A0A077Z7S9_TRITR Loading...

Tau-tubulin kinase 1

AlphaFold DB , UniProt , Accession A0A077Z7S9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 383 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	34.8	Very low	55.2	Low	244 Å²	244	106.5 Å²	106.5	100%	1.202	61%	0.61	S	S	*	*				0	98.7	0	-69.6	-175.9	-130.5	0	0	106.4	N3	M1-N3 PolarHBondContact O-N 2.87Å
2	E	30.9	Very low	58.4	Low	188 Å²	188	105.7 Å²	105.7	88%	0.879	61%	0.612	S	S	*	*			trans	-60.8	117.8	179.6	-84.8	173.1	150.3	0	0	109.3	T4	E2-T4 PolarHBondContact O-N 3.34Å
3	N	31.3	Very low	61.2	Low	158 Å²	158	100.9 Å²	100.9	85%	0.845	60%	0.599	S	S	*	*			trans	-69.9	94.3	175.5	-163.2	12.8	0	0	0	107.1	M1 A5	M1-N3 PolarHBondContact O-N 2.87Å; N3-A5 PolarHBondContact O-N 2.9Å
4	T	31.7	Very low	63.6	Low	129 Å²	129	98 Å²	98	79%	0.791	58%	0.583	S	S	*	*			trans	-70	80.3	175.6	54.8	0	0	0	0	108.9	E2 D6	E2-T4 PolarHBondContact O-N 3.34Å; T4-D6 PolarHBondContact O-N 3.4Å
5	A	41.7	Very low	65.7	Low	79 Å²	79	96.7 Å²	96.7	65%	0.653	58%	0.576	S	S	*	*			trans	-60.3	123.1	169	0	0	0	0	0	108.2	N3 P7	N3-A5 PolarHBondContact O-N 2.9Å; A5-P7 WeakPolarHBondContact O-CD 3.39Å; A5-P7 VanDerWaalsContact O-N 3.11Å
6	D	56.2	Low	67.5	Low	58 Å²	58	91.7 Å²	91.7	31%	0.31	55%	0.545	S	S	.	.			trans	-54.8	118	171.2	175.7	13.4	0	0	0	107.5	T4 F8 A9 R27 R51	T4-D6 PolarHBondContact O-N 3.4Å; D6-F8 PolarHBondContact O-N 3.01Å; D6-F8 PolarHBondContact OD1-N 2.98Å; D6-A9 PolarHBondContact O-N 3.18Å; D6-R27 IonicContact OD2-CZ 3.05Å; D6-R27 IonicContact OD2-NH1 2.72Å; D6-R27 PolarHBondContact OD2-NH1 3.47Å; D6-R51 IonicContact OD1-CZ 3.7Å; D6-R51 IonicContact OD1-NH2 2.89Å; D6-R51 PolarHBondContact OD1-NH2 3.22Å; D6-R51 IonicContact OD2-NH2 3.49Å; D6-R51 PolarHBondContact OD2-NH2 3.22Å
7	P	51.1	Low	68.9	Low	114 Å²	114	94.9 Å²	94.9	74%	0.74	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-3.1	-174	22.7	-32.5	0	0	0	113.8	A5	A5-P7 WeakPolarHBondContact O-CD 3.39Å; A5-P7 VanDerWaalsContact O-N 3.11Å
8	F	69.7	Low	70.4	Confident	52 Å²	52	93.9 Å²	93.9	23%	0.228	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108	2.7	176.9	-70.5	-91.2	0	0	0	114.5	D6 I10 R51 I90	D6-F8 PolarHBondContact O-N 3.01Å; D6-F8 PolarHBondContact OD1-N 2.98Å; F8-I10 PolarHBondContact O-N 3.35Å; F8-I10 VanDerWaalsContact O-N 3.07Å; F8-R51 HydrophobicContact CD1-CG 3.85Å; F8-R51 VanDerWaalsContact CD2-NH1 3.28Å; F8-R51 HydrophobicContact CE1-CB 4.26Å; F8-R51 HydrophobicContact CE1-CG 3.83Å; F8-R51 HydrophobicContact CG-CG 4.33Å; F8-R51 HydrophobicContact CZ-CG 4.31Å; F8-I90 HydrophobicContact CE1-CB 4.28Å
9	A	79.7	Confident	71.8	Confident	51 Å²	51	89.1 Å²	89.1	42%	0.421	51%	0.513	S	S	.	.			trans	-68.9	105.7	170.2	0	0	0	0	0	109	D6 S11	D6-A9 PolarHBondContact O-N 3.18Å; A9-S11 PolarHBondContact O-N 3.01Å
10	I	88.3	Confident	73.1	Confident	25 Å²	25	88.8 Å²	88.8	13%	0.128	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-76.5	117.5	176.2	-46	-178.4	0	0	0	108	F8 T14 I16 I21 Y34 V49 F91	F8-I10 PolarHBondContact O-N 3.35Å; F8-I10 VanDerWaalsContact O-N 3.07Å; I10-T14 HydrophobicContact CG2-CG2 3.79Å; I10-I16 HydrophobicContact CD1-CD1 3.79Å; I10-I16 HydrophobicContact CG2-CD1 4.28Å; I10-I21 HydrophobicContact CB-CD1 4.48Å; I10-I21 HydrophobicContact CG2-CD1 4.13Å; I10-I21 HydrophobicContact CG2-CG1 3.75Å; I10-Y34 HydrophobicContact CB-CE1 4.28Å; I10-Y34 HydrophobicContact CB-CE2 4.45Å; I10-Y34 HydrophobicContact CD1-CE2 3.99Å; I10-Y34 HydrophobicContact CG1-CE2 4.18Å; I10-Y34 PolarHBondContact N-OH 3.36Å; I10-V49 HydrophobicContact CD1-CG1 4.26Å; I10-F91 HydrophobicContact CD1-CE1 3.86Å; I10-F91 HydrophobicContact CD1-CZ 3.85Å
11	S	91.6	Very high	74.2	Confident	74 Å²	74	84.6 Å²	84.6	52%	0.517	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-66.4	143.1	-175.6	-60.8	0	0	0	0	112	A9 G13 T14	A9-S11 PolarHBondContact O-N 3.01Å; S11-G13 PolarHBondContact O-N 3.44Å; S11-T14 VanDerWaalsContact O-CB 3.29Å; S11-T14 WeakPolarHBondContact O-CB 3.29Å; S11-T14 PolarHBondContact O-N 3.47Å; S11-T14 VanDerWaalsContact O-N 3.12Å; S11-T14 PolarHBondContact O-OG1 2.98Å; S11-T14 VanDerWaalsContact O-OG1 3.06Å
12	P	94.4	Very high	77.2	Confident	96 Å²	96	75.3 Å²	75.3	62%	0.623	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	137.8	164.9	-27.6	36.6	0	0	0	111.7	T14 I21	P12-T14 VanDerWaalsContact C-N 3.34Å; P12-I21 WeakPolarHBondContact CA-O 3.41Å
13	G	94.9	Very high	80.3	Confident	44 Å²	44	70.3 Å²	70.3	45%	0.454	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	-19.8	-175.3	0	0	0	0	0	114.6	S11 T15 I21	S11-G13 PolarHBondContact O-N 3.44Å; G13-T15 PolarHBondContact O-N 3.33Å; G13-I21 PolarHBondContact N-O 3.39Å
14	T	94.7	Very high	83.3	Confident	60 Å²	60	66.6 Å²	66.6	37%	0.368	39%	0.389	S	S	.	.			trans	-61.4	133.6	172.7	-59.6	0	0	0	0	110.3	I10 S11 P12 I21	I10-T14 HydrophobicContact CG2-CG2 3.79Å; S11-T14 VanDerWaalsContact O-CB 3.29Å; S11-T14 WeakPolarHBondContact O-CB 3.29Å; S11-T14 PolarHBondContact O-N 3.47Å; S11-T14 VanDerWaalsContact O-N 3.12Å; S11-T14 PolarHBondContact O-OG1 2.98Å; S11-T14 VanDerWaalsContact O-OG1 3.06Å; P12-T14 VanDerWaalsContact C-N 3.34Å; T14-I21 WeakPolarHBondContact O-CB 3.49Å; T14-I21 VanDerWaalsContact O-CG1 3.31Å; T14-I21 WeakPolarHBondContact O-CG1 3.44Å; T14-I21 PolarHBondContact O-N 3.45Å
15	T	95.1	Very high	86.1	Confident	79 Å²	79	64 Å²	64	49%	0.485	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.6	177.1	-58.9	0	0	0	0	110	G13 H17 W19	G13-T15 PolarHBondContact O-N 3.33Å; T15-H17 WeakPolarHBondContact CG2-O 3.33Å; T15-W19 WeakPolarHBondContact CA-O 3.43Å
16	I	93.9	Very high	88.3	Confident	16 Å²	16	61.8 Å²	61.8	8%	0.082	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	113.2	174.9	-63.1	161.8	0	0	0	107.1	I10 K18 W19 I21 M47 F91 Y93	I10-I16 HydrophobicContact CD1-CD1 3.79Å; I10-I16 HydrophobicContact CG2-CD1 4.28Å; I16-K18 PolarHBondContact O-N 3.39Å; I16-W19 PolarHBondContact N-O 2.77Å; I16-W19 PolarHBondContact O-N 2.82Å; I16-I21 HydrophobicContact CD1-CD1 4.07Å; I16-I21 HydrophobicContact CD1-CG1 4.3Å; I16-M47 HydrophobicContact CB-CE 4.01Å; I16-M47 HydrophobicContact CB-SD 4.4Å; I16-M47 HydrophobicContact CD1-CE 4.28Å; I16-M47 HydrophobicContact CD1-SD 3.58Å; I16-M47 VanDerWaalsContact CD1-SD 3.58Å; I16-M47 HydrophobicContact CG2-CE 4.16Å; I16-M47 HydrophobicContact CG2-SD 4.49Å; I16-F91 HydrophobicContact CD1-CE2 4.14Å; I16-F91 HydrophobicContact CD1-CZ 3.69Å; I16-F91 HydrophobicContact CG1-CZ 4.28Å; I16-Y93 HydrophobicContact CG2-CD1 4.06Å; I16-Y93 HydrophobicContact CG2-CE1 3.86Å; I16-Y93 HydrophobicContact CG2-CE2 4.49Å; I16-Y93 HydrophobicContact CG2-CG 4.45Å
17	H	92.1	Very high	89.8	Confident	147 Å²	147	63.6 Å²	63.6	68%	0.681	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	-105.3	-166.2	-167.5	-94.5	0	0	0	110.2	T15	T15-H17 WeakPolarHBondContact CG2-O 3.33Å
18	K	94.9	Very high	91	Very high	76 Å²	76	60.6 Å²	60.6	33%	0.33	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-3.3	175.8	66.2	175.1	-178.5	155	0	114.1	I16 D38	I16-K18 PolarHBondContact O-N 3.39Å; K18-D38 VanDerWaalsContact CE-OD2 3.3Å; K18-D38 WeakPolarHBondContact CE-OD2 3.42Å; K18-D38 IonicContact NZ-OD2 2.68Å; K18-D38 PolarHBondContact NZ-OD2 3.27Å
19	W	97.4	Very high	91.1	Very high	3 Å²	3	63.9 Å²	63.9	1%	0.011	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	114	-170.8	-62.3	99.2	0	0	0	110.4	T15 I16 V36 D38 A45 M47 F83 D84 V95	T15-W19 WeakPolarHBondContact CA-O 3.43Å; I16-W19 PolarHBondContact N-O 2.77Å; I16-W19 PolarHBondContact O-N 2.82Å; W19-V36 HydrophobicContact CB-CB 4.11Å; W19-V36 HydrophobicContact CB-CG1 4.45Å; W19-V36 HydrophobicContact CB-CG2 4.24Å; W19-V36 HydrophobicContact CD2-CG2 4.22Å; W19-V36 HydrophobicContact CE3-CB 4.34Å; W19-V36 HydrophobicContact CE3-CG2 3.68Å; W19-V36 HydrophobicContact CG-CG2 4.47Å; W19-V36 HydrophobicContact CZ3-CG2 4.39Å; W19-D38 HydrophobicContact CE3-CB 3.87Å; W19-D38 HydrophobicContact CH2-CB 4.02Å; W19-D38 HydrophobicContact CZ3-CB 3.54Å; W19-A45 HydrophobicContact CE3-CB 4.26Å; W19-A45 HydrophobicContact CH2-CB 4.08Å; W19-A45 HydrophobicContact CZ3-CB 3.59Å; W19-M47 HydrophobicContact CB-CE 3.61Å; W19-M47 HydrophobicContact CG-CE 4.09Å; W19-F83 HydrophobicContact CH2-CB 4.31Å; W19-F83 HydrophobicContact CH2-CD2 4.27Å; W19-F83 HydrophobicContact CZ2-CB 4.15Å; W19-D84 HydrophobicContact CZ2-CB 4.22Å; W19-D84 PolarHBondContact NE1-OD2 3.34Å; W19-V95 HydrophobicContact CD2-CB 4.44Å; W19-V95 HydrophobicContact CD2-CG1 3.83Å; W19-V95 HydrophobicContact CD2-CG2 4.13Å; W19-V95 HydrophobicContact CE3-CG1 3.95Å; W19-V95 HydrophobicContact CG-CG2 3.99Å; W19-V95 HydrophobicContact CH2-CG1 3.83Å; W19-V95 HydrophobicContact CZ2-CB 4.25Å; W19-V95 HydrophobicContact CZ2-CG1 3.72Å; W19-V95 HydrophobicContact CZ3-CG1 3.94Å
20	R	97.5	Very high	91	Very high	83 Å²	83	66.5 Å²	66.5	31%	0.313	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127.9	176.9	-175.5	169.4	54.1	78	3.6	110.7	V22 V36 A37 D39	R20-V22 PolarHBondContact O-N 2.8Å; R20-V36 CarbonylContact O-C 3.54Å; R20-V36 WeakPolarHBondContact O-CA 3.45Å; R20-V36 WeakPolarHBondContact O-CB 3.5Å; R20-A37 PolarHBondContact N-O 3.25Å; R20-A37 PolarHBondContact O-N 2.9Å; R20-D39 IonicContact CZ-OD1 3.4Å; R20-D39 IonicContact CZ-OD2 3.56Å; R20-D39 IonicContact NE-OD1 2.89Å; R20-D39 IonicContact NE-OD2 2.66Å; R20-D39 PolarHBondContact NE-OD2 2.88Å; R20-D39 IonicContact NH2-OD1 3.65Å; R20-D39 PolarHBondContact NH2-OD1 3.11Å; R20-D39 IonicContact NH2-OD2 3.77Å; R20-D39 PolarHBondContact NH2-OD2 2.65Å
21	I	97.2	Very high	90.9	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	122.1	176.6	-60.7	-81.5	0	0	0	109	I10 P12 G13 T14 I16 Y34 V36 M47	I10-I21 HydrophobicContact CB-CD1 4.48Å; I10-I21 HydrophobicContact CG2-CD1 4.13Å; I10-I21 HydrophobicContact CG2-CG1 3.75Å; P12-I21 WeakPolarHBondContact CA-O 3.41Å; G13-I21 PolarHBondContact N-O 3.39Å; T14-I21 WeakPolarHBondContact O-CB 3.49Å; T14-I21 VanDerWaalsContact O-CG1 3.31Å; T14-I21 WeakPolarHBondContact O-CG1 3.44Å; T14-I21 PolarHBondContact O-N 3.45Å; I16-I21 HydrophobicContact CD1-CD1 4.07Å; I16-I21 HydrophobicContact CD1-CG1 4.3Å; I21-Y34 HydrophobicContact CD1-CD1 4.23Å; I21-Y34 HydrophobicContact CD1-CD2 4.24Å; I21-Y34 HydrophobicContact CD1-CG 3.82Å; I21-Y34 HydrophobicContact CG2-CD1 3.92Å; I21-Y34 HydrophobicContact CG2-CG 4.44Å; I21-V36 HydrophobicContact CD1-CG1 3.72Å; I21-V36 HydrophobicContact CG1-CG1 4.45Å; I21-M47 HydrophobicContact CD1-SD 4.21Å
22	V	96.6	Very high	90.9	Very high	49 Å²	49	62.9 Å²	62.9	30%	0.297	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-52.6	177.4	178.5	0	0	0	0	110	R20 K35 A37	R20-V22 PolarHBondContact O-N 2.8Å; V22-K35 HydrophobicContact CB-CB 4.25Å; V22-K35 HydrophobicContact CB-CD 4.35Å; V22-K35 HydrophobicContact CB-CG 4.12Å; V22-K35 WeakPolarHBondContact CB-O 3.43Å; V22-K35 HydrophobicContact CG1-CD 4.18Å; V22-K35 HydrophobicContact CG2-CG 4.46Å; V22-K35 PolarHBondContact N-O 2.71Å; V22-A37 HydrophobicContact CG2-CB 3.94Å
23	K	95.4	Very high	90.9	Very high	82 Å²	82	60.4 Å²	60.4	36%	0.357	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	162	177.7	64.2	176.1	-171.5	168.2	0	111.6	Y34 K35	K23-Y34 CarbonylContact O-C 3.51Å; K23-Y34 WeakPolarHBondContact O-CA 3.2Å; K23-K35 HydrophobicContact CG-CB 4.04Å; K23-K35 PolarHBondContact N-O 3Å; K23-K35 PolarHBondContact O-N 3.5Å
24	E	94.6	Very high	91	Very high	80 Å²	80	58.4 Å²	58.4	37%	0.374	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136.4	168	-168.6	168.1	142.8	0	0	110.9	R27 Y34	E24-R27 VanDerWaalsContact CD-NH2 3.31Å; E24-R27 VanDerWaalsContact OE1-CB 3.28Å; E24-R27 WeakPolarHBondContact OE1-CB 3.32Å; E24-R27 IonicContact OE1-CZ 2.66Å; E24-R27 IonicContact OE1-NE 3.73Å; E24-R27 PolarHBondContact OE1-NE 2.83Å; E24-R27 IonicContact OE1-NH2 3.62Å; E24-R27 PolarHBondContact OE1-NH2 3.47Å; E24-R27 IonicContact OE2-CZ 2.8Å; E24-R27 IonicContact OE2-NE 2.73Å; E24-R27 IonicContact OE2-NH2 2.71Å; E24-R27 PolarHBondContact OE2-NH2 3.35Å; E24-Y34 HydrophobicContact CB-CD1 3.99Å; E24-Y34 HydrophobicContact CB-CE1 3.87Å; E24-Y34 HydrophobicContact CG-CD1 4.34Å; E24-Y34 HydrophobicContact CG-CE1 4.01Å
25	L	91.4	Very high	91.1	Very high	74 Å²	74	56.6 Å²	56.6	39%	0.387	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-31.1	175.3	-64.9	176.8	0	0	0	111.8	V33 K35 L98	L25-V33 HydrophobicContact CB-CG1 4.43Å; L25-V33 WeakPolarHBondContact CB-O 3.45Å; L25-V33 HydrophobicContact CD1-CG1 4.27Å; L25-V33 PolarHBondContact N-O 3.1Å; L25-K35 HydrophobicContact CD1-CB 4.07Å; L25-K35 HydrophobicContact CD2-CB 4.05Å; L25-K35 HydrophobicContact CG-CB 4.05Å; L25-L98 HydrophobicContact CD1-CD1 3.67Å
26	G	87.5	Confident	91.2	Very high	33 Å²	33	52.8 Å²	52.8	34%	0.34	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.4	160.5	176.4	0	0	0	0	0	111.9	A32 V33	G26-A32 CarbonylContact O-C 3.59Å; G26-A32 WeakPolarHBondContact O-CA 3.36Å; G26-V33 PolarHBondContact N-O 3.22Å; G26-V33 PolarHBondContact O-N 3.01Å
27	R	86.9	Confident	91.4	Very high	97 Å²	97	52.4 Å²	52.4	37%	0.366	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	134.5	-178.3	-177.9	175.9	-61.5	-95.1	-9.2	110.1	D6 E24 A32 Y34	D6-R27 IonicContact OD2-CZ 3.05Å; D6-R27 IonicContact OD2-NH1 2.72Å; D6-R27 PolarHBondContact OD2-NH1 3.47Å; E24-R27 VanDerWaalsContact CD-NH2 3.31Å; E24-R27 VanDerWaalsContact OE1-CB 3.28Å; E24-R27 WeakPolarHBondContact OE1-CB 3.32Å; E24-R27 IonicContact OE1-CZ 2.66Å; E24-R27 IonicContact OE1-NE 3.73Å; E24-R27 PolarHBondContact OE1-NE 2.83Å; E24-R27 IonicContact OE1-NH2 3.62Å; E24-R27 PolarHBondContact OE1-NH2 3.47Å; E24-R27 IonicContact OE2-CZ 2.8Å; E24-R27 IonicContact OE2-NE 2.73Å; E24-R27 IonicContact OE2-NH2 2.71Å; E24-R27 PolarHBondContact OE2-NH2 3.35Å; R27-A32 HydrophobicContact CB-CB 4.37Å; R27-A32 HydrophobicContact CG-CB 4.35Å; R27-Y34 PolarHBondContact NH2-OH 2.88Å
28	G	76.6	Confident	91.6	Very high	50 Å²	50	45.5 Å²	45.5	52%	0.515	25%	0.245	S	C	.	.			trans	-111.7	-175.8	172	0	0	0	0	0	111.1	Y30 G31	G28-Y30 VanDerWaalsContact C-N 3.25Å; G28-Y30 PolarHBondContact O-N 2.96Å; G28-G31 PolarHBondContact N-O 3.16Å
29	T	72.5	Confident	91.5	Very high	121 Å²	121	45.5 Å²	45.5	74%	0.742	25%	0.248	S	C	*	.	S	Bend	trans	-60.9	-33.5	179.8	-48.8	0	0	0	0	113.2
30	Y	77.1	Confident	91.3	Very high	106 Å²	106	53 Å²	53	42%	0.416	28%	0.283	S	S	.	.	S	Bend	trans	-114.8	-3.4	-168	-61	-56.8	0	0	0	113.9	G28 R51 I54	G28-Y30 VanDerWaalsContact C-N 3.25Å; G28-Y30 PolarHBondContact O-N 2.96Å; Y30-R51 PolarHBondContact O-N 3.42Å; Y30-I54 HydrophobicContact CD1-CD1 3.87Å; Y30-I54 HydrophobicContact CD1-CG1 4.25Å; Y30-I54 HydrophobicContact CD1-CG2 4.14Å; Y30-I54 HydrophobicContact CG-CD1 4.23Å; Y30-I54 WeakPolarHBondContact O-CD1 3.42Å
31	G	85.6	Confident	91.1	Very high	20 Å²	20	53.5 Å²	53.5	21%	0.206	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	179	-169.6	0	0	0	0	0	113.1	G28 V49	G28-G31 PolarHBondContact N-O 3.16Å; G31-V49 WeakPolarHBondContact CA-O 3.44Å
32	A	92.1	Very high	90.8	Very high	3 Å²	3	61.8 Å²	61.8	3%	0.025	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	159.5	176.9	0	0	0	0	0	110.1	G26 R27 Y34 K48 V49	G26-A32 CarbonylContact O-C 3.59Å; G26-A32 WeakPolarHBondContact O-CA 3.36Å; R27-A32 HydrophobicContact CB-CB 4.37Å; R27-A32 HydrophobicContact CG-CB 4.35Å; A32-Y34 HydrophobicContact CB-CD2 4.42Å; A32-Y34 HydrophobicContact CB-CE2 3.62Å; A32-K48 WeakPolarHBondContact O-CA 3.44Å; A32-V49 HydrophobicContact CB-CG2 4.12Å; A32-V49 PolarHBondContact N-O 3.49Å; A32-V49 PolarHBondContact O-N 3.48Å
33	V	94.2	Very high	90.6	Very high	45 Å²	45	63.9 Å²	63.9	27%	0.273	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.6	174.4	-174.3	0	0	0	0	108	L25 G26 A46 M47 K48	L25-V33 HydrophobicContact CB-CG1 4.43Å; L25-V33 WeakPolarHBondContact CB-O 3.45Å; L25-V33 HydrophobicContact CD1-CG1 4.27Å; L25-V33 PolarHBondContact N-O 3.1Å; G26-V33 PolarHBondContact N-O 3.22Å; G26-V33 PolarHBondContact O-N 3.01Å; V33-A46 HydrophobicContact CG1-CB 4.26Å; V33-M47 CarbonylContact C-O 3.57Å; V33-M47 VanDerWaalsContact CA-O 3.3Å; V33-M47 WeakPolarHBondContact CA-O 3.1Å; V33-K48 HydrophobicContact CG2-CB 4.29Å; V33-K48 HydrophobicContact CG2-CG 4.14Å
34	Y	96.6	Very high	90.6	Very high	1 Å²	1	62.8 Å²	62.8	0%	0.004	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.8	-179.4	-63.2	-86.7	0	0	0	110.3	I10 I21 K23 E24 R27 A32 A46 M47 V49	I10-Y34 HydrophobicContact CB-CE1 4.28Å; I10-Y34 HydrophobicContact CB-CE2 4.45Å; I10-Y34 HydrophobicContact CD1-CE2 3.99Å; I10-Y34 HydrophobicContact CG1-CE2 4.18Å; I10-Y34 PolarHBondContact N-OH 3.36Å; I21-Y34 HydrophobicContact CD1-CD1 4.23Å; I21-Y34 HydrophobicContact CD1-CD2 4.24Å; I21-Y34 HydrophobicContact CD1-CG 3.82Å; I21-Y34 HydrophobicContact CG2-CD1 3.92Å; I21-Y34 HydrophobicContact CG2-CG 4.44Å; K23-Y34 CarbonylContact O-C 3.51Å; K23-Y34 WeakPolarHBondContact O-CA 3.2Å; E24-Y34 HydrophobicContact CB-CD1 3.99Å; E24-Y34 HydrophobicContact CB-CE1 3.87Å; E24-Y34 HydrophobicContact CG-CD1 4.34Å; E24-Y34 HydrophobicContact CG-CE1 4.01Å; R27-Y34 PolarHBondContact NH2-OH 2.88Å; A32-Y34 HydrophobicContact CB-CD2 4.42Å; A32-Y34 HydrophobicContact CB-CE2 3.62Å; Y34-A46 CarbonylContact O-C 3.59Å; Y34-A46 WeakPolarHBondContact O-CA 3.48Å; Y34-M47 PolarHBondContact N-O 3.33Å; Y34-M47 PolarHBondContact O-N 3.21Å; Y34-V49 HydrophobicContact CD2-CG1 4.4Å; Y34-V49 HydrophobicContact CD2-CG2 4.37Å; Y34-V49 HydrophobicContact CE2-CG1 4.47Å; Y34-V49 HydrophobicContact CE2-CG2 3.8Å
35	K	96.9	Very high	90.7	Very high	22 Å²	22	59 Å²	59	10%	0.096	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	129.2	158.5	-176.5	177.6	-179.1	-179.8	0	107	V22 K23 L25 D44 L98 S330	V22-K35 HydrophobicContact CB-CB 4.25Å; V22-K35 HydrophobicContact CB-CD 4.35Å; V22-K35 HydrophobicContact CB-CG 4.12Å; V22-K35 WeakPolarHBondContact CB-O 3.43Å; V22-K35 HydrophobicContact CG1-CD 4.18Å; V22-K35 HydrophobicContact CG2-CG 4.46Å; V22-K35 PolarHBondContact N-O 2.71Å; K23-K35 HydrophobicContact CG-CB 4.04Å; K23-K35 PolarHBondContact N-O 3Å; K23-K35 PolarHBondContact O-N 3.5Å; L25-K35 HydrophobicContact CD1-CB 4.07Å; L25-K35 HydrophobicContact CD2-CB 4.05Å; L25-K35 HydrophobicContact CG-CB 4.05Å; K35-D44 VanDerWaalsContact CE-OD1 3.23Å; K35-D44 WeakPolarHBondContact CE-OD1 3.22Å; K35-D44 WeakPolarHBondContact CE-OD2 3.43Å; K35-D44 IonicContact NZ-OD1 3.07Å; K35-D44 IonicContact NZ-OD2 3.51Å; K35-D44 PolarHBondContact NZ-OD2 3.12Å; K35-L98 HydrophobicContact CD-CD2 4.23Å; K35-L98 HydrophobicContact CG-CD2 4.22Å; K35-S330 PolarHBondContact NZ-O 3.24Å
36	V	97.7	Very high	91	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	155.7	175	-64.5	0	0	0	0	110.4	W19 R20 I21 D44 A45 M47 V95	W19-V36 HydrophobicContact CB-CB 4.11Å; W19-V36 HydrophobicContact CB-CG1 4.45Å; W19-V36 HydrophobicContact CB-CG2 4.24Å; W19-V36 HydrophobicContact CD2-CG2 4.22Å; W19-V36 HydrophobicContact CE3-CB 4.34Å; W19-V36 HydrophobicContact CE3-CG2 3.68Å; W19-V36 HydrophobicContact CG-CG2 4.47Å; W19-V36 HydrophobicContact CZ3-CG2 4.39Å; R20-V36 CarbonylContact O-C 3.54Å; R20-V36 WeakPolarHBondContact O-CA 3.45Å; R20-V36 WeakPolarHBondContact O-CB 3.5Å; I21-V36 HydrophobicContact CD1-CG1 3.72Å; I21-V36 HydrophobicContact CG1-CG1 4.45Å; V36-D44 WeakPolarHBondContact O-CA 3.48Å; V36-A45 HydrophobicContact CG2-CB 3.9Å; V36-A45 PolarHBondContact N-O 3.22Å; V36-A45 PolarHBondContact O-N 3.05Å; V36-M47 HydrophobicContact CB-CB 4.47Å; V36-M47 HydrophobicContact CG1-CB 3.57Å; V36-M47 HydrophobicContact CG1-CE 4.08Å; V36-M47 HydrophobicContact CG1-SD 4.28Å; V36-M47 HydrophobicContact CG2-CB 4.01Å; V36-V95 HydrophobicContact CG2-CG1 3.96Å
37	A	97.6	Very high	91.4	Very high	8 Å²	8	54.3 Å²	54.3	7%	0.066	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.5	173.3	0	0	0	0	0	109.8	R20 V22 R43	R20-A37 PolarHBondContact N-O 3.25Å; R20-A37 PolarHBondContact O-N 2.9Å; V22-A37 HydrophobicContact CG2-CB 3.94Å; A37-R43 WeakPolarHBondContact CA-O 3.28Å
38	D	96.7	Very high	91.8	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.011	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	107.1	159.1	-175.1	-32.1	0	0	0	106.5	K18 W19 E40 L41 H42 R43	K18-D38 VanDerWaalsContact CE-OD2 3.3Å; K18-D38 WeakPolarHBondContact CE-OD2 3.42Å; K18-D38 IonicContact NZ-OD2 2.68Å; K18-D38 PolarHBondContact NZ-OD2 3.27Å; W19-D38 HydrophobicContact CE3-CB 3.87Å; W19-D38 HydrophobicContact CH2-CB 4.02Å; W19-D38 HydrophobicContact CZ3-CB 3.54Å; D38-E40 VanDerWaalsContact C-N 3.29Å; D38-E40 WeakPolarHBondContact OD1-CB 3.31Å; D38-E40 PolarHBondContact OD1-N 3.04Å; D38-E40 VanDerWaalsContact OD1-N 3.12Å; D38-L41 HydrophobicContact CB-CB 4.26Å; D38-L41 PolarHBondContact OD1-N 3.14Å; D38-L41 WeakPolarHBondContact OD2-CD1 3.5Å; D38-H42 VanDerWaalsContact O-CA 3.32Å; D38-H42 WeakPolarHBondContact O-CA 3.49Å; D38-H42 PolarHBondContact O-N 3.36Å; D38-R43 HydrophobicContact CB-CB 4.41Å; D38-R43 PolarHBondContact N-O 3.42Å; D38-R43 PolarHBondContact O-N 3.04Å
