContact O-N 3.45Å; E16-L20 VanDerWaalsContact O-N 3.08Å
17	R	93	Very high	92.4	Very high	2 Å²	2	71 Å²	71	1%	0.008	33%	0.325	C	S	.	.	H	α-helix	trans	-65.6	-42.5	175.2	-67.7	170.3	-163.8	142.9	-0.5	112.4	L13 Q14 N15 Q19 L20 I21 L148 L151 E152 Q155	L13-R17 WeakPolarHBondContact O-CG 3.36Å; L13-R17 PolarHBondContact O-N 2.93Å; Q14-R17 PolarHBondContact O-N 3.14Å; N15-R17 VanDerWaalsContact C-N 3.35Å; N15-R17 PolarHBondContact O-N 2.72Å; R17-Q19 PolarHBondContact O-N 2.66Å; R17-L20 PolarHBondContact O-N 2.73Å; R17-I21 PolarHBondContact O-N 3.38Å; R17-L148 HydrophobicContact CB-CD2 4.13Å; R17-L151 HydrophobicContact CG-CB 4.43Å; R17-E152 VanDerWaalsContact CZ-CB 3.43Å; R17-E152 IonicContact CZ-OE2 3.53Å; R17-E152 IonicContact NH1-OE2 3.67Å; R17-E152 PolarHBondContact NH1-OE2 2.88Å; R17-E152 IonicContact NH2-OE2 3.63Å; R17-Q155 VanDerWaalsContact CZ-OE1 3.23Å
18	H	94.7	Very high	92.9	Very high	16 Å²	16	65.9 Å²	65.9	7%	0.074	31%	0.313	C	S	.	.	H	α-helix	trans	-57.5	-40.1	172.6	-65.5	156.6	0	0	0	111.2	Q14 N15 L20 I21 I22 W79 L84	Q14-H18 PolarHBondContact O-N 3.4Å; Q14-H18 PolarHBondContact O-ND1 3.15Å; N15-H18 WeakPolarHBondContact O-CB 3.41Å; N15-H18 PolarHBondContact O-N 3.02Å; H18-L20 PolarHBondContact O-N 2.98Å; H18-I21 PolarHBondContact O-N 3.28Å; H18-I22 WeakPolarHBondContact O-CG1 3.45Å; H18-I22 PolarHBondContact O-N 3.27Å; H18-W79 HydrophobicContact CB-CB 4.31Å; H18-W79 PolarHBondContact CE1-O 3.45Å; H18-W79 PolarHBondContact ND1-O 3.21Å; H18-L84 HydrophobicContact CB-CD1 3.8Å; H18-L84 VanDerWaalsContact CD2-CD1 3.45Å; H18-L84 WeakPolarHBondContact CD2-CD1 3.4Å
19	Q	94.7	Very high	93.3	Very high	37 Å²	37	64.1 Å²	64.1	17%	0.173	32%	0.315	C	S	.	.	H	α-helix	trans	-64.5	-38.6	177.7	-161.1	63	35.5	0	0	112.8	N15 E16 R17 I21 I22 Q23 V74	N15-Q19 PolarHBondContact O-N 3.01Å; E16-Q19 WeakPolarHBondContact O-CB 3.46Å; E16-Q19 PolarHBondContact O-N 2.95Å; R17-Q19 PolarHBondContact O-N 2.66Å; Q19-I21 VanDerWaalsContact C-N 3.33Å; Q19-I21 PolarHBondContact O-N 3.42Å; Q19-I22 PolarHBondContact O-N 3.45Å; Q19-Q23 WeakPolarHBondContact O-CB 3.49Å; Q19-Q23 VanDerWaalsContact O-CG 3.31Å; Q19-Q23 WeakPolarHBondContact O-CG 3.01Å; Q19-Q23 PolarHBondContact O-N 3.37Å; Q19-V74 PolarHBondContact NE2-O 2.91Å; Q19-V74 PolarHBondContact OE1-O 3.21Å
20	L	94.1	Very high	93.7	Very high	76 Å²	76	63.6 Å²	63.6	40%	0.398	31%	0.312	S	S	.	.	H	α-helix	trans	-59.8	-42	174.8	-66.4	174.2	0	0	0	111.8	E16 R17 H18 Q23 E24	E16-L20 WeakPolarHBondContact O-CG 3.45Å; E16-L20 PolarHBondContact O-N 3.45Å; E16-L20 VanDerWaalsContact O-N 3.08Å; R17-L20 PolarHBondContact O-N 2.73Å; H18-L20 PolarHBondContact O-N 2.98Å; L20-Q23 PolarHBondContact O-N 3.05Å; L20-E24 PolarHBondContact O-N 3.22Å
21	I	94.9	Very high	94.2	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-43.8	176.5	-58.7	-53.2	0	0	0	111.4	R17 H18 Q19 Q23 E24 L25 L84 L144 E147 L148 L151	R17-I21 PolarHBondContact O-N 3.38Å; H18-I21 PolarHBondContact O-N 3.28Å; Q19-I21 VanDerWaalsContact C-N 3.33Å; Q19-I21 PolarHBondContact O-N 3.42Å; I21-Q23 VanDerWaalsContact C-N 3.34Å; I21-E24 WeakPolarHBondContact O-CB 3.45Å; I21-E24 PolarHBondContact O-N 3.47Å; I21-L25 WeakPolarHBondContact O-CG 3.26Å; I21-L25 PolarHBondContact O-N 2.9Å; I21-L25 VanDerWaalsContact O-N 3.1Å; I21-L84 HydrophobicContact CB-CD1 4.34Å; I21-L84 HydrophobicContact CG2-CD1 4.46Å; I21-L144 HydrophobicContact CG1-CD1 4.35Å; I21-L144 HydrophobicContact CG2-CD1 4.06Å; I21-E147 WeakPolarHBondContact CD1-OE1 3.36Å; I21-L148 HydrophobicContact CD1-CD2 4.49Å; I21-L148 HydrophobicContact CG1-CD2 3.84Å; I21-L151 HydrophobicContact CD1-CD1 3.72Å; I21-L151 HydrophobicContact CG1-CD1 4.43Å
22	I	95.6	Very high	94.6	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-66.5	-38.9	178.5	-58.5	166.3	0	0	0	110.9	H18 Q19 E24 L25 L26 F52 V74 W79 L84	H18-I22 WeakPolarHBondContact O-CG1 3.45Å; H18-I22 PolarHBondContact O-N 3.27Å; Q19-I22 PolarHBondContact O-N 3.45Å; I22-E24 VanDerWaalsContact C-N 3.29Å; I22-E24 PolarHBondContact O-N 3.44Å; I22-L25 PolarHBondContact O-N 3.33Å; I22-L26 HydrophobicContact CG2-CD1 4.44Å; I22-L26 WeakPolarHBondContact O-CG 3.45Å; I22-L26 PolarHBondContact O-N 3.02Å; I22-F52 HydrophobicContact CG2-CE1 4.21Å; I22-V74 HydrophobicContact CG2-CB 4.49Å; I22-V74 HydrophobicContact CG2-CG1 3.57Å; I22-W79 HydrophobicContact CD1-CB 4.26Å; I22-W79 HydrophobicContact CD1-CD2 3.69Å; I22-W79 HydrophobicContact CD1-CE3 4.47Å; I22-W79 HydrophobicContact CD1-CG 3.53Å; I22-L84 HydrophobicContact CD1-CD2 3.77Å; I22-L84 HydrophobicContact CG1-CD2 3.31Å
23	Q	95.1	Very high	95	Very high	89 Å²	89	58.4 Å²	58.4	42%	0.416	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-36.2	174.9	-76.1	176.4	-6.1	0	0	112	Q19 L20 I21 L26 R27	Q19-Q23 WeakPolarHBondContact O-CB 3.49Å; Q19-Q23 VanDerWaalsContact O-CG 3.31Å; Q19-Q23 WeakPolarHBondContact O-CG 3.01Å; Q19-Q23 PolarHBondContact O-N 3.37Å; L20-Q23 PolarHBondContact O-N 3.05Å; I21-Q23 VanDerWaalsContact C-N 3.34Å; Q23-L26 PolarHBondContact O-N 3.22Å; Q23-R27 WeakPolarHBondContact O-CG 3.15Å; Q23-R27 PolarHBondContact O-N 3.17Å
24	E	95.3	Very high	95.3	Very high	92 Å²	92	55.8 Å²	55.8	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-50.2	172.6	-161.6	64.9	-133.3	0	0	111.1	L20 I21 I22 L26 R27	L20-E24 PolarHBondContact O-N 3.22Å; I21-E24 WeakPolarHBondContact O-CB 3.45Å; I21-E24 PolarHBondContact O-N 3.47Å; I22-E24 VanDerWaalsContact C-N 3.29Å; I22-E24 PolarHBondContact O-N 3.44Å; E24-L26 PolarHBondContact O-N 3.09Å; E24-R27 VanDerWaalsContact O-CB 3.24Å; E24-R27 WeakPolarHBondContact O-CB 3.46Å; E24-R27 PolarHBondContact O-N 3.09Å; E24-R27 WeakPolarHBondContact OE1-CD 3.43Å; E24-R27 IonicContact OE1-CZ 2.76Å; E24-R27 IonicContact OE1-NE 3.97Å; E24-R27 IonicContact OE1-NH1 3.11Å; E24-R27 PolarHBondContact OE1-NH1 3.44Å; E24-R27 IonicContact OE2-CZ 3.74Å; E24-R27 IonicContact OE2-NE 3.54Å; E24-R27 IonicContact OE2-NH1 3.93Å; E24-R27 PolarHBondContact OE2-NH1 3.41Å; E24-R27 IonicContact OE2-NH2 3.78Å
25	L	96	Very high	95.7	Very high	17 Å²	17	53 Å²	53	9%	0.089	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-34.8	177.6	-63.8	176.3	0	0	0	112.4	I21 I22 R27 D28 N31 F52 M87 R88	I21-L25 WeakPolarHBondContact O-CG 3.26Å; I21-L25 PolarHBondContact O-N 2.9Å; I21-L25 VanDerWaalsContact O-N 3.1Å; I22-L25 PolarHBondContact O-N 3.33Å; L25-R27 PolarHBondContact O-N 3.32Å; L25-D28 PolarHBondContact O-N 2.97Å; L25-N31 VanDerWaalsContact O-CB 3.27Å; L25-N31 WeakPolarHBondContact O-CB 3.32Å; L25-N31 PolarHBondContact O-ND2 3.04Å; L25-F52 HydrophobicContact CB-CE2 4.13Å; L25-F52 HydrophobicContact CB-CZ 3.86Å; L25-F52 HydrophobicContact CD1-CZ 4.43Å; L25-M87 HydrophobicContact CD1-CB 3.84Å; L25-R88 HydrophobicContact CD1-CB 4.3Å; L25-R88 HydrophobicContact CD2-CB 4.02Å; L25-R88 HydrophobicContact CD2-CG 4.22Å
26	L	96.1	Very high	95.9	Very high	29 Å²	29	50.8 Å²	50.8	15%	0.152	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-3.6	175	-73.2	177.8	0	0	0	114.6	I22 Q23 E24 N31 F52 V74	I22-L26 HydrophobicContact CG2-CD1 4.44Å; I22-L26 WeakPolarHBondContact O-CG 3.45Å; I22-L26 PolarHBondContact O-N 3.02Å; Q23-L26 PolarHBondContact O-N 3.22Å; E24-L26 PolarHBondContact O-N 3.09Å; L26-N31 HydrophobicContact CD2-CB 4.44Å; L26-F52 HydrophobicContact CD2-CD1 3.63Å; L26-F52 HydrophobicContact CD2-CD2 4.34Å; L26-F52 HydrophobicContact CD2-CE1 3.67Å; L26-F52 HydrophobicContact CD2-CE2 4.37Å; L26-F52 HydrophobicContact CD2-CG 3.97Å; L26-F52 HydrophobicContact CD2-CZ 4.05Å; L26-F52 HydrophobicContact CG-CD1 4.44Å; L26-F52 HydrophobicContact CG-CE1 4.01Å; L26-F52 HydrophobicContact CG-CZ 4.25Å; L26-V74 HydrophobicContact CD1-CG1 3.52Å
27	R	95.7	Very high	96.2	Very high	152 Å²	152	46.1 Å²	46.1	57%	0.574	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-25.4	170.8	-64.3	-178.6	-174.3	156.9	7.8	112.6	Q23 E24 L25 K32	Q23-R27 WeakPolarHBondContact O-CG 3.15Å; Q23-R27 PolarHBondContact O-N 3.17Å; E24-R27 VanDerWaalsContact O-CB 3.24Å; E24-R27 WeakPolarHBondContact O-CB 3.46Å; E24-R27 PolarHBondContact O-N 3.09Å; E24-R27 WeakPolarHBondContact OE1-CD 3.43Å; E24-R27 IonicContact OE1-CZ 2.76Å; E24-R27 IonicContact OE1-NE 3.97Å; E24-R27 IonicContact OE1-NH1 3.11Å; E24-R27 PolarHBondContact OE1-NH1 3.44Å; E24-R27 IonicContact OE2-CZ 3.74Å; E24-R27 IonicContact OE2-NE 3.54Å; E24-R27 IonicContact OE2-NH1 3.93Å; E24-R27 PolarHBondContact OE2-NH1 3.41Å; E24-R27 IonicContact OE2-NH2 3.78Å; L25-R27 PolarHBondContact O-N 3.32Å; R27-K32 PolarHBondContact O-NZ 3.12Å
28	D	95.5	Very high	96.3	Very high	87 Å²	87	49.1 Å²	49.1	47%	0.465	23%	0.234	S	C	.	.	S	Bend	trans	-60.1	137	175.5	-54	-30.7	0	0	0	110.6	L25 D30 N31 K32	L25-D28 PolarHBondContact O-N 2.97Å; D28-D30 VanDerWaalsContact C-N 3.35Å; D28-D30 PolarHBondContact O-N 3.41Å; D28-N31 HydrophobicContact CB-CB 4.17Å; D28-N31 PolarHBondContact O-N 3.4Å; D28-N31 PolarHBondContact OD2-ND2 2.98Å; D28-K32 PolarHBondContact O-N 3.24Å
29	D	97.1	Very high	96.4	Very high	121 Å²	121	49.8 Å²	49.8	65%	0.647	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-61.8	-39.7	-175	-69.3	-49.6	0	0	0	113.2	N31 K32 Y33	D29-N31 PolarHBondContact O-N 2.88Å; D29-K32 WeakPolarHBondContact O-CB 3.49Å; D29-K32 PolarHBondContact O-N 3.38Å; D29-K32 VanDerWaalsContact O-N 3.14Å; D29-K32 WeakPolarHBondContact OD1-CE 3.11Å; D29-K32 IonicContact OD1-NZ 2.88Å; D29-Y33 WeakPolarHBondContact O-CD2 3.4Å
30	D	97.1	Very high	96.6	Very high	52 Å²	52	56.2 Å²	56.2	28%	0.278	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-62.1	-30.5	174	-85.6	-49.5	0	0	0	113.5	D28 K32 N92 S93 R96	D28-D30 VanDerWaalsContact C-N 3.35Å; D28-D30 PolarHBondContact O-N 3.41Å; D30-K32 VanDerWaalsContact C-N 3.29Å; D30-N92 HydrophobicContact CB-CB 4.11Å; D30-N92 WeakPolarHBondContact O-CB 3.29Å; D30-N92 PolarHBondContact O-ND2 3.01Å; D30-S93 WeakPolarHBondContact OD2-CA 3.36Å; D30-S93 WeakPolarHBondContact OD2-CB 3.44Å; D30-S93 PolarHBondContact OD2-OG 2.63Å; D30-R96 IonicContact OD1-CZ 3.63Å; D30-R96 IonicContact OD1-NH1 2.69Å; D30-R96 PolarHBondContact OD1-NH1 3.33Å
31	N	97.9	Very high	96.7	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.016	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-82.7	-7.1	-179.9	-65.1	-25.4	0	0	0	112.3	L25 L26 D28 D29 Y33 P42 F52 N92	L25-N31 VanDerWaalsContact O-CB 3.27Å; L25-N31 WeakPolarHBondContact O-CB 3.32Å; L25-N31 PolarHBondContact O-ND2 3.04Å; L26-N31 HydrophobicContact CD2-CB 4.44Å; D28-N31 HydrophobicContact CB-CB 4.17Å; D28-N31 PolarHBondContact O-N 3.4Å; D28-N31 PolarHBondContact OD2-ND2 2.98Å; D29-N31 PolarHBondContact O-N 2.88Å; N31-Y33 VanDerWaalsContact C-N 3.25Å; N31-Y33 PolarHBondContact O-N 3.38Å; N31-P42 WeakPolarHBondContact O-CG 3.24Å; N31-F52 HydrophobicContact CB-CD2 3.79Å; N31-F52 HydrophobicContact CB-CE2 4.01Å; N31-F52 WeakPolarHBondContact OD1-CD2 3.44Å; N31-N92 VanDerWaalsContact OD1-CB 3.29Å; N31-N92 WeakPolarHBondContact OD1-CB 3.34Å; N31-N92 PolarHBondContact OD1-N 3.06Å
32	K	97.5	Very high	96.8	Very high	80 Å²	80	54.1 Å²	54.1	35%	0.348	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-75.4	-10.7	172.6	-55.7	-174.2	-160.3	-53.8	0	113.7	R27 D28 D29 D30 G41 P42	R27-K32 PolarHBondContact O-NZ 3.12Å; D28-K32 PolarHBondContact O-N 3.24Å; D29-K32 WeakPolarHBondContact O-CB 3.49Å; D29-K32 PolarHBondContact O-N 3.38Å; D29-K32 VanDerWaalsContact O-N 3.14Å; D29-K32 WeakPolarHBondContact OD1-CE 3.11Å; D29-K32 IonicContact OD1-NZ 2.88Å; D30-K32 VanDerWaalsContact C-N 3.29Å; K32-G41 PolarHBondContact O-N 2.9Å; K32-P42 VanDerWaalsContact C-CD 3.47Å; K32-P42 VanDerWaalsContact O-CD 3.25Å; K32-P42 WeakPolarHBondContact O-CD 3.49Å
33	Y	98	Very high	96.9	Very high	98 Å²	98	60.5 Å²	60.5	38%	0.384	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-123.5	149.1	-176.9	-60.1	-91.2	0	0	0	110.7	D29 N31 A35 D38 K40 N92	D29-Y33 WeakPolarHBondContact O-CD2 3.4Å; N31-Y33 VanDerWaalsContact C-N 3.25Å; N31-Y33 PolarHBondContact O-N 3.38Å; Y33-A35 PolarHBondContact O-N 3.3Å; Y33-D38 WeakPolarHBondContact CD1-O 3.44Å; Y33-K40 HydrophobicContact CD1-CG 3.93Å; Y33-K40 HydrophobicContact CE1-CD 4.35Å; Y33-K40 HydrophobicContact CE1-CG 3.63Å; Y33-N92 PolarHBondContact O-ND2 2.96Å
34	C	98.2	Very high	97.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.279	C	S	.	.			trans	-69.2	127.1	176.6	177.1	0	0	0	0	111.4	D36 C37 D38 A39 C54 C57	C34-D36 PolarHBondContact O-N 3.07Å; C34-C37 PolarHBondContact O-N 2.81Å; C34-C37 VanDerWaalsContact SG-SG 3.62Å; C34-D38 VanDerWaalsContact O-CA 3.27Å; C34-D38 WeakPolarHBondContact O-CA 3.43Å; C34-D38 PolarHBondContact O-N 2.91Å; C34-A39 HydrophobicContact CB-CB 4.21Å; C34-A39 WeakPolarHBondContact CB-O 3.41Å; C34-A39 PolarHBondContact N-O 2.87Å; C34-C54 HydrophobicContact CB-CB 3.96Å; C34-C54 PolarHBondContact SG-N 3.49Å; C34-C57 PolarHBondContact SG-SG 3.28Å
35	A	98	Very high	97.2	Very high	5 Å²	5	54 Å²	54	4%	0.041	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-16.1	-176.2	0	0	0	0	0	116.1	Y33 I51 F52 L53 R109 K123	Y33-A35 PolarHBondContact O-N 3.3Å; A35-I51 HydrophobicContact CB-CB 4.02Å; A35-I51 HydrophobicContact CB-CD1 4.39Å; A35-I51 HydrophobicContact CB-CG2 4.26Å; A35-F52 PolarHBondContact N-O 2.86Å; A35-L53 HydrophobicContact CB-CD2 4.33Å; A35-R109 PolarHBondContact O-NH1 3.32Å; A35-K123 PolarHBondContact O-NZ 2.79Å
36	D	97.9	Very high	97.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-24.5	-175.2	-56.6	-45.9	0	0	0	115.8	C34 L53 C57 H61 R109 L116 F119 I120 K123 Y124	C34-D36 PolarHBondContact O-N 3.07Å; D36-L53 WeakPolarHBondContact OD2-CD2 3.42Å; D36-C57 HydrophobicContact CB-CB 4.44Å; D36-H61 IonicContact OD2-CD2 3.27Å; D36-H61 IonicContact OD2-NE2 2.84Å; D36-H61 PolarHBondContact OD2-NE2 2.64Å; D36-H61 VanDerWaalsContact OD2-NE2 3.07Å; D36-R109 WeakPolarHBondContact O-CD 3.18Å; D36-R109 VanDerWaalsContact O-CG 3.22Å; D36-R109 WeakPolarHBondContact O-CG 3.14Å; D36-R109 PolarHBondContact O-NH1 3.03Å; D36-L116 HydrophobicContact CB-CD1 4.31Å; D36-L116 WeakPolarHBondContact O-CD1 3.1Å; D36-F119 HydrophobicContact CB-CE1 4.41Å; D36-I120 HydrophobicContact CB-CD1 3.82Å; D36-I120 HydrophobicContact CB-CG1 3.81Å; D36-K123 IonicContact OD1-NZ 3.92Å; D36-K123 PolarHBondContact OD1-NZ 2.97Å; D36-Y124 VanDerWaalsContact OD1-CE2 3.3Å; D36-Y124 WeakPolarHBondContact OD1-CE2 3.31Å; D36-Y124 PolarHBondContact OD1-OH 2.76Å
37	C	97.1	Very high	97.4	Very high	6 Å²	6	54.2 Å²	54.2	4%	0.041	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	3.4	177.3	65.6	0	0	0	0	114.4	C34 A39 C54 C57 R109 L116	C34-C37 PolarHBondContact O-N 2.81Å; C34-C37 VanDerWaalsContact SG-SG 3.62Å; C37-A39 PolarHBondContact O-N 2.55Å; C37-A39 VanDerWaalsContact SG-CB 3.55Å; C37-C54 PolarHBondContact SG-SG 2.73Å; C37-C57 PolarHBondContact SG-SG 3.28Å; C37-R109 VanDerWaalsContact C-CD 3.42Å; C37-R109 VanDerWaalsContact CA-CD 3.42Å; C37-L116 HydrophobicContact CB-CD1 3.97Å; C37-L116 HydrophobicContact CB-CD2 4.04Å
38	D	96.5	Very high	97.5	Very high	65 Å²	65	49.6 Å²	49.6	35%	0.348	24%	0.243	S	C	.	.			trans	51.4	20.5	-174.5	-60.9	-37	0	0	0	114.9	Y33 C34 K40 R96 R109	Y33-D38 WeakPolarHBondContact CD1-O 3.44Å; C34-D38 VanDerWaalsContact O-CA 3.27Å; C34-D38 WeakPolarHBondContact O-CA 3.43Å; C34-D38 PolarHBondContact O-N 2.91Å; D38-K40 PolarHBondContact O-N 2.76Å; D38-R96 IonicContact OD1-NH2 3.61Å; D38-R109 VanDerWaalsContact CG-NE 3.28Å; D38-R109 IonicContact OD1-CZ 3.07Å; D38-R109 IonicContact OD1-NE 3.75Å; D38-R109 IonicContact OD1-NH2 3.18Å; D38-R109 WeakPolarHBondContact OD2-CD 3.03Å; D38-R109 IonicContact OD2-CZ 3.84Å; D38-R109 IonicContact OD2-NE 2.86Å; D38-R109 PolarHBondContact OD2-NE 3.04Å; D38-R109 IonicContact OD2-NH2 3.58Å
39	A	97.1	Very high	97.6	Very high	29 Å²	29	45.8 Å²	45.8	24%	0.24	22%	0.222	C	C	.	.			trans	-64.8	131.5	172	0	0	0	0	0	111	C34 C37 C54	C34-A39 HydrophobicContact CB-CB 4.21Å; C34-A39 WeakPolarHBondContact CB-O 3.41Å; C34-A39 PolarHBondContact N-O 2.87Å; C37-A39 PolarHBondContact O-N 2.55Å; C37-A39 VanDerWaalsContact SG-CB 3.55Å; A39-C54 HydrophobicContact CB-CB 4.09Å
40	K	97.3	Very high	97.6	Very high	172 Å²	172	40 Å²	40	75%	0.748	19%	0.192	S	C	*	.	B	Isolated β-bridge	trans	-62.8	146.2	-177.7	-67.5	-178.6	178	-178.3	0	112.8	Y33 D38	Y33-K40 HydrophobicContact CD1-CG 3.93Å; Y33-K40 HydrophobicContact CE1-CD 4.35Å; Y33-K40 HydrophobicContact CE1-CG 3.63Å; D38-K40 PolarHBondContact O-N 2.76Å
41	G	96	Very high	97.7	Very high	36 Å²	36	37.5 Å²	37.5	37%	0.371	18%	0.178	S	C	.	.	S	Bend	trans	66	58.2	170.5	0	0	0	0	0	114.8	K32 R43	K32-G41 PolarHBondContact O-N 2.9Å; G41-R43 PolarHBondContact O-N 3.39Å
42	P	97.8	Very high	97.7	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	18%	0.178	C	C	.	.			trans	-58.4	135.1	176	27.6	-35.4	0	0	0	111.7	N31 K32 F52 L53	N31-P42 WeakPolarHBondContact O-CG 3.24Å; K32-P42 VanDerWaalsContact C-CD 3.47Å; K32-P42 VanDerWaalsContact O-CD 3.25Å; K32-P42 WeakPolarHBondContact O-CD 3.49Å; P42-F52 HydrophobicContact CB-CB 3.9Å; P42-F52 HydrophobicContact CG-CB 3.73Å; P42-L53 CarbonylContact C-O 3.47Å; P42-L53 WeakPolarHBondContact CA-O 3.38Å; P42-L53 WeakPolarHBondContact CB-O 3.5Å
43	R	97.9	Very high	97.8	Very high	137 Å²	137	33.6 Å²	33.6	52%	0.517	16%	0.161	S	C	.	.			trans	-123.5	8.4	180	-58.9	-59.8	170.7	-176.5	-2.9	113.3	G41 L53 V74	G41-R43 PolarHBondContact O-N 3.39Å; R43-L53 PolarHBondContact N-O 2.9Å; R43-V74 VanDerWaalsContact C-CG2 3.45Å; R43-V74 WeakPolarHBondContact O-CB 3.44Å; R43-V74 WeakPolarHBondContact O-CG2 3.42Å; R43-V74 PolarHBondContact O-N 3.37Å
44	W	98.6	Very high	97.8	Very high	43 Å²	43	29.6 Å²	29.6	16%	0.163	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	164.4	172.7	-64.5	83.9	0	0	0	108.5	L53 I55 A58 V71 K72	W44-L53 HydrophobicContact CB-CB 4.27Å; W44-L53 WeakPolarHBondContact CB-O 3.34Å; W44-L53 PolarHBondContact N-O 3.27Å; W44-L53 PolarHBondContact O-N 3.28Å; W44-I55 HydrophobicContact CZ2-CD1 4.5Å; W44-A58 HydrophobicContact CB-CB 3.51Å; W44-A58 HydrophobicContact CD2-CB 3.95Å; W44-A58 HydrophobicContact CE3-CB 4.39Å; W44-A58 HydrophobicContact CG-CB 3.55Å; W44-V71 HydrophobicContact CE3-CG1 3.76Å; W44-V71 HydrophobicContact CZ3-CG1 4.44Å; W44-K72 CarbonylContact C-O 3.5Å; W44-K72 VanDerWaalsContact CA-O 3.3Å; W44-K72 WeakPolarHBondContact CA-O 3.47Å; W44-K72 VanDerWaalsContact CE3-C 3.47Å
45	A	98.6	Very high	97.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	148.7	175.1	0	0	0	0	0	110.2	I51 F52 V71 K72 V74 W79 M87	A45-I51 CarbonylContact C-O 3.59Å; A45-I51 WeakPolarHBondContact CA-O 3.44Å; A45-I51 VanDerWaalsContact CB-O 3.28Å; A45-I51 WeakPolarHBondContact CB-O 3.5Å; A45-F52 HydrophobicContact CB-CD1 4.08Å; A45-F52 HydrophobicContact CB-CE1 4.48Å; A45-V71 CarbonylContact O-C 3.55Å; A45-V71 WeakPolarHBondContact O-CA 3.14Å; A45-K72 PolarHBondContact N-O 3.31Å; A45-K72 PolarHBondContact O-N 3.38Å; A45-V74 HydrophobicContact CB-CG2 4.49Å; A45-W79 HydrophobicContact CB-CH2 3.87Å; A45-W79 HydrophobicContact CB-CZ2 4.28Å; A45-M87 HydrophobicContact CB-CE 3.8Å; A45-M87 HydrophobicContact CB-SD 4.04Å