39	D	93.2	Very high	92.6	Very high	76 Å²	76	49.9 Å²	49.9	41%	0.406	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-27	-175.1	-69.8	-36.5	0	0	0	112.2	R20 H42	R20-D39 IonicContact CZ-OD1 3.4Å; R20-D39 IonicContact CZ-OD2 3.56Å; R20-D39 IonicContact NE-OD1 2.89Å; R20-D39 IonicContact NE-OD2 2.66Å; R20-D39 PolarHBondContact NE-OD2 2.88Å; R20-D39 IonicContact NH2-OD1 3.65Å; R20-D39 PolarHBondContact NH2-OD1 3.11Å; R20-D39 IonicContact NH2-OD2 3.77Å; R20-D39 PolarHBondContact NH2-OD2 2.65Å; D39-H42 PolarHBondContact O-CE1 3.11Å; D39-H42 VanDerWaalsContact O-CE1 3.24Å; D39-H42 PolarHBondContact O-ND1 3.27Å; D39-H42 VanDerWaalsContact O-ND1 3.13Å
40	E	93.2	Very high	93.5	Very high	161 Å²	161	44.8 Å²	44.8	75%	0.752	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-42.8	177.7	-61.8	179.8	173.2	0	0	111.1	D38	D38-E40 VanDerWaalsContact C-N 3.29Å; D38-E40 WeakPolarHBondContact OD1-CB 3.31Å; D38-E40 PolarHBondContact OD1-N 3.04Å; D38-E40 VanDerWaalsContact OD1-N 3.12Å
41	L	92.7	Very high	94	Very high	93 Å²	93	43.1 Å²	43.1	49%	0.487	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	2	179.9	-62.2	-177.2	0	0	0	113.7	D38 R43	D38-L41 HydrophobicContact CB-CB 4.26Å; D38-L41 PolarHBondContact OD1-N 3.14Å; D38-L41 WeakPolarHBondContact OD2-CD1 3.5Å; L41-R43 HydrophobicContact CB-CB 4.3Å; L41-R43 PolarHBondContact O-N 3.02Å
42	H	91.2	Very high	94.1	Very high	175 Å²	175	46.7 Å²	46.7	81%	0.81	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	45	44.7	-173.4	-60.8	-50.3	0	0	0	113	D38 D39	D38-H42 VanDerWaalsContact O-CA 3.32Å; D38-H42 WeakPolarHBondContact O-CA 3.49Å; D38-H42 PolarHBondContact O-N 3.36Å; D39-H42 PolarHBondContact O-CE1 3.11Å; D39-H42 VanDerWaalsContact O-CE1 3.24Å; D39-H42 PolarHBondContact O-ND1 3.27Å; D39-H42 VanDerWaalsContact O-ND1 3.13Å
43	R	92.4	Very high	93.8	Very high	93 Å²	93	51.2 Å²	51.2	35%	0.351	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.7	-172.6	-176.1	-175.9	-60.3	176.8	4.6	111.6	A37 D38 L41	A37-R43 WeakPolarHBondContact CA-O 3.28Å; D38-R43 HydrophobicContact CB-CB 4.41Å; D38-R43 PolarHBondContact N-O 3.42Å; D38-R43 PolarHBondContact O-N 3.04Å; L41-R43 HydrophobicContact CB-CB 4.3Å; L41-R43 PolarHBondContact O-N 3.02Å
44	D	95.2	Very high	93.2	Very high	59 Å²	59	50.2 Å²	50.2	32%	0.316	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.6	165.8	-78.4	-25.8	0	0	0	111.1	K35 V36 L98	K35-D44 VanDerWaalsContact CE-OD1 3.23Å; K35-D44 WeakPolarHBondContact CE-OD1 3.22Å; K35-D44 WeakPolarHBondContact CE-OD2 3.43Å; K35-D44 IonicContact NZ-OD1 3.07Å; K35-D44 IonicContact NZ-OD2 3.51Å; K35-D44 PolarHBondContact NZ-OD2 3.12Å; V36-D44 WeakPolarHBondContact O-CA 3.48Å; D44-L98 HydrophobicContact CB-CD2 3.95Å
45	A	97.1	Very high	92.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	173.1	176.7	0	0	0	0	0	111.6	W19 V36 F83 V95 M96	W19-A45 HydrophobicContact CE3-CB 4.26Å; W19-A45 HydrophobicContact CH2-CB 4.08Å; W19-A45 HydrophobicContact CZ3-CB 3.59Å; V36-A45 HydrophobicContact CG2-CB 3.9Å; V36-A45 PolarHBondContact N-O 3.22Å; V36-A45 PolarHBondContact O-N 3.05Å; A45-F83 HydrophobicContact CB-CD2 3.87Å; A45-F83 HydrophobicContact CB-CE2 4.06Å; A45-V95 HydrophobicContact CB-CG1 3.54Å; A45-M96 WeakPolarHBondContact CB-O 3.31Å
46	A	97.2	Very high	91.8	Very high	8 Å²	8	55.8 Å²	55.8	7%	0.066	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128	172	0	0	0	0	0	110	V33 Y34 V95 M96 L98	V33-A46 HydrophobicContact CG1-CB 4.26Å; Y34-A46 CarbonylContact O-C 3.59Å; Y34-A46 WeakPolarHBondContact O-CA 3.48Å; A46-V95 CarbonylContact O-C 3.49Å; A46-V95 WeakPolarHBondContact O-CA 3.49Å; A46-M96 HydrophobicContact CB-CG 4.22Å; A46-M96 PolarHBondContact N-O 3.07Å; A46-M96 PolarHBondContact O-N 2.99Å; A46-L98 HydrophobicContact CB-CD1 4.05Å
47	M	97.1	Very high	90.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.5	173.2	-178.1	-178.6	-73.7	0	0	110.1	I16 W19 I21 V33 Y34 V36 V49 Y93 M94 V95	I16-M47 HydrophobicContact CB-CE 4.01Å; I16-M47 HydrophobicContact CB-SD 4.4Å; I16-M47 HydrophobicContact CD1-CE 4.28Å; I16-M47 HydrophobicContact CD1-SD 3.58Å; I16-M47 VanDerWaalsContact CD1-SD 3.58Å; I16-M47 HydrophobicContact CG2-CE 4.16Å; I16-M47 HydrophobicContact CG2-SD 4.49Å; W19-M47 HydrophobicContact CB-CE 3.61Å; W19-M47 HydrophobicContact CG-CE 4.09Å; I21-M47 HydrophobicContact CD1-SD 4.21Å; V33-M47 CarbonylContact C-O 3.57Å; V33-M47 VanDerWaalsContact CA-O 3.3Å; V33-M47 WeakPolarHBondContact CA-O 3.1Å; Y34-M47 PolarHBondContact N-O 3.33Å; Y34-M47 PolarHBondContact O-N 3.21Å; V36-M47 HydrophobicContact CB-CB 4.47Å; V36-M47 HydrophobicContact CG1-CB 3.57Å; V36-M47 HydrophobicContact CG1-CE 4.08Å; V36-M47 HydrophobicContact CG1-SD 4.28Å; V36-M47 HydrophobicContact CG2-CB 4.01Å; M47-V49 HydrophobicContact CG-CG1 3.98Å; M47-V49 HydrophobicContact SD-CG1 4.1Å; M47-Y93 HydrophobicContact CE-CD2 4.07Å; M47-Y93 HydrophobicContact CE-CE2 4.47Å; M47-Y93 HydrophobicContact SD-CD2 4.42Å; M47-M94 CarbonylContact C-O 3.5Å; M47-M94 VanDerWaalsContact CA-O 3.27Å; M47-M94 WeakPolarHBondContact CA-O 3.33Å; M47-V95 HydrophobicContact CB-CG2 4.27Å; M47-V95 HydrophobicContact CE-CG2 3.59Å; M47-V95 HydrophobicContact CG-CG2 4.17Å
48	K	95.3	Very high	90	Very high	41 Å²	41	64.7 Å²	64.7	18%	0.178	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	129.1	171.3	-174.9	176.5	-173.2	-177.9	0	108.6	A32 V33 L61 E64 Y93 M94 M96 D171	A32-K48 WeakPolarHBondContact O-CA 3.44Å; V33-K48 HydrophobicContact CG2-CB 4.29Å; V33-K48 HydrophobicContact CG2-CG 4.14Å; K48-L61 HydrophobicContact CB-CD1 4.3Å; K48-L61 HydrophobicContact CD-CD1 3.84Å; K48-L61 HydrophobicContact CG-CD1 3.86Å; K48-E64 IonicContact NZ-OE1 3.04Å; K48-E64 PolarHBondContact NZ-OE1 3.06Å; K48-E64 IonicContact NZ-OE2 3.56Å; K48-E64 PolarHBondContact NZ-OE2 2.92Å; K48-Y93 VanDerWaalsContact O-CA 3.29Å; K48-Y93 WeakPolarHBondContact O-CA 3.37Å; K48-M94 HydrophobicContact CB-CG 3.88Å; K48-M94 HydrophobicContact CB-SD 4.41Å; K48-M94 HydrophobicContact CD-SD 4.4Å; K48-M94 PolarHBondContact N-O 3.28Å; K48-M94 PolarHBondContact O-N 2.88Å; K48-M96 HydrophobicContact CB-CE 3.52Å; K48-M96 HydrophobicContact CD-CE 4.02Å; K48-M96 HydrophobicContact CG-CE 4.41Å; K48-D171 IonicContact NZ-OD1 3.03Å; K48-D171 PolarHBondContact NZ-OD1 2.87Å; K48-D171 VanDerWaalsContact NZ-OD1 3.13Å
49	V	93.8	Very high	89.4	Confident	13 Å²	13	68.4 Å²	68.4	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145	178.7	-54.6	0	0	0	0	111	I10 G31 A32 Y34 M47 F91 N92	I10-V49 HydrophobicContact CD1-CG1 4.26Å; G31-V49 WeakPolarHBondContact CA-O 3.44Å; A32-V49 HydrophobicContact CB-CG2 4.12Å; A32-V49 PolarHBondContact N-O 3.49Å; A32-V49 PolarHBondContact O-N 3.48Å; Y34-V49 HydrophobicContact CD2-CG1 4.4Å; Y34-V49 HydrophobicContact CD2-CG2 4.37Å; Y34-V49 HydrophobicContact CE2-CG1 4.47Å; Y34-V49 HydrophobicContact CE2-CG2 3.8Å; M47-V49 HydrophobicContact CG-CG1 3.98Å; M47-V49 HydrophobicContact SD-CG1 4.1Å; V49-F91 HydrophobicContact CB-CD2 4.1Å; V49-F91 HydrophobicContact CB-CG 4.44Å; V49-F91 HydrophobicContact CG1-CD2 4.05Å; V49-F91 HydrophobicContact CG1-CE2 4.09Å; V49-N92 CarbonylContact C-O 3.51Å; V49-N92 WeakPolarHBondContact CA-O 3.16Å
50	E	91.6	Very high	89.1	Confident	14 Å²	14	66.6 Å²	66.6	7%	0.065	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	128.6	178.2	-177.5	-169.4	87.4	0	0	109.7	I54 R59 M60 L61 F91 N92	E50-I54 HydrophobicContact CG-CD1 4.45Å; E50-R59 VanDerWaalsContact CD-CA 3.48Å; E50-R59 VanDerWaalsContact OE1-CA 3.26Å; E50-R59 WeakPolarHBondContact OE1-CA 3.42Å; E50-R59 WeakPolarHBondContact OE1-CB 2.99Å; E50-R59 VanDerWaalsContact OE1-CG 3.24Å; E50-R59 WeakPolarHBondContact OE1-CG 3.48Å; E50-R59 WeakPolarHBondContact OE2-CA 3.25Å; E50-M60 PolarHBondContact OE2-N 3.39Å; E50-L61 HydrophobicContact CB-CB 4.24Å; E50-L61 HydrophobicContact CB-CD2 4.22Å; E50-L61 PolarHBondContact OE2-N 3.45Å; E50-L61 VanDerWaalsContact OE2-N 3.11Å; E50-F91 CarbonylContact O-C 3.58Å; E50-F91 VanDerWaalsContact O-CA 3.25Å; E50-F91 WeakPolarHBondContact O-CA 3.41Å; E50-F91 VanDerWaalsContact O-CB 3.28Å; E50-F91 WeakPolarHBondContact O-CB 3.44Å; E50-N92 PolarHBondContact N-O 2.84Å; E50-N92 PolarHBondContact O-N 2.91Å
51	R	87.8	Confident	89	Confident	72 Å²	72	59.1 Å²	59.1	27%	0.272	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	136.7	-176.3	-54.3	-179.8	-178.9	-160.8	-5	110.8	D6 F8 Y30 A53 I54	D6-R51 IonicContact OD1-CZ 3.7Å; D6-R51 IonicContact OD1-NH2 2.89Å; D6-R51 PolarHBondContact OD1-NH2 3.22Å; D6-R51 IonicContact OD2-NH2 3.49Å; D6-R51 PolarHBondContact OD2-NH2 3.22Å; F8-R51 HydrophobicContact CD1-CG 3.85Å; F8-R51 VanDerWaalsContact CD2-NH1 3.28Å; F8-R51 HydrophobicContact CE1-CB 4.26Å; F8-R51 HydrophobicContact CE1-CG 3.83Å; F8-R51 HydrophobicContact CG-CG 4.33Å; F8-R51 HydrophobicContact CZ-CG 4.31Å; Y30-R51 PolarHBondContact O-N 3.42Å; R51-A53 VanDerWaalsContact C-N 3.32Å; R51-A53 PolarHBondContact O-N 3.1Å; R51-I54 HydrophobicContact CB-CD1 3.7Å; R51-I54 HydrophobicContact CB-CG1 3.99Å; R51-I54 HydrophobicContact CG-CD1 4.26Å; R51-I54 PolarHBondContact O-N 2.68Å
52	R	87.5	Confident	88.9	Confident	95 Å²	95	61.3 Å²	61.3	36%	0.358	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-28.1	177.1	-80.3	-176.1	159.9	-132.7	-5.2	113.6	I54 R59 C87 T88 I90 N92	R52-I54 PolarHBondContact O-N 3.2Å; R52-R59 PolarHBondContact O-NH1 3.24Å; R52-C87 PolarHBondContact NH2-SG 2.79Å; R52-T88 WeakPolarHBondContact CD-O 3.45Å; R52-T88 PolarHBondContact NE-O 2.89Å; R52-I90 PolarHBondContact N-O 3.16Å; R52-N92 PolarHBondContact NE-OD1 2.73Å; R52-N92 PolarHBondContact NH2-OD1 2.86Å; R52-N92 VanDerWaalsContact NH2-OD1 3.13Å
53	A	85.6	Confident	89	Confident	97 Å²	97	55.9 Å²	55.9	80%	0.802	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-13.2	179	0	0	0	0	0	113.9	R51	R51-A53 VanDerWaalsContact C-N 3.32Å; R51-A53 PolarHBondContact O-N 3.1Å
54	I	80.8	Confident	89.1	Confident	24 Å²	24	51.7 Å²	51.7	12%	0.123	26%	0.264	C	S	.	.	S	Bend	trans	-69.6	141.3	176.5	-67.6	163.2	0	0	0	109.8	Y30 E50 R51 R52 Y58 R59	Y30-I54 HydrophobicContact CD1-CD1 3.87Å; Y30-I54 HydrophobicContact CD1-CG1 4.25Å; Y30-I54 HydrophobicContact CD1-CG2 4.14Å; Y30-I54 HydrophobicContact CG-CD1 4.23Å; Y30-I54 WeakPolarHBondContact O-CD1 3.42Å; E50-I54 HydrophobicContact CG-CD1 4.45Å; R51-I54 HydrophobicContact CB-CD1 3.7Å; R51-I54 HydrophobicContact CB-CG1 3.99Å; R51-I54 HydrophobicContact CG-CD1 4.26Å; R51-I54 PolarHBondContact O-N 2.68Å; R52-I54 PolarHBondContact O-N 3.2Å; I54-Y58 HydrophobicContact CG2-CD2 4.33Å; I54-Y58 HydrophobicContact CG2-CG 4.36Å; I54-R59 HydrophobicContact CB-CG 4.48Å; I54-R59 HydrophobicContact CG2-CG 4.4Å; I54-R59 PolarHBondContact O-NH1 3Å
55	S	82.6	Confident	89.2	Confident	57 Å²	57	49.6 Å²	49.6	40%	0.399	25%	0.253	S	S	.	.			trans	-55.3	140.7	179.4	-44.4	0	0	0	0	111.7	E57 Y58	S55-E57 WeakPolarHBondContact CB-OE1 3.45Å; S55-E57 WeakPolarHBondContact CB-OE2 3.49Å; S55-E57 PolarHBondContact O-N 2.66Å; S55-Y58 PolarHBondContact O-N 2.96Å
56	P	81.1	Confident	89.1	Confident	84 Å²	84	52.4 Å²	52.4	55%	0.545	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-49.8	-35.3	-173.4	-21.4	25.4	0	0	0	115.4	Y58 R59	P56-Y58 PolarHBondContact O-N 3.18Å; P56-R59 VanDerWaalsContact CG-NH2 3.32Å; P56-R59 PolarHBondContact O-N 2.91Å; P56-R59 VanDerWaalsContact O-N 3.15Å
57	E	79.4	Confident	89.1	Confident	95 Å²	95	52.2 Å²	52.2	44%	0.444	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-66.9	-20.3	-178	65.1	-84.8	-163.6	0	0	114.2	S55 R195	S55-E57 WeakPolarHBondContact CB-OE1 3.45Å; S55-E57 WeakPolarHBondContact CB-OE2 3.49Å; S55-E57 PolarHBondContact O-N 2.66Å; E57-R195 PolarHBondContact O-NH1 2.88Å; E57-R195 VanDerWaalsContact O-NH1 3.14Å; E57-R195 PolarHBondContact O-NH2 3.4Å
58	Y	78	Confident	89.1	Confident	99 Å²	99	52.4 Å²	52.4	39%	0.388	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-99.5	-3.5	175.7	-56.3	-74.2	0	0	0	113	I54 S55 P56 M60	I54-Y58 HydrophobicContact CG2-CD2 4.33Å; I54-Y58 HydrophobicContact CG2-CG 4.36Å; S55-Y58 PolarHBondContact O-N 2.96Å; P56-Y58 PolarHBondContact O-N 3.18Å; Y58-M60 PolarHBondContact O-N 3.42Å
59	R	84.3	Confident	89.2	Confident	81 Å²	81	54.4 Å²	54.4	31%	0.306	29%	0.287	S	S	.	.			trans	-82.4	100.9	179.1	-67.2	-165.5	-65.1	-118.9	5.1	111	E50 R52 I54 P56	E50-R59 VanDerWaalsContact CD-CA 3.48Å; E50-R59 VanDerWaalsContact OE1-CA 3.26Å; E50-R59 WeakPolarHBondContact OE1-CA 3.42Å; E50-R59 WeakPolarHBondContact OE1-CB 2.99Å; E50-R59 VanDerWaalsContact OE1-CG 3.24Å; E50-R59 WeakPolarHBondContact OE1-CG 3.48Å; E50-R59 WeakPolarHBondContact OE2-CA 3.25Å; R52-R59 PolarHBondContact O-NH1 3.24Å; I54-R59 HydrophobicContact CB-CG 4.48Å; I54-R59 HydrophobicContact CG2-CG 4.4Å; I54-R59 PolarHBondContact O-NH1 3Å; P56-R59 VanDerWaalsContact CG-NH2 3.32Å; P56-R59 PolarHBondContact O-N 2.91Å; P56-R59 VanDerWaalsContact O-N 3.15Å
60	M	86.8	Confident	89.4	Confident	37 Å²	37	55.5 Å²	55.5	18%	0.182	29%	0.291	C	S	.	.			trans	-100.4	-18.8	-174.8	-52.9	-57.5	177.3	0	0	113	E50 Y58 K62 V63 E64	E50-M60 PolarHBondContact OE2-N 3.39Å; Y58-M60 PolarHBondContact O-N 3.42Å; M60-K62 PolarHBondContact O-N 3.24Å; M60-K62 VanDerWaalsContact O-N 3.12Å; M60-V63 WeakPolarHBondContact O-CA 3.39Å; M60-V63 WeakPolarHBondContact O-CB 3.45Å; M60-V63 PolarHBondContact O-N 3.43Å; M60-E64 PolarHBondContact O-N 2.84Å
61	L	91.2	Very high	89.6	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-34.2	-171.3	-150.8	70.8	0	0	0	113.3	K48 E50 V63 E64 V65 N92 M94	K48-L61 HydrophobicContact CB-CD1 4.3Å; K48-L61 HydrophobicContact CD-CD1 3.84Å; K48-L61 HydrophobicContact CG-CD1 3.86Å; E50-L61 HydrophobicContact CB-CB 4.24Å; E50-L61 HydrophobicContact CB-CD2 4.22Å; E50-L61 PolarHBondContact OE2-N 3.45Å; E50-L61 VanDerWaalsContact OE2-N 3.11Å; L61-V63 VanDerWaalsContact C-N 3.34Å; L61-V63 PolarHBondContact O-N 2.96Å; L61-E64 PolarHBondContact O-N 3Å; L61-V65 WeakPolarHBondContact O-CG2 3.47Å; L61-V65 PolarHBondContact O-N 3.35Å; L61-N92 HydrophobicContact CD2-CB 3.8Å; L61-N92 WeakPolarHBondContact CD2-O 3.28Å; L61-M94 HydrophobicContact CD1-CG 3.71Å; L61-M94 HydrophobicContact CD1-SD 3.56Å; L61-M94 VanDerWaalsContact CD1-SD 3.56Å; L61-M94 HydrophobicContact CD2-CG 4.36Å; L61-M94 HydrophobicContact CG-CB 4.49Å; L61-M94 HydrophobicContact CG-CG 4.09Å; L61-M94 HydrophobicContact CG-SD 4.15Å
62	K	91.7	Very high	90	Very high	140 Å²	140	56.6 Å²	56.6	61%	0.609	30%	0.295	S	S	*	.	H	α-helix	trans	-64.1	-38.2	175.1	-69.6	-172.2	176.6	-172.4	0	112.5	M60 A66	M60-K62 PolarHBondContact O-N 3.24Å; M60-K62 VanDerWaalsContact O-N 3.12Å; K62-A66 WeakPolarHBondContact O-CB 3.49Å; K62-A66 PolarHBondContact O-N 3.21Å; K62-A66 VanDerWaalsContact O-N 3.13Å
63	V	92.3	Very high	90.4	Very high	61 Å²	61	55.9 Å²	55.9	37%	0.37	31%	0.309	S	S	.	.	H	α-helix	trans	-66.8	-45.5	176	178.3	0	0	0	0	109.4	M60 L61 V65 A66 V67	M60-V63 WeakPolarHBondContact O-CA 3.39Å; M60-V63 WeakPolarHBondContact O-CB 3.45Å; M60-V63 PolarHBondContact O-N 3.43Å; L61-V63 VanDerWaalsContact C-N 3.34Å; L61-V63 PolarHBondContact O-N 2.96Å; V63-V65 PolarHBondContact O-N 3.24Å; V63-A66 PolarHBondContact O-N 3.05Å; V63-V67 HydrophobicContact CG1-CG2 4.38Å; V63-V67 VanDerWaalsContact O-CG2 3.3Å; V63-V67 WeakPolarHBondContact O-CG2 3.18Å; V63-V67 PolarHBondContact O-N 3.12Å
64	E	95.3	Very high	90.9	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.019	29%	0.289	C	S	.	.	H	α-helix	trans	-57.1	-51	177.5	-70.8	-178.1	-122.3	0	0	112.2	K48 M60 L61 A66 V67 M68 M94 F172 G173	K48-E64 IonicContact NZ-OE1 3.04Å; K48-E64 PolarHBondContact NZ-OE1 3.06Å; K48-E64 IonicContact NZ-OE2 3.56Å; K48-E64 PolarHBondContact NZ-OE2 2.92Å; M60-E64 PolarHBondContact O-N 2.84Å; L61-E64 PolarHBondContact O-N 3Å; E64-A66 PolarHBondContact O-N 3.4Å; E64-V67 PolarHBondContact O-N 3.41Å; E64-M68 WeakPolarHBondContact O-CB 3.49Å; E64-M68 VanDerWaalsContact O-CG 3.27Å; E64-M68 WeakPolarHBondContact O-CG 3.28Å; E64-M68 PolarHBondContact O-N 2.93Å; E64-M94 HydrophobicContact CB-SD 4.05Å; E64-F172 HydrophobicContact CB-CB 4.44Å; E64-F172 VanDerWaalsContact CG-C 3.41Å; E64-F172 HydrophobicContact CG-CB 4.07Å; E64-G173 VanDerWaalsContact CG-CA 3.46Å
65	V	96.7	Very high	91.6	Very high	16 Å²	16	62.7 Å²	62.7	10%	0.097	32%	0.32	C	S	.	.	H	α-helix	trans	-57.8	-47.5	178.5	167	0	0	0	0	111.1	L61 V63 V67 M68 I69 L82 H85 M94	L61-V65 WeakPolarHBondContact O-CG2 3.47Å; L61-V65 PolarHBondContact O-N 3.35Å; V63-V65 PolarHBondContact O-N 3.24Å; V65-V67 PolarHBondContact O-N 3.35Å; V65-M68 PolarHBondContact O-N 3.24Å; V65-I69 HydrophobicContact CG1-CD1 3.76Å; V65-I69 HydrophobicContact CG1-CG1 4.46Å; V65-I69 VanDerWaalsContact O-CG1 3.27Å; V65-I69 WeakPolarHBondContact O-CG1 3.33Å; V65-I69 PolarHBondContact O-N 3.42Å; V65-L82 HydrophobicContact CG1-CD2 3.95Å; V65-L82 HydrophobicContact CG2-CD1 4.35Å; V65-H85 HydrophobicContact CG1-CB 4.27Å; V65-H85 HydrophobicContact CG2-CB 3.89Å; V65-M94 HydrophobicContact CG2-CB 3.88Å; V65-M94 HydrophobicContact CG2-SD 4.46Å
66	A	96.2	Very high	92.2	Very high	58 Å²	58	60.3 Å²	60.3	48%	0.479	30%	0.303	S	S	.	.	H	α-helix	trans	-61.2	-44.1	-179.8	0	0	0	0	0	112.4	K62 V63 E64 E70	K62-A66 WeakPolarHBondContact O-CB 3.49Å; K62-A66 PolarHBondContact O-N 3.21Å; K62-A66 VanDerWaalsContact O-N 3.13Å; V63-A66 PolarHBondContact O-N 3.05Å; E64-A66 PolarHBondContact O-N 3.4Å; A66-E70 PolarHBondContact O-N 3.4Å
67	V	97	Very high	92.7	Very high	5 Å²	5	64.2 Å²	64.2	3%	0.03	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-48.4	176.8	171.5	0	0	0	0	110.4	V63 E64 V65 I69 E70 L71 F145 F172 T175	V63-V67 HydrophobicContact CG1-CG2 4.38Å; V63-V67 VanDerWaalsContact O-CG2 3.3Å; V63-V67 WeakPolarHBondContact O-CG2 3.18Å; V63-V67 PolarHBondContact O-N 3.12Å; E64-V67 PolarHBondContact O-N 3.41Å; V65-V67 PolarHBondContact O-N 3.35Å; V67-I69 VanDerWaalsContact C-N 3.34Å; V67-I69 PolarHBondContact O-N 3.29Å; V67-E70 PolarHBondContact O-N 3.16Å; V67-E70 VanDerWaalsContact O-N 3.12Å; V67-L71 HydrophobicContact CG1-CD1 3.75Å; V67-L71 HydrophobicContact CG1-CG 4.08Å; V67-L71 WeakPolarHBondContact O-CG 3.38Å; V67-L71 PolarHBondContact O-N 2.97Å; V67-F145 HydrophobicContact CG1-CD2 4.4Å; V67-F145 HydrophobicContact CG1-CE2 4.46Å; V67-F145 HydrophobicContact CG2-CD1 4.18Å; V67-F145 HydrophobicContact CG2-CE1 3.84Å; V67-F145 HydrophobicContact CG2-CZ 4.1Å; V67-F172 HydrophobicContact CB-CB 4.22Å; V67-F172 HydrophobicContact CG1-CB 4.03Å; V67-F172 HydrophobicContact CG1-CD1 3.86Å; V67-F172 HydrophobicContact CG1-CG 3.93Å; V67-T175 HydrophobicContact CB-CG2 4.38Å; V67-T175 HydrophobicContact CG1-CG2 3.89Å; V67-T175 HydrophobicContact CG2-CG2 3.57Å
68	M	97.6	Very high	93.5	Very high	3 Å²	3	61.7 Å²	61.7	2%	0.015	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-33.3	-176.2	-69.6	173	65	0	0	113.1	E64 V65 E70 R72 V80 L82 M94 M96 F172	E64-M68 WeakPolarHBondContact O-CB 3.49Å; E64-M68 VanDerWaalsContact O-CG 3.27Å; E64-M68 WeakPolarHBondContact O-CG 3.28Å; E64-M68 PolarHBondContact O-N 2.93Å; V65-M68 PolarHBondContact O-N 3.24Å; M68-E70 VanDerWaalsContact C-N 3.33Å; M68-R72 VanDerWaalsContact O-CB 3.25Å; M68-R72 WeakPolarHBondContact O-CB 3.36Å; M68-R72 PolarHBondContact O-N 3.14Å; M68-V80 HydrophobicContact CE-CG2 3.99Å; M68-V80 WeakPolarHBondContact CE-O 3.25Å; M68-L82 HydrophobicContact CB-CB 3.94Å; M68-L82 HydrophobicContact CE-CB 3.89Å; M68-L82 HydrophobicContact CE-CD1 4.31Å; M68-M94 HydrophobicContact CE-CE 3.56Å; M68-M94 HydrophobicContact SD-CE 3.22Å; M68-M94 WeakPolarHBondContact SD-CE 3.21Å; M68-M96 HydrophobicContact CE-CB 3.76Å; M68-M96 HydrophobicContact CE-SD 4.28Å; M68-F172 HydrophobicContact CG-CD2 3.5Å; M68-F172 VanDerWaalsContact CG-CD2 3.5Å; M68-F172 HydrophobicContact CG-CE2 3.78Å; M68-F172 HydrophobicContact CG-CG 4.41Å; M68-F172 HydrophobicContact SD-CD2 3.81Å; M68-F172 HydrophobicContact SD-CE2 4.18Å
69	I	97.2	Very high	94.3	Very high	84 Å²	84	57 Å²	57	43%	0.431	28%	0.282	S	S	.	.	H	α-helix	trans	-59	-46.9	171	-72.3	167.3	0	0	0	110.2	V65 V67 R72 A73 L82	V65-I69 HydrophobicContact CG1-CD1 3.76Å; V65-I69 HydrophobicContact CG1-CG1 4.46Å; V65-I69 VanDerWaalsContact O-CG1 3.27Å; V65-I69 WeakPolarHBondContact O-CG1 3.33Å; V65-I69 PolarHBondContact O-N 3.42Å; V67-I69 VanDerWaalsContact C-N 3.34Å; V67-I69 PolarHBondContact O-N 3.29Å; I69-R72 PolarHBondContact O-N 3.27Å; I69-A73 WeakPolarHBondContact O-CB 3.31Å; I69-A73 PolarHBondContact O-N 3.32Å; I69-L82 HydrophobicContact CD1-CD2 4.26Å; I69-L82 HydrophobicContact CG1-CD2 3.69Å
70	E	96.6	Very high	94.9	Very high	35 Å²	35	53.2 Å²	53.2	16%	0.164	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-42.1	-179.5	-171.8	176.7	160.4	0	0	112.5	A66 V67 M68 R72 A73 K74 F145 R177	A66-E70 PolarHBondContact O-N 3.4Å; V67-E70 PolarHBondContact O-N 3.16Å; V67-E70 VanDerWaalsContact O-N 3.12Å; M68-E70 VanDerWaalsContact C-N 3.33Å; E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 3.02Å; E70-A73 PolarHBondContact O-N 2.84Å; E70-K74 HydrophobicContact CG-CD 4.18Å; E70-K74 WeakPolarHBondContact O-CB 3.31Å; E70-K74 WeakPolarHBondContact O-CG 3.29Å; E70-K74 PolarHBondContact O-N 3.25Å; E70-K74 WeakPolarHBondContact OE1-CE 3.33Å; E70-K74 IonicContact OE1-NZ 2.9Å; E70-K74 PolarHBondContact OE1-NZ 2.82Å; E70-F145 HydrophobicContact CB-CE2 4.26Å; E70-F145 VanDerWaalsContact CD-CE2 3.44Å; E70-F145 HydrophobicContact CG-CE2 4.18Å; E70-F145 VanDerWaalsContact OE2-CE2 3.25Å; E70-F145 WeakPolarHBondContact OE2-CE2 3.43Å; E70-F145 WeakPolarHBondContact OE2-CZ 3.23Å; E70-R177 IonicContact OE1-CZ 3.83Å; E70-R177 IonicContact OE1-NH1 2.77Å; E70-R177 PolarHBondContact OE1-NH1 3.21Å; E70-R177 IonicContact OE1-NH2 3.05Å; E70-R177 PolarHBondContact OE1-NH2 3.15Å; E70-R177 IonicContact OE2-CZ 3.86Å; E70-R177 IonicContact OE2-NH2 2.69Å; E70-R177 PolarHBondContact OE2-NH2 2.82Å
71	L	96.8	Very high	95.3	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-41.2	175.9	-66.5	178.6	0	0	0	111.6	V67 K74 K75 V76 C79 L140 C143 F145 F172	V67-L71 HydrophobicContact CG1-CD1 3.75Å; V67-L71 HydrophobicContact CG1-CG 4.08Å; V67-L71 WeakPolarHBondContact O-CG 3.38Å; V67-L71 PolarHBondContact O-N 2.97Å; L71-K74 CarbonylContact O-C 3.46Å; L71-K74 PolarHBondContact O-N 3.46Å; L71-K75 PolarHBondContact O-N 2.98Å; L71-K75 VanDerWaalsContact O-N 3.07Å; L71-V76 HydrophobicContact CB-CB 4.33Å; L71-V76 HydrophobicContact CB-CG2 4.46Å; L71-V76 HydrophobicContact CD2-CB 4.47Å; L71-V76 HydrophobicContact CD2-CG2 4.01Å; L71-V76 PolarHBondContact O-N 3.25Å; L71-C79 HydrophobicContact CD1-CB 4.19Å; L71-L140 HydrophobicContact CD1-CD1 4.04Å; L71-L140 HydrophobicContact CD2-CD1 3.95Å; L71-C143 HydrophobicContact CD2-CB 3.78Å; L71-F145 HydrophobicContact CD2-CD2 4.5Å; L71-F172 HydrophobicContact CD1-CD1 4.28Å; L71-F172 HydrophobicContact CD1-CE1 3.73Å; L71-F172 HydrophobicContact CD1-CE2 4.38Å; L71-F172 HydrophobicContact CD1-CZ 3.8Å
72	R	95.7	Very high	95.5	Very high	108 Å²	108	53.7 Å²	53.7	41%	0.408	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-45.4	174.4	-176.4	177.8	178.8	-174.3	-3.2	111.5	M68 I69 E70 K74 K75 L82	M68-R72 VanDerWaalsContact O-CB 3.25Å; M68-R72 WeakPolarHBondContact O-CB 3.36Å; M68-R72 PolarHBondContact O-N 3.14Å; I69-R72 PolarHBondContact O-N 3.27Å; E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 3.02Å; R72-K74 VanDerWaalsContact C-N 3.26Å; R72-K74 PolarHBondContact O-N 2.93Å; R72-K75 PolarHBondContact O-N 3.5Å; R72-L82 PolarHBondContact NH1-O 2.89Å
73	A	96.1	Very high	95.7	Very high	79 Å²	79	50.1 Å²	50.1	65%	0.653	26%	0.255	S	S	*	.	H	α-helix	trans	-60.8	-36.5	176.6	0	0	0	0	0	112.2	I69 E70 K75	I69-A73 WeakPolarHBondContact O-CB 3.31Å; I69-A73 PolarHBondContact O-N 3.32Å; E70-A73 PolarHBondContact O-N 2.84Å; A73-K75 VanDerWaalsContact C-N 3.26Å; A73-K75 PolarHBondContact O-N 3.25Å
74	K	95.5	Very high	95.9	Very high	86 Å²	86	48.9 Å²	48.9	37%	0.374	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	4	174.6	-68.8	178.7	175.7	171.2	0	113.9	E70 L71 R72 V76 C143 E181	E70-K74 HydrophobicContact CG-CD 4.18Å; E70-K74 WeakPolarHBondContact O-CB 3.31Å; E70-K74 WeakPolarHBondContact O-CG 3.29Å; E70-K74 PolarHBondContact O-N 3.25Å; E70-K74 WeakPolarHBondContact OE1-CE 3.33Å; E70-K74 IonicContact OE1-NZ 2.9Å; E70-K74 PolarHBondContact OE1-NZ 2.82Å; L71-K74 CarbonylContact O-C 3.46Å; L71-K74 PolarHBondContact O-N 3.46Å; R72-K74 VanDerWaalsContact C-N 3.26Å; R72-K74 PolarHBondContact O-N 2.93Å; K74-V76 VanDerWaalsContact C-N 3.31Å; K74-V76 HydrophobicContact CB-CG2 4.37Å; K74-V76 PolarHBondContact O-N 3.12Å; K74-C143 HydrophobicContact CD-CB 3.95Å; K74-C143 VanDerWaalsContact CD-SG 3.52Å; K74-E181 IonicContact NZ-OE2 3.45Å
75	K	95.4	Very high	95.9	Very high	178 Å²	178	53.2 Å²	53.2	77%	0.774	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	36	177	-55.5	-179.6	-178.9	178.8	0	114.1	L71 R72 A73 K77	L71-K75 PolarHBondContact O-N 2.98Å; L71-K75 VanDerWaalsContact O-N 3.07Å; R72-K75 PolarHBondContact O-N 3.5Å; A73-K75 VanDerWaalsContact C-N 3.26Å; A73-K75 PolarHBondContact O-N 3.25Å; K75-K77 PolarHBondContact O-N 3.35Å
76	V	95.5	Very high	95.8	Very high	8 Å²	8	53.5 Å²	53.5	5%	0.048	27%	0.273	C	S	.	.			trans	-71	120.7	174.7	-179.6	0	0	0	0	109.4	L71 K74 C79 Q81 D139 C143	L71-V76 HydrophobicContact CB-CB 4.33Å; L71-V76 HydrophobicContact CB-CG2 4.46Å; L71-V76 HydrophobicContact CD2-CB 4.47Å; L71-V76 HydrophobicContact CD2-CG2 4.01Å; L71-V76 PolarHBondContact O-N 3.25Å; K74-V76 VanDerWaalsContact C-N 3.31Å; K74-V76 HydrophobicContact CB-CG2 4.37Å; K74-V76 PolarHBondContact O-N 3.12Å; V76-C79 HydrophobicContact CG1-CB 4.31Å; V76-Q81 PolarHBondContact O-NE2 3Å; V76-D139 HydrophobicContact CG1-CB 3.97Å; V76-C143 VanDerWaalsContact CG2-SG 3.52Å
77	K	92.4	Very high	95.6	Very high	166 Å²	166	54 Å²	54	72%	0.722	27%	0.272	S	S	*	.	S	Bend	trans	-85.9	-40.7	-170.9	-64.6	-177.9	-179.7	179.5	0	113.6	K75 C79	K75-K77 PolarHBondContact O-N 3.35Å; K77-C79 PolarHBondContact O-N 3.4Å; K77-C79 VanDerWaalsContact O-N 3.14Å
78	N	95.2	Very high	95.3	Very high	41 Å²	41	55.3 Å²	55.3	22%	0.219	28%	0.28	C	S	.	.	S	Bend	trans	-85.6	24.6	-172.4	-66.5	72.1	0	0	0	113.9	T136 I167 Y168 L169	N78-T136 HydrophobicContact CB-CG2 3.88Å; N78-T136 VanDerWaalsContact CB-OG1 3.31Å; N78-T136 WeakPolarHBondContact CB-OG1 3.41Å; N78-T136 WeakPolarHBondContact O-CG2 3.29Å; N78-I167 PolarHBondContact ND2-O 2.8Å; N78-Y168 WeakPolarHBondContact O-CA 3.28Å; N78-L169 PolarHBondContact O-N 3.46Å
79	C	96.1	Very high	94.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-120	147.5	171.3	-66.2	0	0	0	0	108.5	L71 V76 K77 Q81 F172	L71-C79 HydrophobicContact CD1-CB 4.19Å; V76-C79 HydrophobicContact CG1-CB 4.31Å; K77-C79 PolarHBondContact O-N 3.4Å; K77-C79 VanDerWaalsContact O-N 3.14Å; C79-Q81 PolarHBondContact O-N 3.24Å; C79-Q81 PolarHBondContact O-NE2 2.75Å; C79-F172 HydrophobicContact CB-CZ 3.8Å
80	V	95.5	Very high	94.6	Very high	3 Å²	3	61.4 Å²	61.4	2%	0.018	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.4	140.5	170.7	-73.4	0	0	0	0	110.6	M68 M96 V99 L169 L170 F172	M68-V80 HydrophobicContact CE-CG2 3.99Å; M68-V80 WeakPolarHBondContact CE-O 3.25Å; V80-M96 HydrophobicContact CB-SD 4.46Å; V80-M96 HydrophobicContact CG2-SD 3.96Å; V80-V99 HydrophobicContact CG1-CG1 3.63Å; V80-L169 PolarHBondContact N-O 3.28Å; V80-L170 HydrophobicContact CB-CD2 4.41Å; V80-L170 HydrophobicContact CG1-CD2 3.29Å; V80-L170 HydrophobicContact CG2-CD2 4.28Å; V80-F172 HydrophobicContact CG2-CE2 3.97Å
81	Q	94.8	Very high	94.3	Very high	44 Å²	44	60.5 Å²	60.5	21%	0.206	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-98.6	138.2	-174.2	-58.9	-62.8	-50.4	0	0	110.4	V76 C79 F83 M96 S97	V76-Q81 PolarHBondContact O-NE2 3Å; C79-Q81 PolarHBondContact O-N 3.24Å; C79-Q81 PolarHBondContact O-NE2 2.75Å; Q81-F83 HydrophobicContact CB-CE1 4.12Å; Q81-M96 CarbonylContact O-C 3.6Å; Q81-M96 WeakPolarHBondContact O-CA 3.48Å; Q81-M96 VanDerWaalsContact O-CB 3.29Å; Q81-M96 WeakPolarHBondContact O-CB 3.43Å; Q81-S97 PolarHBondContact N-OG 3.43Å; Q81-S97 PolarHBondContact O-N 2.85Å
82	L	96.4	Very high	94.2	Very high	7 Å²	7	61 Å²	61	4%	0.037	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.7	173.5	-172.1	72.1	0	0	0	110.2	V65 M68 I69 R72 D84 M94	V65-L82 HydrophobicContact CG1-CD2 3.95Å; V65-L82 HydrophobicContact CG2-CD1 4.35Å; M68-L82 HydrophobicContact CB-CB 3.94Å; M68-L82 HydrophobicContact CE-CB 3.89Å; M68-L82 HydrophobicContact CE-CD1 4.31Å; I69-L82 HydrophobicContact CD1-CD2 4.26Å; I69-L82 HydrophobicContact CG1-CD2 3.69Å; R72-L82 PolarHBondContact NH1-O 2.89Å; L82-D84 WeakPolarHBondContact CD1-O 3.48Å; L82-M94 HydrophobicContact CD1-CB 3.91Å; L82-M94 HydrophobicContact CD1-CE 3.92Å
83	F	95.2	Very high	94.1	Very high	65 Å²	65	56.6 Å²	56.6	29%	0.285	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-42.1	174.5	-60.8	-26.8	0	0	0	112.2	W19 A45 Q81 V95	W19-F83 HydrophobicContact CH2-CB 4.31Å; W19-F83 HydrophobicContact CH2-CD2 4.27Å; W19-F83 HydrophobicContact CZ2-CB 4.15Å; A45-F83 HydrophobicContact CB-CD2 3.87Å; A45-F83 HydrophobicContact CB-CE2 4.06Å; Q81-F83 HydrophobicContact CB-CE1 4.12Å; F83-V95 HydrophobicContact CB-CG1 4.41Å; F83-V95 HydrophobicContact CD2-CG1 4.44Å; F83-V95 PolarHBondContact N-O 3.36Å
84	D	96.5	Very high	94.2	Very high	35 Å²	35	52.9 Å²	52.9	19%	0.187	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	161.4	-175.6	-158.1	-5.6	0	0	0	110.6	W19 L82 M94 V95	W19-D84 HydrophobicContact CZ2-CB 4.22Å; W19-D84 PolarHBondContact NE1-OD2 3.34Å; L82-D84 WeakPolarHBondContact CD1-O 3.48Å; D84-M94 CarbonylContact O-C 3.58Å; D84-M94 WeakPolarHBondContact O-CA 3.07Å; D84-V95 HydrophobicContact CB-CB 3.9Å; D84-V95 HydrophobicContact CB-CG2 4.07Å; D84-V95 PolarHBondContact N-O 3.44Å; D84-V95 VanDerWaalsContact N-O 3.15Å; D84-V95 PolarHBondContact O-N 2.97Å
85	H	96.6	Very high	94.3	Very high	94 Å²	94	48.8 Å²	48.8	44%	0.435	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	155.5	170.9	67.4	83.2	0	0	0	111.1	V65 Y93 M94	V65-H85 HydrophobicContact CG1-CB 4.27Å; V65-H85 HydrophobicContact CG2-CB 3.89Å; H85-Y93 WeakPolarHBondContact CA-O 3.41Å; H85-M94 HydrophobicContact CB-CB 4.28Å
86	G	94.6	Very high	94.3	Very high	23 Å²	23	41.2 Å²	41.2	24%	0.237	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	-162.1	177.5	0	0	0	0	0	113	Y93	G86-Y93 VanDerWaalsContact C-CE1 3.42Å; G86-Y93 PolarHBondContact N-O 3.47Å; G86-Y93 PolarHBondContact O-N 2.68Å
87	C	91.9	Very high	94.3	Very high	68 Å²	68	41.9 Å²	41.9	46%	0.459	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	153.1	176.4	58.1	0	0	0	0	111.9	R52 F91 N92	R52-C87 PolarHBondContact NH2-SG 2.79Å; C87-F91 WeakPolarHBondContact CA-O 3.45Å; C87-N92 WeakPolarHBondContact CB-OD1 3.24Å
88	T	90.9	Very high	94.5	Very high	32 Å²	32	35 Å²	35	20%	0.196	20%	0.196	C	C	.	.			trans	-113.2	173.4	166.7	70.1	0	0	0	0	108.2	R52 I90 F91	R52-T88 WeakPolarHBondContact CD-O 3.45Å; R52-T88 PolarHBondContact NE-O 2.89Å; T88-I90 PolarHBondContact O-N 2.78Å; T88-I90 VanDerWaalsContact O-N 3.13Å; T88-I90 WeakPolarHBondContact OG1-CG1 3.32Å; T88-I90 PolarHBondContact OG1-N 3.12Å; T88-F91 HydrophobicContact CG2-CD2 4.14Å; T88-F91 HydrophobicContact CG2-CE1 4.09Å; T88-F91 HydrophobicContact CG2-CE2 3.52Å; T88-F91 HydrophobicContact CG2-CZ 3.48Å; T88-F91 VanDerWaalsContact CG2-CZ 3.48Å; T88-F91 PolarHBondContact N-O 3.42Å; T88-F91 WeakPolarHBondContact OG1-CD1 3.46Å; T88-F91 WeakPolarHBondContact OG1-CE1 3.38Å; T88-F91 WeakPolarHBondContact OG1-CG 3.36Å; T88-F91 PolarHBondContact OG1-N 2.9Å; T88-F91 PolarHBondContact OG1-O 2.96Å
89	P	89.2	Confident	94.5	Very high	125 Å²	125	34.5 Å²	34.5	81%	0.812	20%	0.195	S	C	*	.	S	Bend	trans	-56	-26.7	173	-28.2	37.2	0	0	0	113.7
90	I	89.2	Confident	94.4	Very high	91 Å²	91	35.8 Å²	35.8	47%	0.467	21%	0.207	S	C	.	.	S	Bend	trans	-109.5	-25.9	-170.4	52.4	161.9	0	0	0	114.5	F8 R52 T88	F8-I90 HydrophobicContact CE1-CB 4.28Å; R52-I90 PolarHBondContact N-O 3.16Å; T88-I90 PolarHBondContact O-N 2.78Å; T88-I90 VanDerWaalsContact O-N 3.13Å; T88-I90 WeakPolarHBondContact OG1-CG1 3.32Å; T88-I90 PolarHBondContact OG1-N 3.12Å
91	F	91.6	Very high	94.3	Very high	15 Å²	15	38.7 Å²	38.7	7%	0.066	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	158.6	-179.3	60.7	-101.8	0	0	0	112.8	I10 I16 V49 E50 C87 T88 Y93	I10-F91 HydrophobicContact CD1-CE1 3.86Å; I10-F91 HydrophobicContact CD1-CZ 3.85Å; I16-F91 HydrophobicContact CD1-CE2 4.14Å; I16-F91 HydrophobicContact CD1-CZ 3.69Å; I16-F91 HydrophobicContact CG1-CZ 4.28Å; V49-F91 HydrophobicContact CB-CD2 4.1Å; V49-F91 HydrophobicContact CB-CG 4.44Å; V49-F91 HydrophobicContact CG1-CD2 4.05Å; V49-F91 HydrophobicContact CG1-CE2 4.09Å; E50-F91 CarbonylContact O-C 3.58Å; E50-F91 VanDerWaalsContact O-CA 3.25Å; E50-F91 WeakPolarHBondContact O-CA 3.41Å; E50-F91 VanDerWaalsContact O-CB 3.28Å; E50-F91 WeakPolarHBondContact O-CB 3.44Å; C87-F91 WeakPolarHBondContact CA-O 3.45Å; T88-F91 HydrophobicContact CG2-CD2 4.14Å; T88-F91 HydrophobicContact CG2-CE1 4.09Å; T88-F91 HydrophobicContact CG2-CE2 3.52Å; T88-F91 HydrophobicContact CG2-CZ 3.48Å; T88-F91 VanDerWaalsContact CG2-CZ 3.48Å; T88-F91 PolarHBondContact N-O 3.42Å; T88-F91 WeakPolarHBondContact OG1-CD1 3.46Å; T88-F91 WeakPolarHBondContact OG1-CE1 3.38Å; T88-F91 WeakPolarHBondContact OG1-CG 3.36Å; T88-F91 PolarHBondContact OG1-N 2.9Å; T88-F91 PolarHBondContact OG1-O 2.96Å; F91-Y93 HydrophobicContact CD2-CD1 4.48Å; F91-Y93 HydrophobicContact CE2-CD1 4.07Å; F91-Y93 HydrophobicContact CE2-CG 4.45Å
92	N	93.5	Very high	94.3	Very high	12 Å²	12	38.7 Å²	38.7	6%	0.064	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	150.2	162.4	-56.8	-49	0	0	0	108.6	V49 E50 R52 L61 C87	V49-N92 CarbonylContact C-O 3.51Å; V49-N92 WeakPolarHBondContact CA-O 3.16Å; E50-N92 PolarHBondContact N-O 2.84Å; E50-N92 PolarHBondContact O-N 2.91Å; R52-N92 PolarHBondContact NE-OD1 2.73Å; R52-N92 PolarHBondContact NH2-OD1 2.86Å; R52-N92 VanDerWaalsContact NH2-OD1 3.13Å; L61-N92 HydrophobicContact CD2-CB 3.8Å; L61-N92 WeakPolarHBondContact CD2-O 3.28Å; C87-N92 WeakPolarHBondContact CB-OD1 3.24Å
93	Y	95.2	Very high	94.4	Very high	17 Å²	17	38.3 Å²	38.3	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	155.3	176.2	73	-89.6	0	0	0	112	I16 M47 K48 H85 G86 F91 V95	I16-Y93 HydrophobicContact CG2-CD1 4.06Å; I16-Y93 HydrophobicContact CG2-CE1 3.86Å; I16-Y93 HydrophobicContact CG2-CE2 4.49Å; I16-Y93 HydrophobicContact CG2-CG 4.45Å; M47-Y93 HydrophobicContact CE-CD2 4.07Å; M47-Y93 HydrophobicContact CE-CE2 4.47Å; M47-Y93 HydrophobicContact SD-CD2 4.42Å; K48-Y93 VanDerWaalsContact O-CA 3.29Å; K48-Y93 WeakPolarHBondContact O-CA 3.37Å; H85-Y93 WeakPolarHBondContact CA-O 3.41Å; G86-Y93 VanDerWaalsContact C-CE1 3.42Å; G86-Y93 PolarHBondContact N-O 3.47Å; G86-Y93 PolarHBondContact O-N 2.68Å; F91-Y93 HydrophobicContact CD2-CD1 4.48Å; F91-Y93 HydrophobicContact CE2-CD1 4.07Å; F91-Y93 HydrophobicContact CE2-CG 4.45Å; Y93-V95 HydrophobicContact CD2-CG2 4.1Å; Y93-V95 HydrophobicContact CE2-CG2 4.27Å
94	M	96.6	Very high	94.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147.5	164.7	62	178	-76.5	0	0	108.7	M47 K48 L61 E64 V65 M68 L82 D84 H85 M96	M47-M94 CarbonylContact C-O 3.5Å; M47-M94 VanDerWaalsContact CA-O 3.27Å; M47-M94 WeakPolarHBondContact CA-O 3.33Å; K48-M94 HydrophobicContact CB-CG 3.88Å; K48-M94 HydrophobicContact CB-SD 4.41Å; K48-M94 HydrophobicContact CD-SD 4.4Å; K48-M94 PolarHBondContact N-O 3.28Å; K48-M94 PolarHBondContact O-N 2.88Å; L61-M94 HydrophobicContact CD1-CG 3.71Å; L61-M94 HydrophobicContact CD1-SD 3.56Å; L61-M94 VanDerWaalsContact CD1-SD 3.56Å; L61-M94 HydrophobicContact CD2-CG 4.36Å; L61-M94 HydrophobicContact CG-CB 4.49Å; L61-M94 HydrophobicContact CG-CG 4.09Å; L61-M94 HydrophobicContact CG-SD 4.15Å; E64-M94 HydrophobicContact CB-SD 4.05Å; V65-M94 HydrophobicContact CG2-CB 3.88Å; V65-M94 HydrophobicContact CG2-SD 4.46Å; M68-M94 HydrophobicContact CE-CE 3.56Å; M68-M94 HydrophobicContact SD-CE 3.22Å; M68-M94 WeakPolarHBondContact SD-CE 3.21Å; L82-M94 HydrophobicContact CD1-CB 3.91Å; L82-M94 HydrophobicContact CD1-CE 3.92Å; D84-M94 CarbonylContact O-C 3.58Å; D84-M94 WeakPolarHBondContact O-CA 3.07Å; H85-M94 HydrophobicContact CB-CB 4.28Å; M94-M96 HydrophobicContact CE-CB 4.04Å; M94-M96 HydrophobicContact CE-CE 3.49Å; M94-M96 VanDerWaalsContact CE-CE 3.49Å; M94-M96 HydrophobicContact CE-CG 4.2Å; M94-M96 HydrophobicContact CE-SD 3.56Å; M94-M96 VanDerWaalsContact CE-SD 3.56Å; M94-M96 HydrophobicContact CG-CE 4.2Å; M94-M96 HydrophobicContact SD-CE 3.97Å
95	V	97.5	Very high	94.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.7	174	-172.8	0	0	0	0	108.3	W19 V36 A45 A46 M47 F83 D84 Y93	W19-V95 HydrophobicContact CD2-CB 4.44Å; W19-V95 HydrophobicContact CD2-CG1 3.83Å; W19-V95 HydrophobicContact CD2-CG2 4.13Å; W19-V95 HydrophobicContact CE3-CG1 3.95Å; W19-V95 HydrophobicContact CG-CG2 3.99Å; W19-V95 HydrophobicContact CH2-CG1 3.83Å; W19-V95 HydrophobicContact CZ2-CB 4.25Å; W19-V95 HydrophobicContact CZ2-CG1 3.72Å; W19-V95 HydrophobicContact CZ3-CG1 3.94Å; V36-V95 HydrophobicContact CG2-CG1 3.96Å; A45-V95 HydrophobicContact CB-CG1 3.54Å; A46-V95 CarbonylContact O-C 3.49Å; A46-V95 WeakPolarHBondContact O-CA 3.49Å; M47-V95 HydrophobicContact CB-CG2 4.27Å; M47-V95 HydrophobicContact CE-CG2 3.59Å; M47-V95 HydrophobicContact CG-CG2 4.17Å; F83-V95 HydrophobicContact CB-CG1 4.41Å; F83-V95 HydrophobicContact CD2-CG1 4.44Å; F83-V95 PolarHBondContact N-O 3.36Å; D84-V95 HydrophobicContact CB-CB 3.9Å; D84-V95 HydrophobicContact CB-CG2 4.07Å; D84-V95 PolarHBondContact N-O 3.44Å; D84-V95 VanDerWaalsContact N-O 3.15Å; D84-V95 PolarHBondContact O-N 2.97Å; Y93-V95 HydrophobicContact CD2-CG2 4.1Å; Y93-V95 HydrophobicContact CE2-CG2 4.27Å
96	M	97	Very high	94.3	Very high	20 Å²	20	34.9 Å²	34.9	10%	0.099	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	173.4	-174.6	63.9	-175.5	124.1	0	0	111.9	A45 A46 K48 M68 V80 Q81 M94 L98	A45-M96 WeakPolarHBondContact CB-O 3.31Å; A46-M96 HydrophobicContact CB-CG 4.22Å; A46-M96 PolarHBondContact N-O 3.07Å; A46-M96 PolarHBondContact O-N 2.99Å; K48-M96 HydrophobicContact CB-CE 3.52Å; K48-M96 HydrophobicContact CD-CE 4.02Å; K48-M96 HydrophobicContact CG-CE 4.41Å; M68-M96 HydrophobicContact CE-CB 3.76Å; M68-M96 HydrophobicContact CE-SD 4.28Å; V80-M96 HydrophobicContact CB-SD 4.46Å; V80-M96 HydrophobicContact CG2-SD 3.96Å; Q81-M96 CarbonylContact O-C 3.6Å; Q81-M96 WeakPolarHBondContact O-CA 3.48Å; Q81-M96 VanDerWaalsContact O-CB 3.29Å; Q81-M96 WeakPolarHBondContact O-CB 3.43Å; M94-M96 HydrophobicContact CE-CB 4.04Å; M94-M96 HydrophobicContact CE-CE 3.49Å; M94-M96 VanDerWaalsContact CE-CE 3.49Å; M94-M96 HydrophobicContact CE-CG 4.2Å; M94-M96 HydrophobicContact CE-SD 3.56Å; M94-M96 VanDerWaalsContact CE-SD 3.56Å; M94-M96 HydrophobicContact CG-CE 4.2Å; M94-M96 HydrophobicContact SD-CE 3.97Å; M96-L98 PolarHBondContact O-N 3.35Å
97	S	95.4	Very high	94.3	Very high	21 Å²	21	33.9 Å²	33.9	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-45.1	126.7	170.5	-58.3	0	0	0	0	111.5	Q81	Q81-S97 PolarHBondContact N-OG 3.43Å; Q81-S97 PolarHBondContact O-N 2.85Å
98	L	95.8	Very high	94.5	Very high	21 Å²	21	33.7 Å²	33.7	11%	0.11	19%	0.192	C	C	.	.			trans	-72.7	137.9	164	-174.5	63.6	0	0	0	108.3	L25 K35 D44 A46 M96 C159 T331	L25-L98 HydrophobicContact CD1-CD1 3.67Å; K35-L98 HydrophobicContact CD-CD2 4.23Å; K35-L98 HydrophobicContact CG-CD2 4.22Å; D44-L98 HydrophobicContact CB-CD2 3.95Å; A46-L98 HydrophobicContact CB-CD1 4.05Å; M96-L98 PolarHBondContact O-N 3.35Å; L98-C159 PolarHBondContact O-SG 3.38Å; L98-C159 VanDerWaalsContact O-SG 3.34Å; L98-T331 HydrophobicContact CD2-CG2 4.14Å
99	V	94.7	Very high	94.6	Very high	32 Å²	32	34.2 Å²	34.2	19%	0.194	19%	0.192	C	C	.	.			trans	-127	166.4	178.9	-65.7	0	0	0	0	110.4	V80 A156 Y168 L170	V80-V99 HydrophobicContact CG1-CG1 3.63Å; V99-A156 HydrophobicContact CB-CB 4.07Å; V99-A156 HydrophobicContact CG2-CB 3.77Å; V99-Y168 HydrophobicContact CG1-CD2 3.94Å; V99-Y168 HydrophobicContact CG1-CG 4.23Å; V99-L170 HydrophobicContact CG1-CD2 4.29Å; V99-L170 HydrophobicContact CG2-CD1 4.2Å; V99-L170 HydrophobicContact CG2-CD2 3.94Å
100	G	93.5	Very high	94.8	Very high	26 Å²	26	28.3 Å²	28.3	27%	0.268	15%	0.153	S	C	.	.			trans	-80.5	-149.6	177.5	0	0	0	0	0	113	I157	G100-I157 WeakPolarHBondContact CA-O 3.36Å; G100-I157 PolarHBondContact N-O 2.91Å
101	H	93.5	Very high	95.1	Very high	64 Å²	64	24 Å²	24	30%	0.296	13%	0.132	S	C	.	.			trans	-65.4	136.4	178.4	-75.5	-81.4	0	0	0	111.4	S105 L106 K109 A156 I157	H101-S105 PolarHBondContact ND1-OG 3.12Å; H101-L106 HydrophobicContact CB-CB 4.09Å; H101-L106 HydrophobicContact CB-CD1 4.24Å; H101-K109 PolarHBondContact NE2-NZ 2.89Å; H101-A156 WeakPolarHBondContact O-CA 3.32Å; H101-I157 PolarHBondContact O-N 3.44Å; H101-I157 VanDerWaalsContact O-N 3.13Å