46	S	98.5	Very high	97.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	100.3	164.9	-173.8	0	0	0	0	108.1	N48 I49 G50 I51 S69 K70	S46-N48 VanDerWaalsContact C-N 3.33Å; S46-N48 PolarHBondContact O-N 2.78Å; S46-N48 PolarHBondContact OG-OD1 3.12Å; S46-I49 PolarHBondContact O-N 3.23Å; S46-G50 PolarHBondContact O-N 3.47Å; S46-I51 PolarHBondContact N-O 3.14Å; S46-I51 PolarHBondContact O-N 3.44Å; S46-S69 PolarHBondContact OG-OG 2.99Å; S46-K70 WeakPolarHBondContact CA-O 3.27Å; S46-K70 PolarHBondContact OG-N 3.25Å
47	W	97.8	Very high	97.8	Very high	51 Å²	51	39.9 Å²	39.9	19%	0.193	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-24.1	-165.2	70.1	-100.7	0	0	0	113.8	K70 W79 Q83 V86 M87	W47-K70 HydrophobicContact CH2-CD 4.18Å; W47-K70 HydrophobicContact CZ2-CB 4.27Å; W47-K70 HydrophobicContact CZ2-CD 3.53Å; W47-K70 PolarHBondContact N-O 3.04Å; W47-K70 VanDerWaalsContact N-O 3.07Å; W47-W79 HydrophobicContact CB-CH2 3.96Å; W47-W79 HydrophobicContact CB-CZ3 3.65Å; W47-Q83 HydrophobicContact CB-CB 4.4Å; W47-Q83 HydrophobicContact CD2-CB 4.32Å; W47-Q83 HydrophobicContact CD2-CG 3.66Å; W47-Q83 HydrophobicContact CE3-CB 4.25Å; W47-Q83 HydrophobicContact CE3-CG 3.64Å; W47-Q83 HydrophobicContact CG-CB 4.4Å; W47-Q83 HydrophobicContact CG-CG 4.11Å; W47-Q83 HydrophobicContact CH2-CG 4.39Å; W47-Q83 HydrophobicContact CZ2-CG 4.41Å; W47-Q83 HydrophobicContact CZ3-CG 4.02Å; W47-V86 WeakPolarHBondContact O-CG1 3.04Å; W47-M87 HydrophobicContact CB-SD 4.35Å
48	N	97.3	Very high	97.9	Very high	56 Å²	56	39.6 Å²	39.6	30%	0.299	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-19.5	177.6	72.8	-69.5	0	0	0	112.8	S46 I68 S69 K70	S46-N48 VanDerWaalsContact C-N 3.33Å; S46-N48 PolarHBondContact O-N 2.78Å; S46-N48 PolarHBondContact OG-OD1 3.12Å; N48-I68 PolarHBondContact ND2-O 3.34Å; N48-S69 WeakPolarHBondContact OD1-CA 3.42Å; N48-K70 HydrophobicContact CB-CB 4.4Å; N48-K70 HydrophobicContact CB-CD 4.36Å; N48-K70 HydrophobicContact CB-CG 4.45Å; N48-K70 WeakPolarHBondContact OD1-CB 3.31Å; N48-K70 PolarHBondContact OD1-N 2.89Å
49	I	97.4	Very high	97.9	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-34.5	172	-56	177.6	0	0	0	109.3	S46 I51 M90 Y99 Y124	S46-I49 PolarHBondContact O-N 3.23Å; I49-I51 HydrophobicContact CB-CD1 4.36Å; I49-I51 HydrophobicContact CB-CG1 4.17Å; I49-I51 HydrophobicContact CD1-CD1 4.47Å; I49-I51 HydrophobicContact CG2-CD1 3.94Å; I49-I51 HydrophobicContact CG2-CG1 4.06Å; I49-I51 HydrophobicContact CG2-CG2 4.06Å; I49-M90 WeakPolarHBondContact O-CG 3.42Å; I49-Y99 HydrophobicContact CG2-CD2 4.45Å; I49-Y99 HydrophobicContact CG2-CE2 3.68Å; I49-Y124 HydrophobicContact CD1-CD1 3.92Å; I49-Y124 HydrophobicContact CD1-CE1 4.3Å; I49-Y124 HydrophobicContact CD1-CG 4.14Å; I49-Y124 HydrophobicContact CG2-CD1 4.18Å; I49-Y124 HydrophobicContact CG2-CE1 3.89Å
50	G	97.8	Very high	98	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.8	31	178.5	0	0	0	0	0	114.4	S46 G91	S46-G50 PolarHBondContact O-N 3.47Å; G50-G91 CarbonylContact O-C 3.49Å; G50-G91 WeakPolarHBondContact O-CA 3.37Å; G50-G91 PolarHBondContact O-N 3.03Å
51	I	98.5	Very high	98.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.2	-173.5	58.4	177.7	0	0	0	113.6	A35 A45 S46 I49 L53 N92 A95 Y124	A35-I51 HydrophobicContact CB-CB 4.02Å; A35-I51 HydrophobicContact CB-CD1 4.39Å; A35-I51 HydrophobicContact CB-CG2 4.26Å; A45-I51 CarbonylContact C-O 3.59Å; A45-I51 WeakPolarHBondContact CA-O 3.44Å; A45-I51 VanDerWaalsContact CB-O 3.28Å; A45-I51 WeakPolarHBondContact CB-O 3.5Å; S46-I51 PolarHBondContact N-O 3.14Å; S46-I51 PolarHBondContact O-N 3.44Å; I49-I51 HydrophobicContact CB-CD1 4.36Å; I49-I51 HydrophobicContact CB-CG1 4.17Å; I49-I51 HydrophobicContact CD1-CD1 4.47Å; I49-I51 HydrophobicContact CG2-CD1 3.94Å; I49-I51 HydrophobicContact CG2-CG1 4.06Å; I49-I51 HydrophobicContact CG2-CG2 4.06Å; I51-L53 HydrophobicContact CD1-CD1 4.47Å; I51-L53 HydrophobicContact CD1-CD2 3.87Å; I51-L53 HydrophobicContact CD1-CG 4.34Å; I51-L53 HydrophobicContact CG1-CD2 4.26Å; I51-L53 HydrophobicContact CG1-CG 4.3Å; I51-N92 WeakPolarHBondContact CA-OD1 3.48Å; I51-A95 HydrophobicContact CG2-CB 3.22Å; I51-Y124 HydrophobicContact CD1-CE1 4.03Å; I51-Y124 HydrophobicContact CD1-CE2 4.31Å; I51-Y124 WeakPolarHBondContact CD1-OH 3.33Å
52	F	98.7	Very high	98.2	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	134	173	-65.6	-81	0	0	0	112.2	I22 L25 L26 N31 A35 P42 A45 V74 M87 N92	I22-F52 HydrophobicContact CG2-CE1 4.21Å; L25-F52 HydrophobicContact CB-CE2 4.13Å; L25-F52 HydrophobicContact CB-CZ 3.86Å; L25-F52 HydrophobicContact CD1-CZ 4.43Å; L26-F52 HydrophobicContact CD2-CD1 3.63Å; L26-F52 HydrophobicContact CD2-CD2 4.34Å; L26-F52 HydrophobicContact CD2-CE1 3.67Å; L26-F52 HydrophobicContact CD2-CE2 4.37Å; L26-F52 HydrophobicContact CD2-CG 3.97Å; L26-F52 HydrophobicContact CD2-CZ 4.05Å; L26-F52 HydrophobicContact CG-CD1 4.44Å; L26-F52 HydrophobicContact CG-CE1 4.01Å; L26-F52 HydrophobicContact CG-CZ 4.25Å; N31-F52 HydrophobicContact CB-CD2 3.79Å; N31-F52 HydrophobicContact CB-CE2 4.01Å; N31-F52 WeakPolarHBondContact OD1-CD2 3.44Å; A35-F52 PolarHBondContact N-O 2.86Å; P42-F52 HydrophobicContact CB-CB 3.9Å; P42-F52 HydrophobicContact CG-CB 3.73Å; A45-F52 HydrophobicContact CB-CD1 4.08Å; A45-F52 HydrophobicContact CB-CE1 4.48Å; F52-V74 HydrophobicContact CD1-CG2 4.01Å; F52-V74 HydrophobicContact CE1-CG2 4.15Å; F52-M87 HydrophobicContact CD1-CE 3.88Å; F52-M87 HydrophobicContact CD2-CE 3.77Å; F52-M87 HydrophobicContact CE1-CE 3.59Å; F52-M87 HydrophobicContact CE2-CE 3.48Å; F52-M87 VanDerWaalsContact CE2-CE 3.48Å; F52-M87 HydrophobicContact CG-CE 3.97Å; F52-M87 HydrophobicContact CZ-CE 3.39Å; F52-N92 PolarHBondContact N-OD1 2.84Å
53	L	98.6	Very high	98.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.2	-169.5	-61.3	178.3	0	0	0	112.3	A35 D36 P42 R43 W44 I51 C57 A58 H61	A35-L53 HydrophobicContact CB-CD2 4.33Å; D36-L53 WeakPolarHBondContact OD2-CD2 3.42Å; P42-L53 CarbonylContact C-O 3.47Å; P42-L53 WeakPolarHBondContact CA-O 3.38Å; P42-L53 WeakPolarHBondContact CB-O 3.5Å; R43-L53 PolarHBondContact N-O 2.9Å; W44-L53 HydrophobicContact CB-CB 4.27Å; W44-L53 WeakPolarHBondContact CB-O 3.34Å; W44-L53 PolarHBondContact N-O 3.27Å; W44-L53 PolarHBondContact O-N 3.28Å; I51-L53 HydrophobicContact CD1-CD1 4.47Å; I51-L53 HydrophobicContact CD1-CD2 3.87Å; I51-L53 HydrophobicContact CD1-CG 4.34Å; I51-L53 HydrophobicContact CG1-CD2 4.26Å; I51-L53 HydrophobicContact CG1-CG 4.3Å; L53-C57 HydrophobicContact CB-CB 4.32Å; L53-C57 HydrophobicContact CD2-CB 4.06Å; L53-A58 HydrophobicContact CB-CB 4.45Å; L53-H61 HydrophobicContact CD1-CB 4.18Å
54	C	98.3	Very high	98.1	Very high	14 Å²	14	32 Å²	32	10%	0.095	15%	0.152	C	C	.	.			trans	-76.5	166	162.9	76.9	0	0	0	0	110.3	C34 C37 A39 R56 C57 A58	C34-C54 HydrophobicContact CB-CB 3.96Å; C34-C54 PolarHBondContact SG-N 3.49Å; C37-C54 PolarHBondContact SG-SG 2.73Å; A39-C54 HydrophobicContact CB-CB 4.09Å; C54-R56 VanDerWaalsContact C-N 3.25Å; C54-R56 PolarHBondContact O-N 2.98Å; C54-C57 PolarHBondContact O-N 2.78Å; C54-C57 VanDerWaalsContact SG-SG 3.66Å; C54-A58 VanDerWaalsContact O-CB 3.3Å; C54-A58 WeakPolarHBondContact O-CB 3.2Å; C54-A58 PolarHBondContact O-N 3.32Å
55	I	98	Very high	98.1	Very high	120 Å²	120	31.1 Å²	31.1	62%	0.615	16%	0.156	S	C	*	.	H	α-helix	trans	-60.1	-31.8	-178.3	-168.2	165.3	0	0	0	113.7	W44 G59	W44-I55 HydrophobicContact CZ2-CD1 4.5Å; I55-G59 PolarHBondContact O-N 3.1Å
56	R	97.7	Very high	98.1	Very high	101 Å²	101	36.4 Å²	36.4	38%	0.381	19%	0.188	S	C	.	.	H	α-helix	trans	-64.9	-55.7	176.9	-60.7	-167.4	-67.7	154.5	-6.8	111.4	C54 A58 G59 I60 Q111 D113	C54-R56 VanDerWaalsContact C-N 3.25Å; C54-R56 PolarHBondContact O-N 2.98Å; R56-A58 VanDerWaalsContact C-N 3.28Å; R56-A58 PolarHBondContact O-N 3.18Å; R56-G59 WeakPolarHBondContact O-CA 3.35Å; R56-G59 PolarHBondContact O-N 3.28Å; R56-I60 PolarHBondContact O-N 3.29Å; R56-Q111 PolarHBondContact NH1-O 2.85Å; R56-D113 IonicContact NH1-OD1 2.76Å; R56-D113 PolarHBondContact NH1-OD1 3.26Å
57	C	98.5	Very high	98	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-37.5	176.6	-60.6	0	0	0	0	111.7	C34 D36 C37 L53 C54 G59 I60 H61 I120	C34-C57 PolarHBondContact SG-SG 3.28Å; D36-C57 HydrophobicContact CB-CB 4.44Å; C37-C57 PolarHBondContact SG-SG 3.28Å; L53-C57 HydrophobicContact CB-CB 4.32Å; L53-C57 HydrophobicContact CD2-CB 4.06Å; C54-C57 PolarHBondContact O-N 2.78Å; C54-C57 VanDerWaalsContact SG-SG 3.66Å; C57-G59 VanDerWaalsContact C-N 3.26Å; C57-G59 PolarHBondContact O-N 2.96Å; C57-I60 PolarHBondContact O-N 3.46Å; C57-H61 WeakPolarHBondContact O-CB 3.45Å; C57-H61 PolarHBondContact O-CD2 3.22Å; C57-H61 VanDerWaalsContact O-CD2 3.28Å; C57-H61 PolarHBondContact O-N 3.33Å; C57-I120 HydrophobicContact CB-CD1 4.19Å
58	A	98.4	Very high	98	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-33	174.3	0	0	0	0	0	113	W44 L53 C54 R56 R62 V71	W44-A58 HydrophobicContact CB-CB 3.51Å; W44-A58 HydrophobicContact CD2-CB 3.95Å; W44-A58 HydrophobicContact CE3-CB 4.39Å; W44-A58 HydrophobicContact CG-CB 3.55Å; L53-A58 HydrophobicContact CB-CB 4.45Å; C54-A58 VanDerWaalsContact O-CB 3.3Å; C54-A58 WeakPolarHBondContact O-CB 3.2Å; C54-A58 PolarHBondContact O-N 3.32Å; R56-A58 VanDerWaalsContact C-N 3.28Å; R56-A58 PolarHBondContact O-N 3.18Å; A58-R62 WeakPolarHBondContact O-CG 3.43Å; A58-R62 PolarHBondContact O-N 3.46Å; A58-V71 HydrophobicContact CB-CG1 3.89Å
59	G	98.1	Very high	98	Very high	25 Å²	25	40.1 Å²	40.1	26%	0.258	21%	0.206	S	C	.	.	H	α-helix	trans	-63.7	-53.1	170.3	0	0	0	0	0	111.9	I55 R56 C57 H61 R62 N63	I55-G59 PolarHBondContact O-N 3.1Å; R56-G59 WeakPolarHBondContact O-CA 3.35Å; R56-G59 PolarHBondContact O-N 3.28Å; C57-G59 VanDerWaalsContact C-N 3.26Å; C57-G59 PolarHBondContact O-N 2.96Å; G59-H61 VanDerWaalsContact C-N 3.3Å; G59-H61 PolarHBondContact O-N 2.89Å; G59-R62 WeakPolarHBondContact O-CB 3.4Å; G59-R62 PolarHBondContact O-N 3.48Å; G59-N63 PolarHBondContact O-N 3.45Å
60	I	98.3	Very high	98.1	Very high	13 Å²	13	44 Å²	44	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-58.1	-42.5	178	-60	169.2	0	0	0	111.1	R56 C57 R62 N63 L64 L116 E117 I120	R56-I60 PolarHBondContact O-N 3.29Å; C57-I60 PolarHBondContact O-N 3.46Å; I60-R62 PolarHBondContact O-N 2.89Å; I60-N63 WeakPolarHBondContact O-CA 3.45Å; I60-N63 WeakPolarHBondContact O-CB 3.41Å; I60-N63 PolarHBondContact O-N 3.21Å; I60-L64 PolarHBondContact O-N 3.36Å; I60-L116 HydrophobicContact CD1-CB 4.17Å; I60-L116 HydrophobicContact CD1-CD2 3.9Å; I60-L116 HydrophobicContact CD1-CG 3.76Å; I60-E117 HydrophobicContact CD1-CB 4.34Å; I60-E117 HydrophobicContact CG1-CB 4.49Å; I60-E117 HydrophobicContact CG2-CB 3.9Å; I60-E117 HydrophobicContact CG2-CG 3.95Å; I60-I120 HydrophobicContact CB-CD1 4.1Å; I60-I120 HydrophobicContact CD1-CD1 3.92Å; I60-I120 HydrophobicContact CG2-CB 4.04Å; I60-I120 HydrophobicContact CG2-CD1 3.9Å; I60-I120 HydrophobicContact CG2-CG2 3.79Å
61	H	98.6	Very high	98.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-21.1	177.4	-91.8	-103.5	0	0	0	114.2	D36 L53 C57 G59 S69 V71 Y124	D36-H61 IonicContact OD2-CD2 3.27Å; D36-H61 IonicContact OD2-NE2 2.84Å; D36-H61 PolarHBondContact OD2-NE2 2.64Å; D36-H61 VanDerWaalsContact OD2-NE2 3.07Å; L53-H61 HydrophobicContact CD1-CB 4.18Å; C57-H61 WeakPolarHBondContact O-CB 3.45Å; C57-H61 PolarHBondContact O-CD2 3.22Å; C57-H61 VanDerWaalsContact O-CD2 3.28Å; C57-H61 PolarHBondContact O-N 3.33Å; G59-H61 VanDerWaalsContact C-N 3.3Å; G59-H61 PolarHBondContact O-N 2.89Å; H61-S69 WeakPolarHBondContact CB-OG 3.41Å; H61-S69 WeakPolarHBondContact ND1-CB 3.48Å; H61-S69 PolarHBondContact ND1-OG 3.08Å; H61-S69 WeakPolarHBondContact O-CB 3.47Å; H61-V71 HydrophobicContact CB-CG2 3.5Å; H61-V71 VanDerWaalsContact CB-CG2 3.5Å; H61-Y124 AromaticContact CE1-CD2 3.47Å; H61-Y124 VanDerWaalsContact CE1-CD2 3.47Å; H61-Y124 WeakPolarHBondContact CE1-CD2 3.5Å; H61-Y124 AromaticContact CE1-CE2 3.33Å; H61-Y124 WeakPolarHBondContact CE1-CE2 3.44Å; H61-Y124 AromaticContact CE1-CZ 3.97Å; H61-Y124 AromaticContact NE2-CD2 3.65Å; H61-Y124 AromaticContact NE2-CE2 3.26Å; H61-Y124 VanDerWaalsContact NE2-CE2 3.26Å; H61-Y124 WeakPolarHBondContact NE2-CE2 3.31Å
62	R	98.1	Very high	98.1	Very high	135 Å²	135	47 Å²	47	51%	0.509	24%	0.238	S	C	.	.	H	α-helix	trans	-75.8	-35.7	170.2	-65.5	163.8	-173.2	177	3	111.2	A58 G59 I60 L64 G65 V71	A58-R62 WeakPolarHBondContact O-CG 3.43Å; A58-R62 PolarHBondContact O-N 3.46Å; G59-R62 WeakPolarHBondContact O-CB 3.4Å; G59-R62 PolarHBondContact O-N 3.48Å; I60-R62 PolarHBondContact O-N 2.89Å; R62-L64 PolarHBondContact O-N 3.5Å; R62-G65 PolarHBondContact O-N 3.14Å; R62-V71 HydrophobicContact CG-CB 4.33Å; R62-V71 HydrophobicContact CG-CG2 4.24Å
63	N	97.7	Very high	98	Very high	102 Å²	102	47.2 Å²	47.2	55%	0.545	24%	0.24	S	C	.	.	H	α-helix	trans	-70.7	-13.2	178.4	-59.8	-2.9	0	0	0	113.6	G59 I60 G65 R121	G59-N63 PolarHBondContact O-N 3.45Å; I60-N63 WeakPolarHBondContact O-CA 3.45Å; I60-N63 WeakPolarHBondContact O-CB 3.41Å; I60-N63 PolarHBondContact O-N 3.21Å; N63-G65 VanDerWaalsContact C-N 3.34Å; N63-R121 PolarHBondContact O-NH2 3.07Å
64	L	97.6	Very high	98	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-25.1	167	-53.7	179.9	0	0	0	112.2	I60 R62 H67 I68 I120 R121	I60-L64 PolarHBondContact O-N 3.36Å; R62-L64 PolarHBondContact O-N 3.5Å; L64-H67 PolarHBondContact O-CE1 3.05Å; L64-H67 VanDerWaalsContact O-CE1 3.25Å; L64-I68 HydrophobicContact CB-CB 4.11Å; L64-I68 HydrophobicContact CB-CD1 4.29Å; L64-I68 HydrophobicContact CB-CG2 4.15Å; L64-I68 HydrophobicContact CD1-CG2 3.91Å; L64-I120 HydrophobicContact CD1-CG2 3.87Å; L64-I120 HydrophobicContact CD2-CG2 4.38Å; L64-I120 HydrophobicContact CG-CG2 4.46Å; L64-R121 HydrophobicContact CD2-CG 3.6Å
65	G	97.5	Very high	97.8	Very high	23 Å²	23	50.6 Å²	50.6	24%	0.237	26%	0.257	C	S	.	.			trans	84.2	157.4	-175.6	0	0	0	0	0	114.8	R62 N63 H67 I68 S69	R62-G65 PolarHBondContact O-N 3.14Å; N63-G65 VanDerWaalsContact C-N 3.34Å; G65-H67 PolarHBondContact O-N 3.14Å; G65-I68 PolarHBondContact O-N 3.08Å; G65-S69 PolarHBondContact O-N 3.36Å
66	V	97.8	Very high	97.6	Very high	112 Å²	112	51.9 Å²	51.9	68%	0.679	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-9.4	-170.5	-60.3	0	0	0	0	115.6	S69 K70	V66-S69 WeakPolarHBondContact CA-O 3.43Å; V66-K70 WeakPolarHBondContact O-CE 3.2Å; V66-K70 WeakPolarHBondContact O-CG 3.42Å
67	H	97.5	Very high	97.6	Very high	153 Å²	153	50.2 Å²	50.2	71%	0.708	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-23.5	176.1	65.6	-75.5	0	0	0	112.2	L64 G65	L64-H67 PolarHBondContact O-CE1 3.05Å; L64-H67 VanDerWaalsContact O-CE1 3.25Å; G65-H67 PolarHBondContact O-N 3.14Å
68	I	97.5	Very high	97.4	Very high	29 Å²	29	54.1 Å²	54.1	15%	0.149	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-48.9	173.5	-64.3	166.5	0	0	0	110.3	N48 L64 G65 E125	N48-I68 PolarHBondContact ND2-O 3.34Å; L64-I68 HydrophobicContact CB-CB 4.11Å; L64-I68 HydrophobicContact CB-CD1 4.29Å; L64-I68 HydrophobicContact CB-CG2 4.15Å; L64-I68 HydrophobicContact CD1-CG2 3.91Å; G65-I68 PolarHBondContact O-N 3.08Å; I68-E125 HydrophobicContact CD1-CB 3.82Å; I68-E125 HydrophobicContact CD1-CG 3.71Å
69	S	98.3	Very high	97.3	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.021	29%	0.288	C	S	.	.			trans	-141	132.7	-170	175.4	0	0	0	0	112.8	S46 N48 H61 G65 V66	S46-S69 PolarHBondContact OG-OG 2.99Å; N48-S69 WeakPolarHBondContact OD1-CA 3.42Å; H61-S69 WeakPolarHBondContact CB-OG 3.41Å; H61-S69 WeakPolarHBondContact ND1-CB 3.48Å; H61-S69 PolarHBondContact ND1-OG 3.08Å; H61-S69 WeakPolarHBondContact O-CB 3.47Å; G65-S69 PolarHBondContact O-N 3.36Å; V66-S69 WeakPolarHBondContact CA-O 3.43Å
70	K	98.4	Very high	97.1	Very high	86 Å²	86	56 Å²	56	37%	0.374	29%	0.293	S	S	.	.			trans	-119.7	95.2	-178.5	-61.5	-177	-178.1	176.5	0	109.1	S46 W47 N48 V66	S46-K70 WeakPolarHBondContact CA-O 3.27Å; S46-K70 PolarHBondContact OG-N 3.25Å; W47-K70 HydrophobicContact CH2-CD 4.18Å; W47-K70 HydrophobicContact CZ2-CB 4.27Å; W47-K70 HydrophobicContact CZ2-CD 3.53Å; W47-K70 PolarHBondContact N-O 3.04Å; W47-K70 VanDerWaalsContact N-O 3.07Å; N48-K70 HydrophobicContact CB-CB 4.4Å; N48-K70 HydrophobicContact CB-CD 4.36Å; N48-K70 HydrophobicContact CB-CG 4.45Å; N48-K70 WeakPolarHBondContact OD1-CB 3.31Å; N48-K70 PolarHBondContact OD1-N 2.89Å; V66-K70 WeakPolarHBondContact O-CE 3.2Å; V66-K70 WeakPolarHBondContact O-CG 3.42Å
71	V	98.5	Very high	97	Very high	30 Å²	30	57.3 Å²	57.3	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	137.4	-173.4	179.1	0	0	0	0	111.4	W44 A45 A58 H61 R62	W44-V71 HydrophobicContact CE3-CG1 3.76Å; W44-V71 HydrophobicContact CZ3-CG1 4.44Å; A45-V71 CarbonylContact O-C 3.55Å; A45-V71 WeakPolarHBondContact O-CA 3.14Å; A58-V71 HydrophobicContact CB-CG1 3.89Å; H61-V71 HydrophobicContact CB-CG2 3.5Å; H61-V71 VanDerWaalsContact CB-CG2 3.5Å; R62-V71 HydrophobicContact CG-CB 4.33Å; R62-V71 HydrophobicContact CG-CG2 4.24Å
72	K	98	Very high	96.8	Very high	34 Å²	34	61.8 Å²	61.8	15%	0.148	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	153.9	169.5	-79.3	-170.7	168.3	-166.7	0	111.6	W44 A45 D77 T78 W79	W44-K72 CarbonylContact C-O 3.5Å; W44-K72 VanDerWaalsContact CA-O 3.3Å; W44-K72 WeakPolarHBondContact CA-O 3.47Å; W44-K72 VanDerWaalsContact CE3-C 3.47Å; A45-K72 PolarHBondContact N-O 3.31Å; A45-K72 PolarHBondContact O-N 3.38Å; K72-D77 WeakPolarHBondContact CA-OD2 3.37Å; K72-D77 HydrophobicContact CB-CB 4.13Å; K72-D77 HydrophobicContact CD-CB 4.11Å; K72-D77 HydrophobicContact CG-CB 4.17Å; K72-T78 PolarHBondContact NZ-O 3.47Å; K72-W79 HydrophobicContact CB-CH2 4.19Å; K72-W79 HydrophobicContact CB-CZ2 3.74Å; K72-W79 HydrophobicContact CD-CD2 4.45Å; K72-W79 HydrophobicContact CD-CZ2 4.38Å
73	S	97.7	Very high	96.7	Very high	5 Å²	5	56.4 Å²	56.4	4%	0.035	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	139.6	164.4	-178.3	0	0	0	0	110.3	N75 L76 D77 W79	S73-N75 PolarHBondContact O-N 2.9Å; S73-N75 PolarHBondContact OG-N 3.3Å; S73-L76 WeakPolarHBondContact OG-CB 3.45Å; S73-L76 PolarHBondContact OG-N 3.34Å; S73-L76 VanDerWaalsContact OG-N 3.13Å; S73-D77 PolarHBondContact N-OD2 2.98Å; S73-W79 PolarHBondContact O-NE1 2.92Å
74	V	97.2	Very high	96.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-29.7	174.6	167.9	0	0	0	0	111.6	Q19 I22 L26 R43 A45 F52	Q19-V74 PolarHBondContact NE2-O 2.91Å; Q19-V74 PolarHBondContact OE1-O 3.21Å; I22-V74 HydrophobicContact CG2-CB 4.49Å; I22-V74 HydrophobicContact CG2-CG1 3.57Å; L26-V74 HydrophobicContact CD1-CG1 3.52Å; R43-V74 VanDerWaalsContact C-CG2 3.45Å; R43-V74 WeakPolarHBondContact O-CB 3.44Å; R43-V74 WeakPolarHBondContact O-CG2 3.42Å; R43-V74 PolarHBondContact O-N 3.37Å; A45-V74 HydrophobicContact CB-CG2 4.49Å; F52-V74 HydrophobicContact CD1-CG2 4.01Å; F52-V74 HydrophobicContact CE1-CG2 4.15Å