102	N	96.2	Very high	95.1	Very high	44 Å²	44	31 Å²	31	24%	0.235	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-70	158.6	165.6	69.4	50.6	0	0	0	111	E104 S105 L106 A153 F155 A156	N102-E104 PolarHBondContact O-N 3.01Å; N102-E104 WeakPolarHBondContact OD1-CB 3.21Å; N102-E104 PolarHBondContact OD1-N 2.75Å; N102-S105 PolarHBondContact N-OG 2.85Å; N102-S105 PolarHBondContact O-N 3.09Å; N102-S105 PolarHBondContact O-OG 3.13Å; N102-S105 WeakPolarHBondContact OD1-CB 3.48Å; N102-S105 PolarHBondContact OD1-N 2.94Å; N102-S105 PolarHBondContact OD1-OG 3.36Å; N102-L106 VanDerWaalsContact O-CB 3.23Å; N102-L106 WeakPolarHBondContact O-CB 3.24Å; N102-L106 PolarHBondContact O-N 3.02Å; N102-A153 WeakPolarHBondContact CB-O 3.48Å; N102-F155 CarbonylContact C-O 3.58Å; N102-F155 WeakPolarHBondContact CA-O 3.45Å; N102-F155 WeakPolarHBondContact CB-O 3.39Å; N102-A156 HydrophobicContact CB-CB 4.24Å
103	L	97.5	Very high	95	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-29.7	-173	-64	-178.2	0	0	0	113.2	L106 A107 I129 T133 P152 F155 I157 I167 L227	L103-L106 HydrophobicContact CD2-CD2 4.41Å; L103-A107 WeakPolarHBondContact O-CB 3.43Å; L103-A107 PolarHBondContact O-N 3.3Å; L103-I129 HydrophobicContact CD1-CD1 4.4Å; L103-I129 HydrophobicContact CD1-CG1 4.38Å; L103-I129 HydrophobicContact CD1-CG2 3.62Å; L103-I129 HydrophobicContact CD2-CD1 4.13Å; L103-I129 HydrophobicContact CD2-CG1 4.32Å; L103-T133 HydrophobicContact CD1-CG2 4.34Å; L103-P152 HydrophobicContact CB-CB 4.25Å; L103-P152 PolarHBondContact N-O 3.26Å; L103-F155 HydrophobicContact CD1-CB 3.58Å; L103-F155 HydrophobicContact CD1-CG 4.35Å; L103-F155 HydrophobicContact CG-CB 3.86Å; L103-F155 PolarHBondContact N-O 2.93Å; L103-I157 HydrophobicContact CD2-CG2 4.44Å; L103-I167 HydrophobicContact CD2-CD1 4.43Å; L103-L227 HydrophobicContact CB-CD1 4.04Å; L103-L227 HydrophobicContact CB-CD2 4.44Å; L103-L227 HydrophobicContact CD1-CD1 3.81Å
104	E	96	Very high	94.8	Very high	84 Å²	84	36.7 Å²	36.7	39%	0.393	19%	0.193	S	C	.	.	H	α-helix	trans	-65.2	-56.5	174.9	-162.6	168	-98.9	0	0	110.8	N102 L106 A107 D108 P152	N102-E104 PolarHBondContact O-N 3.01Å; N102-E104 WeakPolarHBondContact OD1-CB 3.21Å; N102-E104 PolarHBondContact OD1-N 2.75Å; E104-L106 PolarHBondContact O-N 3.4Å; E104-A107 PolarHBondContact O-N 2.88Å; E104-D108 PolarHBondContact O-N 3.29Å; E104-P152 HydrophobicContact CB-CB 3.91Å
105	S	94.9	Very high	94.6	Very high	36 Å²	36	44.1 Å²	44.1	25%	0.252	23%	0.233	S	C	.	.	H	α-helix	trans	-63.5	-31.2	179.4	72.8	0	0	0	0	112.4	H101 N102 K109	H101-S105 PolarHBondContact ND1-OG 3.12Å; N102-S105 PolarHBondContact N-OG 2.85Å; N102-S105 PolarHBondContact O-N 3.09Å; N102-S105 PolarHBondContact O-OG 3.13Å; N102-S105 WeakPolarHBondContact OD1-CB 3.48Å; N102-S105 PolarHBondContact OD1-N 2.94Å; N102-S105 PolarHBondContact OD1-OG 3.36Å; S105-K109 VanDerWaalsContact O-CB 3.27Å; S105-K109 WeakPolarHBondContact O-CB 3.33Å; S105-K109 PolarHBondContact O-N 3.35Å
106	L	95.2	Very high	94.3	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-71	-45.4	178.6	-174.1	58.2	0	0	0	111.1	H101 N102 L103 E104 K109 I110 F121 I157 W317 M321	H101-L106 HydrophobicContact CB-CB 4.09Å; H101-L106 HydrophobicContact CB-CD1 4.24Å; N102-L106 VanDerWaalsContact O-CB 3.23Å; N102-L106 WeakPolarHBondContact O-CB 3.24Å; N102-L106 PolarHBondContact O-N 3.02Å; L103-L106 HydrophobicContact CD2-CD2 4.41Å; E104-L106 PolarHBondContact O-N 3.4Å; L106-K109 PolarHBondContact O-N 2.96Å; L106-I110 HydrophobicContact CD1-CD1 3.92Å; L106-I110 HydrophobicContact CD1-CG1 4.4Å; L106-I110 HydrophobicContact CG-CD1 3.86Å; L106-I110 WeakPolarHBondContact O-CB 3.46Å; L106-I110 WeakPolarHBondContact O-CG1 3.46Å; L106-I110 PolarHBondContact O-N 2.88Å; L106-F121 HydrophobicContact CB-CZ 4.2Å; L106-F121 HydrophobicContact CD2-CE1 4.31Å; L106-F121 HydrophobicContact CD2-CZ 4.16Å; L106-F121 HydrophobicContact CG-CE1 4.13Å; L106-F121 HydrophobicContact CG-CZ 4.05Å; L106-I157 HydrophobicContact CD1-CD1 4.5Å; L106-I157 HydrophobicContact CD2-CD1 3.97Å; L106-I157 HydrophobicContact CD2-CG1 4.38Å; L106-I157 HydrophobicContact CD2-CG2 3.98Å; L106-W317 HydrophobicContact CD1-CB 3.9Å; L106-W317 HydrophobicContact CD2-CB 4Å; L106-W317 HydrophobicContact CD2-CD2 3.87Å; L106-W317 HydrophobicContact CD2-CE3 3.63Å; L106-W317 HydrophobicContact CD2-CG 4.06Å; L106-W317 HydrophobicContact CD2-CZ3 4.28Å; L106-W317 HydrophobicContact CG-CB 4.34Å; L106-M321 HydrophobicContact CD1-CE 3.61Å
107	A	96.1	Very high	93.9	Very high	3 Å²	3	57.4 Å²	57.4	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-59.6	-45.8	174.4	0	0	0	0	0	111.3	L103 E104 K109 I110 A111 F121 L227	L103-A107 WeakPolarHBondContact O-CB 3.43Å; L103-A107 PolarHBondContact O-N 3.3Å; E104-A107 PolarHBondContact O-N 2.88Å; A107-K109 PolarHBondContact O-N 3.37Å; A107-I110 PolarHBondContact O-N 3.44Å; A107-A111 WeakPolarHBondContact O-CB 3.22Å; A107-A111 PolarHBondContact O-N 2.95Å; A107-F121 HydrophobicContact CB-CD2 4.31Å; A107-F121 HydrophobicContact CB-CE2 3.78Å; A107-F121 HydrophobicContact CB-CZ 3.92Å; A107-L227 HydrophobicContact CB-CD2 4.35Å
108	D	95	Very high	93.7	Very high	63 Å²	63	59.6 Å²	59.6	34%	0.337	30%	0.298	S	S	.	.	H	α-helix	trans	-58.9	-45.5	175.4	-81.1	-9.6	0	0	0	112.2	E104 A111 K112 S119	E104-D108 PolarHBondContact O-N 3.29Å; D108-A111 PolarHBondContact O-N 3.11Å; D108-K112 WeakPolarHBondContact O-CG 3.32Å; D108-K112 PolarHBondContact O-N 3.24Å; D108-S119 WeakPolarHBondContact OD1-CB 2.98Å; D108-S119 PolarHBondContact OD1-OG 2.94Å
109	K	93.3	Very high	93.6	Very high	43 Å²	43	60.6 Å²	60.6	19%	0.187	31%	0.307	C	S	.	.	H	α-helix	trans	-65.5	-45	-178.9	-167.5	178.2	-163.1	-178.2	0	111.4	H101 S105 L106 A107 A111 K112 L113 I324	H101-K109 PolarHBondContact NE2-NZ 2.89Å; S105-K109 VanDerWaalsContact O-CB 3.27Å; S105-K109 WeakPolarHBondContact O-CB 3.33Å; S105-K109 PolarHBondContact O-N 3.35Å; L106-K109 PolarHBondContact O-N 2.96Å; A107-K109 PolarHBondContact O-N 3.37Å; K109-A111 VanDerWaalsContact C-N 3.34Å; K109-K112 PolarHBondContact O-N 3.46Å; K109-L113 HydrophobicContact CG-CD1 4.23Å; K109-L113 WeakPolarHBondContact O-CB 3.23Å; K109-L113 VanDerWaalsContact O-CG 3.29Å; K109-L113 WeakPolarHBondContact O-CG 3.28Å; K109-L113 PolarHBondContact O-N 2.99Å; K109-I324 HydrophobicContact CD-CD1 4Å
110	I	93.8	Very high	93.7	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-65.4	-39.2	178	-72.2	164.8	0	0	0	110.9	L106 A107 L113 N114 F121 E316 W317 A320	L106-I110 HydrophobicContact CD1-CD1 3.92Å; L106-I110 HydrophobicContact CD1-CG1 4.4Å; L106-I110 HydrophobicContact CG-CD1 3.86Å; L106-I110 WeakPolarHBondContact O-CB 3.46Å; L106-I110 WeakPolarHBondContact O-CG1 3.46Å; L106-I110 PolarHBondContact O-N 2.88Å; A107-I110 PolarHBondContact O-N 3.44Å; I110-L113 PolarHBondContact O-N 3.02Å; I110-N114 WeakPolarHBondContact CG2-ND2 3.44Å; I110-N114 WeakPolarHBondContact O-CB 3.27Å; I110-N114 PolarHBondContact O-N 3.46Å; I110-N114 VanDerWaalsContact O-N 3.09Å; I110-N114 PolarHBondContact O-ND2 3.43Å; I110-F121 HydrophobicContact CD1-CD1 4.21Å; I110-F121 HydrophobicContact CD1-CE1 3.65Å; I110-E316 HydrophobicContact CD1-CB 3.94Å; I110-E316 HydrophobicContact CG2-CB 4.23Å; I110-W317 HydrophobicContact CD1-CB 4.21Å; I110-A320 HydrophobicContact CG1-CB 3.99Å
111	A	94.1	Very high	93.9	Very high	2 Å²	2	61.5 Å²	61.5	2%	0.017	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-47.5	175.3	0	0	0	0	0	111.5	A107 D108 K109 N114 N115 K116	A107-A111 WeakPolarHBondContact O-CB 3.22Å; A107-A111 PolarHBondContact O-N 2.95Å; D108-A111 PolarHBondContact O-N 3.11Å; K109-A111 VanDerWaalsContact C-N 3.34Å; A111-N114 CarbonylContact O-C 3.57Å; A111-N114 PolarHBondContact O-N 2.9Å; A111-N115 PolarHBondContact O-N 2.95Å; A111-K116 HydrophobicContact CB-CB 4.16Å; A111-K116 PolarHBondContact O-N 3.22Å
112	K	92.9	Very high	93.9	Very high	160 Å²	160	60.5 Å²	60.5	70%	0.696	30%	0.299	S	S	*	.	H	α-helix	trans	-60	-47.1	175.5	-71.5	173	-174.5	175.4	0	112.4	D108 K109 N114 N115	D108-K112 WeakPolarHBondContact O-CG 3.32Å; D108-K112 PolarHBondContact O-N 3.24Å; K109-K112 PolarHBondContact O-N 3.46Å; K112-N114 PolarHBondContact O-N 2.76Å; K112-N115 PolarHBondContact O-N 3.04Å
113	L	91.2	Very high	94	Very high	79 Å²	79	61.6 Å²	61.6	41%	0.414	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-28.6	179.5	-74.9	171.6	0	0	0	113.2	K109 I110 A320 I324	K109-L113 HydrophobicContact CG-CD1 4.23Å; K109-L113 WeakPolarHBondContact O-CB 3.23Å; K109-L113 VanDerWaalsContact O-CG 3.29Å; K109-L113 WeakPolarHBondContact O-CG 3.28Å; K109-L113 PolarHBondContact O-N 2.99Å; I110-L113 PolarHBondContact O-N 3.02Å; L113-A320 HydrophobicContact CD1-CB 4.06Å; L113-I324 HydrophobicContact CD1-CD1 4.46Å; L113-I324 HydrophobicContact CD1-CG1 4.39Å
114	N	90.1	Very high	93.9	Very high	71 Å²	71	63 Å²	63	38%	0.38	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	12	-179.3	-64.3	-47.2	0	0	0	113.2	I110 A111 K112 K116	I110-N114 WeakPolarHBondContact CG2-ND2 3.44Å; I110-N114 WeakPolarHBondContact O-CB 3.27Å; I110-N114 PolarHBondContact O-N 3.46Å; I110-N114 VanDerWaalsContact O-N 3.09Å; I110-N114 PolarHBondContact O-ND2 3.43Å; A111-N114 CarbonylContact O-C 3.57Å; A111-N114 PolarHBondContact O-N 2.9Å; K112-N114 PolarHBondContact O-N 2.76Å; N114-K116 HydrophobicContact CB-CD 4.24Å; N114-K116 HydrophobicContact CB-CG 4.01Å; N114-K116 PolarHBondContact O-N 3.14Å; N114-K116 VanDerWaalsContact O-N 3.11Å
115	N	92	Very high	94	Very high	156 Å²	156	59 Å²	59	83%	0.834	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	33	-175.7	-62.9	-43.5	0	0	0	113.9	A111 K112	A111-N115 PolarHBondContact O-N 2.95Å; K112-N115 PolarHBondContact O-N 3.04Å
116	K	91.5	Very high	94.1	Very high	85 Å²	85	57.2 Å²	57.2	37%	0.37	28%	0.279	S	S	.	.			trans	-83.8	138.6	175.7	-63.5	177.7	-179.1	175.1	0	109.6	A111 N114 E316	A111-K116 HydrophobicContact CB-CB 4.16Å; A111-K116 PolarHBondContact O-N 3.22Å; N114-K116 HydrophobicContact CB-CD 4.24Å; N114-K116 HydrophobicContact CB-CG 4.01Å; N114-K116 PolarHBondContact O-N 3.14Å; N114-K116 VanDerWaalsContact O-N 3.11Å; K116-E316 IonicContact NZ-OE1 2.66Å; K116-E316 PolarHBondContact NZ-OE1 3.31Å
117	K	89.8	Confident	94.3	Very high	213 Å²	213	57.2 Å²	57.2	93%	0.926	28%	0.279	S	S	*	.	S	Bend	trans	-72.9	-30.9	177.6	-175	177.1	-178.7	175	0	113.6
118	E	90.2	Very high	94.4	Very high	67 Å²	67	60 Å²	60	31%	0.313	29%	0.29	S	S	.	.	S	Bend	trans	-107.6	131	-176.8	-65.3	-177.7	146.5	0	0	110	K120 K231	E118-K120 HydrophobicContact CB-CD 4.15Å; E118-K120 HydrophobicContact CB-CG 4.43Å; E118-K120 PolarHBondContact O-N 3.22Å; E118-K120 VanDerWaalsContact O-N 3.08Å; E118-K120 IonicContact OE2-NZ 3.28Å; E118-K120 PolarHBondContact OE2-NZ 3.32Å; E118-K231 IonicContact OE1-NZ 2.76Å; E118-K231 PolarHBondContact OE1-NZ 2.95Å
119	S	95.1	Very high	94.6	Very high	43 Å²	43	57.1 Å²	57.1	30%	0.301	27%	0.274	S	S	.	.			trans	-76.6	87.6	173	-56.3	0	0	0	0	110.4	D108 G230	D108-S119 WeakPolarHBondContact OD1-CB 2.98Å; D108-S119 PolarHBondContact OD1-OG 2.94Å; S119-G230 WeakPolarHBondContact O-CA 3.43Å
120	K	96	Very high	94.8	Very high	69 Å²	69	55 Å²	55	30%	0.3	27%	0.265	S	S	.	.			trans	-147.2	159.9	-179.9	69.7	-171.2	-177.1	-171.1	0	111.4	E118 L227	E118-K120 HydrophobicContact CB-CD 4.15Å; E118-K120 HydrophobicContact CB-CG 4.43Å; E118-K120 PolarHBondContact O-N 3.22Å; E118-K120 VanDerWaalsContact O-N 3.08Å; E118-K120 IonicContact OE2-NZ 3.28Å; E118-K120 PolarHBondContact OE2-NZ 3.32Å; K120-L227 WeakPolarHBondContact CA-O 3.4Å
121	F	96.8	Very high	95	Very high	7 Å²	7	56 Å²	56	3%	0.031	27%	0.27	C	S	.	.			trans	-94	163.5	176.7	-67.1	-74.6	0	0	0	112.5	L106 A107 I110 T125 I129 L227 E316 W317	L106-F121 HydrophobicContact CB-CZ 4.2Å; L106-F121 HydrophobicContact CD2-CE1 4.31Å; L106-F121 HydrophobicContact CD2-CZ 4.16Å; L106-F121 HydrophobicContact CG-CE1 4.13Å; L106-F121 HydrophobicContact CG-CZ 4.05Å; A107-F121 HydrophobicContact CB-CD2 4.31Å; A107-F121 HydrophobicContact CB-CE2 3.78Å; A107-F121 HydrophobicContact CB-CZ 3.92Å; I110-F121 HydrophobicContact CD1-CD1 4.21Å; I110-F121 HydrophobicContact CD1-CE1 3.65Å; F121-T125 HydrophobicContact CB-CG2 3.81Å; F121-T125 HydrophobicContact CD1-CG2 3.5Å; F121-T125 HydrophobicContact CE1-CG2 4.19Å; F121-T125 HydrophobicContact CG-CG2 3.76Å; F121-I129 HydrophobicContact CD1-CD1 4.47Å; F121-I129 HydrophobicContact CD2-CD1 3.47Å; F121-I129 VanDerWaalsContact CD2-CD1 3.47Å; F121-I129 HydrophobicContact CE1-CD1 4.48Å; F121-I129 HydrophobicContact CE2-CD1 3.49Å; F121-I129 VanDerWaalsContact CE2-CD1 3.49Å; F121-I129 HydrophobicContact CG-CD1 3.99Å; F121-I129 HydrophobicContact CZ-CD1 4.04Å; F121-L227 HydrophobicContact CD2-CB 4.05Å; F121-L227 HydrophobicContact CD2-CD2 4.06Å; F121-L227 HydrophobicContact CD2-CG 4.48Å; F121-L227 HydrophobicContact CE2-CB 4.49Å; F121-L227 HydrophobicContact CE2-CD1 4.42Å; F121-L227 HydrophobicContact CE2-CD2 3.73Å; F121-L227 HydrophobicContact CE2-CG 4.43Å; F121-L227 PolarHBondContact N-O 3.12Å; F121-E316 WeakPolarHBondContact CA-OE2 3.17Å; F121-E316 WeakPolarHBondContact CB-OE2 3.13Å; F121-E316 WeakPolarHBondContact CD1-OE2 3.08Å; F121-W317 HydrophobicContact CD1-CZ3 4.42Å; F121-W317 AromaticContact CE1-CE3 3.93Å; F121-W317 HydrophobicContact CE1-CE3 3.93Å; F121-W317 AromaticContact CE1-CZ3 4Å; F121-W317 HydrophobicContact CE1-CZ3 4Å; F121-W317 HydrophobicContact CZ-CZ3 4.41Å
122	T	95.3	Very high	95.2	Very high	44 Å²	44	56.5 Å²	56.5	27%	0.27	27%	0.274	S	S	.	.			trans	-62.3	159.6	165.1	57.1	0	0	0	0	110.7	Y124 T125 A126 E316	T122-Y124 PolarHBondContact O-N 3.08Å; T122-T125 PolarHBondContact O-N 3.07Å; T122-T125 WeakPolarHBondContact OG1-CB 3.24Å; T122-T125 PolarHBondContact OG1-OG1 3.24Å; T122-A126 WeakPolarHBondContact O-CB 3.45Å; T122-A126 PolarHBondContact O-N 3.07Å; T122-E316 VanDerWaalsContact CG2-CD 3.48Å; T122-E316 HydrophobicContact CG2-CG 3.85Å; T122-E316 PolarHBondContact N-OE2 3.32Å
123	L	96.4	Very high	95.5	Very high	66 Å²	66	49 Å²	49	35%	0.346	24%	0.241	S	C	.	.	H	α-helix	trans	-60.4	-44.2	-179.6	-67.1	-178.6	0	0	0	112	T125 A126 F127 T228 P271 L306	L123-T125 VanDerWaalsContact C-N 3.35Å; L123-T125 PolarHBondContact O-N 3.2Å; L123-A126 PolarHBondContact O-N 3.22Å; L123-F127 HydrophobicContact CB-CE2 4.34Å; L123-F127 WeakPolarHBondContact O-CD2 3.26Å; L123-F127 PolarHBondContact O-N 2.88Å; L123-T228 HydrophobicContact CD2-CG2 3.96Å; L123-P271 HydrophobicContact CD2-CB 4.42Å; L123-P271 HydrophobicContact CD2-CG 4.27Å; L123-L306 HydrophobicContact CB-CD1 3.82Å; L123-L306 HydrophobicContact CD1-CD2 4.47Å
124	Y	96.9	Very high	95.9	Very high	29 Å²	29	45.2 Å²	45.2	11%	0.114	22%	0.221	C	C	.	.	H	α-helix	trans	-56.3	-49.3	175.8	178	-95	0	0	0	111.8	T122 A126 F127 Y128 I303 E311 P313 Q314 L315	T122-Y124 PolarHBondContact O-N 3.08Å; Y124-A126 VanDerWaalsContact C-N 3.34Å; Y124-A126 PolarHBondContact O-N 2.8Å; Y124-F127 PolarHBondContact O-N 3.02Å; Y124-Y128 PolarHBondContact O-N 2.8Å; Y124-I303 HydrophobicContact CD2-CG2 4.41Å; Y124-I303 HydrophobicContact CE2-CG2 3.97Å; Y124-E311 WeakPolarHBondContact CB-OE1 3.4Å; Y124-P313 HydrophobicContact CD2-CB 4.3Å; Y124-P313 HydrophobicContact CE1-CB 4.12Å; Y124-P313 HydrophobicContact CE2-CB 3.42Å; Y124-P313 VanDerWaalsContact CE2-CB 3.42Å; Y124-P313 VanDerWaalsContact CZ-CA 3.42Å; Y124-P313 WeakPolarHBondContact OH-CB 3.41Å; Y124-Q314 WeakPolarHBondContact CD1-O 3.4Å; Y124-L315 HydrophobicContact CD1-CD2 4.36Å; Y124-L315 HydrophobicContact CE1-CD2 3.94Å; Y124-L315 HydrophobicContact CE1-CG 4.4Å
125	T	97.1	Very high	96.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-39.6	179	-59.3	0	0	0	0	111.6	F121 T122 L123 Y128 I129 L315 E316 W317	F121-T125 HydrophobicContact CB-CG2 3.81Å; F121-T125 HydrophobicContact CD1-CG2 3.5Å; F121-T125 HydrophobicContact CE1-CG2 4.19Å; F121-T125 HydrophobicContact CG-CG2 3.76Å; T122-T125 PolarHBondContact O-N 3.07Å; T122-T125 WeakPolarHBondContact OG1-CB 3.24Å; T122-T125 PolarHBondContact OG1-OG1 3.24Å; L123-T125 VanDerWaalsContact C-N 3.35Å; L123-T125 PolarHBondContact O-N 3.2Å; T125-Y128 PolarHBondContact O-N 3.24Å; T125-I129 HydrophobicContact CG2-CD1 3.97Å; T125-I129 HydrophobicContact CG2-CG1 4.49Å; T125-I129 WeakPolarHBondContact O-CB 3.46Å; T125-I129 VanDerWaalsContact O-CG1 3.28Å; T125-I129 WeakPolarHBondContact O-CG1 3.46Å; T125-I129 PolarHBondContact O-N 3.05Å; T125-L315 HydrophobicContact CG2-CD2 4.36Å; T125-E316 PolarHBondContact OG1-N 3.23Å; T125-W317 HydrophobicContact CG2-CE3 3.89Å; T125-W317 HydrophobicContact CG2-CH2 3.93Å; T125-W317 HydrophobicContact CG2-CZ3 3.2Å
126	A	98.1	Very high	96.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.7	-45.6	176.5	0	0	0	0	0	112	T122 L123 Y124 Y128 I129 G130 L224 T228	T122-A126 WeakPolarHBondContact O-CB 3.45Å; T122-A126 PolarHBondContact O-N 3.07Å; L123-A126 PolarHBondContact O-N 3.22Å; Y124-A126 VanDerWaalsContact C-N 3.34Å; Y124-A126 PolarHBondContact O-N 2.8Å; A126-Y128 VanDerWaalsContact C-N 3.35Å; A126-Y128 PolarHBondContact O-N 3.1Å; A126-I129 PolarHBondContact O-N 2.87Å; A126-G130 PolarHBondContact O-N 2.78Å; A126-L224 VanDerWaalsContact O-CD1 3.25Å; A126-L224 WeakPolarHBondContact O-CD1 3.48Å; A126-T228 HydrophobicContact CB-CG2 4.32Å
127	F	98.4	Very high	96.9	Very high	1 Å²	1	32.2 Å²	32.2	0%	0.004	16%	0.156	C	C	.	.	H	α-helix	trans	-61	-43.4	174.8	-74.2	-59.7	0	0	0	112.1	L123 Y124 G130 I131 P271 E273 Y274 L299 I303 L306	L123-F127 HydrophobicContact CB-CE2 4.34Å; L123-F127 WeakPolarHBondContact O-CD2 3.26Å; L123-F127 PolarHBondContact O-N 2.88Å; Y124-F127 PolarHBondContact O-N 3.02Å; F127-G130 PolarHBondContact O-N 3.08Å; F127-I131 PolarHBondContact O-N 3.41Å; F127-P271 HydrophobicContact CE1-CG 3.95Å; F127-P271 HydrophobicContact CE2-CB 4.41Å; F127-P271 HydrophobicContact CE2-CG 4.27Å; F127-P271 HydrophobicContact CZ-CB 3.74Å; F127-P271 HydrophobicContact CZ-CG 3.48Å; F127-P271 VanDerWaalsContact CZ-CG 3.48Å; F127-E273 HydrophobicContact CE1-CB 3.98Å; F127-E273 HydrophobicContact CE1-CG 4.28Å; F127-E273 HydrophobicContact CZ-CB 4.27Å; F127-E273 HydrophobicContact CZ-CG 4.26Å; F127-Y274 HydrophobicContact CD1-CE1 4.21Å; F127-Y274 HydrophobicContact CE1-CD1 4.33Å; F127-Y274 AromaticContact CE1-CE1 3.81Å; F127-Y274 HydrophobicContact CE1-CE1 3.81Å; F127-L299 HydrophobicContact CD1-CB 4.14Å; F127-L299 HydrophobicContact CD1-CD2 3.78Å; F127-L299 WeakPolarHBondContact CD1-O 3.1Å; F127-L299 HydrophobicContact CE1-CD2 4.07Å; F127-I303 HydrophobicContact CB-CD1 3.98Å; F127-I303 HydrophobicContact CB-CG1 3.53Å; F127-I303 HydrophobicContact CD2-CG1 4.46Å; F127-I303 HydrophobicContact CG-CG1 4.19Å; F127-L306 HydrophobicContact CD2-CD1 3.93Å; F127-L306 HydrophobicContact CE2-CD1 4.06Å
128	Y	98	Very high	97.3	Very high	61 Å²	61	25 Å²	25	24%	0.239	12%	0.123	C	C	.	.	H	α-helix	trans	-59	-48.6	175.9	-177.8	-88.9	0	0	0	112.1	Y124 T125 A126 G130 I131 S132 T165 I167 L315 W317	Y124-Y128 PolarHBondContact O-N 2.8Å; T125-Y128 PolarHBondContact O-N 3.24Å; A126-Y128 VanDerWaalsContact C-N 3.35Å; A126-Y128 PolarHBondContact O-N 3.1Å; Y128-G130 VanDerWaalsContact C-N 3.29Å; Y128-G130 PolarHBondContact O-N 2.84Å; Y128-I131 PolarHBondContact O-N 3.09Å; Y128-S132 VanDerWaalsContact O-CB 3.31Å; Y128-S132 WeakPolarHBondContact O-CB 3.39Å; Y128-S132 PolarHBondContact O-N 3.3Å; Y128-T165 PolarHBondContact OH-O 3.07Å; Y128-I167 HydrophobicContact CD1-CD1 4.44Å; Y128-I167 HydrophobicContact CE1-CD1 4.34Å; Y128-L315 HydrophobicContact CD1-CD1 4.08Å; Y128-L315 HydrophobicContact CD1-CD2 3.55Å; Y128-L315 HydrophobicContact CD1-CG 4.47Å; Y128-L315 HydrophobicContact CD2-CD2 4.06Å; Y128-L315 HydrophobicContact CE1-CD1 3.85Å; Y128-L315 HydrophobicContact CE1-CD2 4.2Å; Y128-L315 HydrophobicContact CE2-CD1 4.4Å; Y128-L315 HydrophobicContact CG-CD1 4.46Å; Y128-L315 HydrophobicContact CG-CD2 3.48Å; Y128-L315 VanDerWaalsContact CG-CD2 3.48Å; Y128-W317 HydrophobicContact CD1-CH2 4.26Å; Y128-W317 HydrophobicContact CD1-CZ2 4.42Å; Y128-W317 HydrophobicContact CE1-CZ2 4.35Å