75	N	94.4	Very high	96.6	Very high	85 Å²	85	51.4 Å²	51.4	46%	0.455	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-23.8	-170.3	-69	66	0	0	0	114.2	S73	S73-N75 PolarHBondContact O-N 2.9Å; S73-N75 PolarHBondContact OG-N 3.3Å
76	L	94.7	Very high	96.6	Very high	148 Å²	148	51.5 Å²	51.5	78%	0.775	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-19.9	-172.7	-55.2	175	0	0	0	113.7	S73	S73-L76 WeakPolarHBondContact OG-CB 3.45Å; S73-L76 PolarHBondContact OG-N 3.34Å; S73-L76 VanDerWaalsContact OG-N 3.13Å
77	D	95.9	Very high	96.6	Very high	66 Å²	66	46.3 Å²	46.3	35%	0.353	24%	0.243	S	C	.	.	S	Bend	trans	-95.8	149.8	-178.9	-82.2	-62.5	0	0	0	112.3	K72 S73	K72-D77 WeakPolarHBondContact CA-OD2 3.37Å; K72-D77 HydrophobicContact CB-CB 4.13Å; K72-D77 HydrophobicContact CD-CB 4.11Å; K72-D77 HydrophobicContact CG-CB 4.17Å; S73-D77 PolarHBondContact N-OD2 2.98Å
78	T	94.8	Very high	96.4	Very high	81 Å²	81	42.9 Å²	42.9	50%	0.497	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-77.2	129.8	167.6	-68.1	0	0	0	0	110.2	N15 K72	N15-T78 PolarHBondContact ND2-OG1 3.44Å; N15-T78 WeakPolarHBondContact OD1-CG2 3.48Å; K72-T78 PolarHBondContact NZ-O 3.47Å
79	W	96.4	Very high	96.3	Very high	7 Å²	7	43.6 Å²	43.6	3%	0.027	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-101.4	151.5	178.6	-71.7	80	0	0	0	111.9	H18 I22 A45 W47 K72 S73 Q83 L84 M87	H18-W79 HydrophobicContact CB-CB 4.31Å; H18-W79 PolarHBondContact CE1-O 3.45Å; H18-W79 PolarHBondContact ND1-O 3.21Å; I22-W79 HydrophobicContact CD1-CB 4.26Å; I22-W79 HydrophobicContact CD1-CD2 3.69Å; I22-W79 HydrophobicContact CD1-CE3 4.47Å; I22-W79 HydrophobicContact CD1-CG 3.53Å; A45-W79 HydrophobicContact CB-CH2 3.87Å; A45-W79 HydrophobicContact CB-CZ2 4.28Å; W47-W79 HydrophobicContact CB-CH2 3.96Å; W47-W79 HydrophobicContact CB-CZ3 3.65Å; K72-W79 HydrophobicContact CB-CH2 4.19Å; K72-W79 HydrophobicContact CB-CZ2 3.74Å; K72-W79 HydrophobicContact CD-CD2 4.45Å; K72-W79 HydrophobicContact CD-CZ2 4.38Å; S73-W79 PolarHBondContact O-NE1 2.92Å; W79-Q83 HydrophobicContact CE3-CB 3.74Å; W79-Q83 HydrophobicContact CZ3-CB 4.09Å; W79-L84 HydrophobicContact CB-CD2 4.07Å; W79-L84 HydrophobicContact CB-CG 4.28Å; W79-L84 HydrophobicContact CD2-CD2 4.27Å; W79-L84 HydrophobicContact CE3-CD2 3.99Å; W79-L84 HydrophobicContact CG-CD2 4.32Å; W79-M87 HydrophobicContact CH2-CG 4.11Å; W79-M87 HydrophobicContact CH2-SD 4.37Å; W79-M87 HydrophobicContact CZ3-CG 3.66Å; W79-M87 HydrophobicContact CZ3-SD 4.41Å
80	T	95.1	Very high	96.2	Very high	59 Å²	59	44.5 Å²	44.5	36%	0.362	23%	0.231	S	C	.	.			trans	-109.4	155.4	172	72.8	0	0	0	0	110.8	M82 Q83 L84	T80-M82 VanDerWaalsContact C-N 3.28Å; T80-M82 PolarHBondContact O-N 3.28Å; T80-Q83 VanDerWaalsContact N-OE1 3.12Å; T80-Q83 WeakPolarHBondContact O-CB 3.45Å; T80-Q83 PolarHBondContact O-N 2.87Å; T80-Q83 VanDerWaalsContact OG1-CD 3.29Å; T80-Q83 VanDerWaalsContact OG1-CG 3.29Å; T80-Q83 WeakPolarHBondContact OG1-CG 3.29Å; T80-Q83 PolarHBondContact OG1-N 3.27Å; T80-L84 PolarHBondContact O-N 3.11Å; T80-L84 VanDerWaalsContact O-N 3.09Å
81	P	94.9	Very high	96.1	Very high	39 Å²	39	40.8 Å²	40.8	25%	0.253	22%	0.216	S	C	.	.	H	α-helix	trans	-54	-42	177.6	-28.1	35.5	0	0	0	113.2	Q83 L84 A85 V141 L144 M145 L148	P81-Q83 VanDerWaalsContact C-N 3.3Å; P81-Q83 PolarHBondContact O-N 3.05Å; P81-L84 PolarHBondContact O-N 3.36Å; P81-A85 WeakPolarHBondContact O-CB 2.88Å; P81-A85 PolarHBondContact O-N 3.24Å; P81-V141 HydrophobicContact CB-CG1 4.24Å; P81-L144 HydrophobicContact CB-CD2 4.16Å; P81-L144 WeakPolarHBondContact O-CD2 3.44Å; P81-M145 HydrophobicContact CB-CG 4.3Å; P81-L148 HydrophobicContact CB-CD1 4.09Å; P81-L148 HydrophobicContact CG-CD1 3.95Å
82	M	94.8	Very high	96.1	Very high	95 Å²	95	39.4 Å²	39.4	47%	0.468	21%	0.208	S	C	.	.	H	α-helix	trans	-56.1	-42.2	174.6	173.8	60	90.7	0	0	112.6	T80 A85 V86 P139 V141	T80-M82 VanDerWaalsContact C-N 3.28Å; T80-M82 PolarHBondContact O-N 3.28Å; M82-A85 PolarHBondContact O-N 3.08Å; M82-V86 PolarHBondContact O-N 3.46Å; M82-P139 HydrophobicContact SD-CG 3.61Å; M82-V141 HydrophobicContact CE-CG2 3.87Å; M82-V141 HydrophobicContact SD-CG2 3.67Å
83	Q	96.8	Very high	96	Very high	21 Å²	21	41 Å²	41	10%	0.098	22%	0.224	C	C	.	.	H	α-helix	trans	-69.4	-40.8	-179	-66.6	165.5	-9.5	0	0	111.6	W47 W79 T80 P81 A85 V86 M87	W47-Q83 HydrophobicContact CB-CB 4.4Å; W47-Q83 HydrophobicContact CD2-CB 4.32Å; W47-Q83 HydrophobicContact CD2-CG 3.66Å; W47-Q83 HydrophobicContact CE3-CB 4.25Å; W47-Q83 HydrophobicContact CE3-CG 3.64Å; W47-Q83 HydrophobicContact CG-CB 4.4Å; W47-Q83 HydrophobicContact CG-CG 4.11Å; W47-Q83 HydrophobicContact CH2-CG 4.39Å; W47-Q83 HydrophobicContact CZ2-CG 4.41Å; W47-Q83 HydrophobicContact CZ3-CG 4.02Å; W79-Q83 HydrophobicContact CE3-CB 3.74Å; W79-Q83 HydrophobicContact CZ3-CB 4.09Å; T80-Q83 VanDerWaalsContact N-OE1 3.12Å; T80-Q83 WeakPolarHBondContact O-CB 3.45Å; T80-Q83 PolarHBondContact O-N 2.87Å; T80-Q83 VanDerWaalsContact OG1-CD 3.29Å; T80-Q83 VanDerWaalsContact OG1-CG 3.29Å; T80-Q83 WeakPolarHBondContact OG1-CG 3.29Å; T80-Q83 PolarHBondContact OG1-N 3.27Å; P81-Q83 VanDerWaalsContact C-N 3.3Å; P81-Q83 PolarHBondContact O-N 3.05Å; Q83-A85 VanDerWaalsContact C-N 3.33Å; Q83-V86 PolarHBondContact O-N 3.23Å; Q83-M87 WeakPolarHBondContact O-CG 3.44Å; Q83-M87 PolarHBondContact O-N 3.09Å; Q83-M87 VanDerWaalsContact O-N 3.08Å
84	L	96.5	Very high	95.9	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-37.1	174.8	-65.3	177.9	0	0	0	112.2	H18 I21 I22 W79 T80 P81 M87 R88 L144	H18-L84 HydrophobicContact CB-CD1 3.8Å; H18-L84 VanDerWaalsContact CD2-CD1 3.45Å; H18-L84 WeakPolarHBondContact CD2-CD1 3.4Å; I21-L84 HydrophobicContact CB-CD1 4.34Å; I21-L84 HydrophobicContact CG2-CD1 4.46Å; I22-L84 HydrophobicContact CD1-CD2 3.77Å; I22-L84 HydrophobicContact CG1-CD2 3.31Å; W79-L84 HydrophobicContact CB-CD2 4.07Å; W79-L84 HydrophobicContact CB-CG 4.28Å; W79-L84 HydrophobicContact CD2-CD2 4.27Å; W79-L84 HydrophobicContact CE3-CD2 3.99Å; W79-L84 HydrophobicContact CG-CD2 4.32Å; T80-L84 PolarHBondContact O-N 3.11Å; T80-L84 VanDerWaalsContact O-N 3.09Å; P81-L84 PolarHBondContact O-N 3.36Å; L84-M87 PolarHBondContact O-N 3.46Å; L84-R88 WeakPolarHBondContact O-CB 3.47Å; L84-R88 PolarHBondContact O-N 3.25Å; L84-L144 HydrophobicContact CB-CD2 3.53Å; L84-L144 HydrophobicContact CD1-CD2 4.41Å
85	A	96.4	Very high	95.9	Very high	4 Å²	4	47.1 Å²	47.1	3%	0.033	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-41.6	178.5	0	0	0	0	0	111.5	P81 M82 Q83 R88 E89 P139 V141 L144	P81-A85 WeakPolarHBondContact O-CB 2.88Å; P81-A85 PolarHBondContact O-N 3.24Å; M82-A85 PolarHBondContact O-N 3.08Å; Q83-A85 VanDerWaalsContact C-N 3.33Å; A85-R88 PolarHBondContact O-N 2.97Å; A85-E89 VanDerWaalsContact O-CB 3.31Å; A85-E89 WeakPolarHBondContact O-CB 3.37Å; A85-E89 PolarHBondContact O-N 3.01Å; A85-P139 HydrophobicContact CB-CB 3.81Å; A85-V141 HydrophobicContact CB-CB 4.49Å; A85-V141 HydrophobicContact CB-CG2 4.07Å; A85-L144 HydrophobicContact CB-CD2 4.03Å
86	V	96.8	Very high	96	Very high	25 Å²	25	46.5 Å²	46.5	15%	0.152	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-43.8	172.8	-179.9	0	0	0	0	111.7	W47 M82 Q83 R88 E89 M90 P139	W47-V86 WeakPolarHBondContact O-CG1 3.04Å; M82-V86 PolarHBondContact O-N 3.46Å; Q83-V86 PolarHBondContact O-N 3.23Å; V86-R88 VanDerWaalsContact C-N 3.28Å; V86-R88 PolarHBondContact O-N 3.34Å; V86-E89 PolarHBondContact O-N 3.42Å; V86-M90 PolarHBondContact O-N 2.96Å; V86-M90 VanDerWaalsContact O-N 3.08Å; V86-P139 HydrophobicContact CG2-CB 3.92Å; V86-P139 HydrophobicContact CG2-CG 3.76Å
87	M	97.2	Very high	96	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-36.5	176.9	-71.9	-60.1	-54.9	0	0	112.6	L25 A45 W47 F52 W79 Q83 L84 G91	L25-M87 HydrophobicContact CD1-CB 3.84Å; A45-M87 HydrophobicContact CB-CE 3.8Å; A45-M87 HydrophobicContact CB-SD 4.04Å; W47-M87 HydrophobicContact CB-SD 4.35Å; F52-M87 HydrophobicContact CD1-CE 3.88Å; F52-M87 HydrophobicContact CD2-CE 3.77Å; F52-M87 HydrophobicContact CE1-CE 3.59Å; F52-M87 HydrophobicContact CE2-CE 3.48Å; F52-M87 VanDerWaalsContact CE2-CE 3.48Å; F52-M87 HydrophobicContact CG-CE 3.97Å; F52-M87 HydrophobicContact CZ-CE 3.39Å; W79-M87 HydrophobicContact CH2-CG 4.11Å; W79-M87 HydrophobicContact CH2-SD 4.37Å; W79-M87 HydrophobicContact CZ3-CG 3.66Å; W79-M87 HydrophobicContact CZ3-SD 4.41Å; Q83-M87 WeakPolarHBondContact O-CG 3.44Å; Q83-M87 PolarHBondContact O-N 3.09Å; Q83-M87 VanDerWaalsContact O-N 3.08Å; L84-M87 PolarHBondContact O-N 3.46Å; M87-G91 PolarHBondContact O-N 3.27Å; M87-G91 VanDerWaalsContact O-N 3.14Å
88	R	94.9	Very high	96.1	Very high	80 Å²	80	40.3 Å²	40.3	30%	0.302	22%	0.215	S	C	.	.	H	α-helix	trans	-73.8	-38	176.1	176	-178.7	-71.6	-167.2	-12.2	113	L25 L84 A85 V86 E147	L25-R88 HydrophobicContact CD1-CB 4.3Å; L25-R88 HydrophobicContact CD2-CB 4.02Å; L25-R88 HydrophobicContact CD2-CG 4.22Å; L84-R88 WeakPolarHBondContact O-CB 3.47Å; L84-R88 PolarHBondContact O-N 3.25Å; A85-R88 PolarHBondContact O-N 2.97Å; V86-R88 VanDerWaalsContact C-N 3.28Å; V86-R88 PolarHBondContact O-N 3.34Å; R88-E147 IonicContact CZ-OE1 3.96Å; R88-E147 IonicContact CZ-OE2 3.79Å; R88-E147 VanDerWaalsContact CZ-OE2 3.22Å; R88-E147 IonicContact NH1-OE1 3.57Å; R88-E147 IonicContact NH1-OE2 2.68Å; R88-E147 PolarHBondContact NH1-OE2 3.21Å; R88-E147 IonicContact NH2-OE1 2.63Å; R88-E147 PolarHBondContact NH2-OE1 2.99Å; R88-E147 IonicContact NH2-OE2 3.92Å; R88-E147 PolarHBondContact NH2-OE2 2.85Å
89	E	95	Very high	96.2	Very high	45 Å²	45	37.7 Å²	37.7	21%	0.21	20%	0.197	C	C	.	.	H	α-helix	trans	-70.5	-33.4	-178.6	179.6	174.6	-147.1	0	0	112.3	A85 V86 R94 S137 P139	A85-E89 VanDerWaalsContact O-CB 3.31Å; A85-E89 WeakPolarHBondContact O-CB 3.37Å; A85-E89 PolarHBondContact O-N 3.01Å; V86-E89 PolarHBondContact O-N 3.42Å; E89-R94 WeakPolarHBondContact O-CD 3.44Å; E89-R94 PolarHBondContact O-NH1 3.06Å; E89-S137 WeakPolarHBondContact OE1-CB 3.47Å; E89-S137 PolarHBondContact OE1-OG 2.61Å; E89-P139 WeakPolarHBondContact OE2-CA 3.19Å; E89-P139 WeakPolarHBondContact OE2-CB 3.32Å
90	M	95.2	Very high	96.2	Very high	22 Å²	22	38.4 Å²	38.4	11%	0.108	20%	0.2	C	C	.	.	S	Bend	trans	-97.2	-79.3	179.2	-172.2	71.2	78.4	0	0	111.5	I49 V86 R94 A95 Y99 Y134	I49-M90 WeakPolarHBondContact O-CG 3.42Å; V86-M90 PolarHBondContact O-N 2.96Å; V86-M90 VanDerWaalsContact O-N 3.08Å; M90-R94 WeakPolarHBondContact O-CB 3.48Å; M90-R94 HydrophobicContact SD-CB 3.92Å; M90-R94 HydrophobicContact SD-CG 3.74Å; M90-A95 HydrophobicContact CG-CB 3.8Å; M90-A95 HydrophobicContact SD-CB 4.04Å; M90-A95 PolarHBondContact SD-N 3.46Å; M90-Y99 HydrophobicContact CE-CE2 4.2Å; M90-Y134 HydrophobicContact CE-CE2 4.28Å; M90-Y134 WeakPolarHBondContact CE-OH 3.49Å
91	G	96.4	Very high	96.2	Very high	7 Å²	7	37.9 Å²	37.9	7%	0.072	20%	0.202	C	C	.	.	H	α-helix	trans	63.9	171.6	-167	0	0	0	0	0	112.9	G50 M87 S93 A95	G50-G91 CarbonylContact O-C 3.49Å; G50-G91 WeakPolarHBondContact O-CA 3.37Å; G50-G91 PolarHBondContact O-N 3.03Å; M87-G91 PolarHBondContact O-N 3.27Å; M87-G91 VanDerWaalsContact O-N 3.14Å; G91-S93 VanDerWaalsContact C-N 3.28Å; G91-S93 PolarHBondContact O-N 2.9Å; G91-A95 WeakPolarHBondContact O-CB 3.18Å; G91-A95 PolarHBondContact O-N 3.29Å
92	N	98	Very high	96.2	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-66.5	-30.6	-177.8	-71.7	-4.2	0	0	0	112.9	D30 N31 Y33 I51 F52 R96	D30-N92 HydrophobicContact CB-CB 4.11Å; D30-N92 WeakPolarHBondContact O-CB 3.29Å; D30-N92 PolarHBondContact O-ND2 3.01Å; N31-N92 VanDerWaalsContact OD1-CB 3.29Å; N31-N92 WeakPolarHBondContact OD1-CB 3.34Å; N31-N92 PolarHBondContact OD1-N 3.06Å; Y33-N92 PolarHBondContact O-ND2 2.96Å; I51-N92 WeakPolarHBondContact CA-OD1 3.48Å; F52-N92 PolarHBondContact N-OD1 2.84Å; N92-R96 WeakPolarHBondContact O-CB 3.42Å; N92-R96 PolarHBondContact O-N 3.5Å
93	S	96.7	Very high	96.2	Very high	69 Å²	69	37.5 Å²	37.5	48%	0.483	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-57.2	-179.2	-155.8	0	0	0	0	111.7	D30 G91 A95 R96 A97	D30-S93 WeakPolarHBondContact OD2-CA 3.36Å; D30-S93 WeakPolarHBondContact OD2-CB 3.44Å; D30-S93 PolarHBondContact OD2-OG 2.63Å; G91-S93 VanDerWaalsContact C-N 3.28Å; G91-S93 PolarHBondContact O-N 2.9Å; S93-A95 PolarHBondContact O-N 2.92Å; S93-R96 PolarHBondContact O-N 2.85Å; S93-A97 PolarHBondContact O-N 3.05Å; S93-A97 VanDerWaalsContact O-N 3.14Å
94	R	96.2	Very high	96.1	Very high	130 Å²	130	39.6 Å²	39.6	49%	0.491	22%	0.215	S	C	.	.	H	α-helix	trans	-67.6	-36.6	176.5	-172.4	177.6	-98.6	173.7	-11.8	111.6	E89 M90 R96 A97 V98	E89-R94 WeakPolarHBondContact O-CD 3.44Å; E89-R94 PolarHBondContact O-NH1 3.06Å; M90-R94 WeakPolarHBondContact O-CB 3.48Å; M90-R94 HydrophobicContact SD-CB 3.92Å; M90-R94 HydrophobicContact SD-CG 3.74Å; R94-R96 VanDerWaalsContact C-N 3.27Å; R94-R96 PolarHBondContact O-N 3.48Å; R94-A97 CarbonylContact O-C 3.59Å; R94-A97 PolarHBondContact O-N 3.11Å; R94-V98 HydrophobicContact CG-CG2 4.22Å; R94-V98 WeakPolarHBondContact O-CB 3.26Å; R94-V98 WeakPolarHBondContact O-CG2 3.29Å; R94-V98 PolarHBondContact O-N 3.48Å
95	A	97.2	Very high	95.8	Very high	2 Å²	2	48.1 Å²	48.1	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-35.1	176.1	0	0	0	0	0	112.5	I51 M90 G91 S93 V98 Y99	I51-A95 HydrophobicContact CG2-CB 3.22Å; M90-A95 HydrophobicContact CG-CB 3.8Å; M90-A95 HydrophobicContact SD-CB 4.04Å; M90-A95 PolarHBondContact SD-N 3.46Å; G91-A95 WeakPolarHBondContact O-CB 3.18Å; G91-A95 PolarHBondContact O-N 3.29Å; S93-A95 PolarHBondContact O-N 2.92Å; A95-V98 PolarHBondContact O-N 3.09Å; A95-Y99 HydrophobicContact CB-CD2 4.2Å; A95-Y99 WeakPolarHBondContact O-CB 3.39Å; A95-Y99 WeakPolarHBondContact O-CD2 3.36Å; A95-Y99 PolarHBondContact O-N 2.82Å
96	R	95.9	Very high	95.7	Very high	73 Å²	73	54.9 Å²	54.9	28%	0.275	30%	0.296	S	S	.	.	H	α-helix	trans	-66.6	-48.9	172.6	-170.1	171	-61.8	112.7	-12	110.8	D30 D38 N92 S93 R94 V98 E100	D30-R96 IonicContact OD1-CZ 3.63Å; D30-R96 IonicContact OD1-NH1 2.69Å; D30-R96 PolarHBondContact OD1-NH1 3.33Å; D38-R96 IonicContact OD1-NH2 3.61Å; N92-R96 WeakPolarHBondContact O-CB 3.42Å; N92-R96 PolarHBondContact O-N 3.5Å; S93-R96 PolarHBondContact O-N 2.85Å; R94-R96 VanDerWaalsContact C-N 3.27Å; R94-R96 PolarHBondContact O-N 3.48Å; R96-V98 PolarHBondContact O-N 3.35Å; R96-V98 VanDerWaalsContact O-N 3.14Å; R96-E100 HydrophobicContact CG-CB 4.12Å; R96-E100 HydrophobicContact CG-CG 4.41Å; R96-E100 WeakPolarHBondContact CG-OE2 3.2Å; R96-E100 IonicContact NE-OE2 3.79Å; R96-E100 WeakPolarHBondContact O-CA 3.45Å; R96-E100 WeakPolarHBondContact O-CB 3.33Å; R96-E100 PolarHBondContact O-N 3.23Å
97	A	95.9	Very high	95.6	Very high	70 Å²	70	56.7 Å²	56.7	58%	0.579	30%	0.302	S	S	*	.	H	α-helix	trans	-59.6	-24	176.2	0	0	0	0	0	114.2	S93 R94 A101	S93-A97 PolarHBondContact O-N 3.05Å; S93-A97 VanDerWaalsContact O-N 3.14Å; R94-A97 CarbonylContact O-C 3.59Å; R94-A97 PolarHBondContact O-N 3.11Å; A97-A101 WeakPolarHBondContact O-CB 3.5Å
98	V	96.3	Very high	95.4	Very high	13 Å²	13	66.9 Å²	66.9	8%	0.079	34%	0.341	C	S	.	.	H	α-helix	trans	-95.2	-53.9	178.9	167.4	0	0	0	0	112.8	R94 A95 R96 I130 A131 Y134	R94-V98 HydrophobicContact CG-CG2 4.22Å; R94-V98 WeakPolarHBondContact O-CB 3.26Å; R94-V98 WeakPolarHBondContact O-CG2 3.29Å; R94-V98 PolarHBondContact O-N 3.48Å; A95-V98 PolarHBondContact O-N 3.09Å; R96-V98 PolarHBondContact O-N 3.35Å; R96-V98 VanDerWaalsContact O-N 3.14Å; V98-I130 HydrophobicContact CG1-CD1 4.46Å; V98-I130 HydrophobicContact CG1-CG1 4.05Å; V98-I130 CarbonylContact O-C 3.6Å; V98-I130 VanDerWaalsContact O-CA 3.26Å; V98-I130 WeakPolarHBondContact O-CA 3.33Å; V98-A131 PolarHBondContact O-N 2.99Å; V98-Y134 HydrophobicContact CB-CD2 4.2Å; V98-Y134 HydrophobicContact CB-CE2 4.5Å; V98-Y134 HydrophobicContact CB-CG 4.37Å; V98-Y134 HydrophobicContact CG1-CD1 3.48Å; V98-Y134 VanDerWaalsContact CG1-CD1 3.48Å; V98-Y134 HydrophobicContact CG1-CD2 3.57Å; V98-Y134 HydrophobicContact CG1-CE1 3.79Å; V98-Y134 HydrophobicContact CG1-CE2 3.89Å; V98-Y134 HydrophobicContact CG1-CG 3.36Å; V98-Y134 HydrophobicContact CG2-CD2 3.48Å; V98-Y134 VanDerWaalsContact CG2-CD2 3.48Å; V98-Y134 HydrophobicContact CG2-CE2 3.8Å; V98-Y134 HydrophobicContact CG2-CG 4.08Å
99	Y	97.1	Very high	95.3	Very high	27 Å²	27	64.5 Å²	64.5	11%	0.106	33%	0.332	C	S	.	.	H	α-helix	trans	-91.7	-9	-171.2	-68.5	-81.5	0	0	0	114	I49 M90 A95 Y124 Y129 I130	I49-Y99 HydrophobicContact CG2-CD2 4.45Å; I49-Y99 HydrophobicContact CG2-CE2 3.68Å; M90-Y99 HydrophobicContact CE-CE2 4.2Å; A95-Y99 HydrophobicContact CB-CD2 4.2Å; A95-Y99 WeakPolarHBondContact O-CB 3.39Å; A95-Y99 WeakPolarHBondContact O-CD2 3.36Å; A95-Y99 PolarHBondContact O-N 2.82Å; Y99-Y124 AromaticContact CD1-CD1 3.8Å; Y99-Y124 HydrophobicContact CD1-CD1 3.8Å; Y99-Y124 HydrophobicContact CD1-CE1 4.01Å; Y99-Y124 HydrophobicContact CD2-CE1 4.22Å; Y99-Y124 AromaticContact CE1-CD1 3.9Å; Y99-Y124 HydrophobicContact CE1-CD1 3.9Å; Y99-Y124 HydrophobicContact CE1-CE1 4.35Å; Y99-Y124 HydrophobicContact CG-CD1 4.23Å; Y99-Y124 AromaticContact CG-CE1 3.95Å; Y99-Y124 HydrophobicContact CG-CE1 3.95Å; Y99-Y129 WeakPolarHBondContact O-CB 3.47Å; Y99-I130 HydrophobicContact CD1-CD1 4.21Å; Y99-I130 HydrophobicContact CD1-CG1 4.35Å; Y99-I130 HydrophobicContact CE1-CD1 4.02Å
100	E	96.5	Very high	95.3	Very high	21 Å²	21	63.3 Å²	63.3	10%	0.098	33%	0.328	C	S	.	.	S	Bend	trans	-120.6	16.1	175.6	-56	-170.4	166	0	0	111.4	R96 N102 L103 R109 K123	R96-E100 HydrophobicContact CG-CB 4.12Å; R96-E100 HydrophobicContact CG-CG 4.41Å; R96-E100 WeakPolarHBondContact CG-OE2 3.2Å; R96-E100 IonicContact NE-OE2 3.79Å; R96-E100 WeakPolarHBondContact O-CA 3.45Å; R96-E100 WeakPolarHBondContact O-CB 3.33Å; R96-E100 PolarHBondContact O-N 3.23Å; E100-N102 PolarHBondContact O-N 2.67Å; E100-L103 HydrophobicContact CB-CB 4.15Å; E100-L103 HydrophobicContact CB-CD2 3.87Å; E100-L103 HydrophobicContact CG-CD2 4.09Å; E100-L103 WeakPolarHBondContact O-CB 2.95Å; E100-L103 PolarHBondContact O-N 3.05Å; E100-R109 VanDerWaalsContact CD-NH2 3.35Å; E100-R109 IonicContact OE1-CZ 2.81Å; E100-R109 IonicContact OE1-NH1 3.83Å; E100-R109 PolarHBondContact OE1-NH1 3.26Å; E100-R109 IonicContact OE1-NH2 3.95Å; E100-R109 PolarHBondContact OE1-NH2 3.34Å; E100-R109 VanDerWaalsContact OE1-NH2 3.11Å; E100-R109 IonicContact OE2-CZ 3.44Å; E100-R109 IonicContact OE2-NH1 2.85Å; E100-R109 IonicContact OE2-NH2 2.86Å; E100-R109 PolarHBondContact OE2-NH2 2.88Å; E100-K123 HydrophobicContact CG-CD 4.32Å; E100-K123 WeakPolarHBondContact OE1-CE 3.43Å; E100-K123 IonicContact OE1-NZ 2.64Å; E100-K123 PolarHBondContact OE1-NZ 2.85Å
101	A	95.6	Very high	95.1	Very high	48 Å²	48	67.7 Å²	67.7	40%	0.397	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-40.7	-177.6	0	0	0	0	0	113.8	A97 Y129 A131	A97-A101 WeakPolarHBondContact O-CB 3.5Å; A101-Y129 PolarHBondContact N-O 3.15Å; A101-Y129 VanDerWaalsContact N-O 3.15Å; A101-A131 HydrophobicContact CB-CB 3.71Å
102	N	95	Very high	95	Very high	97 Å²	97	71.8 Å²	71.8	52%	0.519	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	28.3	178.8	-71.1	-56.4	0	0	0	111.6	E100 Y129 I130	E100-N102 PolarHBondContact O-N 2.67Å; N102-Y129 PolarHBondContact N-O 2.64Å; N102-Y129 WeakPolarHBondContact O-CD1 3.44Å; N102-I130 PolarHBondContact ND2-O 2.68Å
103	L	94.3	Very high	94.9	Very high	29 Å²	29	76.2 Å²	76.2	15%	0.152	40%	0.396	C	S	.	.			trans	-82.1	133.5	176.7	-167.3	65.9	0	0	0	109.5	E100 F107 F119 Y129	E100-L103 HydrophobicContact CB-CB 4.15Å; E100-L103 HydrophobicContact CB-CD2 3.87Å; E100-L103 HydrophobicContact CG-CD2 4.09Å; E100-L103 WeakPolarHBondContact O-CB 2.95Å; E100-L103 PolarHBondContact O-N 3.05Å; L103-F107 HydrophobicContact CD1-CB 4.22Å; L103-F107 HydrophobicContact CD1-CD1 3.97Å; L103-F107 HydrophobicContact CD1-CD2 3.94Å; L103-F107 HydrophobicContact CD1-CE1 4.31Å; L103-F107 HydrophobicContact CD1-CE2 4.31Å; L103-F107 HydrophobicContact CD1-CG 3.76Å; L103-F107 HydrophobicContact CD1-CZ 4.48Å; L103-F107 HydrophobicContact CD2-CB 4.33Å; L103-F107 HydrophobicContact CD2-CD1 3.57Å; L103-F107 HydrophobicContact CD2-CE1 4.07Å; L103-F107 HydrophobicContact CD2-CG 4.04Å; L103-F107 HydrophobicContact CG-CB 3.9Å; L103-F107 HydrophobicContact CG-CD1 3.93Å; L103-F107 HydrophobicContact CG-CG 3.85Å; L103-F119 HydrophobicContact CD1-CE2 4.05Å; L103-Y129 HydrophobicContact CB-CG 4.5Å; L103-Y129 HydrophobicContact CD1-CD1 3.86Å; L103-Y129 HydrophobicContact CD1-CD2 3.79Å; L103-Y129 HydrophobicContact CD1-CE1 3.93Å; L103-Y129 HydrophobicContact CD1-CE2 3.88Å; L103-Y129 HydrophobicContact CD1-CG 3.78Å
104	P	94.4	Very high	94.9	Very high	66 Å²	66	77.3 Å²	77.3	43%	0.429	40%	0.403	S	S	.	.			trans	-60.2	139.1	-179.5	-25.5	35	0	0	0	112.9	N106 F107	P104-N106 VanDerWaalsContact CB-OD1 3.32Å; P104-N106 WeakPolarHBondContact CB-OD1 3.07Å; P104-N106 PolarHBondContact O-N 3.37Å; P104-N106 VanDerWaalsContact O-N 3.08Å; P104-F107 WeakPolarHBondContact O-CB 3.25Å; P104-F107 PolarHBondContact O-N 3.14Å
105	D	91.2	Very high	94.9	Very high	179 Å²	179	73 Å²	73	96%	0.957	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.6	-178.5	-59.4	-46.3	0	0	0	113.6	F107	D105-F107 VanDerWaalsContact C-N 3.34Å
106	N	93.6	Very high	94.9	Very high	146 Å²	146	72.9 Å²	72.9	78%	0.781	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	8.2	176.5	69.5	-15	0	0	0	113.8	P104 R108	P104-N106 VanDerWaalsContact CB-OD1 3.32Å; P104-N106 WeakPolarHBondContact CB-OD1 3.07Å; P104-N106 PolarHBondContact O-N 3.37Å; P104-N106 VanDerWaalsContact O-N 3.08Å; N106-R108 PolarHBondContact O-N 3.36Å
107	F	94.3	Very high	95	Very high	63 Å²	63	72.1 Å²	72.1	28%	0.276	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-67.6	118.4	-177.5	176.8	-96	0	0	0	111.8	L103 P104 D105 R109 F119	L103-F107 HydrophobicContact CD1-CB 4.22Å; L103-F107 HydrophobicContact CD1-CD1 3.97Å; L103-F107 HydrophobicContact CD1-CD2 3.94Å; L103-F107 HydrophobicContact CD1-CE1 4.31Å; L103-F107 HydrophobicContact CD1-CE2 4.31Å; L103-F107 HydrophobicContact CD1-CG 3.76Å; L103-F107 HydrophobicContact CD1-CZ 4.48Å; L103-F107 HydrophobicContact CD2-CB 4.33Å; L103-F107 HydrophobicContact CD2-CD1 3.57Å; L103-F107 HydrophobicContact CD2-CE1 4.07Å; L103-F107 HydrophobicContact CD2-CG 4.04Å; L103-F107 HydrophobicContact CG-CB 3.9Å; L103-F107 HydrophobicContact CG-CD1 3.93Å; L103-F107 HydrophobicContact CG-CG 3.85Å; P104-F107 WeakPolarHBondContact O-CB 3.25Å; P104-F107 PolarHBondContact O-N 3.14Å; D105-F107 VanDerWaalsContact C-N 3.34Å; F107-R109 HydrophobicContact CE1-CB 4.19Å; F107-R109 HydrophobicContact CE1-CG 4.5Å; F107-F119 HydrophobicContact CE1-CD2 4.12Å; F107-F119 AromaticContact CE1-CE2 3.68Å; F107-F119 HydrophobicContact CE1-CE2 3.68Å; F107-F119 AromaticContact CE1-CZ 3.99Å; F107-F119 HydrophobicContact CE1-CZ 3.99Å; F107-F119 AromaticContact CE2-CD2 3.86Å; F107-F119 HydrophobicContact CE2-CD2 3.86Å; F107-F119 HydrophobicContact CE2-CE2 4.06Å; F107-F119 AromaticContact CZ-CD2 3.29Å; F107-F119 HydrophobicContact CZ-CD2 3.29Å; F107-F119 AromaticContact CZ-CE2 3.31Å; F107-F119 HydrophobicContact CZ-CE2 3.31Å; F107-F119 AromaticContact CZ-CG 3.94Å; F107-F119 HydrophobicContact CZ-CG 3.94Å; F107-F119 AromaticContact CZ-CZ 3.99Å; F107-F119 HydrophobicContact CZ-CZ 3.99Å
108	R	93.7	Very high	95.1	Very high	217 Å²	217	72.9 Å²	72.9	82%	0.819	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-94.9	117.4	172.3	-168.7	177.1	-173.8	-131.3	2.1	110.6	N106	N106-R108 PolarHBondContact O-N 3.36Å
109	R	93.6	Very high	95.2	Very high	30 Å²	30	72.7 Å²	72.7	11%	0.113	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-58.8	124.8	-179.9	-163.6	176.4	-71.2	-76	7.3	111.7	A35 D36 C37 D38 E100 F107 Q111	A35-R109 PolarHBondContact O-NH1 3.32Å; D36-R109 WeakPolarHBondContact O-CD 3.18Å; D36-R109 VanDerWaalsContact O-CG 3.22Å; D36-R109 WeakPolarHBondContact O-CG 3.14Å; D36-R109 PolarHBondContact O-NH1 3.03Å; C37-R109 VanDerWaalsContact C-CD 3.42Å; C37-R109 VanDerWaalsContact CA-CD 3.42Å; D38-R109 VanDerWaalsContact CG-NE 3.28Å; D38-R109 IonicContact OD1-CZ 3.07Å; D38-R109 IonicContact OD1-NE 3.75Å; D38-R109 IonicContact OD1-NH2 3.18Å; D38-R109 WeakPolarHBondContact OD2-CD 3.03Å; D38-R109 IonicContact OD2-CZ 3.84Å; D38-R109 IonicContact OD2-NE 2.86Å; D38-R109 PolarHBondContact OD2-NE 3.04Å; D38-R109 IonicContact OD2-NH2 3.58Å; E100-R109 VanDerWaalsContact CD-NH2 3.35Å; E100-R109 IonicContact OE1-CZ 2.81Å; E100-R109 IonicContact OE1-NH1 3.83Å; E100-R109 PolarHBondContact OE1-NH1 3.26Å; E100-R109 IonicContact OE1-NH2 3.95Å; E100-R109 PolarHBondContact OE1-NH2 3.34Å; E100-R109 VanDerWaalsContact OE1-NH2 3.11Å; E100-R109 IonicContact OE2-CZ 3.44Å; E100-R109 IonicContact OE2-NH1 2.85Å; E100-R109 IonicContact OE2-NH2 2.86Å; E100-R109 PolarHBondContact OE2-NH2 2.88Å; F107-R109 HydrophobicContact CE1-CB 4.19Å; F107-R109 HydrophobicContact CE1-CG 4.5Å; R109-Q111 PolarHBondContact O-NE2 3Å
110	P	93.7	Very high	95.2	Very high	20 Å²	20	71.4 Å²	71.4	13%	0.13	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-67.9	146.3	-171.4	26.5	-35.8	0	0	0	112.7	A115 L116 F119	P110-A115 HydrophobicContact CB-CB 3.63Å; P110-L116 HydrophobicContact CG-CB 4.22Å; P110-L116 HydrophobicContact CG-CD1 4.08Å; P110-F119 HydrophobicContact CG-CB 3.83Å; P110-F119 HydrophobicContact CG-CD1 4.33Å; P110-F119 HydrophobicContact CG-CG 4.21Å
111	Q	90.9	Very high	95.3	Very high	113 Å²	113	73.3 Å²	73.3	53%	0.528	39%	0.391	S	S	.	.			trans	-109.3	-23.2	-178.3	-62.1	-57	-44.3	0	0	113.8	R56 R109	R56-Q111 PolarHBondContact NH1-O 2.85Å; R109-Q111 PolarHBondContact O-NE2 3Å
112	T	95.7	Very high	95.4	Very high	94 Å²	94	71 Å²	71	58%	0.577	37%	0.372	S	S	*	.	S	Bend	trans	-87.1	142	175.2	58.1	0	0	0	0	110.5	S114 A115 L116	T112-S114 VanDerWaalsContact C-N 3.3Å; T112-S114 PolarHBondContact O-N 3.01Å; T112-A115 PolarHBondContact O-N 2.86Å; T112-A115 WeakPolarHBondContact OG1-CB 3.34Å; T112-L116 VanDerWaalsContact O-CB 3.3Å; T112-L116 WeakPolarHBondContact O-CB 3.44Å; T112-L116 PolarHBondContact O-N 3.15Å
113	D	95.2	Very high	95.5	Very high	94 Å²	94	66.5 Å²	66.5	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-33.5	-171.5	-64.6	-18.7	0	0	0	112.9	R56 L116 E117	R56-D113 IonicContact NH1-OD1 2.76Å; R56-D113 PolarHBondContact NH1-OD1 3.26Å; D113-L116 PolarHBondContact O-N 3.25Å; D113-E117 PolarHBondContact O-N 2.95Å
114	S	96.2	Very high	95.7	Very high	91 Å²	91	65.6 Å²	65.6	64%	0.636	34%	0.342	S	S	*	.	H	α-helix	trans	-68.2	-42.6	176.2	173.5	0	0	0	0	113.5	T112 L116 E117 T118	T112-S114 VanDerWaalsContact C-N 3.3Å; T112-S114 PolarHBondContact O-N 3.01Å; S114-L116 VanDerWaalsContact C-N 3.32Å; S114-E117 PolarHBondContact O-N 2.8Å; S114-T118 PolarHBondContact O-N 3.04Å; S114-T118 VanDerWaalsContact O-N 3.07Å; S114-T118 PolarHBondContact O-OG1 2.82Å
115	A	97.2	Very high	95.8	Very high	40 Å²	40	66.3 Å²	66.3	33%	0.331	34%	0.34	S	S	.	.	H	α-helix	trans	-69.7	-34.3	174.8	0	0	0	0	0	111.1	P110 T112 T118 F119	P110-A115 HydrophobicContact CB-CB 3.63Å; T112-A115 PolarHBondContact O-N 2.86Å; T112-A115 WeakPolarHBondContact OG1-CB 3.34Å; A115-T118 PolarHBondContact O-N 2.97Å; A115-F119 WeakPolarHBondContact O-CB 3.14Å; A115-F119 PolarHBondContact O-N 3.44Å
116	L	97.2	Very high	96	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.7	-40.4	174.7	-175.9	60.9	0	0	0	112.2	D36 C37 I60 P110 T112 D113 S114 F119 I120	D36-L116 HydrophobicContact CB-CD1 4.31Å; D36-L116 WeakPolarHBondContact O-CD1 3.1Å; C37-L116 HydrophobicContact CB-CD1 3.97Å; C37-L116 HydrophobicContact CB-CD2 4.04Å; I60-L116 HydrophobicContact CD1-CB 4.17Å; I60-L116 HydrophobicContact CD1-CD2 3.9Å; I60-L116 HydrophobicContact CD1-CG 3.76Å; P110-L116 HydrophobicContact CG-CB 4.22Å; P110-L116 HydrophobicContact CG-CD1 4.08Å; T112-L116 VanDerWaalsContact O-CB 3.3Å; T112-L116 WeakPolarHBondContact O-CB 3.44Å; T112-L116 PolarHBondContact O-N 3.15Å; D113-L116 PolarHBondContact O-N 3.25Å; S114-L116 VanDerWaalsContact C-N 3.32Å; L116-F119 HydrophobicContact CD1-CD1 4.44Å; L116-F119 PolarHBondContact O-N 3.3Å; L116-I120 HydrophobicContact CD1-CD1 3.98Å; L116-I120 HydrophobicContact CD1-CG1 4.36Å; L116-I120 HydrophobicContact CG-CD1 3.9Å; L116-I120 WeakPolarHBondContact O-CB 3.3Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.13Å; L116-I120 PolarHBondContact O-N 2.85Å
117	E	97.9	Very high	96.1	Very high	56 Å²	56	62.1 Å²	62.1	26%	0.262	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-45.5	171.4	175.5	164	-174.3	0	0	111.6	I60 D113 S114 F119 I120 R121	I60-E117 HydrophobicContact CD1-CB 4.34Å; I60-E117 HydrophobicContact CG1-CB 4.49Å; I60-E117 HydrophobicContact CG2-CB 3.9Å; I60-E117 HydrophobicContact CG2-CG 3.95Å; D113-E117 PolarHBondContact O-N 2.95Å; S114-E117 PolarHBondContact O-N 2.8Å; E117-F119 VanDerWaalsContact C-N 3.29Å; E117-F119 PolarHBondContact O-N 3.19Å; E117-I120 PolarHBondContact O-N 2.87Å; E117-R121 HydrophobicContact CG-CG 4.33Å; E117-R121 WeakPolarHBondContact O-CB 3.43Å; E117-R121 WeakPolarHBondContact O-CG 3.36Å; E117-R121 PolarHBondContact O-N 3.23Å; E117-R121 IonicContact OE1-CZ 3.56Å; E117-R121 VanDerWaalsContact OE1-CZ 3.27Å; E117-R121 IonicContact OE1-NE 3.97Å; E117-R121 PolarHBondContact OE1-NE 3.29Å; E117-R121 IonicContact OE1-NH2 3.9Å; E117-R121 PolarHBondContact OE1-NH2 3.38Å
118	T	97.7	Very high	96.2	Very high	87 Å²	87	65.1 Å²	65.1	53%	0.534	32%	0.317	S	S	.	.	H	α-helix	trans	-59	-41.3	177.8	-55.6	0	0	0	0	111.6	S114 A115 A122	S114-T118 PolarHBondContact O-N 3.04Å; S114-T118 VanDerWaalsContact O-N 3.07Å; S114-T118 PolarHBondContact O-OG1 2.82Å; A115-T118 PolarHBondContact O-N 2.97Å; T118-A122 WeakPolarHBondContact O-CB 3.28Å; T118-A122 PolarHBondContact O-N 3.18Å
119	F	97.7	Very high	96.3	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.035	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-45.3	175.1	170.9	-110.2	0	0	0	112.9	D36 L103 F107 P110 A115 L116 E117 R121 A122 K123 Y129	D36-F119 HydrophobicContact CB-CE1 4.41Å; L103-F119 HydrophobicContact CD1-CE2 4.05Å; F107-F119 HydrophobicContact CE1-CD2 4.12Å; F107-F119 AromaticContact CE1-CE2 3.68Å; F107-F119 HydrophobicContact CE1-CE2 3.68Å; F107-F119 AromaticContact CE1-CZ 3.99Å; F107-F119 HydrophobicContact CE1-CZ 3.99Å; F107-F119 AromaticContact CE2-CD2 3.86Å; F107-F119 HydrophobicContact CE2-CD2 3.86Å; F107-F119 HydrophobicContact CE2-CE2 4.06Å; F107-F119 AromaticContact CZ-CD2 3.29Å; F107-F119 HydrophobicContact CZ-CD2 3.29Å; F107-F119 AromaticContact CZ-CE2 3.31Å; F107-F119 HydrophobicContact CZ-CE2 3.31Å; F107-F119 AromaticContact CZ-CG 3.94Å; F107-F119 HydrophobicContact CZ-CG 3.94Å; F107-F119 AromaticContact CZ-CZ 3.99Å; F107-F119 HydrophobicContact CZ-CZ 3.99Å; P110-F119 HydrophobicContact CG-CB 3.83Å; P110-F119 HydrophobicContact CG-CD1 4.33Å; P110-F119 HydrophobicContact CG-CG 4.21Å; A115-F119 WeakPolarHBondContact O-CB 3.14Å; A115-F119 PolarHBondContact O-N 3.44Å; L116-F119 HydrophobicContact CD1-CD1 4.44Å; L116-F119 PolarHBondContact O-N 3.3Å; E117-F119 VanDerWaalsContact C-N 3.29Å; E117-F119 PolarHBondContact O-N 3.19Å; F119-R121 VanDerWaalsContact C-N 3.35Å; F119-R121 PolarHBondContact O-N 2.81Å; F119-A122 WeakPolarHBondContact O-CB 3.09Å; F119-A122 PolarHBondContact O-N 2.68Å; F119-K123 HydrophobicContact CE1-CD 3.99Å; F119-K123 HydrophobicContact CE2-CD 4.49Å; F119-K123 HydrophobicContact CZ-CD 3.77Å; F119-K123 VanDerWaalsContact O-CB 3.31Å; F119-K123 WeakPolarHBondContact O-CB 3.5Å; F119-K123 PolarHBondContact O-N 3.07Å; F119-Y129 HydrophobicContact CD2-CE2 4.2Å; F119-Y129 HydrophobicContact CE2-CD2 4.43Å; F119-Y129 HydrophobicContact CE2-CE2 4.09Å
120	I	98.1	Very high	96.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.4	-40.9	179.8	-75.4	170.6	0	0	0	110.9	D36 C57 I60 L64 L116 E117 K123 Y124	D36-I120 HydrophobicContact CB-CD1 3.82Å; D36-I120 HydrophobicContact CB-CG1 3.81Å; C57-I120 HydrophobicContact CB-CD1 4.19Å; I60-I120 HydrophobicContact CB-CD1 4.1Å; I60-I120 HydrophobicContact CD1-CD1 3.92Å; I60-I120 HydrophobicContact CG2-CB 4.04Å; I60-I120 HydrophobicContact CG2-CD1 3.9Å; I60-I120 HydrophobicContact CG2-CG2 3.79Å; L64-I120 HydrophobicContact CD1-CG2 3.87Å; L64-I120 HydrophobicContact CD2-CG2 4.38Å; L64-I120 HydrophobicContact CG-CG2 4.46Å; L116-I120 HydrophobicContact CD1-CD1 3.98Å; L116-I120 HydrophobicContact CD1-CG1 4.36Å; L116-I120 HydrophobicContact CG-CD1 3.9Å; L116-I120 WeakPolarHBondContact O-CB 3.3Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.13Å; L116-I120 PolarHBondContact O-N 2.85Å; E117-I120 PolarHBondContact O-N 2.87Å; I120-K123 PolarHBondContact O-N 3.04Å; I120-Y124 HydrophobicContact CG2-CD2 3.94Å; I120-Y124 HydrophobicContact CG2-CE2 4.27Å; I120-Y124 WeakPolarHBondContact O-CD2 3.38Å; I120-Y124 PolarHBondContact O-N 3.08Å
121	R	97.9	Very high	96.5	Very high	61 Å²	61	56 Å²	56	23%	0.23	29%	0.286	C	S	.	.	I	π-helix	trans	-62.3	-46.8	171.5	-69.6	-175.9	178.7	-77	-2.6	111.8	N63 L64 E117 F119 K123 E125 Q126	N63-R121 PolarHBondContact O-NH2 3.07Å; L64-R121 HydrophobicContact CD2-CG 3.6Å; E117-R121 HydrophobicContact CG-CG 4.33Å; E117-R121 WeakPolarHBondContact O-CB 3.43Å; E117-R121 WeakPolarHBondContact O-CG 3.36Å; E117-R121 PolarHBondContact O-N 3.23Å; E117-R121 IonicContact OE1-CZ 3.56Å; E117-R121 VanDerWaalsContact OE1-CZ 3.27Å; E117-R121 IonicContact OE1-NE 3.97Å; E117-R121 PolarHBondContact OE1-NE 3.29Å; E117-R121 IonicContact OE1-NH2 3.9Å; E117-R121 PolarHBondContact OE1-NH2 3.38Å; F119-R121 VanDerWaalsContact C-N 3.35Å; F119-R121 PolarHBondContact O-N 2.81Å; R121-K123 VanDerWaalsContact C-N 3.27Å; R121-K123 PolarHBondContact O-N 3.44Å; R121-E125 WeakPolarHBondContact CB-OE2 3.32Å; R121-E125 WeakPolarHBondContact CD-OE2 3.49Å; R121-E125 VanDerWaalsContact CG-OE2 3.24Å; R121-E125 WeakPolarHBondContact CG-OE2 3.49Å; R121-E125 IonicContact CZ-OE2 2.8Å; R121-E125 IonicContact NH1-OE1 2.66Å; R121-E125 IonicContact NH1-OE2 3.17Å; R121-E125 PolarHBondContact NH1-OE2 3.03Å; R121-E125 WeakPolarHBondContact O-CA 3.26Å; R121-E125 VanDerWaalsContact O-CB 3.28Å; R121-E125 WeakPolarHBondContact O-CB 3.47Å; R121-E125 PolarHBondContact O-N 3.11Å; R121-Q126 PolarHBondContact O-N 3.48Å
122	A	97.6	Very high	96.5	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.302	C	S	.	.	I	π-helix	trans	-55.6	-42.3	174.8	0	0	0	0	0	112.9	T118 F119 K127 R128 Y129	T118-A122 WeakPolarHBondContact O-CB 3.28Å; T118-A122 PolarHBondContact O-N 3.18Å; F119-A122 WeakPolarHBondContact O-CB 3.09Å; F119-A122 PolarHBondContact O-N 2.68Å; A122-K127 PolarHBondContact O-N 2.73Å; A122-R128 WeakPolarHBondContact O-CB 3.39Å; A122-R128 PolarHBondContact O-N 2.88Å; A122-Y129 HydrophobicContact CB-CE2 3.89Å
123	K	97.3	Very high	96.2	Very high	3 Å²	3	62.6 Å²	62.6	1%	0.013	31%	0.309	C	S	.	.	I	π-helix	trans	-73.7	-45.2	-175	-173.8	174	172.7	-173.7	0	113.6	A35 D36 E100 F119 I120 R121 K127	A35-K123 PolarHBondContact O-NZ 2.79Å; D36-K123 IonicContact OD1-NZ 3.92Å; D36-K123 PolarHBondContact OD1-NZ 2.97Å; E100-K123 HydrophobicContact CG-CD 4.32Å; E100-K123 WeakPolarHBondContact OE1-CE 3.43Å; E100-K123 IonicContact OE1-NZ 2.64Å; E100-K123 PolarHBondContact OE1-NZ 2.85Å; F119-K123 HydrophobicContact CE1-CD 3.99Å; F119-K123 HydrophobicContact CE2-CD 4.49Å; F119-K123 HydrophobicContact CZ-CD 3.77Å; F119-K123 VanDerWaalsContact O-CB 3.31Å; F119-K123 WeakPolarHBondContact O-CB 3.5Å; F119-K123 PolarHBondContact O-N 3.07Å; I120-K123 PolarHBondContact O-N 3.04Å; R121-K123 VanDerWaalsContact C-N 3.27Å; R121-K123 PolarHBondContact O-N 3.44Å; K123-K127 WeakPolarHBondContact O-CA 3.3Å
124	Y	97.7	Very high	96	Very high	9 Å²	9	61 Å²	61	4%	0.035	30%	0.297	C	S	.	.	I	π-helix	trans	-110.8	-37.1	-171.8	-54.3	-68.3	0	0	0	115.3	D36 I49 I51 H61 Y99 I120	D36-Y124 VanDerWaalsContact OD1-CE2 3.3Å; D36-Y124 WeakPolarHBondContact OD1-CE2 3.31Å; D36-Y124 PolarHBondContact OD1-OH 2.76Å; I49-Y124 HydrophobicContact CD1-CD1 3.92Å; I49-Y124 HydrophobicContact CD1-CE1 4.3Å; I49-Y124 HydrophobicContact CD1-CG 4.14Å; I49-Y124 HydrophobicContact CG2-CD1 4.18Å; I49-Y124 HydrophobicContact CG2-CE1 3.89Å; I51-Y124 HydrophobicContact CD1-CE1 4.03Å; I51-Y124 HydrophobicContact CD1-CE2 4.31Å; I51-Y124 WeakPolarHBondContact CD1-OH 3.33Å; H61-Y124 AromaticContact CE1-CD2 3.47Å; H61-Y124 VanDerWaalsContact CE1-CD2 3.47Å; H61-Y124 WeakPolarHBondContact CE1-CD2 3.5Å; H61-Y124 AromaticContact CE1-CE2 3.33Å; H61-Y124 WeakPolarHBondContact CE1-CE2 3.44Å; H61-Y124 AromaticContact CE1-CZ 3.97Å; H61-Y124 AromaticContact NE2-CD2 3.65Å; H61-Y124 AromaticContact NE2-CE2 3.26Å; H61-Y124 VanDerWaalsContact NE2-CE2 3.26Å; H61-Y124 WeakPolarHBondContact NE2-CE2 3.31Å; Y99-Y124 AromaticContact CD1-CD1 3.8Å; Y99-Y124 HydrophobicContact CD1-CD1 3.8Å; Y99-Y124 HydrophobicContact CD1-CE1 4.01Å; Y99-Y124 HydrophobicContact CD2-CE1 4.22Å; Y99-Y124 AromaticContact CE1-CD1 3.9Å; Y99-Y124 HydrophobicContact CE1-CD1 3.9Å; Y99-Y124 HydrophobicContact CE1-CE1 4.35Å; Y99-Y124 HydrophobicContact CG-CD1 4.23Å; Y99-Y124 AromaticContact CG-CE1 3.95Å; Y99-Y124 HydrophobicContact CG-CE1 3.95Å; I120-Y124 HydrophobicContact CG2-CD2 3.94Å; I120-Y124 HydrophobicContact CG2-CE2 4.27Å; I120-Y124 WeakPolarHBondContact O-CD2 3.38Å; I120-Y124 PolarHBondContact O-N 3.08Å
125	E	96.8	Very high	95.7	Very high	82 Å²	82	62 Å²	62	38%	0.383	30%	0.299	S	S	.	.	I	π-helix	trans	-78.8	-50.6	179.6	177.9	173	-152.5	0	0	110	I68 R121	I68-E125 HydrophobicContact CD1-CB 3.82Å; I68-E125 HydrophobicContact CD1-CG 3.71Å; R121-E125 WeakPolarHBondContact CB-OE2 3.32Å; R121-E125 WeakPolarHBondContact CD-OE2 3.49Å; R121-E125 VanDerWaalsContact CG-OE2 3.24Å; R121-E125 WeakPolarHBondContact CG-OE2 3.49Å; R121-E125 IonicContact CZ-OE2 2.8Å; R121-E125 IonicContact NH1-OE1 2.66Å; R121-E125 IonicContact NH1-OE2 3.17Å; R121-E125 PolarHBondContact NH1-OE2 3.03Å; R121-E125 WeakPolarHBondContact O-CA 3.26Å; R121-E125 VanDerWaalsContact O-CB 3.28Å; R121-E125 WeakPolarHBondContact O-CB 3.47Å; R121-E125 PolarHBondContact O-N 3.11Å