129	I	98.5	Very high	97.6	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-57	-46.8	174.1	-72.8	166.6	0	0	0	110.1	L103 F121 T125 A126 I131 S132 T133 I167 L227 W317	L103-I129 HydrophobicContact CD1-CD1 4.4Å; L103-I129 HydrophobicContact CD1-CG1 4.38Å; L103-I129 HydrophobicContact CD1-CG2 3.62Å; L103-I129 HydrophobicContact CD2-CD1 4.13Å; L103-I129 HydrophobicContact CD2-CG1 4.32Å; F121-I129 HydrophobicContact CD1-CD1 4.47Å; F121-I129 HydrophobicContact CD2-CD1 3.47Å; F121-I129 VanDerWaalsContact CD2-CD1 3.47Å; F121-I129 HydrophobicContact CE1-CD1 4.48Å; F121-I129 HydrophobicContact CE2-CD1 3.49Å; F121-I129 VanDerWaalsContact CE2-CD1 3.49Å; F121-I129 HydrophobicContact CG-CD1 3.99Å; F121-I129 HydrophobicContact CZ-CD1 4.04Å; T125-I129 HydrophobicContact CG2-CD1 3.97Å; T125-I129 HydrophobicContact CG2-CG1 4.49Å; T125-I129 WeakPolarHBondContact O-CB 3.46Å; T125-I129 VanDerWaalsContact O-CG1 3.28Å; T125-I129 WeakPolarHBondContact O-CG1 3.46Å; T125-I129 PolarHBondContact O-N 3.05Å; A126-I129 PolarHBondContact O-N 2.87Å; I129-I131 PolarHBondContact O-N 3.34Å; I129-S132 PolarHBondContact O-N 2.86Å; I129-T133 HydrophobicContact CG2-CG2 4.06Å; I129-T133 WeakPolarHBondContact O-CB 3.3Å; I129-T133 VanDerWaalsContact O-CG2 3.29Å; I129-T133 WeakPolarHBondContact O-CG2 3.35Å; I129-T133 PolarHBondContact O-N 3.49Å; I129-T133 PolarHBondContact O-OG1 3.48Å; I129-I167 HydrophobicContact CB-CD1 4.37Å; I129-I167 HydrophobicContact CG1-CD1 3.91Å; I129-L227 HydrophobicContact CD1-CD1 4.41Å; I129-L227 HydrophobicContact CG2-CD1 3.92Å; I129-W317 HydrophobicContact CD1-CH2 4.28Å; I129-W317 HydrophobicContact CD1-CZ3 4Å; I129-W317 HydrophobicContact CG1-CH2 3.94Å; I129-W317 HydrophobicContact CG1-CZ3 4.18Å
130	G	98.7	Very high	97.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-54.3	-53.2	179.7	0	0	0	0	0	111.9	A126 F127 Y128 T133 L134 W220	A126-G130 PolarHBondContact O-N 2.78Å; F127-G130 PolarHBondContact O-N 3.08Å; Y128-G130 VanDerWaalsContact C-N 3.29Å; Y128-G130 PolarHBondContact O-N 2.84Å; G130-T133 PolarHBondContact O-OG1 3.31Å; G130-L134 WeakPolarHBondContact O-CB 3.42Å; G130-L134 PolarHBondContact O-N 2.84Å; G130-W220 WeakPolarHBondContact O-CZ2 3.04Å; G130-W220 PolarHBondContact O-NE1 3.16Å
131	I	98.6	Very high	97.9	Very high	20 Å²	20	19 Å²	19	10%	0.103	9%	0.093	C	C	.	.	H	α-helix	trans	-62.4	-52.8	179	-67.1	172	0	0	0	111	F127 Y128 I129 T133 L134 D135 R296 L299 Q300 I303	F127-I131 PolarHBondContact O-N 3.41Å; Y128-I131 PolarHBondContact O-N 3.09Å; I129-I131 PolarHBondContact O-N 3.34Å; I131-T133 VanDerWaalsContact C-N 3.35Å; I131-T133 PolarHBondContact O-N 2.93Å; I131-L134 PolarHBondContact O-N 3.1Å; I131-D135 WeakPolarHBondContact O-CB 3.37Å; I131-D135 PolarHBondContact O-N 3.39Å; I131-R296 HydrophobicContact CG2-CG 4.25Å; I131-L299 HydrophobicContact CD1-CB 4.08Å; I131-L299 HydrophobicContact CG1-CB 3.7Å; I131-L299 HydrophobicContact CG1-CD1 3.97Å; I131-Q300 HydrophobicContact CD1-CB 4.43Å; I131-I303 HydrophobicContact CD1-CD1 3.69Å
132	S	98.2	Very high	97.9	Very high	14 Å²	14	25.1 Å²	25.1	10%	0.098	12%	0.12	C	C	.	.	H	α-helix	trans	-61.9	-40.6	-175.1	-176.2	0	0	0	0	112.7	Y128 I129 T136	Y128-S132 VanDerWaalsContact O-CB 3.31Å; Y128-S132 WeakPolarHBondContact O-CB 3.39Å; Y128-S132 PolarHBondContact O-N 3.3Å; I129-S132 PolarHBondContact O-N 2.86Å; S132-T136 PolarHBondContact O-N 3.43Å; S132-T136 VanDerWaalsContact O-N 3.12Å; S132-T136 PolarHBondContact O-OG1 3.05Å
133	T	98.7	Very high	97.9	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.012	11%	0.109	C	C	.	.	H	α-helix	trans	-75.3	-34.4	178.1	57.5	0	0	0	0	112.8	L103 I129 G130 I131 D135 T136 L137 F155 I167 W220	L103-T133 HydrophobicContact CD1-CG2 4.34Å; I129-T133 HydrophobicContact CG2-CG2 4.06Å; I129-T133 WeakPolarHBondContact O-CB 3.3Å; I129-T133 VanDerWaalsContact O-CG2 3.29Å; I129-T133 WeakPolarHBondContact O-CG2 3.35Å; I129-T133 PolarHBondContact O-N 3.49Å; I129-T133 PolarHBondContact O-OG1 3.48Å; G130-T133 PolarHBondContact O-OG1 3.31Å; I131-T133 VanDerWaalsContact C-N 3.35Å; I131-T133 PolarHBondContact O-N 2.93Å; T133-D135 VanDerWaalsContact C-N 3.34Å; T133-T136 PolarHBondContact O-N 3.27Å; T133-L137 WeakPolarHBondContact O-CG 3.41Å; T133-L137 PolarHBondContact O-N 3.5Å; T133-F155 HydrophobicContact CG2-CB 4.38Å; T133-F155 HydrophobicContact CG2-CD1 3.59Å; T133-F155 HydrophobicContact CG2-CD2 4.06Å; T133-F155 HydrophobicContact CG2-CE1 3.71Å; T133-F155 HydrophobicContact CG2-CE2 4.17Å; T133-F155 HydrophobicContact CG2-CG 3.75Å; T133-F155 HydrophobicContact CG2-CZ 4.01Å; T133-I167 HydrophobicContact CG2-CG2 3.96Å; T133-W220 PolarHBondContact OG1-NE1 3.28Å
134	L	98.7	Very high	98	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62	-43.9	173.2	-179.1	70.9	0	0	0	111	G130 I131 T136 L137 Y138 I217 W220 Y292 I295 R296	G130-L134 WeakPolarHBondContact O-CB 3.42Å; G130-L134 PolarHBondContact O-N 2.84Å; I131-L134 PolarHBondContact O-N 3.1Å; L134-T136 VanDerWaalsContact C-N 3.33Å; L134-T136 PolarHBondContact O-N 3.35Å; L134-L137 PolarHBondContact O-N 3.01Å; L134-Y138 WeakPolarHBondContact O-CB 3.4Å; L134-Y138 PolarHBondContact O-N 3.3Å; L134-I217 HydrophobicContact CD1-CD1 3.93Å; L134-W220 HydrophobicContact CB-CZ2 3.87Å; L134-W220 HydrophobicContact CD1-CD2 4.27Å; L134-W220 HydrophobicContact CD1-CE3 4.39Å; L134-W220 HydrophobicContact CD1-CH2 4.35Å; L134-W220 HydrophobicContact CD1-CZ2 4.2Å; L134-W220 HydrophobicContact CD1-CZ3 4.43Å; L134-W220 HydrophobicContact CD2-CZ2 4.44Å; L134-W220 HydrophobicContact CG-CZ2 4.4Å; L134-Y292 HydrophobicContact CD1-CD1 4Å; L134-Y292 HydrophobicContact CG-CD1 4.37Å; L134-I295 HydrophobicContact CD1-CG2 4.2Å; L134-I295 HydrophobicContact CD2-CB 3.86Å; L134-I295 HydrophobicContact CD2-CG2 3.5Å; L134-I295 HydrophobicContact CG-CG2 4.49Å; L134-R296 HydrophobicContact CD2-CB 4.22Å
135	D	98.1	Very high	98.1	Very high	38 Å²	38	20.4 Å²	20.4	20%	0.203	10%	0.095	C	C	.	.	H	α-helix	trans	-62.3	-42.8	177.8	-69.9	0.4	0	0	0	111.7	I131 T133 L137 Y138 D139 R296	I131-D135 WeakPolarHBondContact O-CB 3.37Å; I131-D135 PolarHBondContact O-N 3.39Å; T133-D135 VanDerWaalsContact C-N 3.34Å; D135-L137 VanDerWaalsContact C-N 3.32Å; D135-L137 PolarHBondContact O-N 3.05Å; D135-Y138 WeakPolarHBondContact O-CB 3.45Å; D135-Y138 PolarHBondContact O-N 3.49Å; D135-Y138 VanDerWaalsContact O-N 3.12Å; D135-D139 PolarHBondContact O-N 2.82Å; D135-R296 VanDerWaalsContact CG-NH1 3.31Å; D135-R296 IonicContact OD1-CZ 2.86Å; D135-R296 IonicContact OD1-NE 3.2Å; D135-R296 IonicContact OD1-NH1 2.94Å; D135-R296 PolarHBondContact OD1-NH1 3.03Å; D135-R296 IonicContact OD1-NH2 2.79Å; D135-R296 PolarHBondContact OD1-NH2 2.88Å; D135-R296 IonicContact OD2-CZ 2.68Å; D135-R296 IonicContact OD2-NH1 3.12Å; D135-R296 PolarHBondContact OD2-NH1 2.94Å; D135-R296 IonicContact OD2-NH2 3.55Å; D135-R296 PolarHBondContact OD2-NH2 2.81Å
136	T	98.1	Very high	98.1	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-61.4	-42.6	176.5	-55.8	0	0	0	0	111.3	N78 S132 T133 L134 D139 L140 L169	N78-T136 HydrophobicContact CB-CG2 3.88Å; N78-T136 VanDerWaalsContact CB-OG1 3.31Å; N78-T136 WeakPolarHBondContact CB-OG1 3.41Å; N78-T136 WeakPolarHBondContact O-CG2 3.29Å; S132-T136 PolarHBondContact O-N 3.43Å; S132-T136 VanDerWaalsContact O-N 3.12Å; S132-T136 PolarHBondContact O-OG1 3.05Å; T133-T136 PolarHBondContact O-N 3.27Å; L134-T136 VanDerWaalsContact C-N 3.33Å; L134-T136 PolarHBondContact O-N 3.35Å; T136-D139 PolarHBondContact O-N 3.14Å; T136-L140 PolarHBondContact O-N 3.4Å; T136-L140 VanDerWaalsContact O-N 3.1Å; T136-L169 HydrophobicContact CG2-CB 3.47Å; T136-L169 VanDerWaalsContact CG2-CB 3.47Å; T136-L169 HydrophobicContact CG2-CD2 4.14Å; T136-L169 HydrophobicContact CG2-CG 4.44Å
137	L	98.6	Very high	98.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.4	-36.8	173.9	-69.3	175.2	0	0	0	111.8	T133 L134 D135 L140 H141 H147 V150 F155 L169 I217 W220	T133-L137 WeakPolarHBondContact O-CG 3.41Å; T133-L137 PolarHBondContact O-N 3.5Å; L134-L137 PolarHBondContact O-N 3.01Å; D135-L137 VanDerWaalsContact C-N 3.32Å; D135-L137 PolarHBondContact O-N 3.05Å; L137-L140 PolarHBondContact O-N 3.44Å; L137-H141 WeakPolarHBondContact O-CB 3.46Å; L137-H141 PolarHBondContact O-N 3.03Å; L137-H141 PolarHBondContact O-ND1 3.19Å; L137-H147 HydrophobicContact CD2-CB 4.25Å; L137-V150 HydrophobicContact CD1-CG1 4.13Å; L137-V150 HydrophobicContact CD1-CG2 4.24Å; L137-V150 HydrophobicContact CD2-CG2 3.84Å; L137-F155 HydrophobicContact CG-CZ 4.44Å; L137-L169 HydrophobicContact CD2-CD2 4.43Å; L137-I217 HydrophobicContact CD1-CD1 4.33Å; L137-W220 HydrophobicContact CD1-CB 3.74Å; L137-W220 HydrophobicContact CD1-CG 4.05Å
138	Y	98.2	Very high	98.1	Very high	62 Å²	62	22 Å²	22	24%	0.243	10%	0.101	C	C	.	.	H	α-helix	trans	-58.9	-46.8	174.9	173.4	-111.8	0	0	0	111.6	L134 D135 H141 K142 R289 Y292	L134-Y138 WeakPolarHBondContact O-CB 3.4Å; L134-Y138 PolarHBondContact O-N 3.3Å; D135-Y138 WeakPolarHBondContact O-CB 3.45Å; D135-Y138 PolarHBondContact O-N 3.49Å; D135-Y138 VanDerWaalsContact O-N 3.12Å; Y138-H141 PolarHBondContact O-N 2.9Å; Y138-K142 WeakPolarHBondContact O-CB 3.46Å; Y138-K142 PolarHBondContact O-N 3.2Å; Y138-R289 PolarHBondContact OH-NH2 2.88Å; Y138-Y292 AromaticContact CD2-CD1 3.91Å; Y138-Y292 HydrophobicContact CD2-CD1 3.91Å; Y138-Y292 AromaticContact CD2-CD2 3.45Å; Y138-Y292 HydrophobicContact CD2-CD2 3.45Å; Y138-Y292 VanDerWaalsContact CD2-CD2 3.45Å; Y138-Y292 HydrophobicContact CD2-CE1 4.17Å; Y138-Y292 AromaticContact CD2-CE2 3.78Å; Y138-Y292 HydrophobicContact CD2-CE2 3.78Å; Y138-Y292 AromaticContact CD2-CG 3.54Å; Y138-Y292 HydrophobicContact CD2-CG 3.54Å; Y138-Y292 AromaticContact CE2-CD2 3.93Å; Y138-Y292 HydrophobicContact CE2-CD2 3.93Å; Y138-Y292 HydrophobicContact CE2-CE2 4.31Å; Y138-Y292 HydrophobicContact CE2-CG 4.35Å; Y138-Y292 HydrophobicContact CG-CD1 4.26Å; Y138-Y292 HydrophobicContact CG-CD2 4.48Å; Y138-Y292 HydrophobicContact CG-CG 4.17Å
139	D	97.6	Very high	98.1	Very high	48 Å²	48	19.7 Å²	19.7	26%	0.257	9%	0.093	S	C	.	.	H	α-helix	trans	-63.9	-41.3	177.7	-78.2	-18.3	0	0	0	112.4	V76 D135 T136 H141 K142 C143	V76-D139 HydrophobicContact CG1-CB 3.97Å; D135-D139 PolarHBondContact O-N 2.82Å; T136-D139 PolarHBondContact O-N 3.14Å; D139-H141 PolarHBondContact O-N 3.38Å; D139-K142 WeakPolarHBondContact O-CB 3.34Å; D139-K142 PolarHBondContact O-N 2.66Å; D139-C143 PolarHBondContact O-N 3.23Å; D139-C143 PolarHBondContact O-SG 2.82Å
140	L	98.1	Very high	98.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-46.3	173.2	-175.9	69.8	0	0	0	111.4	L71 T136 L137 K142 C143 L144 F145 H147 L169 F172	L71-L140 HydrophobicContact CD1-CD1 4.04Å; L71-L140 HydrophobicContact CD2-CD1 3.95Å; T136-L140 PolarHBondContact O-N 3.4Å; T136-L140 VanDerWaalsContact O-N 3.1Å; L137-L140 PolarHBondContact O-N 3.44Å; L140-K142 VanDerWaalsContact C-N 3.32Å; L140-K142 PolarHBondContact O-N 3.44Å; L140-C143 CarbonylContact O-C 3.47Å; L140-C143 WeakPolarHBondContact O-CA 3.48Å; L140-C143 WeakPolarHBondContact O-CB 3.47Å; L140-C143 PolarHBondContact O-N 2.67Å; L140-L144 PolarHBondContact O-N 2.86Å; L140-F145 CarbonylContact C-O 3.36Å; L140-F145 HydrophobicContact CD1-CB 3.67Å; L140-F145 HydrophobicContact CG-CB 3.89Å; L140-F145 PolarHBondContact O-N 3.43Å; L140-H147 HydrophobicContact CD2-CB 3.64Å; L140-L169 HydrophobicContact CD2-CD2 3.96Å; L140-F172 HydrophobicContact CD1-CD1 4.47Å; L140-F172 HydrophobicContact CD1-CE1 4.15Å
141	H	98.2	Very high	98	Very high	3 Å²	3	21.8 Å²	21.8	1%	0.014	10%	0.102	C	C	.	.	H	α-helix	trans	-66.5	-33	178.9	-68.6	137.1	0	0	0	112.8	L137 Y138 D139 C143 L144 F145 Y178 R213 D216 Y292	L137-H141 WeakPolarHBondContact O-CB 3.46Å; L137-H141 PolarHBondContact O-N 3.03Å; L137-H141 PolarHBondContact O-ND1 3.19Å; Y138-H141 PolarHBondContact O-N 2.9Å; D139-H141 PolarHBondContact O-N 3.38Å; H141-C143 PolarHBondContact O-N 3.24Å; H141-L144 WeakPolarHBondContact O-CA 3.34Å; H141-L144 PolarHBondContact O-N 2.77Å; H141-F145 WeakPolarHBondContact CA-O 3.18Å; H141-F145 PolarHBondContact CD2-O 2.95Å; H141-Y178 WeakPolarHBondContact O-CE1 3.34Å; H141-Y178 PolarHBondContact O-OH 3.15Å; H141-R213 HydrophobicContact CB-CG 4.39Å; H141-D216 IonicContact CE1-OD2 2.97Å; H141-D216 IonicContact NE2-OD2 3.68Å; H141-D216 PolarHBondContact NE2-OD2 2.82Å; H141-D216 VanDerWaalsContact NE2-OD2 3.09Å; H141-Y292 AromaticContact ND1-CE1 3.69Å; H141-Y292 AromaticContact ND1-CZ 3.63Å; H141-Y292 PolarHBondContact ND1-OH 2.7Å
142	K	96.6	Very high	98	Very high	137 Å²	137	20.9 Å²	20.9	60%	0.596	10%	0.097	S	C	*	.	H	α-helix	trans	-65.5	-31	171.8	-171	-176.7	178.9	-176.1	0	111.4	Y138 D139 L140 L144	Y138-K142 WeakPolarHBondContact O-CB 3.46Å; Y138-K142 PolarHBondContact O-N 3.2Å; D139-K142 WeakPolarHBondContact O-CB 3.34Å; D139-K142 PolarHBondContact O-N 2.66Å; L140-K142 VanDerWaalsContact C-N 3.32Å; L140-K142 PolarHBondContact O-N 3.44Å; K142-L144 PolarHBondContact O-N 2.95Å
143	C	97	Very high	97.9	Very high	7 Å²	7	21.2 Å²	21.2	5%	0.047	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	8.3	170	-60.1	0	0	0	0	113.8	L71 K74 V76 D139 L140 H141 F145	L71-C143 HydrophobicContact CD2-CB 3.78Å; K74-C143 HydrophobicContact CD-CB 3.95Å; K74-C143 VanDerWaalsContact CD-SG 3.52Å; V76-C143 VanDerWaalsContact CG2-SG 3.52Å; D139-C143 PolarHBondContact O-N 3.23Å; D139-C143 PolarHBondContact O-SG 2.82Å; L140-C143 CarbonylContact O-C 3.47Å; L140-C143 WeakPolarHBondContact O-CA 3.48Å; L140-C143 WeakPolarHBondContact O-CB 3.47Å; L140-C143 PolarHBondContact O-N 2.67Å; H141-C143 PolarHBondContact O-N 3.24Å; C143-F145 VanDerWaalsContact C-N 3.28Å; C143-F145 HydrophobicContact CB-CD2 4.06Å; C143-F145 VanDerWaalsContact O-CD2 3.3Å; C143-F145 WeakPolarHBondContact O-CD2 3.37Å; C143-F145 PolarHBondContact O-N 3.05Å
144	L	97.8	Very high	97.9	Very high	20 Å²	20	21.6 Å²	21.6	11%	0.105	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	16.8	177.3	-45	177.3	0	0	0	114.9	L140 H141 K142 R177 Y178 A179 K180	L140-L144 PolarHBondContact O-N 2.86Å; H141-L144 WeakPolarHBondContact O-CA 3.34Å; H141-L144 PolarHBondContact O-N 2.77Å; K142-L144 PolarHBondContact O-N 2.95Å; L144-R177 HydrophobicContact CB-CG 4.35Å; L144-R177 CarbonylContact O-C 3.53Å; L144-R177 VanDerWaalsContact O-CA 3.26Å; L144-R177 WeakPolarHBondContact O-CA 3.39Å; L144-R177 WeakPolarHBondContact O-CG 3.29Å; L144-Y178 VanDerWaalsContact CA-CE1 3.46Å; L144-Y178 HydrophobicContact CB-CE1 4.5Å; L144-Y178 WeakPolarHBondContact O-CD1 3.33Å; L144-Y178 PolarHBondContact O-N 3.16Å; L144-A179 HydrophobicContact CD2-CB 4.2Å; L144-K180 VanDerWaalsContact CD1-O 3.24Å; L144-K180 WeakPolarHBondContact CD1-O 3.35Å
145	F	98.2	Very high	97.9	Very high	12 Å²	12	21.6 Å²	21.6	5%	0.053	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.7	178.9	-72.5	-66.4	0	0	0	112.2	V67 E70 L71 L140 H141 C143 T175 R177	V67-F145 HydrophobicContact CG1-CD2 4.4Å; V67-F145 HydrophobicContact CG1-CE2 4.46Å; V67-F145 HydrophobicContact CG2-CD1 4.18Å; V67-F145 HydrophobicContact CG2-CE1 3.84Å; V67-F145 HydrophobicContact CG2-CZ 4.1Å; E70-F145 HydrophobicContact CB-CE2 4.26Å; E70-F145 VanDerWaalsContact CD-CE2 3.44Å; E70-F145 HydrophobicContact CG-CE2 4.18Å; E70-F145 VanDerWaalsContact OE2-CE2 3.25Å; E70-F145 WeakPolarHBondContact OE2-CE2 3.43Å; E70-F145 WeakPolarHBondContact OE2-CZ 3.23Å; L71-F145 HydrophobicContact CD2-CD2 4.5Å; L140-F145 CarbonylContact C-O 3.36Å; L140-F145 HydrophobicContact CD1-CB 3.67Å; L140-F145 HydrophobicContact CG-CB 3.89Å; L140-F145 PolarHBondContact O-N 3.43Å; H141-F145 WeakPolarHBondContact CA-O 3.18Å; H141-F145 PolarHBondContact CD2-O 2.95Å; C143-F145 VanDerWaalsContact C-N 3.28Å; C143-F145 HydrophobicContact CB-CD2 4.06Å; C143-F145 VanDerWaalsContact O-CD2 3.3Å; C143-F145 WeakPolarHBondContact O-CD2 3.37Å; C143-F145 PolarHBondContact O-N 3.05Å; F145-T175 HydrophobicContact CB-CG2 3.74Å; F145-T175 HydrophobicContact CD1-CG2 3.51Å; F145-T175 HydrophobicContact CE1-CG2 4.35Å; F145-T175 HydrophobicContact CG-CG2 3.82Å; F145-R177 HydrophobicContact CD1-CB 4.02Å; F145-R177 HydrophobicContact CE1-CB 3.85Å
146	L	98.2	Very high	97.8	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	140.1	163.8	-54.3	173.9	0	0	0	108.3	R148 T175 R176 Y178 Q211 S212 R213 D216	L146-R148 HydrophobicContact CB-CG 3.79Å; L146-T175 CarbonylContact O-C 3.46Å; L146-T175 WeakPolarHBondContact O-CA 3.45Å; L146-T175 WeakPolarHBondContact O-CG2 3.42Å; L146-R176 PolarHBondContact N-O 3.3Å; L146-R176 PolarHBondContact O-N 3.25Å; L146-Y178 HydrophobicContact CD2-CD1 3.62Å; L146-Y178 HydrophobicContact CD2-CE1 4.33Å; L146-Y178 HydrophobicContact CD2-CG 3.99Å; L146-Y178 HydrophobicContact CG-CD1 3.86Å; L146-Y178 HydrophobicContact CG-CG 4.13Å; L146-Q211 HydrophobicContact CD1-CB 4.43Å; L146-Q211 VanDerWaalsContact CD1-O 3.22Å; L146-Q211 WeakPolarHBondContact CD1-O 3.33Å; L146-S212 VanDerWaalsContact CD2-C 3.46Å; L146-R213 HydrophobicContact CD2-CB 4.38Å; L146-R213 HydrophobicContact CD2-CG 3.83Å; L146-R213 VanDerWaalsContact CD2-N 3.33Å; L146-D216 VanDerWaalsContact CA-OD2 3.31Å; L146-D216 WeakPolarHBondContact CA-OD2 3.35Å
147	H	98.1	Very high	97.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.094	C	C	.	.			trans	-72.4	-51.1	175.1	-169.4	-97.6	0	0	0	111.6	L137 L140 D149 V150 L170 D171 T174 T175 D216	L137-H147 HydrophobicContact CD2-CB 4.25Å; L140-H147 HydrophobicContact CD2-CB 3.64Å; H147-D149 VanDerWaalsContact C-N 3.26Å; H147-D149 PolarHBondContact CE1-O 3.25Å; H147-D149 VanDerWaalsContact CE1-O 3.25Å; H147-D149 PolarHBondContact ND1-N 3.37Å; H147-D149 PolarHBondContact ND1-O 3.34Å; H147-D149 PolarHBondContact O-N 2.69Å; H147-V150 HydrophobicContact CB-CG2 3.9Å; H147-V150 PolarHBondContact ND1-N 2.95Å; H147-L170 PolarHBondContact NE2-O 3.08Å; H147-D171 PolarHBondContact NE2-O 2.91Å; H147-D171 VanDerWaalsContact NE2-O 3.12Å; H147-T174 CarbonylContact O-C 3.51Å; H147-T174 PolarHBondContact O-OG1 3.22Å; H147-T175 PolarHBondContact O-N 3.1Å; H147-D216 PolarHBondContact N-OD2 2.91Å
148	R	97.8	Very high	97.4	Very high	35 Å²	35	19.9 Å²	19.9	13%	0.132	9%	0.094	C	C	.	.	S	Bend	trans	69.8	-2.8	-179.2	-52.9	-166.8	-63.5	159.1	1.2	117.6	L146 T174 Q211 D216	L146-R148 HydrophobicContact CB-CG 3.79Å; R148-T174 PolarHBondContact NE-O 3.18Å; R148-T174 PolarHBondContact NH2-O 3.45Å; R148-Q211 HydrophobicContact CG-CB 4.37Å; R148-D216 WeakPolarHBondContact CA-OD1 3.27Å; R148-D216 PolarHBondContact N-OD1 3.26Å
149	D	97.2	Very high	97	Very high	12 Å²	12	17.1 Å²	17.1	6%	0.064	8%	0.084	C	C	.	.			trans	-137.7	49.5	171.3	-167.4	33	0	0	0	112.3	H147 K151 N154 T174 G196 S197	H147-D149 VanDerWaalsContact C-N 3.26Å; H147-D149 PolarHBondContact CE1-O 3.25Å; H147-D149 VanDerWaalsContact CE1-O 3.25Å; H147-D149 PolarHBondContact ND1-N 3.37Å; H147-D149 PolarHBondContact ND1-O 3.34Å; H147-D149 PolarHBondContact O-N 2.69Å; D149-K151 PolarHBondContact O-N 2.9Å; D149-K151 IonicContact OD1-NZ 3.99Å; D149-K151 WeakPolarHBondContact OD2-CE 3.45Å; D149-K151 IonicContact OD2-NZ 2.7Å; D149-K151 PolarHBondContact OD2-NZ 3.45Å; D149-N154 PolarHBondContact O-ND2 2.96Å; D149-N154 PolarHBondContact OD2-ND2 2.77Å; D149-T174 HydrophobicContact CB-CG2 4.3Å; D149-T174 WeakPolarHBondContact CB-OG1 3.24Å; D149-G196 WeakPolarHBondContact OD1-CA 3.27Å; D149-S197 PolarHBondContact OD1-N 3.44Å
150	V	98.6	Very high	96.4	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.012	9%	0.092	C	C	.	.			trans	-69.3	118.3	179.5	-177.6	0	0	0	0	109.8	L137 H147 F155 Y200 D216 W220	L137-V150 HydrophobicContact CD1-CG1 4.13Å; L137-V150 HydrophobicContact CD1-CG2 4.24Å; L137-V150 HydrophobicContact CD2-CG2 3.84Å; H147-V150 HydrophobicContact CB-CG2 3.9Å; H147-V150 PolarHBondContact ND1-N 2.95Å; V150-F155 HydrophobicContact CG1-CE2 3.74Å; V150-F155 HydrophobicContact CG1-CZ 4.1Å; V150-Y200 WeakPolarHBondContact O-CB 3.38Å; V150-D216 HydrophobicContact CG2-CB 4.08Å; V150-W220 HydrophobicContact CG1-CB 4.09Å
151	K	98.1	Very high	95.6	Very high	43 Å²	43	22.7 Å²	22.7	19%	0.187	12%	0.121	C	C	.	.			trans	-160.7	160.3	-178.7	65.6	-167.3	-173.7	-155.4	0	111.1	D149 A153 N154 F155 Y200 T223	D149-K151 PolarHBondContact O-N 2.9Å; D149-K151 IonicContact OD1-NZ 3.99Å; D149-K151 WeakPolarHBondContact OD2-CE 3.45Å; D149-K151 IonicContact OD2-NZ 2.7Å; D149-K151 PolarHBondContact OD2-NZ 3.45Å; K151-A153 HydrophobicContact CG-CB 4.33Å; K151-A153 PolarHBondContact O-N 3.14Å; K151-A153 VanDerWaalsContact O-N 3.16Å; K151-N154 WeakPolarHBondContact CE-ND2 3.29Å; K151-N154 HydrophobicContact CG-CB 4.17Å; K151-N154 PolarHBondContact O-N 2.89Å; K151-F155 WeakPolarHBondContact O-CD2 3.47Å; K151-Y200 HydrophobicContact CB-CD2 3.31Å; K151-Y200 HydrophobicContact CB-CE2 3.72Å; K151-Y200 HydrophobicContact CB-CG 3.9Å; K151-Y200 HydrophobicContact CG-CD2 4.5Å; K151-T223 WeakPolarHBondContact CA-OG1 3.42Å