126	Q	96.7	Very high	95.2	Very high	114 Å²	114	64.9 Å²	64.9	53%	0.533	32%	0.315	S	S	.	.	S	Bend	trans	-91	-12.6	-178.6	-55.9	176.1	8.1	0	0	113.3	R121 R128	R121-Q126 PolarHBondContact O-N 3.48Å; Q126-R128 PolarHBondContact O-N 2.79Å; Q126-R128 VanDerWaalsContact O-N 3.13Å
127	K	95.5	Very high	94.7	Very high	122 Å²	122	67.8 Å²	67.8	53%	0.53	34%	0.335	S	S	.	.			trans	51.7	32.4	179.7	-57	-179.4	-177.2	176.6	0	114.3	A122 K123 Y129 I130	A122-K127 PolarHBondContact O-N 2.73Å; K123-K127 WeakPolarHBondContact O-CA 3.3Å; K127-Y129 PolarHBondContact O-N 2.84Å; K127-Y129 VanDerWaalsContact O-N 3.13Å; K127-I130 HydrophobicContact CB-CB 4.28Å; K127-I130 HydrophobicContact CB-CG2 4.06Å; K127-I130 HydrophobicContact CD-CD1 4.32Å; K127-I130 VanDerWaalsContact O-CG2 3.29Å; K127-I130 WeakPolarHBondContact O-CG2 3.48Å; K127-I130 PolarHBondContact O-N 3.22Å
128	R	96.1	Very high	94.4	Very high	126 Å²	126	74.3 Å²	74.3	48%	0.475	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.8	-167.8	-163.6	-173.4	-58.3	150.3	-4.2	114.2	A122 Q126	A122-R128 WeakPolarHBondContact O-CB 3.39Å; A122-R128 PolarHBondContact O-N 2.88Å; Q126-R128 PolarHBondContact O-N 2.79Å; Q126-R128 VanDerWaalsContact O-N 3.13Å
129	Y	96.1	Very high	94	Very high	29 Å²	29	71.6 Å²	71.6	11%	0.114	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	12.2	-173.8	-44.5	-63.4	0	0	0	113	Y99 A101 N102 L103 F119 A122 K127	Y99-Y129 WeakPolarHBondContact O-CB 3.47Å; A101-Y129 PolarHBondContact N-O 3.15Å; A101-Y129 VanDerWaalsContact N-O 3.15Å; N102-Y129 PolarHBondContact N-O 2.64Å; N102-Y129 WeakPolarHBondContact O-CD1 3.44Å; L103-Y129 HydrophobicContact CB-CG 4.5Å; L103-Y129 HydrophobicContact CD1-CD1 3.86Å; L103-Y129 HydrophobicContact CD1-CD2 3.79Å; L103-Y129 HydrophobicContact CD1-CE1 3.93Å; L103-Y129 HydrophobicContact CD1-CE2 3.88Å; L103-Y129 HydrophobicContact CD1-CG 3.78Å; F119-Y129 HydrophobicContact CD2-CE2 4.2Å; F119-Y129 HydrophobicContact CE2-CD2 4.43Å; F119-Y129 HydrophobicContact CE2-CE2 4.09Å; A122-Y129 HydrophobicContact CB-CE2 3.89Å; K127-Y129 PolarHBondContact O-N 2.84Å; K127-Y129 VanDerWaalsContact O-N 3.13Å
130	I	96.1	Very high	93.8	Very high	38 Å²	38	76 Å²	76	20%	0.195	37%	0.37	C	S	.	.			trans	-72	144.2	-175.3	-154.2	169.8	0	0	0	111.5	V98 Y99 N102 K127 Y134	V98-I130 HydrophobicContact CG1-CD1 4.46Å; V98-I130 HydrophobicContact CG1-CG1 4.05Å; V98-I130 CarbonylContact O-C 3.6Å; V98-I130 VanDerWaalsContact O-CA 3.26Å; V98-I130 WeakPolarHBondContact O-CA 3.33Å; Y99-I130 HydrophobicContact CD1-CD1 4.21Å; Y99-I130 HydrophobicContact CD1-CG1 4.35Å; Y99-I130 HydrophobicContact CE1-CD1 4.02Å; N102-I130 PolarHBondContact ND2-O 2.68Å; K127-I130 HydrophobicContact CB-CB 4.28Å; K127-I130 HydrophobicContact CB-CG2 4.06Å; K127-I130 HydrophobicContact CD-CD1 4.32Å; K127-I130 VanDerWaalsContact O-CG2 3.29Å; K127-I130 WeakPolarHBondContact O-CG2 3.48Å; K127-I130 PolarHBondContact O-N 3.22Å; I130-Y134 HydrophobicContact CD1-CD1 3.92Å; I130-Y134 HydrophobicContact CG1-CD1 4.39Å
131	A	94.8	Very high	93.5	Very high	10 Å²	10	77.3 Å²	77.3	8%	0.083	38%	0.378	C	S	.	.			trans	-60.8	133.6	167.9	0	0	0	0	0	110.1	V98 A101 E133 Y134	V98-A131 PolarHBondContact O-N 2.99Å; A101-A131 HydrophobicContact CB-CB 3.71Å; A131-E133 VanDerWaalsContact C-N 3.32Å; A131-E133 PolarHBondContact O-N 3.01Å; A131-Y134 WeakPolarHBondContact O-CB 3.42Å; A131-Y134 PolarHBondContact O-N 2.88Å
132	Q	90.4	Very high	93.3	Very high	186 Å²	186	79 Å²	79	87%	0.869	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-26.6	-171	-172.2	143.5	-22.4	0	0	112.4	Y134	Q132-Y134 VanDerWaalsContact C-N 3.33Å
133	E	90.1	Very high	93.1	Very high	158 Å²	158	81.7 Å²	81.7	74%	0.738	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-5	174.1	68.1	-82.6	-165.3	0	0	113.8	A131 T135	A131-E133 VanDerWaalsContact C-N 3.32Å; A131-E133 PolarHBondContact O-N 3.01Å; E133-T135 PolarHBondContact O-N 2.71Å
134	Y	90.9	Very high	92.9	Very high	61 Å²	61	81.6 Å²	81.6	24%	0.239	41%	0.407	C	S	.	.			trans	-71.2	105.4	-177.3	175.2	-107.3	0	0	0	112.4	M90 V98 I130 A131 Q132 P136	M90-Y134 HydrophobicContact CE-CE2 4.28Å; M90-Y134 WeakPolarHBondContact CE-OH 3.49Å; V98-Y134 HydrophobicContact CB-CD2 4.2Å; V98-Y134 HydrophobicContact CB-CE2 4.5Å; V98-Y134 HydrophobicContact CB-CG 4.37Å; V98-Y134 HydrophobicContact CG1-CD1 3.48Å; V98-Y134 VanDerWaalsContact CG1-CD1 3.48Å; V98-Y134 HydrophobicContact CG1-CD2 3.57Å; V98-Y134 HydrophobicContact CG1-CE1 3.79Å; V98-Y134 HydrophobicContact CG1-CE2 3.89Å; V98-Y134 HydrophobicContact CG1-CG 3.36Å; V98-Y134 HydrophobicContact CG2-CD2 3.48Å; V98-Y134 VanDerWaalsContact CG2-CD2 3.48Å; V98-Y134 HydrophobicContact CG2-CE2 3.8Å; V98-Y134 HydrophobicContact CG2-CG 4.08Å; I130-Y134 HydrophobicContact CD1-CD1 3.92Å; I130-Y134 HydrophobicContact CG1-CD1 4.39Å; A131-Y134 WeakPolarHBondContact O-CB 3.42Å; A131-Y134 PolarHBondContact O-N 2.88Å; Q132-Y134 VanDerWaalsContact C-N 3.33Å; Y134-P136 HydrophobicContact CE1-CB 4.4Å
135	T	89.2	Confident	92.7	Very high	111 Å²	111	85.2 Å²	85.2	68%	0.681	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-97.4	129.6	163	59.7	0	0	0	0	110	E133 S137	E133-T135 PolarHBondContact O-N 2.71Å; T135-S137 PolarHBondContact O-N 2.87Å; T135-S137 VanDerWaalsContact O-N 3.12Å
136	P	87.4	Confident	92.5	Very high	101 Å²	101	86 Å²	86	66%	0.656	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-62.5	118.3	174.7	26.6	-33.7	0	0	0	110	Y134	Y134-P136 HydrophobicContact CE1-CB 4.4Å
137	S	87.3	Confident	92.3	Very high	61 Å²	61	83.2 Å²	83.2	43%	0.427	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-72.5	167.1	175.4	49.4	0	0	0	0	111.1	E89 T135	E89-S137 WeakPolarHBondContact OE1-CB 3.47Å; E89-S137 PolarHBondContact OE1-OG 2.61Å; T135-S137 PolarHBondContact O-N 2.87Å; T135-S137 VanDerWaalsContact O-N 3.12Å
138	K	90.1	Very high	92.2	Very high	193 Å²	193	78 Å²	78	84%	0.839	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-95.5	123.9	179.3	-69.5	-177.7	179.7	179.8	0	108.6	D140	K138-D140 PolarHBondContact O-N 2.78Å
139	P	91	Very high	92	Very high	31 Å²	31	77.9 Å²	77.9	20%	0.201	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-62.9	132.6	-178.2	25.5	-35.9	0	0	0	111.2	M82 A85 V86 E89 V141	M82-P139 HydrophobicContact SD-CG 3.61Å; A85-P139 HydrophobicContact CB-CB 3.81Å; V86-P139 HydrophobicContact CG2-CB 3.92Å; V86-P139 HydrophobicContact CG2-CG 3.76Å; E89-P139 WeakPolarHBondContact OE2-CA 3.19Å; E89-P139 WeakPolarHBondContact OE2-CB 3.32Å; P139-V141 HydrophobicContact CB-CG2 4.46Å; P139-V141 HydrophobicContact CG-CG2 4.37Å; P139-V141 PolarHBondContact O-N 2.91Å
140	D	91.7	Very high	91.8	Very high	99 Å²	99	84.7 Å²	84.7	53%	0.529	42%	0.423	S	S	.	.			trans	-76.7	76.8	173.9	-173.9	0.7	0	0	0	110.6	K138 E142 S143 L144	K138-D140 PolarHBondContact O-N 2.78Å; D140-E142 PolarHBondContact O-N 2.82Å; D140-E142 PolarHBondContact OD1-N 3Å; D140-S143 WeakPolarHBondContact OD1-CB 3.22Å; D140-S143 PolarHBondContact OD1-N 3.33Å; D140-S143 WeakPolarHBondContact OD2-CB 3.27Å; D140-L144 PolarHBondContact O-N 2.94Å
141	V	93	Very high	91.5	Very high	28 Å²	28	85.2 Å²	85.2	17%	0.17	43%	0.426	C	S	.	.	H	α-helix	trans	-64.3	-28.3	175.3	-166.4	0	0	0	0	110.9	P81 M82 A85 P139 L144 M145	P81-V141 HydrophobicContact CB-CG1 4.24Å; M82-V141 HydrophobicContact CE-CG2 3.87Å; M82-V141 HydrophobicContact SD-CG2 3.67Å; A85-V141 HydrophobicContact CB-CB 4.49Å; A85-V141 HydrophobicContact CB-CG2 4.07Å; P139-V141 HydrophobicContact CB-CG2 4.46Å; P139-V141 HydrophobicContact CG-CG2 4.37Å; P139-V141 PolarHBondContact O-N 2.91Å; V141-L144 PolarHBondContact O-N 3.13Å; V141-M145 HydrophobicContact CG1-CE 4.11Å; V141-M145 HydrophobicContact CG1-CG 4.24Å; V141-M145 HydrophobicContact CG1-SD 4.21Å; V141-M145 WeakPolarHBondContact O-CB 3.45Å; V141-M145 VanDerWaalsContact O-CG 3.26Å; V141-M145 WeakPolarHBondContact O-CG 3.3Å; V141-M145 PolarHBondContact O-N 3.13Å
142	E	93.7	Very high	91.3	Very high	97 Å²	97	86.8 Å²	86.8	45%	0.453	43%	0.432	S	S	.	.	H	α-helix	trans	-71	-44.6	-175.4	177.3	60.5	-161.2	0	0	112	D140 M145 K146	D140-E142 PolarHBondContact O-N 2.82Å; D140-E142 PolarHBondContact OD1-N 3Å; E142-M145 PolarHBondContact O-N 2.88Å; E142-M145 WeakPolarHBondContact OE2-CE 3.18Å; E142-K146 VanDerWaalsContact CG-NZ 3.35Å; E142-K146 WeakPolarHBondContact O-CG 3.37Å; E142-K146 PolarHBondContact O-N 3.19Å; E142-K146 VanDerWaalsContact O-N 3.12Å; E142-K146 WeakPolarHBondContact OE1-CE 3.37Å; E142-K146 IonicContact OE1-NZ 2.72Å; E142-K146 PolarHBondContact OE1-NZ 3.01Å
143	S	93.1	Very high	91.2	Very high	57 Å²	57	82.4 Å²	82.4	40%	0.399	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-42.9	172.1	179.7	0	0	0	0	111.8	D140 K146 E147	D140-S143 WeakPolarHBondContact OD1-CB 3.22Å; D140-S143 PolarHBondContact OD1-N 3.33Å; D140-S143 WeakPolarHBondContact OD2-CB 3.27Å; S143-K146 WeakPolarHBondContact O-CB 3.48Å; S143-K146 PolarHBondContact O-N 3.41Å; S143-E147 PolarHBondContact O-N 2.85Å; S143-E147 VanDerWaalsContact O-N 3.09Å
144	L	92.9	Very high	91	Very high	1 Å²	1	77.9 Å²	77.9	1%	0.005	40%	0.399	C	S	.	.	H	α-helix	trans	-63.7	-42.5	175.9	-179.3	74.1	0	0	0	112.5	I21 P81 L84 A85 D140 V141 K146 E147 L148	I21-L144 HydrophobicContact CG1-CD1 4.35Å; I21-L144 HydrophobicContact CG2-CD1 4.06Å; P81-L144 HydrophobicContact CB-CD2 4.16Å; P81-L144 WeakPolarHBondContact O-CD2 3.44Å; L84-L144 HydrophobicContact CB-CD2 3.53Å; L84-L144 HydrophobicContact CD1-CD2 4.41Å; A85-L144 HydrophobicContact CB-CD2 4.03Å; D140-L144 PolarHBondContact O-N 2.94Å; V141-L144 PolarHBondContact O-N 3.13Å; L144-K146 VanDerWaalsContact C-N 3.3Å; L144-K146 PolarHBondContact O-N 3.06Å; L144-E147 WeakPolarHBondContact O-CB 3.27Å; L144-E147 PolarHBondContact O-N 3.46Å; L144-E147 VanDerWaalsContact O-N 3.09Å; L144-L148 HydrophobicContact CD2-CD1 4.4Å; L144-L148 HydrophobicContact CG-CD1 4.13Å; L144-L148 HydrophobicContact CG-CG 4.38Å; L144-L148 WeakPolarHBondContact O-CG 3.42Å; L144-L148 PolarHBondContact O-N 3.39Å
145	M	92.8	Very high	90.5	Very high	85 Å²	85	77.9 Å²	77.9	42%	0.419	40%	0.401	S	S	.	.	H	α-helix	trans	-61.4	-39.4	177.9	-76.3	-175.3	-59.1	0	0	111.6	P81 V141 E142 E147 L148 Q149	P81-M145 HydrophobicContact CB-CG 4.3Å; V141-M145 HydrophobicContact CG1-CE 4.11Å; V141-M145 HydrophobicContact CG1-CG 4.24Å; V141-M145 HydrophobicContact CG1-SD 4.21Å; V141-M145 WeakPolarHBondContact O-CB 3.45Å; V141-M145 VanDerWaalsContact O-CG 3.26Å; V141-M145 WeakPolarHBondContact O-CG 3.3Å; V141-M145 PolarHBondContact O-N 3.13Å; E142-M145 PolarHBondContact O-N 2.88Å; E142-M145 WeakPolarHBondContact OE2-CE 3.18Å; M145-E147 VanDerWaalsContact C-N 3.31Å; M145-E147 PolarHBondContact O-N 2.78Å; M145-L148 PolarHBondContact O-N 2.72Å; M145-Q149 WeakPolarHBondContact O-CB 3.41Å; M145-Q149 PolarHBondContact O-N 2.95Å
146	K	93.6	Very high	90	Very high	97 Å²	97	78.5 Å²	78.5	42%	0.422	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-37.9	172.3	-73.7	164.9	178.6	147.4	0	112.4	E142 S143 L144 R150	E142-K146 VanDerWaalsContact CG-NZ 3.35Å; E142-K146 WeakPolarHBondContact O-CG 3.37Å; E142-K146 PolarHBondContact O-N 3.19Å; E142-K146 VanDerWaalsContact O-N 3.12Å; E142-K146 WeakPolarHBondContact OE1-CE 3.37Å; E142-K146 IonicContact OE1-NZ 2.72Å; E142-K146 PolarHBondContact OE1-NZ 3.01Å; S143-K146 WeakPolarHBondContact O-CB 3.48Å; S143-K146 PolarHBondContact O-N 3.41Å; L144-K146 VanDerWaalsContact C-N 3.3Å; L144-K146 PolarHBondContact O-N 3.06Å; K146-R150 VanDerWaalsContact O-CG 3.31Å; K146-R150 WeakPolarHBondContact O-CG 3.45Å; K146-R150 PolarHBondContact O-N 3.04Å
147	E	93	Very high	89.3	Confident	57 Å²	57	82.4 Å²	82.4	27%	0.266	40%	0.401	S	S	.	.	H	α-helix	trans	-69.6	-45.3	176.3	-167.7	-179.4	137.4	0	0	112.6	I21 R88 S143 L144 M145 Q149 R150 L151	I21-E147 WeakPolarHBondContact CD1-OE1 3.36Å; R88-E147 IonicContact CZ-OE1 3.96Å; R88-E147 IonicContact CZ-OE2 3.79Å; R88-E147 VanDerWaalsContact CZ-OE2 3.22Å; R88-E147 IonicContact NH1-OE1 3.57Å; R88-E147 IonicContact NH1-OE2 2.68Å; R88-E147 PolarHBondContact NH1-OE2 3.21Å; R88-E147 IonicContact NH2-OE1 2.63Å; R88-E147 PolarHBondContact NH2-OE1 2.99Å; R88-E147 IonicContact NH2-OE2 3.92Å; R88-E147 PolarHBondContact NH2-OE2 2.85Å; S143-E147 PolarHBondContact O-N 2.85Å; S143-E147 VanDerWaalsContact O-N 3.09Å; L144-E147 WeakPolarHBondContact O-CB 3.27Å; L144-E147 PolarHBondContact O-N 3.46Å; L144-E147 VanDerWaalsContact O-N 3.09Å; M145-E147 VanDerWaalsContact C-N 3.31Å; M145-E147 PolarHBondContact O-N 2.78Å; E147-Q149 PolarHBondContact O-N 3.03Å; E147-R150 WeakPolarHBondContact O-CB 3.46Å; E147-R150 PolarHBondContact O-N 3.05Å; E147-L151 WeakPolarHBondContact O-CG 3.24Å; E147-L151 PolarHBondContact O-N 3.47Å
148	L	92.6	Very high	88.2	Confident	12 Å²	12	87.6 Å²	87.6	6%	0.063	42%	0.416	C	S	.	.	H	α-helix	trans	-58.3	-38.7	174.2	-68.7	171	0	0	0	111.4	R17 I21 P81 L144 M145 L151 E152	R17-L148 HydrophobicContact CB-CD2 4.13Å; I21-L148 HydrophobicContact CD1-CD2 4.49Å; I21-L148 HydrophobicContact CG1-CD2 3.84Å; P81-L148 HydrophobicContact CB-CD1 4.09Å; P81-L148 HydrophobicContact CG-CD1 3.95Å; L144-L148 HydrophobicContact CD2-CD1 4.4Å; L144-L148 HydrophobicContact CG-CD1 4.13Å; L144-L148 HydrophobicContact CG-CG 4.38Å; L144-L148 WeakPolarHBondContact O-CG 3.42Å; L144-L148 PolarHBondContact O-N 3.39Å; M145-L148 PolarHBondContact O-N 2.72Å; L148-L151 PolarHBondContact O-N 2.69Å; L148-E152 PolarHBondContact O-N 3.13Å
149	Q	92	Very high	86.3	Confident	123 Å²	123	82.7 Å²	82.7	58%	0.575	41%	0.406	S	S	*	.	H	α-helix	trans	-65.4	-39.9	173.2	-169.3	-178.4	12.6	0	0	112.6	M145 E147 E152 L153	M145-Q149 WeakPolarHBondContact O-CB 3.41Å; M145-Q149 PolarHBondContact O-N 2.95Å; E147-Q149 PolarHBondContact O-N 3.03Å; Q149-E152 PolarHBondContact O-N 3.44Å; Q149-L153 WeakPolarHBondContact O-CG 3.28Å; Q149-L153 PolarHBondContact O-N 3.2Å
150	R	92.3	Very high	84.5	Confident	172 Å²	172	86.4 Å²	86.4	65%	0.649	43%	0.43	S	S	*	.	H	α-helix	trans	-63.5	-39.7	173.8	-72.2	168.1	-176	171.8	0.8	111.9	K146 E147 L153 S154	K146-R150 VanDerWaalsContact O-CG 3.31Å; K146-R150 WeakPolarHBondContact O-CG 3.45Å; K146-R150 PolarHBondContact O-N 3.04Å; E147-R150 WeakPolarHBondContact O-CB 3.46Å; E147-R150 PolarHBondContact O-N 3.05Å; R150-L153 PolarHBondContact O-N 3.03Å; R150-S154 WeakPolarHBondContact O-CB 3.37Å; R150-S154 PolarHBondContact O-N 3.27Å; R150-S154 PolarHBondContact O-OG 2.88Å
151	L	90.2	Very high	82.4	Confident	49 Å²	49	87.9 Å²	87.9	26%	0.257	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-42.3	174.6	-68.3	175	0	0	0	111.4	R17 I21 E147 L148 S154 Q155	R17-L151 HydrophobicContact CG-CB 4.43Å; I21-L151 HydrophobicContact CD1-CD1 3.72Å; I21-L151 HydrophobicContact CG1-CD1 4.43Å; E147-L151 WeakPolarHBondContact O-CG 3.24Å; E147-L151 PolarHBondContact O-N 3.47Å; L148-L151 PolarHBondContact O-N 2.69Å; L151-S154 PolarHBondContact O-N 3Å; L151-Q155 WeakPolarHBondContact O-CG 3.47Å; L151-Q155 PolarHBondContact O-N 3.42Å
152	E	89.1	Confident	80.4	Confident	44 Å²	44	93 Å²	93	21%	0.206	47%	0.474	C	S	.	.	H	α-helix	trans	-58.8	-48	173.9	173.9	160.3	161.4	0	0	112.7	Q14 R17 L148 Q149 S154 Q155 K156	Q14-E152 PolarHBondContact NE2-OE2 3.25Å; R17-E152 VanDerWaalsContact CZ-CB 3.43Å; R17-E152 IonicContact CZ-OE2 3.53Å; R17-E152 IonicContact NH1-OE2 3.67Å; R17-E152 PolarHBondContact NH1-OE2 2.88Å; R17-E152 IonicContact NH2-OE2 3.63Å; L148-E152 PolarHBondContact O-N 3.13Å; Q149-E152 PolarHBondContact O-N 3.44Å; E152-S154 VanDerWaalsContact C-N 3.29Å; E152-S154 PolarHBondContact O-N 2.88Å; E152-Q155 PolarHBondContact O-N 3.5Å; E152-K156 HydrophobicContact CG-CD 4.46Å; E152-K156 PolarHBondContact O-N 2.93Å; E152-K156 WeakPolarHBondContact OE1-CE 3.3Å; E152-K156 IonicContact OE1-NZ 2.95Å; E152-K156 PolarHBondContact OE1-NZ 3.19Å
153	L	89.7	Confident	78.3	Confident	94 Å²	94	93.3 Å²	93.3	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-35.6	178	-68.7	170.6	0	0	0	112.2	Q149 R150 K156 K157	Q149-L153 WeakPolarHBondContact O-CG 3.28Å; Q149-L153 PolarHBondContact O-N 3.2Å; R150-L153 PolarHBondContact O-N 3.03Å; L153-K156 PolarHBondContact O-N 2.85Å; L153-K157 PolarHBondContact O-N 3.37Å
154	S	86.3	Confident	76.2	Confident	63 Å²	63	99 Å²	99	44%	0.441	51%	0.512	S	S	.	.	H	α-helix	trans	-69.8	-34.8	179.5	-59.1	0	0	0	0	112.5	R150 L151 E152 K158	R150-S154 WeakPolarHBondContact O-CB 3.37Å; R150-S154 PolarHBondContact O-N 3.27Å; R150-S154 PolarHBondContact O-OG 2.88Å; L151-S154 PolarHBondContact O-N 3Å; E152-S154 VanDerWaalsContact C-N 3.29Å; E152-S154 PolarHBondContact O-N 2.88Å; S154-K158 WeakPolarHBondContact O-CG 3.38Å; S154-K158 PolarHBondContact O-N 3.42Å
155	Q	79.7	Confident	73.9	Confident	60 Å²	60	102.2 Å²	102.2	28%	0.28	55%	0.545	S	S	.	.	H	α-helix	trans	-67	-44.9	173	-72.4	172.2	-15.9	0	0	111.7	R17 L151 E152 K157 K158	R17-Q155 VanDerWaalsContact CZ-OE1 3.23Å; L151-Q155 WeakPolarHBondContact O-CG 3.47Å; L151-Q155 PolarHBondContact O-N 3.42Å; E152-Q155 PolarHBondContact O-N 3.5Å; Q155-K157 PolarHBondContact O-N 3.48Å; Q155-K158 PolarHBondContact O-N 3.5Å
156	K	77.9	Confident	71.5	Confident	125 Å²	125	103 Å²	103	54%	0.543	57%	0.565	S	S	.	*	H	α-helix	trans	-62	-26.1	178.7	-68.8	176.7	-172.8	173.2	0	113.8	E152 L153 S159	E152-K156 HydrophobicContact CG-CD 4.46Å; E152-K156 PolarHBondContact O-N 2.93Å; E152-K156 WeakPolarHBondContact OE1-CE 3.3Å; E152-K156 IonicContact OE1-NZ 2.95Å; E152-K156 PolarHBondContact OE1-NZ 3.19Å; L153-K156 PolarHBondContact O-N 2.85Å; K156-S159 PolarHBondContact O-OG 3.45Å
157	K	74.2	Confident	69.4	Low	182 Å²	182	106.8 Å²	106.8	79%	0.791	58%	0.584	S	S	*	*	H	α-helix	trans	-82.7	-19.8	174.4	-71.1	-178.2	178.4	-174.1	0	113.9	L153 Q155	L153-K157 PolarHBondContact O-N 3.37Å; Q155-K157 PolarHBondContact O-N 3.48Å
158	K	64.1	Low	67.3	Low	171 Å²	171	110.5 Å²	110.5	74%	0.743	61%	0.605	S	S	*	*	H	α-helix	trans	-90.1	-7.2	-176.5	-79.7	-173.3	176.5	-170.3	0	114.4	S154 Q155 P160	S154-K158 WeakPolarHBondContact O-CG 3.38Å; S154-K158 PolarHBondContact O-N 3.42Å; Q155-K158 PolarHBondContact O-N 3.5Å; K158-P160 WeakPolarHBondContact O-CD 3.38Å; K158-P160 WeakPolarHBondContact O-CG 3.49Å
159	S	49.4	Very low	65.4	Low	90 Å²	90	119.4 Å²	119.4	63%	0.629	65%	0.647	S	S	*	*	S	Bend	trans	-81.7	101.7	167.6	46.9	0	0	0	0	109.9	K156	K156-S159 PolarHBondContact O-OG 3.45Å
160	P	53.8	Low	63.3	Low	109 Å²	109	121.9 Å²	121.9	71%	0.708	66%	0.658	S	S	*	*			trans	-93.4	142.1	-171.3	3.3	19.5	0	0	0	110.9	K158 V162	K158-P160 WeakPolarHBondContact O-CD 3.38Å; K158-P160 WeakPolarHBondContact O-CG 3.49Å; P160-V162 PolarHBondContact O-N 3.47Å
161	T	47.3	Very low	61	Low	130 Å²	130	118 Å²	118	80%	0.798	66%	0.657	S	S	*	*			trans	-35.6	102.9	164.5	-52.6	0	0	0	0	113.4	S163	T161-S163 VanDerWaalsContact C-N 3.33Å; T161-S163 PolarHBondContact O-N 3.27Å; T161-S163 VanDerWaalsContact O-N 3.08Å
162	V	51.2	Low	58.9	Low	135 Å²	135	122.4 Å²	122.4	82%	0.818	69%	0.686	S	S	*	*			trans	-74.2	94.4	157.6	-175.7	0	0	0	0	106.4	P160 L164	P160-V162 PolarHBondContact O-N 3.47Å; V162-L164 PolarHBondContact O-N 3.36Å
163	S	48.6	Very low	56.7	Low	103 Å²	103	123.9 Å²	123.9	72%	0.72	71%	0.713	S	S	*	*			trans	-71.1	92.2	-179.7	-171.3	0	0	0	0	110	T161 G165	T161-S163 VanDerWaalsContact C-N 3.33Å; T161-S163 PolarHBondContact O-N 3.27Å; T161-S163 VanDerWaalsContact O-N 3.08Å; S163-G165 PolarHBondContact O-N 3.07Å
164	L	49.5	Very low	54.7	Low	176 Å²	176	126.9 Å²	126.9	92%	0.921	73%	0.728	S	S	*	*			trans	-73.6	75.1	175.3	-170.4	70.3	0	0	0	109.8	V162	V162-L164 PolarHBondContact O-N 3.36Å
165	G	45	Very low	52.8	Low	69 Å²	69	130.8 Å²	130.8	71%	0.711	74%	0.741	S	S	*	*			trans	-125.5	51.6	-172.2	0	0	0	0	0	113.3	S163	S163-G165 PolarHBondContact O-N 3.07Å
166	A	43.1	Very low	51.2	Low	101 Å²	101	136 Å²	136	84%	0.835	77%	0.765	S	S	*	*			trans	-138.5	85.5	174.9	0	0	0	0	0	110.6
167	H	49.3	Very low	49.5	Very low	177 Å²	177	139.4 Å²	139.4	82%	0.819	77%	0.774	S	S	*	*			trans	-134.6	137.4	164.6	-167.7	65.7	0	0	0	110.8
168	L	48.3	Very low	48.1	Very low	135 Å²	135	136.9 Å²	136.9	71%	0.707	78%	0.777	S	S	*	*			trans	-61.8	136.6	-173.1	-76.6	52.4	0	0	0	111.9
169	Q	53.5	Low	46.9	Very low	200 Å²	200	133.2 Å²	133.2	94%	0.935	77%	0.769	S	S	*	*			trans	-134.3	158.1	140.7	-76.2	-162.8	-15.3	0	0	110.4
170	H	46.7	Very low	46.8	Very low	175 Å²	175	137.2 Å²	137.2	81%	0.81	78%	0.775	S	S	*	*			trans	-109.1	170.9	-149.2	-138.7	75.3	0	0	0	113.2
171	S	45.5	Very low	46.3	Very low	89 Å²	89	139.4 Å²	139.4	62%	0.622	78%	0.776	S	S	*	*			trans	69.6	109.2	155.1	71.5	0	0	0	0	121.5
172	T	44.5	Very low	46.3	Very low	142 Å²	142	140.7 Å²	140.7	87%	0.871	78%	0.777	S	S	*	*				60	117.6	126.3	60.2	0	0	0	0	121.3
173	G	42.6	Very low	45.9	Very low	76 Å²	76	139.8 Å²	139.8	78%	0.784	77%	0.774	S	S	*	*			trans	-177.3	62.2	171.2	0	0	0	0	0	116.5
174	I	48.9	Very low	45.5	Very low	156 Å²	156	140.5 Å²	140.5	80%	0.8	77%	0.774	S	S	*	*			trans	28.8	117.4	150.9	-57.7	179.1	0	0	0	120.1
175	M	46	Very low	45	Very low	145 Å²	145	138.6 Å²	138.6	71%	0.714	77%	0.77	S	S	*	*			trans	25.6	124.7	142	-49.9	-174.3	74.6	0	0	121.2
176	H	46.6	Very low	44.9	Very low	169 Å²	169	139.7 Å²	139.7	78%	0.782	77%	0.766	S	S	*	*				177.9	143.2	89.9	-95.9	-76.1	0	0	0	112.6
177	R	41.8	Very low	45	Very low	197 Å²	197	140 Å²	140	74%	0.743	76%	0.763	S	S	*	*			trans	-109.3	150.4	168.2	-164.8	-162.7	-170.6	-159.7	7.1	107.8
178	P	45.1	Very low	44.7	Very low	130 Å²	130	140.6 Å²	140.6	84%	0.844	77%	0.765	S	S	*	*				-143.8	161.1	113.2	29.3	-10.6	0	0	0	115.4
179	T	38	Very low	44.3	Very low	94 Å²	94	139.7 Å²	139.7	58%	0.577	77%	0.766	S	S	*	*			trans	-97.6	144.6	-179	26.2	0	0	0	0	114.3
180	K	48.5	Very low	43.7	Very low	173 Å²	173	138 Å²	138	75%	0.752	76%	0.763	S	S	*	*			trans	-156.2	153.7	149.6	-72.8	-169.5	166.7	-107.6	0	108
181	E	42.6	Very low	43.3	Very low	156 Å²	156	136.6 Å²	136.6	73%	0.729	76%	0.761	S	S	*	*			cis	-159.6	156.8	-17.8	-108.9	154.7	-153.4	0	0	107.5
182	L	47.8	Very low	43.2	Very low	157 Å²	157	139.8 Å²	139.8	82%	0.822	77%	0.77	S	S	*	*			trans	-91.1	170	170.9	-87.1	157.5	0	0	0	109.1
183	P	42.5	Very low	42.8	Very low	115 Å²	115	140 Å²	140	75%	0.747	77%	0.766	S	S	*	*			cis	-152	154.7	48.1	41.6	-18.2	0	0	0	118.4
184	V	40.1	Very low	42.5	Very low	119 Å²	119	148 Å²	148	72%	0.721	77%	0.772	S	S	*	*				64.7	114.2	95.8	-169.5	0	0	0	0	118.7
185	T	39.4	Very low	42.3	Very low	136 Å²	136	145.7 Å²	145.7	83%	0.834	77%	0.766	S	S	*	*			trans	-175	139.4	139.6	23.5	0	0	0	0	106.9
186	S	43.1	Very low	42.2	Very low	92 Å²	92	145.9 Å²	145.9	64%	0.643	77%	0.77	S	S	*	*			cis	158.6	156.4	-20.3	46.9	0	0	0	0	105.7
187	S	45	Very low	42.1	Very low	108 Å²	108	144.8 Å²	144.8	76%	0.755	77%	0.769	S	S	*	*			trans	78.5	134.1	-176.6	79.4	0	0	0	0	116
188	E	43.1	Very low	42.5	Very low	188 Å²	188	142.8 Å²	142.8	88%	0.879	77%	0.774	S	S	*	*			cis	-151.8	158.5	-6.2	-122.7	165.8	-157	0	0	111.3
189	T	38.4	Very low	42.9	Very low	117 Å²	117	144.9 Å²	144.9	72%	0.718	77%	0.77	S	S	*	*			trans	-85.2	142.8	-172.4	44	0	0	0	0	113.9
190	N	40.9	Very low	43.7	Very low	163 Å²	163	147.3 Å²	147.3	87%	0.872	78%	0.779	S	S	*	*				-167.9	102.1	126.6	-96.2	-31.1	0	0	0	114.7
191	N	39.2	Very low	44	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	78%	0.776	S	S	*	*			trans	-33.2	133.3	160.9	-73.5	-27.2	0	0	0	117.2
192	I	42.6	Very low	44.6	Very low	157 Å²	157	144.8 Å²	144.8	81%	0.805	78%	0.777	S	S	*	*				-179.4	125.5	100.3	-87.8	156.6	0	0	0	110.6
193	N	36.8	Very low	44.4	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	78%	0.775	S	S	*	*			trans	27.9	103.9	158.4	-60.3	-6.3	0	0	0	120.5
194	R	36.3	Very low	44.7	Very low	244 Å²	244	142.4 Å²	142.4	92%	0.921	78%	0.776	S	S	*	*			trans	-80.4	128.8	140.4	-70.8	176.1	171.6	170.1	-3.5	109.1
195	T	43.8	Very low	45.2	Very low	108 Å²	108	144.1 Å²	144.1	66%	0.663	78%	0.781	S	S	*	*			trans	-119.4	120.7	154.5	51.7	0	0	0	0	108.5	N197	T195-N197 PolarHBondContact O-N 3.24Å
196	N	44.6	Very low	45.2	Very low	150 Å²	150	145.7 Å²	145.7	80%	0.802	79%	0.785	S	S	*	*			trans	-71.3	115.4	167.9	-63	-39	0	0	0	106.9	D198	N196-D198 PolarHBondContact O-N 2.92Å
197	N	45.3	Very low	45.3	Very low	145 Å²	145	146.2 Å²	146.2	78%	0.775	79%	0.794	S	S	*	*			trans	-81	77.5	174.3	-67.8	-15	0	0	0	109	T195 F199	T195-N197 PolarHBondContact O-N 3.24Å; N197-F199 PolarHBondContact O-N 3.01Å
198	D	49.6	Very low	45.1	Very low	155 Å²	155	146.9 Å²	146.9	83%	0.829	80%	0.799	S	S	*	*			trans	-63.8	113	154.2	-95.3	-46.2	0	0	0	107.2	N196 D200	N196-D198 PolarHBondContact O-N 2.92Å; D198-D200 PolarHBondContact O-N 3.21Å
199	F	52.3	Low	45.1	Very low	175 Å²	175	141.5 Å²	141.5	77%	0.768	79%	0.794	S	S	*	*			trans	-80.5	84.5	-179.1	177.7	-107.4	0	0	0	109.3	N197 L201	N197-F199 PolarHBondContact O-N 3.01Å; F199-L201 HydrophobicContact CD1-CB 4.37Å; F199-L201 HydrophobicContact CE1-CB 4.09Å; F199-L201 HydrophobicContact CE1-CD1 3.47Å; F199-L201 VanDerWaalsContact CE1-CD1 3.47Å; F199-L201 HydrophobicContact CE1-CG 4.37Å; F199-L201 HydrophobicContact CZ-CD1 3.79Å; F199-L201 PolarHBondContact O-N 3.4Å; F199-L201 VanDerWaalsContact O-N 3.15Å
200	D	56.4	Low	45.3	Very low	145 Å²	145	141.4 Å²	141.4	78%	0.775	80%	0.795	S	S	*	*			trans	-73.8	101.7	174.8	-163.3	0.7	0	0	0	110.6	D198 L202	D198-D200 PolarHBondContact O-N 3.21Å; D200-L202 VanDerWaalsContact C-N 3.28Å; D200-L202 PolarHBondContact O-N 3.23Å
201	L	55.1	Low	45.2	Very low	129 Å²	129	140.6 Å²	140.6	68%	0.675	79%	0.786	S	S	*	*	S	Bend	trans	-82.1	57.1	-174.9	-178.4	94	0	0	0	111.3	F199	F199-L201 HydrophobicContact CD1-CB 4.37Å; F199-L201 HydrophobicContact CE1-CB 4.09Å; F199-L201 HydrophobicContact CE1-CD1 3.47Å; F199-L201 VanDerWaalsContact CE1-CD1 3.47Å; F199-L201 HydrophobicContact CE1-CG 4.37Å; F199-L201 HydrophobicContact CZ-CD1 3.79Å; F199-L201 PolarHBondContact O-N 3.4Å; F199-L201 VanDerWaalsContact O-N 3.15Å
202	L	54.5	Low	45.1	Very low	146 Å²	146	141.5 Å²	141.5	76%	0.764	79%	0.791	S	S	*	*			trans	-162.7	48.7	160.6	-83.5	-160	0	0	0	113.3	D200 L204	D200-L202 VanDerWaalsContact C-N 3.28Å; D200-L202 PolarHBondContact O-N 3.23Å; L202-L204 VanDerWaalsContact C-N 3.3Å; L202-L204 PolarHBondContact O-N 3.36Å
203	G	42.7	Very low	45	Very low	75 Å²	75	140.9 Å²	140.9	77%	0.773	78%	0.783	S	S	*	*			trans	-72.7	69.8	173.7	0	0	0	0	0	114.6	D205	G203-D205 PolarHBondContact O-N 3.33Å
204	L	50.3	Low	45.2	Very low	148 Å²	148	140.8 Å²	140.8	78%	0.775	78%	0.782	S	S	*	*			trans	-93.7	75.2	170.3	-99.2	86.9	0	0	0	111.5	L202	L202-L204 VanDerWaalsContact C-N 3.3Å; L202-L204 PolarHBondContact O-N 3.36Å
205	D	49.3	Very low	45.5	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	77%	0.772	S	S	*	*			trans	-89	106.5	170	-70.8	-25	0	0	0	110.6	G203 A207	G203-D205 PolarHBondContact O-N 3.33Å; D205-A207 PolarHBondContact O-N 3.01Å
206	N	39.3	Very low	45.2	Very low	170 Å²	170	136.7 Å²	136.7	91%	0.909	77%	0.774	S	S	*	*			trans	-66	113.9	170.4	-95.2	-2	0	0	0	110.4
207	A	45.3	Very low	44.9	Very low	102 Å²	102	138.2 Å²	138.2	84%	0.843	77%	0.774	S	S	*	*			trans	-123.5	135.1	164.8	0	0	0	0	0	110.6	D205	D205-A207 PolarHBondContact O-N 3.01Å
208	S	41.5	Very low	44.5	Very low	123 Å²	123	137.2 Å²	137.2	86%	0.86	77%	0.768	S	S	*	*			trans	-103.8	114.6	-157.4	53.2	0	0	0	0	115.4
209	G	43	Very low	44.2	Very low	74 Å²	74	138.1 Å²	138.1	76%	0.763	77%	0.767	S	S	*	*			trans	68.9	-176.6	151.6	0	0	0	0	0	118.6
210	P	41.8	Very low	43.3	Very low	116 Å²	116	133.7 Å²	133.7	75%	0.753	77%	0.77	S	S	*	*			cis	-132.6	171.5	-9.8	41	-25.1	0	0	0	115.4
211	E	38.4	Very low	42.3	Very low	145 Å²	145	130.5 Å²	130.5	68%	0.678	77%	0.772	S	S	*	*			trans	53.4	116.7	151.1	-69.2	-176.1	143.4	0	0	122.3	K213	E211-K213 IonicContact OE1-NZ 2.9Å; E211-K213 PolarHBondContact OE1-NZ 3.34Å
212	N	37.1	Very low	41.8	Very low	165 Å²	165	130.2 Å²	130.2	88%	0.882	78%	0.778	S	S	*	*				-144.7	142.3	112.1	-152.5	-15.4	0	0	0	111
213	K	42.3	Very low	41	Very low	145 Å²	145	129 Å²	129	63%	0.63	78%	0.782	S	S	*	*			trans	-112.8	138.4	-171.7	-70.4	160.5	174.9	149.2	0	110.5	E211	E211-K213 IonicContact OE1-NZ 2.9Å; E211-K213 PolarHBondContact OE1-NZ 3.34Å
214	N	41	Very low	40.7	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	79%	0.787	S	S	*	*			trans	-169.8	107.3	146.2	-88.8	-39.9	0	0	0	106.7
215	N	41.4	Very low	40.1	Very low	133 Å²	133	132.3 Å²	132.3	71%	0.711	79%	0.791	S	S	*	*				76.9	133.4	82.7	-74.5	-26.6	0	0	0	112.1
216	L	37.6	Very low	39.4	Very low	133 Å²	133	131 Å²	131	70%	0.696	79%	0.788	S	S	*	*			cis	-173.8	142	0.1	-176.8	64	0	0	0	110.3
217	F	38.9	Very low	39.3	Very low	183 Å²	183	132.6 Å²	132.6	80%	0.803	79%	0.788	S	S	*	*			trans	62.4	133.7	168.3	-76.9	-145.2	0	0	0	117.7
218	D	36.3	Very low	39	Very low	123 Å²	123	130.7 Å²	130.7	66%	0.658	78%	0.778	S	S	*	*			cis	108.2	141.2	12.5	-157.3	12.8	0	0	0	115.8
219	H	42.8	Very low	39	Very low	175 Å²	175	130 Å²	130	81%	0.81	77%	0.773	S	S	*	*			trans	75.7	134.6	170.6	-60.3	-12.5	0	0	0	121.2
220	G	35.2	Very low	39	Very low	81 Å²	81	133.7 Å²	133.7	84%	0.835	77%	0.77	S	S	*	*			trans	142.5	102.5	153.2	0	0	0	0	0	116.6
221	G	34.4	Very low	39	Very low	78 Å²	78	135.4 Å²	135.4	80%	0.804	77%	0.768	S	S	*	*			trans	-85	-179.4	174.9	0	0	0	0	0	115.4
222	P	44.5	Very low	39.2	Very low	123 Å²	123	135.6 Å²	135.6	80%	0.799	77%	0.767	S	S	*	*			trans	-102	156.8	-161.7	38	-35.3	0	0	0	115.4
223	S	37.7	Very low	39.4	Very low	122 Å²	122	135 Å²	135	85%	0.853	76%	0.759	S	S	*	*			trans	-173	159.8	144.6	-89.7	0	0	0	0	115.9
224	Q	35.8	Very low	39.2	Very low	189 Å²	189	133.6 Å²	133.6	88%	0.883	77%	0.767	S	S	*	*			trans	-41	150.8	178.5	-53.8	164.9	7.8	0	0	118.2
225	A	38.2	Very low	38.9	Very low	103 Å²	103	133.3 Å²	133.3	85%	0.851	77%	0.771	S	S	*	*				-171.1	141.6	123.5	0	0	0	0	0	115.3
226	T	35.4	Very low	38.9	Very low	125 Å²	125	134 Å²	134	77%	0.767	78%	0.779	S	S	*	*			trans	-61.2	166.4	179.6	-52.3	0	0	0	0	118.2
227	F	37.6	Very low	39	Very low	205 Å²	205	130.6 Å²	130.6	90%	0.899	78%	0.777	S	S	*	*			trans	121.7	135.1	153.3	-81.1	-87.2	0	0	0	114.3
228	G	38.8	Very low	39.1	Very low	62 Å²	62	130.4 Å²	130.4	64%	0.639	78%	0.778	S	S	*	*			cis	167.3	165.2	-9.1	0	0	0	0	0	112.9
229	S	41.2	Very low	39.3	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	79%	0.785	S	S	*	*			trans	72.4	145.5	162.1	-68.8	0	0	0	0	119.9
230	Q	41.9	Very low	39.5	Very low	151 Å²	151	129.6 Å²	129.6	71%	0.706	78%	0.78	S	S	*	*			cis	-172.6	171.2	-18.3	-128.3	-177.4	53.4	0	0	111.9
231	Q	41.9	Very low	40.1	Very low	152 Å²	152	132.9 Å²	132.9	71%	0.71	78%	0.784	S	S	*	*			trans	75.7	143.9	153.9	-75.7	175.7	47.8	0	0	119.8
232	K	42.8	Very low	40.2	Very low	149 Å²	149	134.7 Å²	134.7	65%	0.648	78%	0.784	S	S	*	*			cis	-170.5	148.3	-10.1	-137.3	-178.9	173.9	-150.5	0	112.9
233	Q	41.3	Very low	40	Very low	153 Å²	153	134.4 Å²	134.4	72%	0.715	79%	0.785	S	S	*	*			trans	58.2	153.6	146.1	-80.5	165.1	-19.5	0	0	120.7
234	S	39.6	Very low	40	Very low	115 Å²	115	135.6 Å²	135.6	80%	0.804	78%	0.781	S	S	*	*			cis	-163.2	165.6	-0.2	35.6	0	0	0	0	113.3
235	T	34.3	Very low	40.4	Very low	136 Å²	136	132.9 Å²	132.9	83%	0.834	78%	0.777	S	S	*	*			trans	-97.2	165.3	-171.5	-32.5	0	0	0	0	115
236	V	41.5	Very low	40.2	Very low	147 Å²	147	134.3 Å²	134.3	89%	0.891	77%	0.77	S	S	*	*			trans	160.6	143.7	131.2	156.7	0	0	0	0	115.5
237	G	38.6	Very low	40.2	Very low	62 Å²	62	133.5 Å²	133.5	64%	0.639	77%	0.766	S	S	*	*			trans	109.8	106.7	158.8	0	0	0	0	0	116.2
238	Q	41.2	Very low	40.1	Very low	179 Å²	179	129.2 Å²	129.2	84%	0.836	76%	0.756	S	S	*	*				65.6	137.4	66.2	-65.1	-169.4	-3	0	0	114.4
239	Q	40.8	Very low	40.2	Very low	171 Å²	171	135.6 Å²	135.6	80%	0.799	77%	0.767	S	S	*	*			cis	-160	178.5	2	-117	-171.3	-9.7	0	0	111
240	P	47.1	Very low	39.9	Very low	110 Å²	110	138.1 Å²	138.1	71%	0.714	77%	0.766	S	S	*	*			trans	-108	177.2	-166	42.5	-38.2	0	0	0	116.9
241	V	46.8	Very low	39.5	Very low	150 Å²	150	136.2 Å²	136.2	91%	0.909	76%	0.76	S	S	*	*			trans	-140.7	161.7	163.4	-66.7	0	0	0	0	113.1
242	S	37.9	Very low	39.2	Very low	115 Å²	115	137.4 Å²	137.4	80%	0.804	77%	0.765	S	S	*	*			trans	-124.2	170.1	-158.7	-48	0	0	0	0	115.5
243	S	39.5	Very low	38.6	Very low	118 Å²	118	139.6 Å²	139.6	83%	0.825	77%	0.774	S	S	*	*			trans	131.8	127.1	153	60.8	0	0	0	0	112.2
244	L	37.5	Very low	38.5	Very low	147 Å²	147	136.8 Å²	136.8	77%	0.77	77%	0.77	S	S	*	*			cis	105.5	105.9	17.4	-156.7	146.6	0	0	0	114.2
245	V	43.6	Very low	38.1	Very low	132 Å²	132	139.6 Å²	139.6	80%	0.8	77%	0.767	S	S	*	*			trans	-172.8	125	144.3	-88.5	0	0	0	0	107.1
246	D	35.6	Very low	38.1	Very low	132 Å²	132	139.6 Å²	139.6	71%	0.706	76%	0.762	S	S	*	*				74.2	137	61.2	-86.5	-43.9	0	0	0	115.3
247	T	35.6	Very low	37.7	Very low	109 Å²	109	139.5 Å²	139.5	67%	0.669	76%	0.762	S	S	*	*			cis	-168.1	154.8	-10.6	-145.6	0	0	0	0	114.8
248	T	35.5	Very low	37.7	Very low	114 Å²	114	141.1 Å²	141.1	70%	0.699	77%	0.769	S	S	*	*			trans	61.7	126.2	146.1	-54.3	0	0	0	0	125.2
249	K	40.4	Very low	37.6	Very low	197 Å²	197	138.2 Å²	138.2	86%	0.857	77%	0.769	S	S	*	*				178.6	120.7	121.5	-95.4	170.5	-170.9	178.4	0	110.5
250	H	35	Very low	37.3	Very low	161 Å²	161	135.4 Å²	135.4	75%	0.745	77%	0.768	S	S	*	*				89.6	121.7	71.2	-168.8	-81.4	0	0	0	113.4
251	I	32.8	Very low	36.8	Very low	112 Å²	112	138.1 Å²	138.1	57%	0.574	78%	0.776	S	S	*	*			cis	-170.2	170.7	-5.6	-151.8	176.1	0	0	0	112.4
252	Q	35.5	Very low	36.3	Very low	177 Å²	177	137.4 Å²	137.4	83%	0.827	77%	0.772	S	S	*	*			trans	74.9	140.3	157.4	-76.5	158.6	10.9	0	0	124.3
253	K	31	Very low	36.5	Very low	194 Å²	194	136.8 Å²	136.8	84%	0.843	77%	0.768	S	S	*	*			trans	-113.1	-174.1	173.8	-135.6	-167	167.6	-178.4	0	107
254	P	39.6	Very low	36.6	Very low	95 Å²	95	138.6 Å²	138.6	62%	0.617	77%	0.768	S	S	*	*			cis	-138.5	-169.8	-20	41.5	-23.3	0	0	0	115.5
255	K	31.1	Very low	36.6	Very low	174 Å²	174	139.5 Å²	139.5	76%	0.757	77%	0.773	S	S	*	*			trans	92.8	104.8	142.9	-90	-178.2	168.9	-173.7	0	121.9
256	D	33.7	Very low	36.5	Very low	136 Å²	136	142.1 Å²	142.1	73%	0.727	78%	0.781	S	S	*	*				44.9	139.3	114.2	-42.1	-20.9	0	0	0	119.2
257	T	32.9	Very low	36.5	Very low	145 Å²	145	139.2 Å²	139.2	89%	0.89	78%	0.782	S	S	*	*				-163.5	164.1	67.2	-45.1	0	0	0	0	112.6
258	A	38.4	Very low	37	Very low	95 Å²	95	142.3 Å²	142.3	79%	0.785	79%	0.794	S	S	*	*			trans	-103.7	175.8	-171.5	0	0	0	0	0	115.7
259	S	39.3	Very low	37.1	Very low	119 Å²	119	143.3 Å²	143.3	83%	0.832	80%	0.795	S	S	*	*			trans	-163.8	154.6	156.3	58.3	0	0	0	0	109.2
260	S	35.2	Very low	37.2	Very low	111 Å²	111	143.7 Å²	143.7	78%	0.776	80%	0.797	S	S	*	*			cis	-158.8	158.6	-23.9	-174.7	0	0	0	0	108.3
261	L	36.4	Very low	37.3	Very low	168 Å²	168	139 Å²	139	88%	0.88	79%	0.793	S	S	*	*			trans	-119.1	129.8	176.6	-77.7	170.4	0	0	0	112
262	T	35.6	Very low	37.5	Very low	134 Å²	134	139.3 Å²	139.3	82%	0.822	80%	0.803	S	S	*	*			trans	-162.2	158.6	163	42	0	0	0	0	107.1
263	S	42.5	Very low	37.6	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	80%	0.8	S	S	*	*			cis	-137.3	-145.6	6.4	-76.8	0	0	0	0	110.3
264	D	41	Very low	37.7	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	80%	0.799	S	S	*	*			trans	83.8	62.8	149.7	-64.3	7.2	0	0	0	120.3
265	L	38.2	Very low	37.6	Very low	166 Å²	166	138.1 Å²	138.1	87%	0.869	81%	0.81	S	S	*	*			trans	-155.8	70.8	153.6	-161.5	99	0	0	0	114.6
266	L	41.3	Very low	37.7	Very low	188 Å²	188	136.6 Å²	136.6	98%	0.984	82%	0.815	S	S	*	*			trans	-153	142.1	159.7	-77.7	-174.3	0	0	0	110.9
267	G	35.4	Very low	37.5	Very low	70 Å²	70	133 Å²	133	72%	0.722	81%	0.81	S	S	*	*			trans	137.6	64.3	162.7	0	0	0	0	0	117.9
268	L	46.4	Very low	37.5	Very low	175 Å²	175	134.8 Å²	134.8	92%	0.916	81%	0.809	S	S	*	*			trans	-141.1	114.1	145.7	-81.6	-174.4	0	0	0	109.6
269	D	37.3	Very low	37.2	Very low	135 Å²	135	141.5 Å²	141.5	72%	0.722	81%	0.814	S	S	*	*			trans	-93.2	140.4	-179.2	172.8	23.2	0	0	0	110.7	G271	D269-G271 PolarHBondContact OD1-N 2.87Å
270	F	43.4	Very low	36.9	Very low	204 Å²	204	139.8 Å²	139.8	90%	0.895	81%	0.807	S	S	*	*			trans	-154.4	80	157.7	-83.1	-68.8	0	0	0	108.5
271	G	35.5	Very low	37	Very low	64 Å²	64	141 Å²	141	66%	0.66	81%	0.81	S	S	*	*			trans	-68.3	154.4	172.3	0	0	0	0	0	113.8	D269	D269-G271 PolarHBondContact OD1-N 2.87Å
272	C	37.4	Very low	36.7	Very low	117 Å²	117	141.1 Å²	141.1	79%	0.791	81%	0.811	S	S	*	*				-164.3	128.6	115.9	-144.2	0	0	0	0	112.6
273	T	38.3	Very low	36.8	Very low	124 Å²	124	139.7 Å²	139.7	76%	0.761	81%	0.813	S	S	*	*			trans	14.2	128.1	155.6	59.3	0	0	0	0	121.9
274	N	32.3	Very low	36.4	Very low	155 Å²	155	139 Å²	139	83%	0.829	81%	0.813	S	S	*	*			trans	-63.7	150	152.7	-65.7	-44.4	0	0	0	111.8
275	L	37.8	Very low	36.3	Very low	162 Å²	162	139.4 Å²	139.4	85%	0.848	82%	0.816	S	S	*	*			trans	-174.1	117.3	135.4	-100.6	155.1	0	0	0	112
276	V	33.1	Very low	36.3	Very low	142 Å²	142	139.1 Å²	139.1	86%	0.861	82%	0.815	S	S	*	*			trans	36.8	131.8	138.3	178.8	0	0	0	0	120.6
277	G	30	Very low	36	Very low	61 Å²	61	133.6 Å²	133.6	63%	0.629	80%	0.804	S	S	*	*			trans	139.3	101.9	138.8	0	0	0	0	0	118.7
278	E	33.7	Very low	36	Very low	182 Å²	182	139.5 Å²	139.5	85%	0.85	81%	0.813	S	S	*	*			trans	54.1	104.6	139.3	-61.8	-175	93.4	0	0	123.5
279	R	31.2	Very low	35.5	Very low	236 Å²	236	138.7 Å²	138.7	89%	0.891	81%	0.808	S	S	*	*				62.6	144.8	102.7	-148.9	173.7	-161.6	164.5	3.9	121.4
280	A	33.9	Very low	35.3	Very low	84 Å²	84	137.5 Å²	137.5	69%	0.694	81%	0.811	S	S	*	*			trans	79.9	140.7	167.1	0	0	0	0	0	116.4
281	T	36.1	Very low	34.8	Very low	136 Å²	136	133.2 Å²	133.2	83%	0.834	81%	0.806	S	S	*	*			cis	-158.9	148.3	-8.3	9.6	0	0	0	0	109.3
282	N	29.7	Very low	34.7	Very low	170 Å²	170	134.1 Å²	134.1	91%	0.909	82%	0.815	S	S	*	*			trans	-80	145.2	167.5	-68.5	-36.2	0	0	0	110.8
283	A	37.8	Very low	34.6	Very low	104 Å²	104	133.5 Å²	133.5	86%	0.86	81%	0.812	S	S	*	*			trans	-137.9	130	161.2	0	0	0	0	0	109
284	A	34.4	Very low	34.7	Very low	88 Å²	88	135.1 Å²	135.1	73%	0.727	82%	0.822	S	S	*	*			trans	-89.4	163.8	180	0	0	0	0	0	111.6