152	P	98.3	Very high	95.1	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-52.9	-38.5	179.8	-26.4	33.3	0	0	0	114.3	L103 E104 N154 F155 Y200 T223 L227	L103-P152 HydrophobicContact CB-CB 4.25Å; L103-P152 PolarHBondContact N-O 3.26Å; E104-P152 HydrophobicContact CB-CB 3.91Å; P152-N154 PolarHBondContact O-N 2.93Å; P152-F155 PolarHBondContact O-N 3.28Å; P152-F155 VanDerWaalsContact O-O 3.08Å; P152-Y200 HydrophobicContact CG-CE1 4.07Å; P152-T223 HydrophobicContact CG-CG2 3.88Å; P152-L227 HydrophobicContact CB-CD1 4.37Å; P152-L227 HydrophobicContact CB-CD2 4.04Å; P152-L227 HydrophobicContact CB-CG 4.39Å; P152-L227 HydrophobicContact CG-CD1 4.39Å; P152-L227 HydrophobicContact CG-CD2 4.12Å; P152-L227 HydrophobicContact CG-CG 4.13Å
153	A	96.6	Very high	94.8	Very high	22 Å²	22	22 Å²	22	18%	0.182	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-66.3	-19.6	-179.4	0	0	0	0	0	114.6	N102 K151	N102-A153 WeakPolarHBondContact CB-O 3.48Å; K151-A153 HydrophobicContact CG-CB 4.33Å; K151-A153 PolarHBondContact O-N 3.14Å; K151-A153 VanDerWaalsContact O-N 3.16Å
154	N	97.6	Very high	94.4	Very high	10 Å²	10	23.1 Å²	23.1	5%	0.053	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-96.4	6.3	179.2	-72.3	-9.3	0	0	0	112.9	D149 K151 P152 L170	D149-N154 PolarHBondContact O-ND2 2.96Å; D149-N154 PolarHBondContact OD2-ND2 2.77Å; K151-N154 WeakPolarHBondContact CE-ND2 3.29Å; K151-N154 HydrophobicContact CG-CB 4.17Å; K151-N154 PolarHBondContact O-N 2.89Å; P152-N154 PolarHBondContact O-N 2.93Å; N154-L170 WeakPolarHBondContact O-CB 3.44Å; N154-L170 PolarHBondContact O-N 3.28Å
155	F	98.3	Very high	94.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.9	169.1	-68.6	-74.2	0	0	0	109	N102 L103 T133 L137 V150 K151 P152 I167 Y168 L169	N102-F155 CarbonylContact C-O 3.58Å; N102-F155 WeakPolarHBondContact CA-O 3.45Å; N102-F155 WeakPolarHBondContact CB-O 3.39Å; L103-F155 HydrophobicContact CD1-CB 3.58Å; L103-F155 HydrophobicContact CD1-CG 4.35Å; L103-F155 HydrophobicContact CG-CB 3.86Å; L103-F155 PolarHBondContact N-O 2.93Å; T133-F155 HydrophobicContact CG2-CB 4.38Å; T133-F155 HydrophobicContact CG2-CD1 3.59Å; T133-F155 HydrophobicContact CG2-CD2 4.06Å; T133-F155 HydrophobicContact CG2-CE1 3.71Å; T133-F155 HydrophobicContact CG2-CE2 4.17Å; T133-F155 HydrophobicContact CG2-CG 3.75Å; T133-F155 HydrophobicContact CG2-CZ 4.01Å; L137-F155 HydrophobicContact CG-CZ 4.44Å; V150-F155 HydrophobicContact CG1-CE2 3.74Å; V150-F155 HydrophobicContact CG1-CZ 4.1Å; K151-F155 WeakPolarHBondContact O-CD2 3.47Å; P152-F155 PolarHBondContact O-N 3.28Å; P152-F155 VanDerWaalsContact O-O 3.08Å; F155-I167 HydrophobicContact CB-CG2 3.81Å; F155-I167 HydrophobicContact CD1-CG2 3.99Å; F155-I167 HydrophobicContact CG-CG2 4.29Å; F155-Y168 CarbonylContact C-O 3.58Å; F155-Y168 WeakPolarHBondContact CA-O 3.43Å; F155-L169 HydrophobicContact CD1-CB 4.31Å; F155-L169 HydrophobicContact CD1-CD1 4.03Å; F155-L169 HydrophobicContact CE1-CB 4.12Å; F155-L169 HydrophobicContact CE1-CD1 3.57Å; F155-L169 HydrophobicContact CE1-CG 4.39Å; F155-L169 HydrophobicContact CZ-CD1 3.86Å
156	A	97.1	Very high	94	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.1	178	0	0	0	0	0	112.5	V99 H101 N102 I167 Y168 L170	V99-A156 HydrophobicContact CB-CB 4.07Å; V99-A156 HydrophobicContact CG2-CB 3.77Å; H101-A156 WeakPolarHBondContact O-CA 3.32Å; N102-A156 HydrophobicContact CB-CB 4.24Å; A156-I167 CarbonylContact O-C 3.57Å; A156-I167 WeakPolarHBondContact O-CA 3.37Å; A156-Y168 PolarHBondContact N-O 2.92Å; A156-Y168 PolarHBondContact O-N 3.13Å; A156-L170 HydrophobicContact CB-CD1 3.78Å; A156-L170 HydrophobicContact CB-CD2 4.41Å; A156-L170 HydrophobicContact CB-CG 4.32Å
157	I	96.1	Very high	94	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	160.4	172.5	61.8	168.4	0	0	0	110.4	G100 H101 L103 L106 T166 I167 W317 M321	G100-I157 WeakPolarHBondContact CA-O 3.36Å; G100-I157 PolarHBondContact N-O 2.91Å; H101-I157 PolarHBondContact O-N 3.44Å; H101-I157 VanDerWaalsContact O-N 3.13Å; L103-I157 HydrophobicContact CD2-CG2 4.44Å; L106-I157 HydrophobicContact CD1-CD1 4.5Å; L106-I157 HydrophobicContact CD2-CD1 3.97Å; L106-I157 HydrophobicContact CD2-CG1 4.38Å; L106-I157 HydrophobicContact CD2-CG2 3.98Å; I157-T166 CarbonylContact C-O 3.46Å; I157-T166 WeakPolarHBondContact CA-O 3.37Å; I157-I167 HydrophobicContact CG2-CG1 4.35Å; I157-W317 HydrophobicContact CD1-CG 4.22Å; I157-W317 HydrophobicContact CG2-CD2 4.41Å; I157-W317 HydrophobicContact CG2-CZ2 4.02Å; I157-M321 HydrophobicContact CD1-CE 3.96Å
158	G	92.6	Very high	94	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.01	17%	0.169	C	C	.	.			trans	-57.9	160.5	168.4	0	0	0	0	0	113.8	D163 T166	G158-D163 VanDerWaalsContact CA-CG 3.44Å; G158-D163 WeakPolarHBondContact CA-O 3.49Å; G158-D163 VanDerWaalsContact CA-OD1 3.27Å; G158-D163 WeakPolarHBondContact CA-OD1 3.13Å; G158-D163 WeakPolarHBondContact CA-OD2 3.5Å; G158-D163 PolarHBondContact N-O 3.11Å; G158-T166 PolarHBondContact N-O 3.48Å; G158-T166 VanDerWaalsContact N-O 3.09Å
159	C	88.2	Confident	94	Very high	4 Å²	4	26 Å²	26	3%	0.027	16%	0.163	C	C	.	.	S	Bend	trans	-107.3	0.4	177	58.2	0	0	0	0	113.9	L98 D163 T331	L98-C159 PolarHBondContact O-SG 3.38Å; L98-C159 VanDerWaalsContact O-SG 3.34Å; C159-D163 PolarHBondContact N-OD1 2.84Å; C159-T331 HydrophobicContact CB-CG2 4.32Å
160	H	84.8	Confident	93.9	Very high	91 Å²	91	26.9 Å²	26.9	42%	0.421	17%	0.167	S	C	.	.	S	Bend	trans	-117	151.6	179.4	-58.1	-70.2	0	0	0	110.3	A162 D163 L164	H160-A162 PolarHBondContact O-N 3.09Å; H160-D163 WeakPolarHBondContact CA-OD1 3.29Å; H160-D163 WeakPolarHBondContact CB-OD1 3.06Å; H160-D163 PolarHBondContact N-OD1 3.04Å; H160-D163 PolarHBondContact O-N 3.44Å; H160-L164 VanDerWaalsContact O-CG 3.31Å; H160-L164 WeakPolarHBondContact O-CG 3.34Å; H160-L164 PolarHBondContact O-N 3.19Å; H160-L164 VanDerWaalsContact O-N 3.13Å
161	A	83	Confident	93.7	Very high	74 Å²	74	29.2 Å²	29.2	61%	0.612	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.6	-179.8	0	0	0	0	0	113.1	D163	A161-D163 VanDerWaalsContact C-N 3.29Å; A161-D163 PolarHBondContact O-N 3.45Å
162	A	87.2	Confident	93.6	Very high	103 Å²	103	27.2 Å²	27.2	85%	0.851	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.5	179.7	0	0	0	0	0	114.5	H160	H160-A162 PolarHBondContact O-N 3.09Å
163	D	89.5	Confident	93.3	Very high	23 Å²	23	27.4 Å²	27.4	12%	0.123	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.2	15	-174.8	77.2	-19.2	0	0	0	114.5	G158 C159 H160 A161 T165 T166 Y168	G158-D163 VanDerWaalsContact CA-CG 3.44Å; G158-D163 WeakPolarHBondContact CA-O 3.49Å; G158-D163 VanDerWaalsContact CA-OD1 3.27Å; G158-D163 WeakPolarHBondContact CA-OD1 3.13Å; G158-D163 WeakPolarHBondContact CA-OD2 3.5Å; G158-D163 PolarHBondContact N-O 3.11Å; C159-D163 PolarHBondContact N-OD1 2.84Å; H160-D163 WeakPolarHBondContact CA-OD1 3.29Å; H160-D163 WeakPolarHBondContact CB-OD1 3.06Å; H160-D163 PolarHBondContact N-OD1 3.04Å; H160-D163 PolarHBondContact O-N 3.44Å; A161-D163 VanDerWaalsContact C-N 3.29Å; A161-D163 PolarHBondContact O-N 3.45Å; D163-T165 PolarHBondContact O-N 3.24Å; D163-T165 VanDerWaalsContact O-N 3.12Å; D163-T166 WeakPolarHBondContact O-CB 3.39Å; D163-T166 PolarHBondContact O-N 2.85Å; D163-Y168 HydrophobicContact CB-CE2 4.5Å; D163-Y168 WeakPolarHBondContact OD2-CE2 3.34Å; D163-Y168 PolarHBondContact OD2-OH 3.34Å
164	L	89.5	Confident	93.2	Very high	29 Å²	29	27.1 Å²	27.1	15%	0.152	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.8	178.3	-72.8	-177.9	0	0	0	114.2	H160 W317 L333	H160-L164 VanDerWaalsContact O-CG 3.31Å; H160-L164 WeakPolarHBondContact O-CG 3.34Å; H160-L164 PolarHBondContact O-N 3.19Å; H160-L164 VanDerWaalsContact O-N 3.13Å; L164-W317 PolarHBondContact O-NE1 3.27Å; L164-L333 HydrophobicContact CD2-CD2 4.41Å
165	T	92	Very high	93.1	Very high	53 Å²	53	27 Å²	27	33%	0.325	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-15.6	176.1	59.5	0	0	0	0	112.1	Y128 D163 L315	Y128-T165 PolarHBondContact OH-O 3.07Å; D163-T165 PolarHBondContact O-N 3.24Å; D163-T165 VanDerWaalsContact O-N 3.12Å; T165-L315 HydrophobicContact CG2-CD1 4.03Å
166	T	94.9	Very high	93	Very high	37 Å²	37	29.6 Å²	29.6	23%	0.227	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-76.1	129	177.4	-55.6	0	0	0	0	110.2	I157 G158 D163 Y168	I157-T166 CarbonylContact C-O 3.46Å; I157-T166 WeakPolarHBondContact CA-O 3.37Å; G158-T166 PolarHBondContact N-O 3.48Å; G158-T166 VanDerWaalsContact N-O 3.09Å; D163-T166 WeakPolarHBondContact O-CB 3.39Å; D163-T166 PolarHBondContact O-N 2.85Å; T166-Y168 HydrophobicContact CG2-CD1 4.16Å; T166-Y168 HydrophobicContact CG2-CD2 4.17Å; T166-Y168 HydrophobicContact CG2-CE1 3.71Å; T166-Y168 HydrophobicContact CG2-CE2 3.74Å; T166-Y168 HydrophobicContact CG2-CG 4.39Å
167	I	97.7	Very high	93	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.3	169.6	-60.9	171.8	0	0	0	107.9	N78 L103 Y128 I129 T133 F155 A156 I157 W317	N78-I167 PolarHBondContact ND2-O 2.8Å; L103-I167 HydrophobicContact CD2-CD1 4.43Å; Y128-I167 HydrophobicContact CD1-CD1 4.44Å; Y128-I167 HydrophobicContact CE1-CD1 4.34Å; I129-I167 HydrophobicContact CB-CD1 4.37Å; I129-I167 HydrophobicContact CG1-CD1 3.91Å; T133-I167 HydrophobicContact CG2-CG2 3.96Å; F155-I167 HydrophobicContact CB-CG2 3.81Å; F155-I167 HydrophobicContact CD1-CG2 3.99Å; F155-I167 HydrophobicContact CG-CG2 4.29Å; A156-I167 CarbonylContact O-C 3.57Å; A156-I167 WeakPolarHBondContact O-CA 3.37Å; I157-I167 HydrophobicContact CG2-CG1 4.35Å; I167-W317 HydrophobicContact CD1-CH2 4.43Å
168	Y	97.9	Very high	93.1	Very high	38 Å²	38	33 Å²	33	15%	0.149	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.8	177.9	-61.4	-82	0	0	0	110.7	N78 V99 F155 A156 D163 T166	N78-Y168 WeakPolarHBondContact O-CA 3.28Å; V99-Y168 HydrophobicContact CG1-CD2 3.94Å; V99-Y168 HydrophobicContact CG1-CG 4.23Å; F155-Y168 CarbonylContact C-O 3.58Å; F155-Y168 WeakPolarHBondContact CA-O 3.43Å; A156-Y168 PolarHBondContact N-O 2.92Å; A156-Y168 PolarHBondContact O-N 3.13Å; D163-Y168 HydrophobicContact CB-CE2 4.5Å; D163-Y168 WeakPolarHBondContact OD2-CE2 3.34Å; D163-Y168 PolarHBondContact OD2-OH 3.34Å; T166-Y168 HydrophobicContact CG2-CD1 4.16Å; T166-Y168 HydrophobicContact CG2-CD2 4.17Å; T166-Y168 HydrophobicContact CG2-CE1 3.71Å; T166-Y168 HydrophobicContact CG2-CE2 3.74Å; T166-Y168 HydrophobicContact CG2-CG 4.39Å
169	L	98.3	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	135	166.1	-179.8	65.7	0	0	0	110.6	N78 V80 T136 L137 L140 F155 F172	N78-L169 PolarHBondContact O-N 3.46Å; V80-L169 PolarHBondContact N-O 3.28Å; T136-L169 HydrophobicContact CG2-CB 3.47Å; T136-L169 VanDerWaalsContact CG2-CB 3.47Å; T136-L169 HydrophobicContact CG2-CD2 4.14Å; T136-L169 HydrophobicContact CG2-CG 4.44Å; L137-L169 HydrophobicContact CD2-CD2 4.43Å; L140-L169 HydrophobicContact CD2-CD2 3.96Å; F155-L169 HydrophobicContact CD1-CB 4.31Å; F155-L169 HydrophobicContact CD1-CD1 4.03Å; F155-L169 HydrophobicContact CE1-CB 4.12Å; F155-L169 HydrophobicContact CE1-CD1 3.57Å; F155-L169 HydrophobicContact CE1-CG 4.39Å; F155-L169 HydrophobicContact CZ-CD1 3.86Å; L169-F172 HydrophobicContact CD2-CE1 3.94Å; L169-F172 HydrophobicContact CD2-CZ 4.46Å; L169-F172 HydrophobicContact CG-CE1 4.16Å; L169-F172 HydrophobicContact CG-CZ 4.32Å
170	L	96.1	Very high	93.7	Very high	31 Å²	31	38.1 Å²	38.1	16%	0.162	21%	0.213	C	C	.	.			trans	-116.6	167.9	-177.5	-45.6	-175.7	0	0	0	111	V80 V99 H147 N154 A156	V80-L170 HydrophobicContact CB-CD2 4.41Å; V80-L170 HydrophobicContact CG1-CD2 3.29Å; V80-L170 HydrophobicContact CG2-CD2 4.28Å; V99-L170 HydrophobicContact CG1-CD2 4.29Å; V99-L170 HydrophobicContact CG2-CD1 4.2Å; V99-L170 HydrophobicContact CG2-CD2 3.94Å; H147-L170 PolarHBondContact NE2-O 3.08Å; N154-L170 WeakPolarHBondContact O-CB 3.44Å; N154-L170 PolarHBondContact O-N 3.28Å; A156-L170 HydrophobicContact CB-CD1 3.78Å; A156-L170 HydrophobicContact CB-CD2 4.41Å; A156-L170 HydrophobicContact CB-CG 4.32Å
171	D	94	Very high	94.2	Very high	51 Å²	51	39.6 Å²	39.6	27%	0.273	22%	0.22	S	C	.	.			trans	56.4	79.4	166.5	-163.5	3.5	0	0	0	116.1	K48 H147 G173	K48-D171 IonicContact NZ-OD1 3.03Å; K48-D171 PolarHBondContact NZ-OD1 2.87Å; K48-D171 VanDerWaalsContact NZ-OD1 3.13Å; H147-D171 PolarHBondContact NE2-O 2.91Å; H147-D171 VanDerWaalsContact NE2-O 3.12Å; D171-G173 PolarHBondContact O-N 2.88Å; D171-G173 PolarHBondContact OD1-N 2.98Å
172	F	95.5	Very high	94.7	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-82.6	13.3	176.9	-56.7	-77.3	0	0	0	113.3	E64 V67 M68 L71 C79 V80 L140 L169 T174 T175	E64-F172 HydrophobicContact CB-CB 4.44Å; E64-F172 VanDerWaalsContact CG-C 3.41Å; E64-F172 HydrophobicContact CG-CB 4.07Å; V67-F172 HydrophobicContact CB-CB 4.22Å; V67-F172 HydrophobicContact CG1-CB 4.03Å; V67-F172 HydrophobicContact CG1-CD1 3.86Å; V67-F172 HydrophobicContact CG1-CG 3.93Å; M68-F172 HydrophobicContact CG-CD2 3.5Å; M68-F172 VanDerWaalsContact CG-CD2 3.5Å; M68-F172 HydrophobicContact CG-CE2 3.78Å; M68-F172 HydrophobicContact CG-CG 4.41Å; M68-F172 HydrophobicContact SD-CD2 3.81Å; M68-F172 HydrophobicContact SD-CE2 4.18Å; L71-F172 HydrophobicContact CD1-CD1 4.28Å; L71-F172 HydrophobicContact CD1-CE1 3.73Å; L71-F172 HydrophobicContact CD1-CE2 4.38Å; L71-F172 HydrophobicContact CD1-CZ 3.8Å; C79-F172 HydrophobicContact CB-CZ 3.8Å; V80-F172 HydrophobicContact CG2-CE2 3.97Å; L140-F172 HydrophobicContact CD1-CD1 4.47Å; L140-F172 HydrophobicContact CD1-CE1 4.15Å; L169-F172 HydrophobicContact CD2-CE1 3.94Å; L169-F172 HydrophobicContact CD2-CZ 4.46Å; L169-F172 HydrophobicContact CG-CE1 4.16Å; L169-F172 HydrophobicContact CG-CZ 4.32Å; F172-T174 PolarHBondContact O-N 3.33Å; F172-T175 WeakPolarHBondContact CA-OG1 3.22Å; F172-T175 WeakPolarHBondContact O-CB 3.1Å; F172-T175 PolarHBondContact O-N 3.17Å; F172-T175 PolarHBondContact O-OG1 3.43Å
173	G	92.9	Very high	95	Very high	6 Å²	6	39.4 Å²	39.4	6%	0.062	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-65.2	-24.7	-172.3	0	0	0	0	0	113.6	E64 D171	E64-G173 VanDerWaalsContact CG-CA 3.46Å; D171-G173 PolarHBondContact O-N 2.88Å; D171-G173 PolarHBondContact OD1-N 2.98Å
174	T	93.7	Very high	95.3	Very high	16 Å²	16	43 Å²	43	10%	0.098	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-98.9	2.4	172.6	64.3	0	0	0	0	113	H147 R148 D149 F172 R195	H147-T174 CarbonylContact O-C 3.51Å; H147-T174 PolarHBondContact O-OG1 3.22Å; R148-T174 PolarHBondContact NE-O 3.18Å; R148-T174 PolarHBondContact NH2-O 3.45Å; D149-T174 HydrophobicContact CB-CG2 4.3Å; D149-T174 WeakPolarHBondContact CB-OG1 3.24Å; F172-T174 PolarHBondContact O-N 3.33Å; T174-R195 HydrophobicContact CG2-CB 4.15Å
175	T	96.2	Very high	95.6	Very high	7 Å²	7	43 Å²	43	4%	0.043	22%	0.224	C	C	.	.			trans	-63.6	146.1	-176.3	-71.3	0	0	0	0	112.1	V67 F145 L146 H147 F172	V67-T175 HydrophobicContact CB-CG2 4.38Å; V67-T175 HydrophobicContact CG1-CG2 3.89Å; V67-T175 HydrophobicContact CG2-CG2 3.57Å; F145-T175 HydrophobicContact CB-CG2 3.74Å; F145-T175 HydrophobicContact CD1-CG2 3.51Å; F145-T175 HydrophobicContact CE1-CG2 4.35Å; F145-T175 HydrophobicContact CG-CG2 3.82Å; L146-T175 CarbonylContact O-C 3.46Å; L146-T175 WeakPolarHBondContact O-CA 3.45Å; L146-T175 WeakPolarHBondContact O-CG2 3.42Å; H147-T175 PolarHBondContact O-N 3.1Å; F172-T175 WeakPolarHBondContact CA-OG1 3.22Å; F172-T175 WeakPolarHBondContact O-CB 3.1Å; F172-T175 PolarHBondContact O-N 3.17Å; F172-T175 PolarHBondContact O-OG1 3.43Å
176	R	95.7	Very high	95.9	Very high	55 Å²	55	43 Å²	43	21%	0.208	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	137.3	176	179.7	177	178.7	-86	-0.3	111.4	L146 Y178	L146-R176 PolarHBondContact N-O 3.3Å; L146-R176 PolarHBondContact O-N 3.25Å; R176-Y178 PolarHBondContact O-N 3Å
177	R	97.4	Very high	96	Very high	63 Å²	63	51.6 Å²	51.6	24%	0.238	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	123.4	169.5	-171.8	177	-69.5	-99.5	23.2	110.8	E70 L144 F145 A179 E181 H186	E70-R177 IonicContact OE1-CZ 3.83Å; E70-R177 IonicContact OE1-NH1 2.77Å; E70-R177 PolarHBondContact OE1-NH1 3.21Å; E70-R177 IonicContact OE1-NH2 3.05Å; E70-R177 PolarHBondContact OE1-NH2 3.15Å; E70-R177 IonicContact OE2-CZ 3.86Å; E70-R177 IonicContact OE2-NH2 2.69Å; E70-R177 PolarHBondContact OE2-NH2 2.82Å; L144-R177 HydrophobicContact CB-CG 4.35Å; L144-R177 CarbonylContact O-C 3.53Å; L144-R177 VanDerWaalsContact O-CA 3.26Å; L144-R177 WeakPolarHBondContact O-CA 3.39Å; L144-R177 WeakPolarHBondContact O-CG 3.29Å; F145-R177 HydrophobicContact CD1-CB 4.02Å; F145-R177 HydrophobicContact CE1-CB 3.85Å; R177-A179 WeakPolarHBondContact CD-O 3.28Å; R177-A179 WeakPolarHBondContact CG-O 3.3Å; R177-E181 IonicContact CZ-OE1 3.09Å; R177-E181 IonicContact NH1-OE1 3.92Å; R177-E181 PolarHBondContact NH1-OE1 3.45Å; R177-E181 IonicContact NH1-OE2 3.53Å; R177-E181 IonicContact NH2-OE1 2.76Å; R177-E181 PolarHBondContact NH2-OE1 3.19Å; R177-H186 PolarHBondContact O-CD2 2.91Å
178	Y	97.9	Very high	96	Very high	9 Å²	9	54.6 Å²	54.6	4%	0.035	27%	0.268	C	S	.	.			trans	-98.2	-16.5	-178.2	72	-91	0	0	0	114.1	H141 L144 L146 R176 H185 H186 R213	H141-Y178 WeakPolarHBondContact O-CE1 3.34Å; H141-Y178 PolarHBondContact O-OH 3.15Å; L144-Y178 VanDerWaalsContact CA-CE1 3.46Å; L144-Y178 HydrophobicContact CB-CE1 4.5Å; L144-Y178 WeakPolarHBondContact O-CD1 3.33Å; L144-Y178 PolarHBondContact O-N 3.16Å; L146-Y178 HydrophobicContact CD2-CD1 3.62Å; L146-Y178 HydrophobicContact CD2-CE1 4.33Å; L146-Y178 HydrophobicContact CD2-CG 3.99Å; L146-Y178 HydrophobicContact CG-CD1 3.86Å; L146-Y178 HydrophobicContact CG-CG 4.13Å; R176-Y178 PolarHBondContact O-N 3Å; Y178-H185 AromaticContact CD2-CD2 3.5Å; Y178-H185 AromaticContact CD2-NE2 3.52Å; Y178-H185 AromaticContact CE2-CD2 3.97Å; Y178-H186 WeakPolarHBondContact O-CB 3.35Å; Y178-H186 PolarHBondContact O-CD2 3.32Å; Y178-H186 VanDerWaalsContact O-CD2 3.24Å; Y178-H186 PolarHBondContact O-N 2.93Å; Y178-R213 HydrophobicContact CE1-CG 4.15Å; Y178-R213 HydrophobicContact CE2-CG 4.32Å; Y178-R213 PolarHBondContact OH-NH1 3.16Å
179	A	97.7	Very high	95.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-138.8	153.8	-178.9	0	0	0	0	0	111.3	L144 R177 L184	L144-A179 HydrophobicContact CD2-CB 4.2Å; R177-A179 WeakPolarHBondContact CD-O 3.28Å; R177-A179 WeakPolarHBondContact CG-O 3.3Å; A179-L184 CarbonylContact C-O 3.18Å; A179-L184 VanDerWaalsContact CA-O 3.24Å; A179-L184 WeakPolarHBondContact CA-O 3.13Å; A179-L184 WeakPolarHBondContact CB-O 3.5Å
180	K	96.4	Very high	95.8	Very high	113 Å²	113	62.8 Å²	62.8	49%	0.491	32%	0.322	S	S	.	.			trans	-67.4	162.2	169.9	-63.5	-178	-177.8	-175.9	0	110.2	L144 N182 G183 L184	L144-K180 VanDerWaalsContact CD1-O 3.24Å; L144-K180 WeakPolarHBondContact CD1-O 3.35Å; K180-N182 VanDerWaalsContact CB-OD1 3.28Å; K180-N182 WeakPolarHBondContact CB-OD1 3.22Å; K180-N182 PolarHBondContact O-N 2.85Å; K180-N182 VanDerWaalsContact O-N 3.07Å; K180-G183 WeakPolarHBondContact O-CA 3.41Å; K180-G183 PolarHBondContact O-N 3.48Å; K180-L184 HydrophobicContact CD-CD2 4.43Å; K180-L184 PolarHBondContact N-O 2.81Å
181	E	94.2	Very high	95.7	Very high	123 Å²	123	68.2 Å²	68.2	58%	0.575	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-26.7	178.5	-66.8	-61.1	160	0	0	113.8	K74 R177 G183	K74-E181 IonicContact NZ-OE2 3.45Å; R177-E181 IonicContact CZ-OE1 3.09Å; R177-E181 IonicContact NH1-OE1 3.92Å; R177-E181 PolarHBondContact NH1-OE1 3.45Å; R177-E181 IonicContact NH1-OE2 3.53Å; R177-E181 IonicContact NH2-OE1 2.76Å; R177-E181 PolarHBondContact NH2-OE1 3.19Å; E181-G183 PolarHBondContact O-N 3.28Å
182	N	94.6	Very high	95.6	Very high	124 Å²	124	66.3 Å²	66.3	66%	0.663	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	7.9	173.3	72.7	-8.8	0	0	0	114.2	K180 L184	K180-N182 VanDerWaalsContact CB-OD1 3.28Å; K180-N182 WeakPolarHBondContact CB-OD1 3.22Å; K180-N182 PolarHBondContact O-N 2.85Å; K180-N182 VanDerWaalsContact O-N 3.07Å; N182-L184 VanDerWaalsContact C-N 3.31Å; N182-L184 PolarHBondContact O-N 3.17Å; N182-L184 VanDerWaalsContact OD1-CB 3.22Å; N182-L184 WeakPolarHBondContact OD1-CB 3.35Å; N182-L184 PolarHBondContact OD1-N 3.49Å; N182-L184 VanDerWaalsContact OD1-N 3.08Å
183	G	92.3	Very high	95.4	Very high	48 Å²	48	69.5 Å²	69.5	50%	0.495	36%	0.361	S	S	.	.	S	Bend	trans	82.6	-4.6	-179.2	0	0	0	0	0	115.3	K180 E181 H185	K180-G183 WeakPolarHBondContact O-CA 3.41Å; K180-G183 PolarHBondContact O-N 3.48Å; E181-G183 PolarHBondContact O-N 3.28Å; G183-H185 PolarHBondContact O-N 2.6Å