285	N	39.9	Very low	35.4	Very low	164 Å²	164	132 Å²	132	88%	0.877	81%	0.812	S	S	*	*			trans	-160.9	145	131	-105	-22	0	0	0	112.4
286	D	36.6	Very low	36	Very low	161 Å²	161	133.7 Å²	133.7	86%	0.861	81%	0.813	S	S	*	*			trans	-74.5	165.7	178.7	-59.9	-77.1	0	0	0	113.2
287	G	35	Very low	37.3	Very low	72 Å²	72	133.2 Å²	133.2	74%	0.742	80%	0.804	S	S	*	*			trans	-179.6	41.9	-179.4	0	0	0	0	0	121.4
288	Q	37	Very low	39	Very low	194 Å²	194	134.7 Å²	134.7	91%	0.907	80%	0.801	S	S	*	*			trans	71.9	140.1	142.3	-148.7	162.2	20.5	0	0	122.3
289	L	34.5	Very low	40.6	Very low	158 Å²	158	134 Å²	134	83%	0.827	80%	0.795	S	S	*	*			trans	-43	147.8	174.7	-79.7	55	0	0	0	117
290	S	34.1	Very low	42.3	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	78%	0.782	S	S	*	*				178.8	142.6	100.9	43.9	0	0	0	0	116.4
291	S	33.5	Very low	44.2	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	76%	0.763	S	S	*	*			trans	35.4	109.4	151.5	58.5	0	0	0	0	122.1
292	G	31.5	Very low	45.6	Very low	83 Å²	83	123.9 Å²	123.9	86%	0.856	75%	0.745	S	S	*	*				72.3	94.4	110.6	0	0	0	0	0	119.8
293	S	36.7	Very low	47.8	Very low	104 Å²	104	121 Å²	121	73%	0.727	73%	0.729	S	S	*	*			trans	-155.7	135.9	141.5	57.2	0	0	0	0	111.9	S295	S293-S295 PolarHBondContact O-N 3.3Å
294	T	39.8	Very low	49.5	Very low	158 Å²	158	118.4 Å²	118.4	97%	0.969	71%	0.707	S	S	*	*			trans	-76.3	86.8	178.1	41.9	0	0	0	0	110.8
295	S	47.5	Very low	51	Low	89 Å²	89	119.6 Å²	119.6	62%	0.622	70%	0.701	S	S	*	*			trans	-128.9	107.4	179.5	51.3	0	0	0	0	112.8	S293	S293-S295 PolarHBondContact O-N 3.3Å
296	K	49.5	Very low	52	Low	198 Å²	198	120.3 Å²	120.3	86%	0.861	69%	0.693	S	S	*	*			trans	23.6	100.2	153.6	-59.8	177.6	-176.7	177.8	0	116.1	T298	K296-T298 PolarHBondContact O-N 3.19Å
297	I	60.7	Low	53.1	Low	131 Å²	131	120 Å²	120	67%	0.672	69%	0.686	S	S	*	*			trans	-49.9	107.3	168.2	-79.8	171.1	0	0	0	110.3	I302	I297-I302 HydrophobicContact CG2-CD1 3.8Å; I297-I302 HydrophobicContact CG2-CG1 3.6Å
298	T	66	Low	54.2	Low	92 Å²	92	124 Å²	124	56%	0.564	69%	0.685	S	S	*	*			trans	-78.9	155.9	169.9	22.5	0	0	0	0	110.2	K296 D300 S301	K296-T298 PolarHBondContact O-N 3.19Å; T298-D300 PolarHBondContact O-N 3.03Å; T298-S301 PolarHBondContact O-N 3.45Å; T298-S301 PolarHBondContact O-OG 2.91Å
299	K	66.4	Low	54.6	Low	167 Å²	167	119.2 Å²	119.2	73%	0.726	67%	0.673	S	S	*	*	H	α-helix	trans	-50.2	-32.5	-179.9	-174.7	179.2	176	-174.8	0	113.2	I302 L303	K299-I302 PolarHBondContact O-N 3.28Å; K299-L303 PolarHBondContact O-N 3.23Å
300	D	68.1	Low	55.2	Low	114 Å²	114	115.6 Å²	115.6	61%	0.61	67%	0.666	S	S	*	*	H	α-helix	trans	-75	-28.1	-177.9	-49	-70.8	0	0	0	113.2	T298 I302 L303 A304	T298-D300 PolarHBondContact O-N 3.03Å; D300-I302 VanDerWaalsContact C-N 3.32Å; D300-I302 PolarHBondContact O-N 2.84Å; D300-L303 PolarHBondContact O-N 3.39Å; D300-A304 PolarHBondContact O-N 2.86Å
301	S	73.9	Confident	55.5	Low	45 Å²	45	114 Å²	114	32%	0.315	66%	0.655	S	S	.	*	H	α-helix	trans	-73.3	-26.4	175.1	84.8	0	0	0	0	112.4	T298 L305	T298-S301 PolarHBondContact O-N 3.45Å; T298-S301 PolarHBondContact O-OG 2.91Å; S301-L305 PolarHBondContact O-N 2.9Å
302	I	65.9	Low	56	Low	86 Å²	86	116.9 Å²	116.9	44%	0.441	66%	0.656	S	S	.	*	H	α-helix	trans	-72.1	-37.8	172.6	-55.9	-178.4	0	0	0	110.4	I297 K299 D300 Y306	I297-I302 HydrophobicContact CG2-CD1 3.8Å; I297-I302 HydrophobicContact CG2-CG1 3.6Å; K299-I302 PolarHBondContact O-N 3.28Å; D300-I302 VanDerWaalsContact C-N 3.32Å; D300-I302 PolarHBondContact O-N 2.84Å; I302-Y306 PolarHBondContact O-N 3.33Å
303	L	75.9	Confident	56.2	Low	109 Å²	109	118.8 Å²	118.8	57%	0.571	65%	0.653	S	S	*	*	H	α-helix	trans	-65.4	-41.2	173	-99.2	69.6	0	0	0	111.9	K299 D300 L305 Y306 Q307	K299-L303 PolarHBondContact O-N 3.23Å; D300-L303 PolarHBondContact O-N 3.39Å; L303-L305 VanDerWaalsContact C-N 3.33Å; L303-L305 PolarHBondContact O-N 3.37Å; L303-Y306 PolarHBondContact O-N 3.2Å; L303-Q307 PolarHBondContact O-N 3.34Å
304	A	71.8	Confident	56.5	Low	50 Å²	50	119.1 Å²	119.1	41%	0.413	66%	0.655	S	S	.	*	H	α-helix	trans	-60	-39.8	177.8	0	0	0	0	0	113	D300 Q307 Q308	D300-A304 PolarHBondContact O-N 2.86Å; A304-Q307 PolarHBondContact O-N 3.02Å; A304-Q308 PolarHBondContact O-N 2.92Å
305	L	66.8	Low	56.3	Low	113 Å²	113	116.9 Å²	116.9	59%	0.592	65%	0.646	S	S	*	*	H	α-helix	trans	-63.9	-40.8	175.5	-80.1	166.1	0	0	0	112.8	S301 L303 Q307 Q308 S309	S301-L305 PolarHBondContact O-N 2.9Å; L303-L305 VanDerWaalsContact C-N 3.33Å; L303-L305 PolarHBondContact O-N 3.37Å; L305-Q307 VanDerWaalsContact C-N 3.3Å; L305-Q307 PolarHBondContact O-N 3.25Å; L305-Q308 PolarHBondContact O-N 3.33Å; L305-S309 PolarHBondContact O-N 3.3Å
306	Y	60.9	Low	56	Low	179 Å²	179	121 Å²	121	70%	0.702	66%	0.661	S	S	*	*	H	α-helix	trans	-64.9	-36.5	173.5	-93.4	-90.4	0	0	0	111.9	I302 L303 S309	I302-Y306 PolarHBondContact O-N 3.33Å; L303-Y306 PolarHBondContact O-N 3.2Å; Y306-S309 PolarHBondContact O-N 2.97Å; Y306-S309 PolarHBondContact O-OG 3.19Å
307	Q	60.3	Low	55.5	Low	154 Å²	154	115 Å²	115	72%	0.72	65%	0.654	S	S	*	*	H	α-helix	trans	-70.3	-33.3	178.8	-141.3	160.5	11.8	0	0	112.7	L303 A304 L305 S309 A310	L303-Q307 PolarHBondContact O-N 3.34Å; A304-Q307 PolarHBondContact O-N 3.02Å; L305-Q307 VanDerWaalsContact C-N 3.3Å; L305-Q307 PolarHBondContact O-N 3.25Å; Q307-S309 VanDerWaalsContact C-N 3.3Å; Q307-S309 PolarHBondContact O-N 3.41Å; Q307-A310 PolarHBondContact O-N 3.24Å
308	Q	56.6	Low	54.4	Low	156 Å²	156	115 Å²	115	73%	0.729	66%	0.663	S	S	*	*	H	α-helix	trans	-70.1	-20.6	171.7	-98.1	177.4	-11.8	0	0	114.3	A304 L305 A310	A304-Q308 PolarHBondContact O-N 2.92Å; L305-Q308 PolarHBondContact O-N 3.33Å; Q308-A310 VanDerWaalsContact C-N 3.3Å
309	S	47.3	Very low	53.2	Low	93 Å²	93	115.2 Å²	115.2	65%	0.65	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-2.8	176.7	71.9	0	0	0	0	114.5	L305 Y306 Q307	L305-S309 PolarHBondContact O-N 3.3Å; Y306-S309 PolarHBondContact O-N 2.97Å; Y306-S309 PolarHBondContact O-OG 3.19Å; Q307-S309 VanDerWaalsContact C-N 3.3Å; Q307-S309 PolarHBondContact O-N 3.41Å
310	A	45.8	Very low	51.6	Low	82 Å²	82	114.5 Å²	114.5	68%	0.678	68%	0.677	S	S	*	*	S	Bend	trans	-118.5	43.1	-168.4	0	0	0	0	0	114	Q307 Q308	Q307-A310 PolarHBondContact O-N 3.24Å; Q308-A310 VanDerWaalsContact C-N 3.3Å
311	S	39.9	Very low	50.6	Low	78 Å²	78	120 Å²	120	55%	0.545	69%	0.691	S	S	.	*			trans	-150.7	84.6	178.3	62.3	0	0	0	0	114.6
312	Q	44.2	Very low	49.1	Very low	174 Å²	174	123.6 Å²	123.6	81%	0.813	71%	0.713	S	S	*	*			trans	-155	105.9	152.3	-78.5	-49	-35	0	0	111.3
313	P	36.5	Very low	47.8	Very low	123 Å²	123	122.9 Å²	122.9	80%	0.799	73%	0.727	S	S	*	*			trans	-97.8	85.7	162.6	34.2	-25.9	0	0	0	109.7	S315	P313-S315 PolarHBondContact O-N 2.95Å
314	S	43	Very low	46.4	Very low	110 Å²	110	124.7 Å²	124.7	77%	0.769	74%	0.743	S	S	*	*			trans	-79.8	97.7	177.6	57.6	0	0	0	0	111.4
315	S	35	Very low	44.9	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	76%	0.763	S	S	*	*			trans	-78.7	111.8	175.1	55.7	0	0	0	0	112.3	P313	P313-S315 PolarHBondContact O-N 2.95Å
316	L	41.5	Very low	43.7	Very low	177 Å²	177	128.6 Å²	128.6	93%	0.927	77%	0.771	S	S	*	*			trans	-138	129.5	164.6	-81.5	168.8	0	0	0	109.2
317	G	39.1	Very low	42.9	Very low	70 Å²	70	128.2 Å²	128.2	72%	0.722	78%	0.776	S	S	*	*			trans	-87.1	171.6	-167.4	0	0	0	0	0	115.4	A319	G317-A319 PolarHBondContact O-N 3.4Å
318	P	38.8	Very low	41.8	Very low	132 Å²	132	128.5 Å²	128.5	86%	0.857	78%	0.775	S	S	*	*			trans	-82.6	113.8	-178.2	32.3	-32.2	0	0	0	111.7
319	A	40.3	Very low	41	Very low	96 Å²	96	127.1 Å²	127.1	79%	0.793	78%	0.782	S	S	*	*			trans	-89.2	126.6	169.1	0	0	0	0	0	110.8	G317	G317-A319 PolarHBondContact O-N 3.4Å
320	L	33.1	Very low	40.5	Very low	152 Å²	152	128 Å²	128	80%	0.796	78%	0.784	S	S	*	*			trans	-64.7	141.5	171.6	-70.5	68.3	0	0	0	110.6
321	Y	46.7	Very low	40.3	Very low	231 Å²	231	129.5 Å²	129.5	91%	0.906	79%	0.79	S	S	*	*			trans	-147.7	154.7	143.5	-102.9	-84.9	0	0	0	110.4
322	P	42	Very low	40.2	Very low	120 Å²	120	133.2 Å²	133.2	78%	0.779	80%	0.804	S	S	*	*			trans	-118.3	175.1	-157.7	42.3	-30.9	0	0	0	115.6
323	G	39	Very low	39.9	Very low	70 Å²	70	134.1 Å²	134.1	72%	0.722	81%	0.805	S	S	*	*			trans	99.3	141.2	170.7	0	0	0	0	0	113.3
324	T	45.9	Very low	40.1	Very low	148 Å²	148	134.1 Å²	134.1	91%	0.908	81%	0.805	S	S	*	*			cis	-147.2	150.1	15.1	-67.6	0	0	0	0	111.2
325	M	40.3	Very low	40	Very low	170 Å²	170	132.5 Å²	132.5	84%	0.837	81%	0.806	S	S	*	*			trans	-71.9	157.1	-176.7	-73.7	-146.7	-158.9	0	0	115.1
326	G	42.3	Very low	39.9	Very low	75 Å²	75	134.5 Å²	134.5	77%	0.773	81%	0.808	S	S	*	*			trans	-154.3	33.7	176.8	0	0	0	0	0	116.5
327	Q	43.7	Very low	39.7	Very low	170 Å²	170	135.1 Å²	135.1	79%	0.794	81%	0.806	S	S	*	*			trans	52.7	112.6	156.7	-55.3	-173.8	9	0	0	121.7
328	F	37.6	Very low	39.3	Very low	161 Å²	161	141.9 Å²	141.9	71%	0.706	81%	0.811	S	S	*	*				40.7	129.6	117.9	-62.8	-72.2	0	0	0	120.1	T330	F328-T330 HydrophobicContact CD1-CG2 4.13Å; F328-T330 HydrophobicContact CE1-CG2 4.45Å
329	S	40	Very low	39.1	Very low	126 Å²	126	145.5 Å²	145.5	88%	0.881	81%	0.814	S	S	*	*				-146.5	149.4	80.1	-68.5	0	0	0	0	115
330	T	36.3	Very low	38.9	Very low	111 Å²	111	146.9 Å²	146.9	68%	0.681	81%	0.812	S	S	*	*			trans	-114.8	148	-169.6	47.9	0	0	0	0	113.6	F328	F328-T330 HydrophobicContact CD1-CG2 4.13Å; F328-T330 HydrophobicContact CE1-CG2 4.45Å
331	S	42.3	Very low	38.7	Very low	114 Å²	114	145.9 Å²	145.9	80%	0.797	82%	0.816	S	S	*	*			trans	173.3	147.2	142.5	41.9	0	0	0	0	110.1
332	N	37.7	Very low	38.1	Very low	157 Å²	157	141.8 Å²	141.8	84%	0.84	81%	0.81	S	S	*	*			cis	-150.7	157.6	-20	-127.8	-12.2	0	0	0	110.8
333	F	37.2	Very low	38.3	Very low	193 Å²	193	141.9 Å²	141.9	85%	0.846	81%	0.811	S	S	*	*			trans	-75.3	-169	175.6	-93.5	-95.2	0	0	0	112.8
334	P	40.2	Very low	38.5	Very low	123 Å²	123	144.8 Å²	144.8	80%	0.799	82%	0.817	S	S	*	*			cis	-132.9	-178	-16	20.2	4.6	0	0	0	114.3
335	G	40.6	Very low	38	Very low	76 Å²	76	145.3 Å²	145.3	78%	0.784	81%	0.813	S	S	*	*			trans	167.6	70	158.1	0	0	0	0	0	118.4
336	N	32.9	Very low	37.8	Very low	152 Å²	152	143.4 Å²	143.4	81%	0.813	81%	0.807	S	S	*	*			trans	-67.7	138.6	169.3	-81.2	-13	0	0	0	112.1
337	Q	38.3	Very low	37.5	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	80%	0.801	S	S	*	*				-165.9	141.2	120.8	-108.3	164.6	77.3	0	0	113
338	Y	30.9	Very low	37.2	Very low	213 Å²	213	141.5 Å²	141.5	84%	0.835	79%	0.79	S	S	*	*			trans	-71	149.9	170.3	-69	-109.8	0	0	0	109.8
339	F	33.6	Very low	37.2	Very low	207 Å²	207	140.9 Å²	140.9	91%	0.908	79%	0.793	S	S	*	*				-167.9	139.2	128.4	-107.1	-70.4	0	0	0	112.1
340	V	35.9	Very low	37.1	Very low	126 Å²	126	143 Å²	143	76%	0.764	79%	0.788	S	S	*	*			trans	-79.9	141.2	171.6	173.3	0	0	0	0	109.4
341	C	29.8	Very low	36.9	Very low	130 Å²	130	144.1 Å²	144.1	88%	0.878	79%	0.79	S	S	*	*			trans	-152.3	138.8	161.3	-101.4	0	0	0	0	113.1
342	N	33.5	Very low	36.8	Very low	146 Å²	146	148.4 Å²	148.4	78%	0.781	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78.4	160.4	176.6	-63.1	-44.4	0	0	0	112.3
343	P	46.9	Very low	36.5	Very low	122 Å²	122	146.7 Å²	146.7	79%	0.792	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-79.9	143.9	167	33.3	-32.9	0	0	0	111.7
344	P	42.5	Very low	36.6	Very low	131 Å²	131	145.3 Å²	145.3	85%	0.851	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-89	165.1	-177.5	35.4	-35.7	0	0	0	114.6
345	L	35.3	Very low	36.3	Very low	158 Å²	158	145.9 Å²	145.9	83%	0.827	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-94.3	165.2	-178.7	-90.2	147.7	0	0	0	113.5
346	D	37.2	Very low	36	Very low	131 Å²	131	150 Å²	150	70%	0.701	79%	0.786	S	S	*	*			trans	73.7	151.4	143.4	-101.2	12.4	0	0	0	120.7
347	N	34.4	Very low	36	Very low	124 Å²	124	148.5 Å²	148.5	66%	0.663	79%	0.787	S	S	*	*			cis	-157.7	170.9	-7.6	-150.5	-35.9	0	0	0	111.5
348	S	38	Very low	35.9	Very low	80 Å²	80	143.2 Å²	143.2	56%	0.559	78%	0.784	S	S	*	*			trans	92.3	117.3	141.1	-85.6	0	0	0	0	123.3
349	I	37.6	Very low	36	Very low	148 Å²	148	141.7 Å²	141.7	76%	0.759	79%	0.79	S	S	*	*				76.8	129.6	125.7	-68	171.3	0	0	0	116.6
350	H	38.1	Very low	36.3	Very low	170 Å²	170	135.5 Å²	135.5	79%	0.787	79%	0.785	S	S	*	*			cis	-151.1	164	14.7	-145.8	46.3	0	0	0	114.3
351	N	33	Very low	36.4	Very low	136 Å²	136	138.9 Å²	138.9	73%	0.727	79%	0.789	S	S	*	*			trans	-62.8	150.6	174.2	-96.9	-30	0	0	0	114.8
352	K	39.6	Very low	37.1	Very low	204 Å²	204	140.4 Å²	140.4	89%	0.887	79%	0.785	S	S	*	*				-163.5	142.7	111.1	-104.3	161.4	-171.8	175.5	0	114.1
353	N	30.9	Very low	37.4	Very low	121 Å²	121	142.7 Å²	142.7	65%	0.647	79%	0.788	S	S	*	*			trans	-103.6	146.3	-172.9	-178.6	10.2	0	0	0	109.7
354	I	38.9	Very low	36.8	Very low	164 Å²	164	144.6 Å²	144.6	84%	0.841	79%	0.786	S	S	*	*			trans	-156.8	124.9	156.9	-92.5	136.1	0	0	0	108.6
355	N	33.6	Very low	36.8	Very low	134 Å²	134	143.6 Å²	143.6	72%	0.717	78%	0.783	S	S	*	*			trans	-88.2	146.2	166	-59.9	-51	0	0	0	109.5
356	N	35.9	Very low	37	Very low	163 Å²	163	143.9 Å²	143.9	87%	0.872	78%	0.78	S	S	*	*			trans	-161.6	154.5	134	-124.7	-24.6	0	0	0	115.5
357	S	31.8	Very low	37.3	Very low	120 Å²	120	147.1 Å²	147.1	84%	0.839	79%	0.788	S	S	*	*			trans	-84.8	157.6	-179.7	-59.7	0	0	0	0	112.9
358	G	36.9	Very low	38.3	Very low	80 Å²	80	146.6 Å²	146.6	83%	0.825	79%	0.791	S	S	*	*			trans	-162.3	112.3	170.8	0	0	0	0	0	113.4
359	N	33.5	Very low	39	Very low	181 Å²	181	148.7 Å²	148.7	97%	0.968	80%	0.803	S	S	*	*			trans	-72.9	146.8	175.3	-92.7	-34.9	0	0	0	112.3
360	G	38.3	Very low	39.4	Very low	77 Å²	77	149.2 Å²	149.2	79%	0.794	81%	0.807	S	S	*	*			trans	-152.8	95.5	174.2	0	0	0	0	0	114
361	K	38.3	Very low	39.3	Very low	197 Å²	197	150.1 Å²	150.1	86%	0.857	81%	0.812	S	S	*	*			trans	-62.3	142.3	167.9	-89.1	174.2	166.3	174.8	0	110.9
362	M	44.6	Very low	39.8	Very low	162 Å²	162	153.2 Å²	153.2	80%	0.798	82%	0.819	S	S	*	*				172.1	144.8	109.8	-99.7	-172.8	-83.2	0	0	116.5
363	K	41	Very low	39.9	Very low	194 Å²	194	150.4 Å²	150.4	84%	0.843	81%	0.813	S	S	*	*			trans	80	116.9	146.7	-72.9	172	-179.2	-178.8	0	120.4
364	E	32.7	Very low	40.1	Very low	161 Å²	161	149.8 Å²	149.8	75%	0.752	82%	0.818	S	S	*	*			trans	-102.5	152.4	168.9	178.6	-175.5	168	0	0	108.8	H366	E364-H366 IonicContact OE1-CE1 3.22Å; E364-H366 IonicContact OE1-ND1 2.66Å
365	S	42.8	Very low	40.6	Very low	111 Å²	111	151 Å²	151	78%	0.776	82%	0.82	S	S	*	*			trans	-130.7	121.3	175.4	45.9	0	0	0	0	111.7
366	H	39.7	Very low	40.6	Very low	164 Å²	164	148 Å²	148	76%	0.759	82%	0.82	S	S	*	*			trans	-87	148.7	176.1	-99.2	57	0	0	0	111.8	E364	E364-H366 IonicContact OE1-CE1 3.22Å; E364-H366 IonicContact OE1-ND1 2.66Å
367	F	44.5	Very low	41	Very low	198 Å²	198	149.1 Å²	149.1	87%	0.868	83%	0.825	S	S	*	*			trans	-125.4	130.6	165.4	-98.8	-85.9	0	0	0	109.5
368	P	54.6	Low	41	Very low	113 Å²	113	146.5 Å²	146.5	73%	0.734	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-98.1	152.2	173.3	36.6	-32	0	0	0	112.5
369	P	52.7	Low	41.4	Very low	124 Å²	124	150.9 Å²	150.9	81%	0.805	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-88.9	145.8	168.7	34.3	-31.8	0	0	0	112.3
370	N	45.1	Very low	41.6	Very low	160 Å²	160	149.5 Å²	149.5	86%	0.856	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-68.8	142.9	179.3	-73.5	-30.5	0	0	0	113.1
371	Q	37.4	Very low	41.9	Very low	188 Å²	188	152 Å²	152	88%	0.879	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-100.4	144.6	157.5	-65.6	-178.6	2.2	0	0	109.1
372	F	43.1	Very low	42	Very low	202 Å²	202	147.9 Å²	147.9	89%	0.886	82%	0.817	S	S	*	*			trans	-132.8	156.6	170.1	-125.1	-90.3	0	0	0	111.1
373	L	40.7	Very low	41.7	Very low	145 Å²	145	143 Å²	143	76%	0.759	81%	0.808	S	S	*	*			trans	-67.3	153.1	-155.8	-91.3	60.3	0	0	0	116.7
374	S	37	Very low	41.7	Very low	107 Å²	107	140.1 Å²	140.1	75%	0.748	81%	0.807	S	S	*	*			trans	-81.4	140.9	168.6	46	0	0	0	0	113.2
375	H	48.6	Very low	42	Very low	190 Å²	190	139.5 Å²	139.5	88%	0.88	81%	0.809	S	S	*	*			trans	-141.7	139.9	151.6	-77.7	-83.4	0	0	0	107.4
376	G	33.5	Very low	41.6	Very low	70 Å²	70	141.2 Å²	141.2	72%	0.722	81%	0.81	S	S	*	*			trans	-144.8	156.3	-170.7	0	0	0	0	0	115.7
377	L	43.6	Very low	41.7	Very low	188 Å²	188	141.7 Å²	141.7	98%	0.984	82%	0.817	S	S	*	*			trans	-154	152.7	164.9	-68.1	178.5	0	0	0	107.8
378	G	32.6	Very low	41.2	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	82%	0.818	S	S	*	*			cis	163.2	20.2	-7.4	0	0	0	0	0	117.6
379	I	44.5	Very low	40.2	Very low	172 Å²	172	138.4 Å²	138.4	88%	0.882	82%	0.819	S	S	*	*			trans	-134.6	145.6	-173.7	-31.9	179.2	0	0	0	113.4
380	N	39.2	Very low	39.5	Very low	153 Å²	153	138.4 Å²	138.4	82%	0.818	82%	0.823	S	S	*	*			trans	-101.4	169	-159.4	-65.2	-62.1	0	0	0	116.5
381	P	44.6	Very low	39.1	Very low	129 Å²	129	136 Å²	136	84%	0.838	82%	0.819	S	S	*	*			trans	-113.8	165.7	175.6	41.4	-32.8	0	0	0	116.1
382	A	40.6	Very low	39.1	Very low	110 Å²	110	134.8 Å²	134.8	91%	0.909	81%	0.813	S	S	*	*			trans	-167.2	156.1	160.3	0	0	0	0	0	108.8
383	G	37.6	Very low	38.6	Very low	60 Å²	60	134 Å²	134	62%	0.619	81%	0.809	S	S	*	*			cis	161.7	152.8	-7.3	0	0	0	0	0	111.5
384	T	40.7	Very low	38.7	Very low	133 Å²	133	133.8 Å²	133.8	82%	0.816	81%	0.807	S	S	*	*			trans	69.8	156.8	165.5	73.8	0	0	0	0	118.6
385	N	39	Very low	39.4	Very low	149 Å²	149	133.8 Å²	133.8	80%	0.797	81%	0.805	S	S	*	*			cis	-161.4	171.1	-19.1	-103.1	-14.8	0	0	0	111.7
386	N	35.3	Very low	39.3	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	80%	0.802	S	S	*	*			trans	-58.3	158.8	179.4	-77.9	-67.9	0	0	0	117.2
387	L	40.3	Very low	39.5	Very low	173 Å²	173	132.8 Å²	132.8	91%	0.906	81%	0.805	S	S	*	*				-179.5	159.7	111.9	-94.2	163	0	0	0	115.3
388	N	33.9	Very low	39.6	Very low	168 Å²	168	128.9 Å²	128.9	90%	0.898	79%	0.791	S	S	*	*			trans	-90.9	159.4	-175.2	-105.9	-21.8	0	0	0	113.8
389	G	34.8	Very low	40	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	80%	0.796	S	S	*	*			trans	164.3	132.8	159.9	0	0	0	0	0	115.8
390	S	36.9	Very low	39.5	Very low	125 Å²	125	133.5 Å²	133.5	87%	0.874	79%	0.794	S	S	*	*			trans	-131.1	141.5	-169.1	-44.1	0	0	0	0	114.3
391	S	38.3	Very low	39.4	Very low	110 Å²	110	130.8 Å²	130.8	77%	0.769	79%	0.793	S	S	*	*			trans	179	118.5	154.6	-161.8	0	0	0	0	108.5
392	Q	36.5	Very low	39	Very low	162 Å²	162	130.2 Å²	130.2	76%	0.757	79%	0.786	S	S	*	*				88.9	147.7	57.3	-73.6	-122	10.3	0	0	115.9
393	F	33.1	Very low	38.6	Very low	185 Å²	185	136.5 Å²	136.5	81%	0.811	79%	0.787	S	S	*	*			trans	76.4	143.7	-173.7	-66.6	-92.7	0	0	0	118.1
394	I	42.3	Very low	38.9	Very low	140 Å²	140	139 Å²	139	72%	0.718	79%	0.792	S	S	*	*			cis	175	145.8	-44.2	-94.2	165.3	0	0	0	106.2
395	P	51.9	Low	38.6	Very low	107 Å²	107	141.7 Å²	141.7	70%	0.695	80%	0.795	S	S	*	*			trans	-114.7	-171.5	-162	43.3	-34.1	0	0	0	115.3
396	P	45.7	Very low	38.8	Very low	127 Å²	127	142.9 Å²	142.9	83%	0.825	80%	0.802	S	S	*	*			trans	-144	157.1	134	37.1	-21.8	0	0	0	117
397	S	37.7	Very low	38.8	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	80%	0.8	S	S	*	*			trans	-89.8	178.7	171.4	-34.9	0	0	0	0	111.7
398	P	46.9	Very low	38.5	Very low	106 Å²	106	139.8 Å²	139.8	69%	0.688	79%	0.791	S	S	*	*				-160.9	-176	63	44.5	-21.5	0	0	0	119.8
399	N	39.7	Very low	38.7	Very low	143 Å²	143	137.8 Å²	137.8	77%	0.765	79%	0.79	S	S	*	*			trans	84	113.1	145.4	-70	-16.6	0	0	0	125.3
400	F	34.8	Very low	38.6	Very low	190 Å²	190	139.4 Å²	139.4	83%	0.833	79%	0.789	S	S	*	*				64	114.6	123.4	-120	-91	0	0	0	122.8	V402	F400-V402 HydrophobicContact CE1-CG2 4.27Å
401	A	36.8	Very low	38.5	Very low	96 Å²	96	140.1 Å²	140.1	79%	0.793	79%	0.792	S	S	*	*			trans	-157.1	145.8	149.7	0	0	0	0	0	111.7
402	V	35.7	Very low	38.1	Very low	117 Å²	117	140.1 Å²	140.1	71%	0.709	79%	0.792	S	S	*	*			trans	-113.1	148.1	-177.2	170	0	0	0	0	110.1	F400	F400-V402 HydrophobicContact CE1-CG2 4.27Å
403	W	32.7	Very low	38.2	Very low	243 Å²	243	137.5 Å²	137.5	92%	0.92	79%	0.792	S	S	*	*			trans	-111.9	134.5	169.8	-72.4	92.7	0	0	0	111.3
404	P	44.7	Very low	38.5	Very low	111 Å²	111	136 Å²	136	72%	0.721	79%	0.791	S	S	*	*			trans	-95.5	150.1	173.8	35.9	-32	0	0	0	112.8
405	E	34.6	Very low	38.3	Very low	191 Å²	191	133.9 Å²	133.9	89%	0.893	79%	0.794	S	S	*	*			trans	-71.6	155	163	-61	-175.3	151.1	0	0	110.6
406	N	41.6	Very low	37.8	Very low	173 Å²	173	133.6 Å²	133.6	93%	0.925	80%	0.801	S	S	*	*			trans	-147.5	146.5	160.1	-118.9	-23.2	0	0	0	113
407	N	35.7	Very low	37.2	Very low	140 Å²	140	136.4 Å²	136.4	75%	0.749	80%	0.803	S	S	*	*			trans	-107.6	157.6	-159	-139.2	-10.2	0	0	0	112
408	T	34.3	Very low	37.8	Very low	116 Å²	116	135.7 Å²	135.7	71%	0.712	80%	0.796	S	S	*	*			trans	32.3	119.7	152.6	54.2	0	0	0	0	120.7
409	S	38.2	Very low	37.4	Very low	126 Å²	126	137.5 Å²	137.5	88%	0.881	80%	0.8	S	S	*	*				-169.2	146.5	119.4	45.2	0	0	0	0	113.2
410	S	33.6	Very low	37.5	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	81%	0.807	S	S	*	*			trans	-84.7	144.8	-179.9	50.4	0	0	0	0	113.2
411	C	33.5	Very low	37.7	Very low	139 Å²	139	138.5 Å²	138.5	94%	0.939	81%	0.807	S	S	*	*			trans	-143.5	119.4	153	-100.8	0	0	0	0	111.2
412	S	30.6	Very low	38.1	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	81%	0.813	S	S	*	*			trans	-92.8	141.1	174.3	-39	0	0	0	0	110.1
413	S	38.8	Very low	38.4	Very low	107 Å²	107	141.2 Å²	141.2	75%	0.748	81%	0.814	S	S	*	*			trans	-172.5	122.7	149.7	-88.5	0	0	0	0	115.4
414	I	38.8	Very low	38.4	Very low	155 Å²	155	135.1 Å²	135.1	80%	0.795	81%	0.807	S	S	*	*				74.1	95.1	129.1	-57.7	171.7	0	0	0	119.9
415	A	38.2	Very low	38.5	Very low	94 Å²	94	135 Å²	135	78%	0.777	81%	0.806	S	S	*	*				86	148	118.7	0	0	0	0	0	124.8
416	A	40.5	Very low	38.5	Very low	101 Å²	101	133.3 Å²	133.3	84%	0.835	80%	0.803	S	S	*	*			trans	80.2	107.6	154.4	0	0	0	0	0	121
417	Q	34.7	Very low	38.3	Very low	186 Å²	186	133.4 Å²	133.4	87%	0.869	80%	0.798	S	S	*	*			trans	-106	-169	147	-51.8	-167.1	-28.5	0	0	108.3
418	P	49.2	Very low	38.3	Very low	97 Å²	97	132 Å²	132	63%	0.63	80%	0.799	S	S	*	*			cis	-138.6	-178.4	-7.7	36.5	-15.7	0	0	0	116.5
419	N	38.5	Very low	38.4	Very low	145 Å²	145	134.7 Å²	134.7	78%	0.775	80%	0.801	S	S	*	*			trans	64.5	123.2	151.9	-70.1	-23	0	0	0	121.1
420	Q	43.2	Very low	38.1	Very low	197 Å²	197	133.2 Å²	133.2	92%	0.921	80%	0.797	S	S	*	*				-168.8	153.1	103.6	-100.2	174.2	31.4	0	0	113
421	N	38.6	Very low	38.3	Very low	157 Å²	157	137.8 Å²	137.8	84%	0.84	80%	0.803	S	S	*	*			trans	-85.8	139.2	-177.8	-65.4	-37.9	0	0	0	112.6
422	V	45.1	Very low	38.2	Very low	151 Å²	151	135.8 Å²	135.8	92%	0.915	79%	0.791	S	S	*	*			trans	-140.8	157.7	153.1	-174.8	0	0	0	0	109.3
423	V	41.1	Very low	38.1	Very low	118 Å²	118	137.7 Å²	137.7	72%	0.715	79%	0.792	S	S	*	*			trans	-121.6	128.9	-149.7	162.2	0	0	0	0	113.2
424	C	34.1	Very low	38	Very low	115 Å²	115	139.4 Å²	139.4	78%	0.777	80%	0.799	S	S	*	*			trans	52.9	175	147.3	-68	0	0	0	0	121.4
425	P	45.5	Very low	37.7	Very low	108 Å²	108	139.7 Å²	139.7	70%	0.701	80%	0.801	S	S	*	*			cis	-134.8	174.5	-41.1	35.2	-18.3	0	0	0	114.7
426	N	34.8	Very low	37.5	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	81%	0.806	S	S	*	*			trans	28.5	114.4	150.3	-64.6	-4.3	0	0	0	121.2
427	Q	38.4	Very low	37.2	Very low	175 Å²	175	143 Å²	143	82%	0.818	80%	0.8	S	S	*	*			trans	-139.8	141.7	136.1	-71.5	-164.2	8.7	0	0	111.3
428	S	33.9	Very low	37.3	Very low	110 Å²	110	140 Å²	140	77%	0.769	80%	0.799	S	S	*	*			trans	-102.9	124.7	177.7	54.1	0	0	0	0	110.8
429	F	37.8	Very low	36.9	Very low	173 Å²	173	140.7 Å²	140.7	76%	0.759	80%	0.803	S	S	*	*			trans	-140.2	127.9	162.6	-79.4	-76.9	0	0	0	110.6
430	A	32.1	Very low	36.7	Very low	96 Å²	96	138.4 Å²	138.4	79%	0.793	80%	0.799	S	S	*	*			trans	-93.2	135.2	165.9	0	0	0	0	0	108.6
431	F	36.1	Very low	36.4	Very low	203 Å²	203	136.6 Å²	136.6	89%	0.89	80%	0.796	S	S	*	*			trans	-140.7	146	162.2	-104.3	-80.2	0	0	0	110.4
432	S	33.3	Very low	36.3	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	79%	0.791	S	S	*	*			trans	-95.2	160.8	-162.3	-46.7	0	0	0	0	113.7
433	N	28.6	Very low	35.8	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	78%	0.784	S	S	*	*			trans	51.7	110.9	146.9	-58.6	-10.1	0	0	0	118.9
434	T	34.9	Very low	35.7	Very low	144 Å²	144	132.9 Å²	132.9	88%	0.883	79%	0.785	S	S	*	*				-146.3	141.9	125.2	-28.7	0	0	0	0	110.6
435	L	33.6	Very low	35.8	Very low	161 Å²	161	134.2 Å²	134.2	84%	0.843	78%	0.784	S	S	*	*			trans	-74.7	147.6	178.2	-55.1	98.4	0	0	0	110.5
436	N	34	Very low	35.4	Very low	166 Å²	166	134.9 Å²	134.9	89%	0.888	79%	0.786	S	S	*	*				-152.9	142.4	128.7	-127.3	-18.7	0	0	0	113.1
437	S	33.5	Very low	35.3	Very low	99 Å²	99	135.4 Å²	135.4	69%	0.692	79%	0.789	S	S	*	*			trans	-99	144.1	-173.8	50.3	0	0	0	0	112.2
438	S	38.2	Very low	35.1	Very low	121 Å²	121	132.1 Å²	132.1	85%	0.846	79%	0.785	S	S	*	*			trans	-174	155.9	141.5	-83.8	0	0	0	0	111.3
439	P	39.3	Very low	35.1	Very low	112 Å²	112	136 Å²	136	73%	0.727	79%	0.791	S	S	*	*			trans	-122.7	-170.6	-152.8	42.4	-29.1	0	0	0	115.4
440	S	35.7	Very low	34.8	Very low	98 Å²	98	135.5 Å²	135.5	69%	0.685	80%	0.795	S	S	*	*			trans	82.7	118	157.6	71.9	0	0	0	0	119.6
441	N	36.5	Very low	34.9	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	80%	0.8	S	S	*	*				-177	109.7	129.9	-94.7	-31.1	0	0	0	111.7
442	P	36.4	Very low	34.8	Very low	115 Å²	115	140.2 Å²	140.2	75%	0.747	80%	0.799	S	S	*	*			trans	-132.6	128.5	157.9	35.1	-19.9	0	0	0	113.4
443	C	33.6	Very low	35.1	Very low	114 Å²	114	143.2 Å²	143.2	77%	0.77	80%	0.804	S	S	*	*			trans	-137.5	118.9	173.5	-67.3	0	0	0	0	108.3
444	T	39.8	Very low	35.5	Very low	119 Å²	119	142.1 Å²	142.1	73%	0.73	80%	0.798	S	S	*	*				66.3	139.9	65	68.5	0	0	0	0	114
445	N	36	Very low	35.8	Very low	143 Å²	143	144 Å²	144	77%	0.765	80%	0.799	S	S	*	*			cis	-163.3	172.2	-15.5	-128.9	-29	0	0	0	111.7
446	T	36.4	Very low	35.8	Very low	121 Å²	121	142.7 Å²	142.7	74%	0.742	79%	0.793	S	S	*	*			trans	-36.1	150.7	172.4	53.7	0	0	0	0	122.3
447	L	33	Very low	36.2	Very low	168 Å²	168	143.9 Å²	143.9	88%	0.88	79%	0.794	S	S	*	*			trans	-153.4	142.2	144.3	-91.6	169.2	0	0	0	106.7
448	S	33.9	Very low	36.4	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	79%	0.793	S	S	*	*			cis	-150	145.2	-0.4	-58	0	0	0	0	109.8
449	Q	33.7	Very low	36.1	Very low	190 Å²	190	146 Å²	146	89%	0.888	79%	0.791	S	S	*	*			trans	-95.7	138.5	156.6	-73.2	-175.1	-3.2	0	0	109.5
450	L	33.2	Very low	36.4	Very low	164 Å²	164	145.8 Å²	145.8	86%	0.859	79%	0.79	S	S	*	*			trans	-171.8	124.1	150.9	-106.3	168.1	0	0	0	108.6
451	W	33.3	Very low	36.3	Very low	234 Å²	234	147.5 Å²	147.5	89%	0.886	79%	0.791	S	S	*	*			trans	157.1	88.3	147.9	-99	67.8	0	0	0	108.4	M453	W451-M453 HydrophobicContact CZ3-SD 4.37Å
452	N	34.6	Very low	36.5	Very low	163 Å²	163	149.5 Å²	149.5	87%	0.872	80%	0.795	S	S	*	*			trans	-117.8	112.9	173.5	-136.2	5.7	0	0	0	106.9
453	M	38.7	Very low	36.5	Very low	160 Å²	160	149.6 Å²	149.6	79%	0.788	79%	0.794	S	S	*	*			trans	-129.8	89.4	171.7	-75.1	-166.3	79.6	0	0	110.7	W451	W451-M453 HydrophobicContact CZ3-SD 4.37Å
454	N	37.6	Very low	36.8	Very low	128 Å²	128	154.4 Å²	154.4	68%	0.684	80%	0.802	S	S	*	*			trans	36.6	109.4	131.7	-170.9	23.2	0	0	0	118.8
455	M	40.8	Very low	36.7	Very low	182 Å²	182	152.1 Å²	152.1	90%	0.897	80%	0.802	S	S	*	*			trans	-147.1	98.7	135.1	-93.4	-58.4	179.6	0	0	109.5
456	N	33.3	Very low	36.7	Very low	134 Å²	134	152.6 Å²	152.6	72%	0.717	81%	0.805	S	S	*	*			trans	-76.2	140	168.9	-92.9	-22.5	0	0	0	111.4
457	Q	42.1	Very low	36.8	Very low	192 Å²	192	157.1 Å²	157.1	90%	0.897	82%	0.815	S	S	*	*			trans	-157.2	149.5	146.8	-115.6	167	91.3	0	0	110.8
458	T	37.4	Very low	36.9	Very low	111 Å²	111	154.6 Å²	154.6	68%	0.681	81%	0.806	S	S	*	*			trans	-127	129.7	-146.9	46.2	0	0	0	0	115.2
459	L	32.5	Very low	36.9	Very low	152 Å²	152	153.7 Å²	153.7	80%	0.796	80%	0.799	S	S	*	*			trans	59.4	172.9	140.9	-75	156.4	0	0	0	118.5
460	P	45.1	Very low	37.1	Very low	109 Å²	109	153.6 Å²	153.6	71%	0.708	80%	0.798	S	S	*	*			cis	-130.2	166.4	-1.4	32.3	-11.6	0	0	0	117.9
461	N	34.1	Very low	37.1	Very low	133 Å²	133	150.6 Å²	150.6	71%	0.711	79%	0.792	S	S	*	*			trans	3.9	136.1	152.4	-66	-24.5	0	0	0	122.3
462	Q	41.5	Very low	37.4	Very low	202 Å²	202	145 Å²	145	94%	0.944	78%	0.783	S	S	*	*				-136.4	151.8	128.3	-73.2	-163.4	-3.7	0	0	110.8
463	T	34.9	Very low	37.4	Very low	117 Å²	117	144 Å²	144	72%	0.718	78%	0.778	S	S	*	*			trans	-130.6	132.8	-166.7	-51.2	0	0	0	0	110.3
464	F	40.4	Very low	37.3	Very low	214 Å²	214	143.5 Å²	143.5	94%	0.939	78%	0.779	S	S	*	*			trans	-156.7	128.7	162.3	-104.8	-72.6	0	0	0	114.3
465	G	38.4	Very low	37.3	Very low	71 Å²	71	144.9 Å²	144.9	73%	0.732	79%	0.786	S	S	*	*			trans	74.3	97.4	136.5	0	0	0	0	0	120.2
466	N	35.9	Very low	37.3	Very low	154 Å²	154	143.2 Å²	143.2	82%	0.824	78%	0.779	S	S	*	*			trans	-70.4	144.6	159.7	-69.7	-33.6	0	0	0	111.7
467	F	38.5	Very low	37.8	Very low	216 Å²	216	141.1 Å²	141.1	95%	0.947	78%	0.781	S	S	*	*			trans	-145	145.7	143.9	-124.3	-88.2	0	0	0	110
468	V	35.8	Very low	38.1	Very low	114 Å²	114	136.7 Å²	136.7	69%	0.691	77%	0.768	S	S	*	*			trans	-117.3	149.8	-160.3	174.4	0	0	0	0	111.9
469	S	34.1	Very low	39.1	Very low	87 Å²	87	137.6 Å²	137.6	61%	0.608	77%	0.769	S	S	*	*			trans	57.6	122.7	161.5	58.4	0	0	0	0	119.6
470	H	37.4	Very low	40.5	Very low	188 Å²	188	138.2 Å²	138.2	87%	0.87	77%	0.765	S	S	*	*				-163.8	172.8	88.7	-100.7	-72.8	0	0	0	112
471	S	33.5	Very low	41.5	Very low	102 Å²	102	140.1 Å²	140.1	71%	0.713	77%	0.765	S	S	*	*			trans	-92.4	169.7	-161.1	-171.8	0	0	0	0	114.8
472	T	38.5	Very low	43	Very low	115 Å²	115	139.8 Å²	139.8	71%	0.706	76%	0.76	S	S	*	*			trans	107	113.7	154.3	69.8	0	0	0	0	119.9
473	N	35.1	Very low	44.3	Very low	142 Å²	142	138.2 Å²	138.2	76%	0.759	75%	0.747	S	S	*	*			trans	62	145.6	138.4	-64.2	-9.7	0	0	0	123.3
474	N	36.8	Very low	46.2	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	74%	0.74	S	S	*	*			trans	77.9	107.4	161.2	-55.2	-26.1	0	0	0	118
475	N	37	Very low	47.9	Very low	157 Å²	157	131.4 Å²	131.4	84%	0.84	72%	0.722	S	S	*	*			trans	-171	143.3	174.9	-108.5	-37.7	0	0	0	106.3
476	I	42	Very low	49.5	Very low	146 Å²	146	133.5 Å²	133.5	75%	0.749	71%	0.713	S	S	*	*			cis	-145.8	135.5	17.6	-74	106.2	0	0	0	110.9
477	A	43.6	Very low	51.6	Low	91 Å²	91	129 Å²	129	75%	0.752	69%	0.69	S	S	*	*			trans	-166.3	150.4	139.6	0	0	0	0	0	108.1
478	P	48.7	Very low	53.5	Low	98 Å²	98	126 Å²	126	64%	0.636	68%	0.677	S	S	*	*			cis	-132.8	119.3	8.9	35.5	-15.5	0	0	0	114.7	K480	P478-K480 PolarHBondContact O-N 3.07Å; P478-K480 VanDerWaalsContact O-N 3.07Å
479	N	58.2	Low	55.3	Low	131 Å²	131	124.2 Å²	124.2	70%	0.701	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	20.7	-179.9	-154.5	6.2	0	0	0	115
480	K	62	Low	57	Low	164 Å²	164	126.1 Å²	126.1	71%	0.713	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-31.8	-169.5	-154.8	176.1	-174.9	-179.1	0	114.4	P478	P478-K480 PolarHBondContact O-N 3.07Å; P478-K480 VanDerWaalsContact O-N 3.07Å
481	E	64.4	Low	58.6	Low	150 Å²	150	122 Å²	122	70%	0.701	65%	0.653	S	S	*	*	H	α-helix	trans	-75.1	-37.4	177.8	-72.2	-166.7	123.3	0	0	112.6	Y483 L484 S485	E481-Y483 VanDerWaalsContact C-N 3.32Å; E481-Y483 PolarHBondContact O-N 3.32Å; E481-L484 PolarHBondContact O-N 3.48Å; E481-S485 PolarHBondContact O-N 3.21Å
482	M	67	Low	60.5	Low	126 Å²	126	121.1 Å²	121.1	62%	0.621	64%	0.643	S	S	*	*	H	α-helix	trans	-60.8	-41.3	-179.9	-160.8	176.4	74.2	0	0	111.7	S485 Q486	M482-S485 PolarHBondContact O-N 2.73Å; M482-Q486 WeakPolarHBondContact O-CB 3.36Å; M482-Q486 PolarHBondContact O-N 3.25Å
483	Y	67.7	Low	62	Low	169 Å²	169	120 Å²	120	66%	0.663	64%	0.64	S	S	*	*	H	α-helix	trans	-64.9	-42.2	175.6	-166.8	-95	0	0	0	112.6	E481 S485 Q486 V487	E481-Y483 VanDerWaalsContact C-N 3.32Å; E481-Y483 PolarHBondContact O-N 3.32Å; Y483-S485 PolarHBondContact O-N 3.42Å; Y483-Q486 PolarHBondContact O-N 2.98Å; Y483-V487 HydrophobicContact CD1-CG2 4.03Å; Y483-V487 HydrophobicContact CE1-CG2 3.7Å; Y483-V487 WeakPolarHBondContact O-CG2 3.46Å; Y483-V487 PolarHBondContact O-N 3.34Å
484	L	75.6	Confident	63.3	Low	107 Å²	107	120 Å²	120	56%	0.56	64%	0.639	S	S	*	*	H	α-helix	trans	-66.5	-35.6	176.9	-80.7	165.9	0	0	0	112.7	E481 K488	E481-L484 PolarHBondContact O-N 3.48Å; L484-K488 WeakPolarHBondContact O-CB 3.5Å; L484-K488 PolarHBondContact O-N 3.4Å; L484-K488 VanDerWaalsContact O-N 3.09Å
485	S	75.7	Confident	64.4	Low	81 Å²	81	122.4 Å²	122.4	57%	0.566	64%	0.638	S	S	*	*	H	α-helix	trans	-65	-46	173.5	-169.3	0	0	0	0	111.3	E481 M482 Y483 K488 S489	E481-S485 PolarHBondContact O-N 3.21Å; M482-S485 PolarHBondContact O-N 2.73Å; Y483-S485 PolarHBondContact O-N 3.42Å; S485-K488 PolarHBondContact O-N 3.07Å; S485-S489 WeakPolarHBondContact O-CB 3.38Å; S485-S489 PolarHBondContact O-N 2.84Å
486	Q	72.4	Confident	65.3	Low	115 Å²	115	121.7 Å²	121.7	54%	0.537	63%	0.634	S	S	.	*	H	α-helix	trans	-69.1	-36.6	-178.3	-162.1	149.1	17.7	0	0	112.9	M482 Y483 S489 Q490	M482-Q486 WeakPolarHBondContact O-CB 3.36Å; M482-Q486 PolarHBondContact O-N 3.25Å; Y483-Q486 PolarHBondContact O-N 2.98Å; Q486-S489 PolarHBondContact O-N 3.23Å; Q486-Q490 PolarHBondContact O-N 2.84Å; Q486-Q490 VanDerWaalsContact O-N 3.14Å
487	V	78.7	Confident	65.7	Low	58 Å²	58	118 Å²	118	35%	0.352	63%	0.632	S	S	.	*	H	α-helix	trans	-67.3	-38.7	172.5	172.6	0	0	0	0	111.8	Y483 Q490 L491	Y483-V487 HydrophobicContact CD1-CG2 4.03Å; Y483-V487 HydrophobicContact CE1-CG2 3.7Å; Y483-V487 WeakPolarHBondContact O-CG2 3.46Å; Y483-V487 PolarHBondContact O-N 3.34Å; V487-Q490 PolarHBondContact O-N 2.8Å; V487-L491 HydrophobicContact CG1-CD1 4.15Å; V487-L491 PolarHBondContact O-N 2.95Å; V487-L491 VanDerWaalsContact O-N 3.14Å
488	K	78.7	Confident	66.2	Low	153 Å²	153	123.3 Å²	123.3	67%	0.665	64%	0.638	S	S	*	*	H	α-helix	trans	-62.5	-45.9	172.7	-84.5	-176	173.7	-178.1	0	111.9	L484 S485 Q490 L491 T492	L484-K488 WeakPolarHBondContact O-CB 3.5Å; L484-K488 PolarHBondContact O-N 3.4Å; L484-K488 VanDerWaalsContact O-N 3.09Å; S485-K488 PolarHBondContact O-N 3.07Å; K488-Q490 VanDerWaalsContact C-N 3.33Å; K488-Q490 PolarHBondContact O-N 3.21Å; K488-L491 PolarHBondContact O-N 3.44Å; K488-T492 PolarHBondContact O-N 3.47Å; K488-T492 PolarHBondContact O-OG1 3.47Å
489	S	74.8	Confident	66.2	Low	77 Å²	77	124.1 Å²	124.1	54%	0.538	65%	0.646	S	S	.	*	H	α-helix	trans	-54.2	-46.2	176.9	162.5	0	0	0	0	112.4	S485 Q486 T492 S493	S485-S489 WeakPolarHBondContact O-CB 3.38Å; S485-S489 PolarHBondContact O-N 2.84Å; Q486-S489 PolarHBondContact O-N 3.23Å; S489-T492 PolarHBondContact O-N 3.05Å; S489-S493 PolarHBondContact O-N 3.44Å; S489-S493 VanDerWaalsContact O-N 3.14Å
490	Q	69.7	Low	66	Low	127 Å²	127	124 Å²	124	59%	0.593	65%	0.652	S	S	*	*	H	α-helix	trans	-68.9	-37.6	178.9	-70	-171.3	-2.9	0	0	113	Q486 V487 K488 S493 L494	Q486-Q490 PolarHBondContact O-N 2.84Å; Q486-Q490 VanDerWaalsContact O-N 3.14Å; V487-Q490 PolarHBondContact O-N 2.8Å; K488-Q490 VanDerWaalsContact C-N 3.33Å; K488-Q490 PolarHBondContact O-N 3.21Å; Q490-S493 PolarHBondContact O-N 3.24Å; Q490-L494 PolarHBondContact O-N 3.26Å
491	L	71.3	Confident	65.6	Low	102 Å²	102	124.7 Å²	124.7	53%	0.534	66%	0.663	S	S	.	*	H	α-helix	trans	-66.9	-37.9	175.2	-85.1	162.1	0	0	0	112.9	V487 K488 L494 Y495	V487-L491 HydrophobicContact CG1-CD1 4.15Å; V487-L491 PolarHBondContact O-N 2.95Å; V487-L491 VanDerWaalsContact O-N 3.14Å; K488-L491 PolarHBondContact O-N 3.44Å; L491-L494 PolarHBondContact O-N 3.46Å; L491-Y495 PolarHBondContact O-N 2.66Å
492	T	73.4	Confident	65.1	Low	84 Å²	84	124.8 Å²	124.8	52%	0.515	67%	0.668	S	S	.	*	H	α-helix	trans	-65.6	-38.5	175.1	-59.1	0	0	0	0	111.8	K488 S489 L494 Y495 L496	K488-T492 PolarHBondContact O-N 3.47Å; K488-T492 PolarHBondContact O-OG1 3.47Å; S489-T492 PolarHBondContact O-N 3.05Å; T492-L494 VanDerWaalsContact C-N 3.3Å; T492-L494 PolarHBondContact O-N 2.89Å; T492-Y495 PolarHBondContact O-N 3.18Å; T492-L496 HydrophobicContact CG2-CD1 3.84Å; T492-L496 PolarHBondContact O-N 3.17Å
493	S	68.6	Low	64.7	Low	91 Å²	91	127.7 Å²	127.7	64%	0.636	70%	0.696	S	S	*	*	H	α-helix	trans	-61.6	-35.6	175.9	-169.5	0	0	0	0	113.1	S489 Q490	S489-S493 PolarHBondContact O-N 3.44Å; S489-S493 VanDerWaalsContact O-N 3.14Å; Q490-S493 PolarHBondContact O-N 3.24Å
494	L	62.8	Low	64.5	Low	141 Å²	141	125.7 Å²	125.7	74%	0.738	70%	0.698	S	S	*	*	H	α-helix	trans	-76.8	-18.4	179.8	-70.7	170.5	0	0	0	114.4	Q490 L491 T492	Q490-L494 PolarHBondContact O-N 3.26Å; L491-L494 PolarHBondContact O-N 3.46Å; T492-L494 VanDerWaalsContact C-N 3.3Å; T492-L494 PolarHBondContact O-N 2.89Å
495	Y	59.4	Low	63.9	Low	203 Å²	203	126.6 Å²	126.6	80%	0.796	71%	0.705	S	S	*	*	H	α-helix	trans	-96.6	-14.6	-177.9	-107	-93.1	0	0	0	115	L491 T492	L491-Y495 PolarHBondContact O-N 2.66Å; T492-Y495 PolarHBondContact O-N 3.18Å
496	L	56.9	Low	63.3	Low	141 Å²	141	129.2 Å²	129.2	74%	0.738	71%	0.713	S	S	*	*	S	Bend	trans	-93.5	0.9	-179.3	-79.4	159.4	0	0	0	114.3	T492 K498	T492-L496 HydrophobicContact CG2-CD1 3.84Å; T492-L496 PolarHBondContact O-N 3.17Å; L496-K498 VanDerWaalsContact C-N 3.31Å; L496-K498 PolarHBondContact O-N 3.45Å
497	G	50.6	Low	62.7	Low	69 Å²	69	130 Å²	130	71%	0.711	72%	0.723	S	S	*	*			trans	-82.3	18.1	-177.6	0	0	0	0	0	116.8
498	K	54.1	Low	61.7	Low	203 Å²	203	134.5 Å²	134.5	88%	0.883	75%	0.747	S	S	*	*			trans	-119.5	89.9	-179.8	-72.6	-172.8	176.9	-178	0	111.9	L496	L496-K498 VanDerWaalsContact C-N 3.31Å; L496-K498 PolarHBondContact O-N 3.45Å
499	S	49.1	Very low	60.6	Low	115 Å²	115	133.3 Å²	133.3	80%	0.804	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-72.1	152.7	167.7	-57.2	0	0	0	0	111.5
500	P	52.6	Low	59.6	Low	127 Å²	127	137.3 Å²	137.3	83%	0.825	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-86	159.8	-165.5	34.5	-36.7	0	0	0	114.1
501	L	54.9	Low	58.8	Low	180 Å²	180	138.1 Å²	138.1	94%	0.942	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-88.8	140.2	162.7	-80.2	164	0	0	0	110.3
502	N	54.3	Low	57.8	Low	152 Å²	152	141.1 Å²	141.1	81%	0.813	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-85.9	158.3	-174.1	-168.4	27.4	0	0	0	110.8
503	P	56.9	Low	56.4	Low	187 Å²	187	146.3 Å²	146.3	100%	1.214	83%	0.827	S	S	*	*			cis	-106.5	0	-11.2	21.9	-0.9	0	0	0	115

Retrieved 503 of 503 residues in 517.8 ms (Link to these results)

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