184	L	95.7	Very high	95.4	Very high	100 Å²	100	70 Å²	70	52%	0.524	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-69	116.2	-179.2	-177.3	65.3	0	0	0	111.1	A179 K180 N182 H186	A179-L184 CarbonylContact C-O 3.18Å; A179-L184 VanDerWaalsContact CA-O 3.24Å; A179-L184 WeakPolarHBondContact CA-O 3.13Å; A179-L184 WeakPolarHBondContact CB-O 3.5Å; K180-L184 HydrophobicContact CD-CD2 4.43Å; K180-L184 PolarHBondContact N-O 2.81Å; N182-L184 VanDerWaalsContact C-N 3.31Å; N182-L184 PolarHBondContact O-N 3.17Å; N182-L184 VanDerWaalsContact OD1-CB 3.22Å; N182-L184 WeakPolarHBondContact OD1-CB 3.35Å; N182-L184 PolarHBondContact OD1-N 3.49Å; N182-L184 VanDerWaalsContact OD1-N 3.08Å; L184-H186 PolarHBondContact O-N 3.21Å
185	H	97.4	Very high	95	Very high	27 Å²	27	73.9 Å²	73.9	13%	0.125	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-61.3	134.1	176.8	-158.9	-61.2	0	0	0	111	Y178 G183 F286 Y287	Y178-H185 AromaticContact CD2-CD2 3.5Å; Y178-H185 AromaticContact CD2-NE2 3.52Å; Y178-H185 AromaticContact CE2-CD2 3.97Å; G183-H185 PolarHBondContact O-N 2.6Å; H185-F286 AromaticContact CE1-CD1 3.96Å; H185-F286 AromaticContact CE1-CE1 3.29Å; H185-F286 WeakPolarHBondContact CE1-CE1 3.26Å; H185-F286 AromaticContact CE1-CZ 3.54Å; H185-F286 AromaticContact ND1-CE1 3.6Å; H185-F286 PolarHBondContact NE2-O 3.24Å; H185-Y287 HydrophobicContact CB-CD1 3.85Å; H185-Y287 HydrophobicContact CB-CE1 4.23Å; H185-Y287 AromaticContact CG-CD1 3.66Å; H185-Y287 AromaticContact ND1-CD1 3.8Å; H185-Y287 AromaticContact ND1-CE1 3.88Å
186	H	97.2	Very high	94.6	Very high	55 Å²	55	75.1 Å²	75.1	26%	0.255	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-63.8	145.9	173.1	-67.5	-51.8	0	0	0	110.7	R177 Y178 L184	R177-H186 PolarHBondContact O-CD2 2.91Å; Y178-H186 WeakPolarHBondContact O-CB 3.35Å; Y178-H186 PolarHBondContact O-CD2 3.32Å; Y178-H186 VanDerWaalsContact O-CD2 3.24Å; Y178-H186 PolarHBondContact O-N 2.93Å; L184-H186 PolarHBondContact O-N 3.21Å
187	R	97	Very high	94.4	Very high	216 Å²	216	73.8 Å²	73.8	82%	0.815	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-62.8	143.2	169.5	-68	-178.3	178.8	166.7	-1	109.6	R189	R187-R189 PolarHBondContact O-N 3.4Å
188	P	97.1	Very high	94.3	Very high	64 Å²	64	72.4 Å²	72.4	42%	0.416	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-63.2	135.7	177.4	26.3	-33.6	0	0	0	110	D210 F286 Y287	P188-D210 HydrophobicContact CB-CB 4.07Å; P188-F286 HydrophobicContact CB-CD1 4.23Å; P188-F286 HydrophobicContact CB-CD2 4.43Å; P188-F286 HydrophobicContact CB-CE1 3.74Å; P188-F286 HydrophobicContact CB-CE2 3.98Å; P188-F286 HydrophobicContact CB-CZ 3.61Å; P188-F286 HydrophobicContact CG-CD1 4.31Å; P188-F286 HydrophobicContact CG-CE1 4.08Å; P188-F286 HydrophobicContact CG-CZ 4.44Å; P188-Y287 WeakPolarHBondContact CD-OH 3.45Å
189	R	96.8	Very high	94.3	Very high	99 Å²	99	73.9 Å²	73.9	37%	0.374	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-70	145.5	166.9	-66	169.4	-69.9	164.5	3.5	109.7	R187 K191 V192 D210	R187-R189 PolarHBondContact O-N 3.4Å; R189-K191 VanDerWaalsContact C-N 3.29Å; R189-K191 PolarHBondContact O-N 2.91Å; R189-V192 HydrophobicContact CB-CG2 3.76Å; R189-D210 HydrophobicContact CB-CB 4.39Å; R189-D210 WeakPolarHBondContact CB-OD2 3.34Å; R189-D210 WeakPolarHBondContact CG-OD2 3.27Å; R189-D210 IonicContact CZ-OD1 3.4Å; R189-D210 IonicContact CZ-OD2 3.53Å; R189-D210 PolarHBondContact N-OD2 3.12Å; R189-D210 IonicContact NE-OD1 3.93Å; R189-D210 PolarHBondContact NE-OD1 2.66Å; R189-D210 IonicContact NE-OD2 3.13Å; R189-D210 PolarHBondContact NE-OD2 3.06Å; R189-D210 IonicContact NH2-OD1 2.79Å; R189-D210 PolarHBondContact NH2-OD1 3.05Å; R189-D210 IonicContact NH2-OD2 3Å
190	A	95.2	Very high	94.3	Very high	111 Å²	111	74.8 Å²	74.8	92%	0.917	40%	0.398	S	S	*	.	S	Bend	trans	-61.6	-37.9	-178.8	0	0	0	0	0	112.8
191	K	94.1	Very high	94.4	Very high	145 Å²	145	69.7 Å²	69.7	63%	0.63	38%	0.377	S	S	*	.			trans	-147.3	136.3	179.7	-167	172.4	-175.7	175.8	0	110.8	R189 E208	R189-K191 VanDerWaalsContact C-N 3.29Å; R189-K191 PolarHBondContact O-N 2.91Å; K191-E208 WeakPolarHBondContact CA-O 3.43Å; K191-E208 VanDerWaalsContact CE-CD 3.42Å; K191-E208 WeakPolarHBondContact CE-OE2 3.41Å; K191-E208 HydrophobicContact CG-CB 4.09Å; K191-E208 IonicContact NZ-OE2 2.82Å; K191-E208 PolarHBondContact NZ-OE2 3.37Å
192	V	93.6	Very high	94.5	Very high	11 Å²	11	63.9 Å²	63.9	7%	0.067	35%	0.35	C	S	.	.			trans	-136.6	115.3	-179.1	-176.9	0	0	0	0	109.1	R189 F194 E208 D210	R189-V192 HydrophobicContact CB-CG2 3.76Å; V192-F194 PolarHBondContact O-N 3.24Å; V192-E208 PolarHBondContact N-O 2.83Å; V192-E208 WeakPolarHBondContact O-CA 3.13Å; V192-E208 VanDerWaalsContact O-CB 3.23Å; V192-E208 WeakPolarHBondContact O-CB 3.25Å; V192-D210 HydrophobicContact CG2-CB 3.9Å
193	A	91.3	Very high	94.7	Very high	67 Å²	67	58.8 Å²	58.8	55%	0.554	33%	0.325	S	S	*	.			trans	-55.2	127.7	174.9	0	0	0	0	0	110.6
194	F	91.3	Very high	94.9	Very high	16 Å²	16	57.7 Å²	57.7	7%	0.07	31%	0.308	C	S	.	.			trans	-69.9	132	179.8	175.8	-107.9	0	0	0	111.2	V192 G196 T198 A201 A205 L206 F245	V192-F194 PolarHBondContact O-N 3.24Å; F194-G196 VanDerWaalsContact CE1-O 3.24Å; F194-G196 WeakPolarHBondContact CE1-O 3.19Å; F194-G196 VanDerWaalsContact CZ-C 3.49Å; F194-G196 WeakPolarHBondContact CZ-O 3.31Å; F194-T198 HydrophobicContact CE1-CG2 3.85Å; F194-A201 HydrophobicContact CE2-CB 3.36Å; F194-A201 HydrophobicContact CZ-CB 3.43Å; F194-A201 VanDerWaalsContact CZ-CB 3.43Å; F194-A205 HydrophobicContact CD2-CB 3.94Å; F194-A205 WeakPolarHBondContact CD2-O 3.02Å; F194-A205 HydrophobicContact CE2-CB 4.01Å; F194-L206 HydrophobicContact CD1-CD2 4.16Å; F194-L206 HydrophobicContact CE1-CD2 3.88Å; F194-L206 HydrophobicContact CE2-CD2 4.33Å; F194-L206 HydrophobicContact CG-CD2 4.48Å; F194-L206 HydrophobicContact CZ-CD2 3.98Å; F194-F245 HydrophobicContact CD1-CZ 4.5Å
195	R	85.8	Confident	95	Very high	99 Å²	99	53 Å²	53	37%	0.374	28%	0.283	S	S	.	.			trans	-132.6	129.4	169.8	-64.5	-177.7	174.9	-178.8	-8.2	107.1	E57 T174	E57-R195 PolarHBondContact O-NH1 2.88Å; E57-R195 VanDerWaalsContact O-NH1 3.14Å; E57-R195 PolarHBondContact O-NH2 3.4Å; T174-R195 HydrophobicContact CG2-CB 4.15Å
196	G	87.7	Confident	95	Very high	32 Å²	32	51.8 Å²	51.8	33%	0.33	28%	0.278	S	S	.	.	S	Bend	trans	137.3	-173.9	178.8	0	0	0	0	0	113.2	D149 F194 T198	D149-G196 WeakPolarHBondContact OD1-CA 3.27Å; F194-G196 VanDerWaalsContact CE1-O 3.24Å; F194-G196 WeakPolarHBondContact CE1-O 3.19Å; F194-G196 VanDerWaalsContact CZ-C 3.49Å; F194-G196 WeakPolarHBondContact CZ-O 3.31Å; G196-T198 PolarHBondContact O-N 3.44Å
197	S	92.7	Very high	95	Very high	28 Å²	28	52.8 Å²	52.8	20%	0.196	28%	0.28	C	S	.	.			trans	-77.7	118.3	178.8	-179.6	0	0	0	0	112.1	D149 L199 Y200 A201	D149-S197 PolarHBondContact OD1-N 3.44Å; S197-L199 PolarHBondContact O-N 2.73Å; S197-Y200 PolarHBondContact O-N 3.18Å; S197-Y200 WeakPolarHBondContact OG-CD2 3.42Å; S197-A201 VanDerWaalsContact O-CB 3.3Å; S197-A201 WeakPolarHBondContact O-CB 3.36Å; S197-A201 PolarHBondContact O-N 3.34Å
198	T	95.2	Very high	95	Very high	33 Å²	33	44.4 Å²	44.4	20%	0.202	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-29.1	177.5	52.7	0	0	0	0	112.7	F194 G196 L206 F245 Q249 K256	F194-T198 HydrophobicContact CE1-CG2 3.85Å; G196-T198 PolarHBondContact O-N 3.44Å; T198-L206 HydrophobicContact CG2-CD2 4.1Å; T198-F245 HydrophobicContact CG2-CE2 4.27Å; T198-Q249 HydrophobicContact CG2-CG 4.44Å; T198-K256 PolarHBondContact O-NZ 2.88Å
199	L	96.3	Very high	95	Very high	40 Å²	40	47.9 Å²	47.9	21%	0.209	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-42.1	-179.5	-174.8	60	0	0	0	111.6	S197 L232 W234 K256	S197-L199 PolarHBondContact O-N 2.73Å; L199-L232 HydrophobicContact CD1-CD1 4.06Å; L199-L232 HydrophobicContact CG-CD1 4Å; L199-W234 PolarHBondContact O-NE1 3.19Å; L199-K256 WeakPolarHBondContact O-CE 3.37Å; L199-K256 PolarHBondContact O-NZ 3.23Å
200	Y	98.2	Very high	95	Very high	19 Å²	19	43.4 Å²	43.4	8%	0.075	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-18.8	-173.4	-52.7	-74.1	0	0	0	114.5	V150 K151 P152 S197 S219 F222 L232	V150-Y200 WeakPolarHBondContact O-CB 3.38Å; K151-Y200 HydrophobicContact CB-CD2 3.31Å; K151-Y200 HydrophobicContact CB-CE2 3.72Å; K151-Y200 HydrophobicContact CB-CG 3.9Å; K151-Y200 HydrophobicContact CG-CD2 4.5Å; P152-Y200 HydrophobicContact CG-CE1 4.07Å; S197-Y200 PolarHBondContact O-N 3.18Å; S197-Y200 WeakPolarHBondContact OG-CD2 3.42Å; Y200-S219 VanDerWaalsContact O-CA 3.22Å; Y200-S219 WeakPolarHBondContact O-CA 3.33Å; Y200-S219 VanDerWaalsContact O-CB 3.29Å; Y200-S219 WeakPolarHBondContact O-CB 3.37Å; Y200-S219 PolarHBondContact O-OG 3.01Å; Y200-F222 VanDerWaalsContact O-CD2 3.3Å; Y200-F222 WeakPolarHBondContact O-CD2 3.3Å; Y200-L232 HydrophobicContact CD1-CD1 4.01Å; Y200-L232 HydrophobicContact CE1-CD1 4.08Å
201	A	98	Very high	95.1	Very high	7 Å²	7	38.3 Å²	38.3	6%	0.058	20%	0.195	C	C	.	.	S	Bend	trans	-60.4	150.6	-177	0	0	0	0	0	114.4	F194 S197 A205 L206 K256	F194-A201 HydrophobicContact CE2-CB 3.36Å; F194-A201 HydrophobicContact CZ-CB 3.43Å; F194-A201 VanDerWaalsContact CZ-CB 3.43Å; S197-A201 VanDerWaalsContact O-CB 3.3Å; S197-A201 WeakPolarHBondContact O-CB 3.36Å; S197-A201 PolarHBondContact O-N 3.34Å; A201-A205 HydrophobicContact CB-CB 4.27Å; A201-L206 HydrophobicContact CB-CD2 4.17Å; A201-L206 HydrophobicContact CB-CG 4.16Å; A201-K256 WeakPolarHBondContact O-CD 3.27Å; A201-K256 WeakPolarHBondContact O-CE 3.22Å; A201-K256 PolarHBondContact O-NZ 3.21Å
202	S	97.8	Very high	95.3	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.007	17%	0.165	C	C	.	.			trans	-62.9	157.9	173.1	86.4	0	0	0	0	112	N204 A205 L206 D215 S219	S202-N204 PolarHBondContact O-N 3.09Å; S202-N204 PolarHBondContact OG-N 3.41Å; S202-A205 PolarHBondContact O-N 2.82Å; S202-A205 PolarHBondContact OG-N 2.93Å; S202-A205 VanDerWaalsContact OG-N 3.12Å; S202-L206 PolarHBondContact O-N 3.04Å; S202-L206 VanDerWaalsContact O-N 3.16Å; S202-D215 WeakPolarHBondContact CB-OD1 3.33Å; S202-D215 PolarHBondContact OG-OD1 2.9Å; S202-S219 PolarHBondContact N-OG 2.86Å
203	A	97.5	Very high	95.5	Very high	16 Å²	16	32.3 Å²	32.3	13%	0.132	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-27.1	173.8	0	0	0	0	0	112.8	R207 A253 K256 V257	A203-R207 WeakPolarHBondContact O-CG 3.44Å; A203-R207 PolarHBondContact O-N 2.82Å; A203-A253 HydrophobicContact CB-CB 4.38Å; A203-K256 HydrophobicContact CB-CB 4.2Å; A203-V257 HydrophobicContact CB-CG2 3.72Å
204	N	97.5	Very high	95.9	Very high	25 Å²	25	30.8 Å²	30.8	13%	0.134	15%	0.147	C	C	.	.	H	α-helix	trans	-69.5	-44.5	175.3	-61.6	-54.2	0	0	0	111.1	S202 L206 R207 E208 R209 R214 D215	S202-N204 PolarHBondContact O-N 3.09Å; S202-N204 PolarHBondContact OG-N 3.41Å; N204-L206 VanDerWaalsContact C-N 3.34Å; N204-L206 PolarHBondContact O-N 3.44Å; N204-R207 CarbonylContact O-C 3.53Å; N204-R207 PolarHBondContact O-N 2.91Å; N204-R207 VanDerWaalsContact O-N 3.12Å; N204-E208 PolarHBondContact O-N 2.99Å; N204-R209 HydrophobicContact CB-CB 4.14Å; N204-R209 WeakPolarHBondContact O-CB 3.04Å; N204-R209 PolarHBondContact O-N 3.31Å; N204-R209 VanDerWaalsContact O-N 3.08Å; N204-R209 PolarHBondContact OD1-NH1 2.8Å; N204-R214 PolarHBondContact ND2-NE 3.33Å; N204-D215 WeakPolarHBondContact CB-OD1 3.12Å; N204-D215 PolarHBondContact ND2-OD1 3.47Å; N204-D215 VanDerWaalsContact ND2-OD1 3.09Å
205	A	97.5	Very high	96.2	Very high	1 Å²	1	30 Å²	30	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-43.7	179.5	0	0	0	0	0	111.4	F194 A201 S202 R207 E208 Q211	F194-A205 HydrophobicContact CD2-CB 3.94Å; F194-A205 WeakPolarHBondContact CD2-O 3.02Å; F194-A205 HydrophobicContact CE2-CB 4.01Å; A201-A205 HydrophobicContact CB-CB 4.27Å; S202-A205 PolarHBondContact O-N 2.82Å; S202-A205 PolarHBondContact OG-N 2.93Å; S202-A205 VanDerWaalsContact OG-N 3.12Å; A205-R207 PolarHBondContact O-N 3.05Å; A205-E208 PolarHBondContact O-N 2.75Å; A205-E208 VanDerWaalsContact O-N 3.13Å; A205-Q211 HydrophobicContact CB-CG 3.77Å
206	L	97.5	Very high	96.8	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-23.2	176.1	-68.3	177.3	0	0	0	113.8	F194 T198 A201 S202 N204 E208 Q249 A253 K256	F194-L206 HydrophobicContact CD1-CD2 4.16Å; F194-L206 HydrophobicContact CE1-CD2 3.88Å; F194-L206 HydrophobicContact CE2-CD2 4.33Å; F194-L206 HydrophobicContact CG-CD2 4.48Å; F194-L206 HydrophobicContact CZ-CD2 3.98Å; T198-L206 HydrophobicContact CG2-CD2 4.1Å; A201-L206 HydrophobicContact CB-CD2 4.17Å; A201-L206 HydrophobicContact CB-CG 4.16Å; S202-L206 PolarHBondContact O-N 3.04Å; S202-L206 VanDerWaalsContact O-N 3.16Å; N204-L206 VanDerWaalsContact C-N 3.34Å; N204-L206 PolarHBondContact O-N 3.44Å; L206-E208 VanDerWaalsContact C-N 3.3Å; L206-Q249 HydrophobicContact CB-CB 4.4Å; L206-Q249 HydrophobicContact CD2-CB 4.25Å; L206-Q249 HydrophobicContact CD2-CG 4.1Å; L206-Q249 PolarHBondContact O-OE1 3Å; L206-A253 HydrophobicContact CB-CB 3.89Å; L206-A253 HydrophobicContact CD1-CB 4.2Å; L206-K256 HydrophobicContact CD1-CD 3.96Å
207	R	97	Very high	97.3	Very high	76 Å²	76	23.8 Å²	23.8	29%	0.287	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	21.1	175.1	-70.1	-170	177	120.4	-3.7	113.1	A203 N204 A205 R209 E250 A253 T254	A203-R207 WeakPolarHBondContact O-CG 3.44Å; A203-R207 PolarHBondContact O-N 2.82Å; N204-R207 CarbonylContact O-C 3.53Å; N204-R207 PolarHBondContact O-N 2.91Å; N204-R207 VanDerWaalsContact O-N 3.12Å; A205-R207 PolarHBondContact O-N 3.05Å; R207-R209 PolarHBondContact O-N 2.72Å; R207-E250 WeakPolarHBondContact CG-OE2 3.48Å; R207-E250 IonicContact CZ-OE1 3.82Å; R207-E250 IonicContact CZ-OE2 2.72Å; R207-E250 IonicContact NE-OE1 3.53Å; R207-E250 PolarHBondContact NE-OE1 3.39Å; R207-E250 VanDerWaalsContact NE-OE1 3.13Å; R207-E250 IonicContact NE-OE2 3.52Å; R207-E250 PolarHBondContact NE-OE2 2.82Å; R207-E250 IonicContact NH2-OE1 2.84Å; R207-E250 PolarHBondContact NH2-OE1 2.92Å; R207-E250 IonicContact NH2-OE2 3.39Å; R207-A253 HydrophobicContact CG-CB 3.93Å; R207-T254 PolarHBondContact NH2-OG1 3.32Å
208	E	96.2	Very high	97.6	Very high	40 Å²	40	23.8 Å²	23.8	19%	0.187	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	25.2	176.7	-57.2	-172.2	111.1	0	0	114.1	K191 V192 N204 A205 L206	K191-E208 WeakPolarHBondContact CA-O 3.43Å; K191-E208 VanDerWaalsContact CE-CD 3.42Å; K191-E208 WeakPolarHBondContact CE-OE2 3.41Å; K191-E208 HydrophobicContact CG-CB 4.09Å; K191-E208 IonicContact NZ-OE2 2.82Å; K191-E208 PolarHBondContact NZ-OE2 3.37Å; V192-E208 PolarHBondContact N-O 2.83Å; V192-E208 WeakPolarHBondContact O-CA 3.13Å; V192-E208 VanDerWaalsContact O-CB 3.23Å; V192-E208 WeakPolarHBondContact O-CB 3.25Å; N204-E208 PolarHBondContact O-N 2.99Å; A205-E208 PolarHBondContact O-N 2.75Å; A205-E208 VanDerWaalsContact O-N 3.13Å; L206-E208 VanDerWaalsContact C-N 3.3Å
209	R	97	Very high	97.8	Very high	137 Å²	137	22.4 Å²	22.4	52%	0.517	10%	0.098	S	C	.	.	P	Polyproline II helix	trans	-78.9	150.1	170.2	-61.8	-179.9	176.3	176.5	-6.1	109.1	N204 R207 Q211	N204-R209 HydrophobicContact CB-CB 4.14Å; N204-R209 WeakPolarHBondContact O-CB 3.04Å; N204-R209 PolarHBondContact O-N 3.31Å; N204-R209 VanDerWaalsContact O-N 3.08Å; N204-R209 PolarHBondContact OD1-NH1 2.8Å; R207-R209 PolarHBondContact O-N 2.72Å; R209-Q211 PolarHBondContact O-N 3.21Å
210	D	97.3	Very high	97.9	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.021	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-62	136.2	174.8	-150.1	-6.8	0	0	0	110.5	P188 R189 V192 F286	P188-D210 HydrophobicContact CB-CB 4.07Å; R189-D210 HydrophobicContact CB-CB 4.39Å; R189-D210 WeakPolarHBondContact CB-OD2 3.34Å; R189-D210 WeakPolarHBondContact CG-OD2 3.27Å; R189-D210 IonicContact CZ-OD1 3.4Å; R189-D210 IonicContact CZ-OD2 3.53Å; R189-D210 PolarHBondContact N-OD2 3.12Å; R189-D210 IonicContact NE-OD1 3.93Å; R189-D210 PolarHBondContact NE-OD1 2.66Å; R189-D210 IonicContact NE-OD2 3.13Å; R189-D210 PolarHBondContact NE-OD2 3.06Å; R189-D210 IonicContact NH2-OD1 2.79Å; R189-D210 PolarHBondContact NH2-OD1 3.05Å; R189-D210 IonicContact NH2-OD2 3Å; V192-D210 HydrophobicContact CG2-CB 3.9Å; D210-F286 HydrophobicContact CB-CE2 3.93Å; D210-F286 HydrophobicContact CB-CZ 4.27Å; D210-F286 VanDerWaalsContact O-CE2 3.31Å; D210-F286 WeakPolarHBondContact O-CE2 3.31Å
211	Q	98.1	Very high	97.9	Very high	5 Å²	5	19.6 Å²	19.6	2%	0.023	8%	0.084	C	C	.	.	P	Polyproline II helix	trans	-86.9	150.5	-177.1	-67.8	178.7	71.4	0	0	110.1	L146 R148 A205 R209 D215	L146-Q211 HydrophobicContact CD1-CB 4.43Å; L146-Q211 VanDerWaalsContact CD1-O 3.22Å; L146-Q211 WeakPolarHBondContact CD1-O 3.33Å; R148-Q211 HydrophobicContact CG-CB 4.37Å; A205-Q211 HydrophobicContact CB-CG 3.77Å; R209-Q211 PolarHBondContact O-N 3.21Å; Q211-D215 WeakPolarHBondContact CA-OD2 3.39Å; Q211-D215 HydrophobicContact CB-CB 4.15Å; Q211-D215 HydrophobicContact CG-CB 4.21Å
212	S	98.2	Very high	98	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.007	8%	0.082	C	C	.	.			trans	-138.5	-176.7	176.2	59.6	0	0	0	0	109.5	L146 R214 D215 F286	L146-S212 VanDerWaalsContact CD2-C 3.46Å; S212-R214 PolarHBondContact O-N 3.33Å; S212-R214 VanDerWaalsContact O-N 3.1Å; S212-R214 WeakPolarHBondContact OG-CG 3.43Å; S212-D215 PolarHBondContact N-OD2 3.32Å; S212-D215 WeakPolarHBondContact O-CB 3.49Å; S212-D215 PolarHBondContact O-N 3.4Å; S212-D215 PolarHBondContact OG-OD2 2.82Å; S212-F286 WeakPolarHBondContact CB-O 3.35Å; S212-F286 PolarHBondContact OG-O 3.07Å
213	R	98.5	Very high	98	Very high	28 Å²	28	19.4 Å²	19.4	11%	0.106	8%	0.082	C	C	.	.	H	α-helix	trans	-52.8	-35.8	179.3	-65.5	175.6	-72.5	-147.5	-0.3	112.7	H141 L146 Y178 D215 D216 I217 Y287 S288 P290	H141-R213 HydrophobicContact CB-CG 4.39Å; L146-R213 HydrophobicContact CD2-CB 4.38Å; L146-R213 HydrophobicContact CD2-CG 3.83Å; L146-R213 VanDerWaalsContact CD2-N 3.33Å; Y178-R213 HydrophobicContact CE1-CG 4.15Å; Y178-R213 HydrophobicContact CE2-CG 4.32Å; Y178-R213 PolarHBondContact OH-NH1 3.16Å; R213-D215 PolarHBondContact O-N 2.97Å; R213-D216 PolarHBondContact O-N 3.24Å; R213-I217 WeakPolarHBondContact O-CG1 3.25Å; R213-I217 PolarHBondContact O-N 3.01Å; R213-I217 VanDerWaalsContact O-N 3.16Å; R213-Y287 PolarHBondContact NH2-O 3.06Å; R213-S288 PolarHBondContact NE-O 3.47Å; R213-S288 PolarHBondContact NH2-O 3.11Å; R213-P290 HydrophobicContact CB-CG 3.99Å
214	R	98	Very high	98	Very high	35 Å²	35	18.7 Å²	18.7	13%	0.132	8%	0.076	C	C	.	.	H	α-helix	trans	-58.1	-33.3	178.4	80.5	-169.5	169.8	171.2	-5.8	112.5	N204 S212 I217 W218 L284	N204-R214 PolarHBondContact ND2-NE 3.33Å; S212-R214 PolarHBondContact O-N 3.33Å; S212-R214 VanDerWaalsContact O-N 3.1Å; S212-R214 WeakPolarHBondContact OG-CG 3.43Å; R214-I217 PolarHBondContact O-N 2.53Å; R214-W218 PolarHBondContact O-N 3.12Å; R214-L284 HydrophobicContact CB-CB 3.68Å; R214-L284 HydrophobicContact CB-CD1 4.13Å; R214-L284 VanDerWaalsContact CD-O 3.24Å; R214-L284 WeakPolarHBondContact CD-O 3.3Å; R214-L284 PolarHBondContact NH1-O 3.33Å
215	D	98.5	Very high	98.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-77	-35.3	-173.4	-59.1	-70.4	0	0	0	110.9	S202 N204 Q211 S212 R213 S219	S202-D215 WeakPolarHBondContact CB-OD1 3.33Å; S202-D215 PolarHBondContact OG-OD1 2.9Å; N204-D215 WeakPolarHBondContact CB-OD1 3.12Å; N204-D215 PolarHBondContact ND2-OD1 3.47Å; N204-D215 VanDerWaalsContact ND2-OD1 3.09Å; Q211-D215 WeakPolarHBondContact CA-OD2 3.39Å; Q211-D215 HydrophobicContact CB-CB 4.15Å; Q211-D215 HydrophobicContact CG-CB 4.21Å; S212-D215 PolarHBondContact N-OD2 3.32Å; S212-D215 WeakPolarHBondContact O-CB 3.49Å; S212-D215 PolarHBondContact O-N 3.4Å; S212-D215 PolarHBondContact OG-OD2 2.82Å; R213-D215 PolarHBondContact O-N 2.97Å; D215-S219 WeakPolarHBondContact O-CB 3.29Å; D215-S219 PolarHBondContact O-N 2.86Å; D215-S219 PolarHBondContact O-OG 2.97Å
216	D	98.7	Very high	98.1	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-64.3	-41	169.2	-79.5	-14.9	0	0	0	111.3	H141 L146 H147 R148 V150 R213 S219 W220	H141-D216 IonicContact CE1-OD2 2.97Å; H141-D216 IonicContact NE2-OD2 3.68Å; H141-D216 PolarHBondContact NE2-OD2 2.82Å; H141-D216 VanDerWaalsContact NE2-OD2 3.09Å; L146-D216 VanDerWaalsContact CA-OD2 3.31Å; L146-D216 WeakPolarHBondContact CA-OD2 3.35Å; H147-D216 PolarHBondContact N-OD2 2.91Å; R148-D216 WeakPolarHBondContact CA-OD1 3.27Å; R148-D216 PolarHBondContact N-OD1 3.26Å; V150-D216 HydrophobicContact CG2-CB 4.08Å; R213-D216 PolarHBondContact O-N 3.24Å; D216-S219 PolarHBondContact O-N 3.24Å; D216-W220 WeakPolarHBondContact O-CB 3.45Å; D216-W220 PolarHBondContact O-N 2.84Å
217	I	98.6	Very high	98.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-71.4	-36.6	179.1	-56.6	-54.5	0	0	0	112.5	L134 L137 R213 R214 S219 W220 L221 M281 P290 Y292 I295	L134-I217 HydrophobicContact CD1-CD1 3.93Å; L137-I217 HydrophobicContact CD1-CD1 4.33Å; R213-I217 WeakPolarHBondContact O-CG1 3.25Å; R213-I217 PolarHBondContact O-N 3.01Å; R213-I217 VanDerWaalsContact O-N 3.16Å; R214-I217 PolarHBondContact O-N 2.53Å; I217-S219 VanDerWaalsContact C-N 3.35Å; I217-W220 HydrophobicContact CG2-CE3 4.07Å; I217-W220 WeakPolarHBondContact O-CB 3.33Å; I217-W220 PolarHBondContact O-N 3.33Å; I217-L221 PolarHBondContact O-N 3.43Å; I217-M281 HydrophobicContact CG2-CE 3.8Å; I217-M281 HydrophobicContact CG2-CG 4.03Å; I217-M281 HydrophobicContact CG2-SD 3.78Å; I217-M281 VanDerWaalsContact O-CE 3.32Å; I217-M281 WeakPolarHBondContact O-CE 3.49Å; I217-P290 HydrophobicContact CG1-CB 4.04Å; I217-P290 HydrophobicContact CG1-CG 3.75Å; I217-Y292 HydrophobicContact CD1-CD1 4.37Å; I217-Y292 HydrophobicContact CD1-CE1 3.77Å; I217-Y292 HydrophobicContact CG1-CE1 4.4Å; I217-I295 HydrophobicContact CG2-CD1 4.1Å
218	W	98.3	Very high	98.2	Very high	28 Å²	28	15 Å²	15	11%	0.106	6%	0.064	C	C	.	.	H	α-helix	trans	-62	-43.7	169.8	-84.9	112.1	0	0	0	112.1	R214 W220 L221 F222 T260 L266 M278 M281	R214-W218 PolarHBondContact O-N 3.12Å; W218-W220 VanDerWaalsContact C-N 3.3Å; W218-W220 PolarHBondContact O-N 3.46Å; W218-L221 HydrophobicContact CE3-CD2 4.26Å; W218-L221 HydrophobicContact CZ3-CD2 3.93Å; W218-L221 PolarHBondContact O-N 3.01Å; W218-F222 HydrophobicContact CB-CE2 4.47Å; W218-F222 AromaticContact CE3-CE1 3.81Å; W218-F222 HydrophobicContact CE3-CE1 3.81Å; W218-F222 AromaticContact CE3-CZ 3.74Å; W218-F222 HydrophobicContact CE3-CZ 3.74Å; W218-F222 HydrophobicContact CZ3-CE1 4.22Å; W218-F222 HydrophobicContact CZ3-CZ 4.42Å; W218-F222 WeakPolarHBondContact O-CD2 3.5Å; W218-F222 VanDerWaalsContact O-CG 3.28Å; W218-F222 WeakPolarHBondContact O-CG 3.38Å; W218-F222 PolarHBondContact O-N 3.04Å; W218-F222 VanDerWaalsContact O-N 3.09Å; W218-T260 HydrophobicContact CE3-CG2 4.06Å; W218-T260 HydrophobicContact CH2-CG2 3.85Å; W218-T260 HydrophobicContact CZ3-CG2 3.53Å; W218-L266 HydrophobicContact CZ3-CD2 4.45Å; W218-M278 HydrophobicContact CH2-CE 4.38Å; W218-M278 HydrophobicContact CH2-CG 4.38Å; W218-M281 HydrophobicContact CB-CE 4.46Å; W218-M281 HydrophobicContact CD2-CE 3.65Å; W218-M281 HydrophobicContact CE3-CE 3.61Å; W218-M281 HydrophobicContact CG-CE 4.05Å; W218-M281 HydrophobicContact CH2-CB 4.35Å; W218-M281 HydrophobicContact CH2-CE 4.47Å; W218-M281 HydrophobicContact CZ2-CB 4.04Å; W218-M281 HydrophobicContact CZ3-CE 4.04Å
219	S	98.7	Very high	98.3	Very high	3 Å²	3	14 Å²	14	2%	0.021	6%	0.06	C	C	.	.	H	α-helix	trans	-66.5	-34.5	177.7	-52.7	0	0	0	0	112.1	Y200 S202 D215 D216 I217 T223	Y200-S219 VanDerWaalsContact O-CA 3.22Å; Y200-S219 WeakPolarHBondContact O-CA 3.33Å; Y200-S219 VanDerWaalsContact O-CB 3.29Å; Y200-S219 WeakPolarHBondContact O-CB 3.37Å; Y200-S219 PolarHBondContact O-OG 3.01Å; S202-S219 PolarHBondContact N-OG 2.86Å; D215-S219 WeakPolarHBondContact O-CB 3.29Å; D215-S219 PolarHBondContact O-N 2.86Å; D215-S219 PolarHBondContact O-OG 2.97Å; D216-S219 PolarHBondContact O-N 3.24Å; I217-S219 VanDerWaalsContact C-N 3.35Å; S219-T223 WeakPolarHBondContact O-CB 3.09Å; S219-T223 PolarHBondContact O-N 3.23Å; S219-T223 PolarHBondContact O-OG1 3.22Å
220	W	98.8	Very high	98.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-63.4	-46.2	171.1	168	83.6	0	0	0	112.4	G130 T133 L134 L137 V150 D216 I217 W218 F222 T223 L224 V277 M281 I295 L299	G130-W220 WeakPolarHBondContact O-CZ2 3.04Å; G130-W220 PolarHBondContact O-NE1 3.16Å; T133-W220 PolarHBondContact OG1-NE1 3.28Å; L134-W220 HydrophobicContact CB-CZ2 3.87Å; L134-W220 HydrophobicContact CD1-CD2 4.27Å; L134-W220 HydrophobicContact CD1-CE3 4.39Å; L134-W220 HydrophobicContact CD1-CH2 4.35Å; L134-W220 HydrophobicContact CD1-CZ2 4.2Å; L134-W220 HydrophobicContact CD1-CZ3 4.43Å; L134-W220 HydrophobicContact CD2-CZ2 4.44Å; L134-W220 HydrophobicContact CG-CZ2 4.4Å; L137-W220 HydrophobicContact CD1-CB 3.74Å; L137-W220 HydrophobicContact CD1-CG 4.05Å; V150-W220 HydrophobicContact CG1-CB 4.09Å; D216-W220 WeakPolarHBondContact O-CB 3.45Å; D216-W220 PolarHBondContact O-N 2.84Å; I217-W220 HydrophobicContact CG2-CE3 4.07Å; I217-W220 WeakPolarHBondContact O-CB 3.33Å; I217-W220 PolarHBondContact O-N 3.33Å; W218-W220 VanDerWaalsContact C-N 3.3Å; W218-W220 PolarHBondContact O-N 3.46Å; W220-F222 VanDerWaalsContact C-N 3.33Å; W220-F222 PolarHBondContact O-N 3.01Å; W220-T223 VanDerWaalsContact O-CB 3.29Å; W220-T223 WeakPolarHBondContact O-CB 3.43Å; W220-T223 PolarHBondContact O-N 3.06Å; W220-L224 HydrophobicContact CH2-CD2 3.98Å; W220-L224 HydrophobicContact CZ2-CD2 3.81Å; W220-L224 WeakPolarHBondContact O-CB 3.49Å; W220-L224 PolarHBondContact O-N 3.28Å; W220-V277 HydrophobicContact CH2-CG1 4.08Å; W220-V277 HydrophobicContact CZ3-CG1 3.78Å; W220-M281 HydrophobicContact CZ3-SD 4.37Å; W220-I295 HydrophobicContact CH2-CG2 3.36Å; W220-I295 HydrophobicContact CZ2-CG2 4.33Å; W220-I295 HydrophobicContact CZ3-CG2 3.68Å; W220-L299 HydrophobicContact CH2-CD1 3.85Å; W220-L299 HydrophobicContact CZ2-CD1 3.73Å
221	L	98.7	Very high	98.2	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.9	-42.1	176.9	177.6	61.5	0	0	0	111.2	I217 W218 T223 L224 I225 V277 M278 M281	I217-L221 PolarHBondContact O-N 3.43Å; W218-L221 HydrophobicContact CE3-CD2 4.26Å; W218-L221 HydrophobicContact CZ3-CD2 3.93Å; W218-L221 PolarHBondContact O-N 3.01Å; L221-T223 VanDerWaalsContact C-N 3.33Å; L221-T223 PolarHBondContact O-N 3.37Å; L221-L224 PolarHBondContact O-N 2.96Å; L221-I225 HydrophobicContact CD1-CD1 4.03Å; L221-I225 HydrophobicContact CD1-CG1 4.16Å; L221-I225 HydrophobicContact CG-CD1 3.85Å; L221-I225 HydrophobicContact CG-CG1 4.42Å; L221-I225 VanDerWaalsContact O-CG1 3.26Å; L221-I225 WeakPolarHBondContact O-CG1 3.47Å; L221-I225 PolarHBondContact O-N 2.87Å; L221-V277 HydrophobicContact CD1-CG1 4.15Å; L221-M278 HydrophobicContact CD2-CB 4.46Å; L221-M281 HydrophobicContact CB-CE 3.66Å; L221-M281 HydrophobicContact CB-SD 4.07Å; L221-M281 HydrophobicContact CD2-CE 3.72Å; L221-M281 HydrophobicContact CD2-SD 3.84Å; L221-M281 HydrophobicContact CG-CE 4.33Å; L221-M281 HydrophobicContact CG-SD 4.46Å
222	F	98.7	Very high	98.1	Very high	2 Å²	2	13.4 Å²	13.4	1%	0.009	7%	0.069	C	C	.	.	H	α-helix	trans	-65.9	-37.7	176.4	-57.2	-25.7	0	0	0	112.2	Y200 W218 W220 S226 L232 W234 K256 T260 L266	Y200-F222 VanDerWaalsContact O-CD2 3.3Å; Y200-F222 WeakPolarHBondContact O-CD2 3.3Å; W218-F222 HydrophobicContact CB-CE2 4.47Å; W218-F222 AromaticContact CE3-CE1 3.81Å; W218-F222 HydrophobicContact CE3-CE1 3.81Å; W218-F222 AromaticContact CE3-CZ 3.74Å; W218-F222 HydrophobicContact CE3-CZ 3.74Å; W218-F222 HydrophobicContact CZ3-CE1 4.22Å; W218-F222 HydrophobicContact CZ3-CZ 4.42Å; W218-F222 WeakPolarHBondContact O-CD2 3.5Å; W218-F222 VanDerWaalsContact O-CG 3.28Å; W218-F222 WeakPolarHBondContact O-CG 3.38Å; W218-F222 PolarHBondContact O-N 3.04Å; W218-F222 VanDerWaalsContact O-N 3.09Å; W220-F222 VanDerWaalsContact C-N 3.33Å; W220-F222 PolarHBondContact O-N 3.01Å; F222-S226 WeakPolarHBondContact O-CB 3.23Å; F222-S226 PolarHBondContact O-N 2.91Å; F222-S226 PolarHBondContact O-OG 2.79Å; F222-L232 HydrophobicContact CB-CD1 4.11Å; F222-L232 HydrophobicContact CB-CD2 3.97Å; F222-W234 HydrophobicContact CB-CZ2 4.44Å; F222-W234 AromaticContact CD1-CH2 3.75Å; F222-W234 HydrophobicContact CD1-CH2 3.75Å; F222-W234 HydrophobicContact CD1-CZ2 4Å; F222-W234 HydrophobicContact CD2-CH2 4.3Å; F222-W234 AromaticContact CD2-CZ2 3.92Å; F222-W234 HydrophobicContact CD2-CZ2 3.92Å; F222-W234 AromaticContact CE1-CH2 3.66Å; F222-W234 HydrophobicContact CE1-CH2 3.66Å; F222-W234 HydrophobicContact CE1-CZ2 4.23Å; F222-W234 HydrophobicContact CE2-CH2 4.23Å; F222-W234 HydrophobicContact CE2-CZ2 4.16Å; F222-W234 HydrophobicContact CG-CH2 4.1Å; F222-W234 AromaticContact CG-CZ2 3.86Å; F222-W234 HydrophobicContact CG-CZ2 3.86Å; F222-W234 AromaticContact CZ-CH2 3.92Å; F222-W234 HydrophobicContact CZ-CH2 3.92Å; F222-W234 HydrophobicContact CZ-CZ2 4.31Å; F222-K256 HydrophobicContact CE2-CD 4.07Å; F222-K256 HydrophobicContact CE2-CG 4.35Å; F222-T260 HydrophobicContact CE1-CG2 4.26Å; F222-T260 HydrophobicContact CZ-CG2 4.06Å; F222-L266 HydrophobicContact CD1-CD1 4.27Å; F222-L266 HydrophobicContact CE1-CD1 4.13Å; F222-L266 HydrophobicContact CE1-CD2 4.14Å
223	T	98.7	Very high	98.1	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.012	9%	0.089	C	C	.	.	H	α-helix	trans	-57.8	-51.8	170.8	-66.3	0	0	0	0	110.3	K151 P152 S219 W220 L221 I225 S226 L227	K151-T223 WeakPolarHBondContact CA-OG1 3.42Å; P152-T223 HydrophobicContact CG-CG2 3.88Å; S219-T223 WeakPolarHBondContact O-CB 3.09Å; S219-T223 PolarHBondContact O-N 3.23Å; S219-T223 PolarHBondContact O-OG1 3.22Å; W220-T223 VanDerWaalsContact O-CB 3.29Å; W220-T223 WeakPolarHBondContact O-CB 3.43Å; W220-T223 PolarHBondContact O-N 3.06Å; L221-T223 VanDerWaalsContact C-N 3.33Å; L221-T223 PolarHBondContact O-N 3.37Å; T223-I225 PolarHBondContact O-N 3.45Å; T223-S226 PolarHBondContact O-N 2.92Å; T223-S226 PolarHBondContact O-OG 3.26Å; T223-L227 HydrophobicContact CG2-CD1 4.2Å; T223-L227 WeakPolarHBondContact O-CG 3.42Å; T223-L227 PolarHBondContact O-N 3.48Å
224	L	98.8	Very high	98	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-61.9	-45.1	-179.5	-178.5	58.3	0	0	0	112.7	A126 W220 L221 S226 L227 T228 Y274 L299	A126-L224 VanDerWaalsContact O-CD1 3.25Å; A126-L224 WeakPolarHBondContact O-CD1 3.48Å; W220-L224 HydrophobicContact CH2-CD2 3.98Å; W220-L224 HydrophobicContact CZ2-CD2 3.81Å; W220-L224 WeakPolarHBondContact O-CB 3.49Å; W220-L224 PolarHBondContact O-N 3.28Å; L221-L224 PolarHBondContact O-N 2.96Å; L224-S226 VanDerWaalsContact C-N 3.34Å; L224-S226 PolarHBondContact O-N 2.84Å; L224-L227 PolarHBondContact O-N 2.71Å; L224-T228 WeakPolarHBondContact O-CB 3.42Å; L224-T228 PolarHBondContact O-N 3.49Å; L224-T228 PolarHBondContact O-OG1 2.87Å; L224-Y274 VanDerWaalsContact CD1-OH 3.28Å; L224-Y274 WeakPolarHBondContact CD1-OH 3.19Å; L224-Y274 HydrophobicContact CD2-CE1 3.91Å; L224-Y274 HydrophobicContact CD2-CE2 4.17Å; L224-Y274 HydrophobicContact CG-CE1 4.36Å; L224-Y274 HydrophobicContact CG-CE2 3.91Å; L224-Y274 WeakPolarHBondContact CG-OH 3.49Å; L224-L299 HydrophobicContact CD2-CD1 4.45Å; L224-L299 HydrophobicContact CD2-CD2 4.1Å
225	I	98.6	Very high	97.8	Very high	3 Å²	3	16 Å²	16	2%	0.015	10%	0.095	C	C	.	.	H	α-helix	trans	-59	-46	175.3	-68.7	165.6	0	0	0	110.5	L221 T223 L227 T228 V229 L232 L266 L267 Y274	L221-I225 HydrophobicContact CD1-CD1 4.03Å; L221-I225 HydrophobicContact CD1-CG1 4.16Å; L221-I225 HydrophobicContact CG-CD1 3.85Å; L221-I225 HydrophobicContact CG-CG1 4.42Å; L221-I225 VanDerWaalsContact O-CG1 3.26Å; L221-I225 WeakPolarHBondContact O-CG1 3.47Å; L221-I225 PolarHBondContact O-N 2.87Å; T223-I225 PolarHBondContact O-N 3.45Å; I225-L227 VanDerWaalsContact C-N 3.28Å; I225-L227 PolarHBondContact O-N 3.46Å; I225-T228 PolarHBondContact O-N 2.97Å; I225-T228 VanDerWaalsContact O-N 3.1Å; I225-V229 HydrophobicContact CG2-CG2 4.47Å; I225-V229 PolarHBondContact O-N 2.73Å; I225-L232 HydrophobicContact CB-CD2 4.13Å; I225-L232 HydrophobicContact CG2-CD2 3.93Å; I225-L266 HydrophobicContact CD1-CD1 3.88Å; I225-L266 HydrophobicContact CD1-CG 3.92Å; I225-L267 HydrophobicContact CD1-CD2 3.72Å; I225-L267 HydrophobicContact CG1-CD2 4.27Å; I225-Y274 HydrophobicContact CG1-CD2 4.12Å; I225-Y274 HydrophobicContact CG1-CE2 4.3Å
226	S	98.1	Very high	97.4	Very high	13 Å²	13	24.9 Å²	24.9	9%	0.091	13%	0.133	C	C	.	.	H	α-helix	trans	-60.5	-38.4	178.9	74.5	0	0	0	0	112.3	F222 T223 L224 T228 G230	F222-S226 WeakPolarHBondContact O-CB 3.23Å; F222-S226 PolarHBondContact O-N 2.91Å; F222-S226 PolarHBondContact O-OG 2.79Å; T223-S226 PolarHBondContact O-N 2.92Å; T223-S226 PolarHBondContact O-OG 3.26Å; L224-S226 VanDerWaalsContact C-N 3.34Å; L224-S226 PolarHBondContact O-N 2.84Å; S226-T228 VanDerWaalsContact C-N 3.34Å; S226-G230 CarbonylContact O-C 3.51Å; S226-G230 WeakPolarHBondContact O-CA 3.31Å; S226-G230 PolarHBondContact O-N 3.06Å
227	L	98.2	Very high	97.2	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	15%	0.147	C	C	.	.	H	α-helix	trans	-75.4	-22.6	177.4	-70.4	-179	0	0	0	113.4	L103 A107 K120 F121 I129 P152 T223 L224 I225	L103-L227 HydrophobicContact CB-CD1 4.04Å; L103-L227 HydrophobicContact CB-CD2 4.44Å; L103-L227 HydrophobicContact CD1-CD1 3.81Å; A107-L227 HydrophobicContact CB-CD2 4.35Å; K120-L227 WeakPolarHBondContact CA-O 3.4Å; F121-L227 HydrophobicContact CD2-CB 4.05Å; F121-L227 HydrophobicContact CD2-CD2 4.06Å; F121-L227 HydrophobicContact CD2-CG 4.48Å; F121-L227 HydrophobicContact CE2-CB 4.49Å; F121-L227 HydrophobicContact CE2-CD1 4.42Å; F121-L227 HydrophobicContact CE2-CD2 3.73Å; F121-L227 HydrophobicContact CE2-CG 4.43Å; F121-L227 PolarHBondContact N-O 3.12Å; I129-L227 HydrophobicContact CD1-CD1 4.41Å; I129-L227 HydrophobicContact CG2-CD1 3.92Å; P152-L227 HydrophobicContact CB-CD1 4.37Å; P152-L227 HydrophobicContact CB-CD2 4.04Å; P152-L227 HydrophobicContact CB-CG 4.39Å; P152-L227 HydrophobicContact CG-CD1 4.39Å; P152-L227 HydrophobicContact CG-CD2 4.12Å; P152-L227 HydrophobicContact CG-CG 4.13Å; T223-L227 HydrophobicContact CG2-CD1 4.2Å; T223-L227 WeakPolarHBondContact O-CG 3.42Å; T223-L227 PolarHBondContact O-N 3.48Å; L224-L227 PolarHBondContact O-N 2.71Å; I225-L227 VanDerWaalsContact C-N 3.28Å; I225-L227 PolarHBondContact O-N 3.46Å
228	T	98.2	Very high	96.8	Very high	8 Å²	8	36.3 Å²	36.3	5%	0.049	19%	0.185	C	C	.	.	H	α-helix	trans	-87.2	-45	179.3	-52.3	0	0	0	0	112	L123 A126 L224 I225 S226 Y274	L123-T228 HydrophobicContact CD2-CG2 3.96Å; A126-T228 HydrophobicContact CB-CG2 4.32Å; L224-T228 WeakPolarHBondContact O-CB 3.42Å; L224-T228 PolarHBondContact O-N 3.49Å; L224-T228 PolarHBondContact O-OG1 2.87Å; I225-T228 PolarHBondContact O-N 2.97Å; I225-T228 VanDerWaalsContact O-N 3.1Å; S226-T228 VanDerWaalsContact C-N 3.34Å; T228-Y274 HydrophobicContact CG2-CE2 4.26Å; T228-Y274 PolarHBondContact OG1-OH 3.03Å
229	V	97	Very high	96.4	Very high	18 Å²	18	37.5 Å²	37.5	11%	0.109	19%	0.193	C	C	.	.	H	α-helix	trans	-104.5	-17	-172.5	-175.2	0	0	0	0	112.1	I225 K231	I225-V229 HydrophobicContact CG2-CG2 4.47Å; I225-V229 PolarHBondContact O-N 2.73Å; V229-K231 VanDerWaalsContact C-N 3.34Å; V229-K231 HydrophobicContact CG1-CG 4.45Å
230	G	96.7	Very high	96	Very high	29 Å²	29	40 Å²	40	30%	0.299	21%	0.209	S	C	.	.	S	Bend	trans	86.4	-1.6	-177.7	0	0	0	0	0	114.5	S119 S226	S119-G230 WeakPolarHBondContact O-CA 3.43Å; S226-G230 CarbonylContact O-C 3.51Å; S226-G230 WeakPolarHBondContact O-CA 3.31Å; S226-G230 PolarHBondContact O-N 3.06Å
231	K	95.4	Very high	95.5	Very high	98 Å²	98	50.5 Å²	50.5	43%	0.426	26%	0.255	S	S	.	.	S	Bend	trans	-161.2	162.6	-179.6	64.5	-164	171.8	-140.8	0	112.1	E118 V229	E118-K231 IonicContact OE1-NZ 2.76Å; E118-K231 PolarHBondContact OE1-NZ 2.95Å; V229-K231 VanDerWaalsContact C-N 3.34Å; V229-K231 HydrophobicContact CG1-CG 4.45Å
232	L	97.3	Very high	95.1	Very high	6 Å²	6	59.3 Å²	59.3	3%	0.031	30%	0.296	C	S	.	.			trans	-105.6	156.9	167.1	-71.5	163	0	0	0	110.1	L199 Y200 F222 I225 W234 S235	L199-L232 HydrophobicContact CD1-CD1 4.06Å; L199-L232 HydrophobicContact CG-CD1 4Å; Y200-L232 HydrophobicContact CD1-CD1 4.01Å; Y200-L232 HydrophobicContact CE1-CD1 4.08Å; F222-L232 HydrophobicContact CB-CD1 4.11Å; F222-L232 HydrophobicContact CB-CD2 3.97Å; I225-L232 HydrophobicContact CB-CD2 4.13Å; I225-L232 HydrophobicContact CG2-CD2 3.93Å; L232-W234 HydrophobicContact CB-CD2 4.33Å; L232-W234 HydrophobicContact CB-CZ2 4.18Å; L232-W234 HydrophobicContact CD1-CZ2 3.96Å; L232-W234 HydrophobicContact CD2-CH2 4.27Å; L232-W234 HydrophobicContact CD2-CZ2 3.92Å; L232-W234 HydrophobicContact CG-CZ2 4.25Å; L232-W234 PolarHBondContact O-N 3.13Å; L232-W234 VanDerWaalsContact O-N 3.1Å; L232-S235 PolarHBondContact N-OG 3.24Å; L232-S235 WeakPolarHBondContact O-CB 3.44Å; L232-S235 PolarHBondContact O-N 3.09Å; L232-S235 PolarHBondContact O-OG 3.29Å
233	P	96.9	Very high	94.6	Very high	65 Å²	65	59.9 Å²	59.9	42%	0.422	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.4	179.2	-26.1	33.6	0	0	0	113.8	L266	P233-L266 HydrophobicContact CG-CD1 4.27Å
234	W	96.7	Very high	94.3	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.015	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	5.8	178.8	53.1	80.8	0	0	0	114.4	L199 F222 L232 K236 L237 Y252 A255 K256 C259 L266	L199-W234 PolarHBondContact O-NE1 3.19Å; F222-W234 HydrophobicContact CB-CZ2 4.44Å; F222-W234 AromaticContact CD1-CH2 3.75Å; F222-W234 HydrophobicContact CD1-CH2 3.75Å; F222-W234 HydrophobicContact CD1-CZ2 4Å; F222-W234 HydrophobicContact CD2-CH2 4.3Å; F222-W234 AromaticContact CD2-CZ2 3.92Å; F222-W234 HydrophobicContact CD2-CZ2 3.92Å; F222-W234 AromaticContact CE1-CH2 3.66Å; F222-W234 HydrophobicContact CE1-CH2 3.66Å; F222-W234 HydrophobicContact CE1-CZ2 4.23Å; F222-W234 HydrophobicContact CE2-CH2 4.23Å; F222-W234 HydrophobicContact CE2-CZ2 4.16Å; F222-W234 HydrophobicContact CG-CH2 4.1Å; F222-W234 AromaticContact CG-CZ2 3.86Å; F222-W234 HydrophobicContact CG-CZ2 3.86Å; F222-W234 AromaticContact CZ-CH2 3.92Å; F222-W234 HydrophobicContact CZ-CH2 3.92Å; F222-W234 HydrophobicContact CZ-CZ2 4.31Å; L232-W234 HydrophobicContact CB-CD2 4.33Å; L232-W234 HydrophobicContact CB-CZ2 4.18Å; L232-W234 HydrophobicContact CD1-CZ2 3.96Å; L232-W234 HydrophobicContact CD2-CH2 4.27Å; L232-W234 HydrophobicContact CD2-CZ2 3.92Å; L232-W234 HydrophobicContact CG-CZ2 4.25Å; L232-W234 PolarHBondContact O-N 3.13Å; L232-W234 VanDerWaalsContact O-N 3.1Å; W234-K236 PolarHBondContact O-N 2.95Å; W234-K236 VanDerWaalsContact O-N 3.11Å; W234-L237 HydrophobicContact CB-CB 4.41Å; W234-L237 VanDerWaalsContact O-CB 3.23Å; W234-L237 WeakPolarHBondContact O-CB 3.35Å; W234-L237 PolarHBondContact O-N 3.41Å; W234-Y252 HydrophobicContact CB-CD1 4.24Å; W234-Y252 HydrophobicContact CB-CE1 4.38Å; W234-Y252 AromaticContact CD1-CD1 3.6Å; W234-Y252 AromaticContact CD1-CE1 3.72Å; W234-Y252 HydrophobicContact CG-CD1 4.1Å; W234-Y252 HydrophobicContact CG-CE1 4.38Å; W234-A255 HydrophobicContact CB-CB 3.98Å; W234-K256 HydrophobicContact CD2-CG 3.91Å; W234-K256 HydrophobicContact CE3-CG 3.95Å; W234-K256 HydrophobicContact CH2-CG 3.71Å; W234-K256 HydrophobicContact CZ2-CD 4.16Å; W234-K256 HydrophobicContact CZ2-CG 3.65Å; W234-K256 HydrophobicContact CZ3-CB 4.47Å; W234-K256 HydrophobicContact CZ3-CG 3.85Å; W234-K256 VanDerWaalsContact NE1-CE 3.34Å; W234-C259 HydrophobicContact CE3-CB 4.31Å; W234-C259 HydrophobicContact CZ3-CB 3.74Å; W234-L266 HydrophobicContact CH2-CD1 3.77Å; W234-L266 HydrophobicContact CZ3-CD1 3.89Å
235	S	94	Very high	93.9	Very high	49 Å²	49	69.1 Å²	69.1	34%	0.343	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.4	-179.7	-69.8	0	0	0	0	113.7	L232	L232-S235 PolarHBondContact N-OG 3.24Å; L232-S235 WeakPolarHBondContact O-CB 3.44Å; L232-S235 PolarHBondContact O-N 3.09Å; L232-S235 PolarHBondContact O-OG 3.29Å
236	K	91.5	Very high	93.5	Very high	187 Å²	187	74.1 Å²	74.1	81%	0.813	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	20.8	178.8	-61.1	-173.3	179.4	-175.7	0	113	W234 K238	W234-K236 PolarHBondContact O-N 2.95Å; W234-K236 VanDerWaalsContact O-N 3.11Å; K236-K238 PolarHBondContact O-N 3.33Å; K236-K238 VanDerWaalsContact O-N 3.12Å
237	L	92.6	Very high	93.3	Very high	57 Å²	57	78.2 Å²	78.2	30%	0.298	39%	0.39	S	S	.	.			trans	-62.1	115.1	179.9	-174.5	62.2	0	0	0	109.9	W234 M239 R251 Y252 A255	W234-L237 HydrophobicContact CB-CB 4.41Å; W234-L237 VanDerWaalsContact O-CB 3.23Å; W234-L237 WeakPolarHBondContact O-CB 3.35Å; W234-L237 PolarHBondContact O-N 3.41Å; L237-M239 HydrophobicContact CD2-CE 3.83Å; L237-M239 HydrophobicContact CG-CE 4.15Å; L237-M239 PolarHBondContact O-N 3.41Å; L237-R251 HydrophobicContact CD2-CB 4.11Å; L237-Y252 HydrophobicContact CB-CE1 4.41Å; L237-Y252 HydrophobicContact CD2-CD1 4.07Å; L237-Y252 HydrophobicContact CD2-CE1 4.28Å; L237-Y252 HydrophobicContact CD2-CG 4.42Å; L237-A255 HydrophobicContact CD2-CB 4.28Å
238	K	91.2	Very high	93.1	Very high	184 Å²	184	81 Å²	81	80%	0.8	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-72.5	125.7	179.4	-66.2	-175.5	180	-179.8	0	110.1	K236 R251	K236-K238 PolarHBondContact O-N 3.33Å; K236-K238 VanDerWaalsContact O-N 3.12Å; K238-R251 PolarHBondContact O-NH1 2.92Å
239	M	90	Very high	92.9	Very high	53 Å²	53	81 Å²	81	26%	0.261	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-93.3	136	172.8	-64.8	-57.5	173.1	0	0	110.4	L237 C243 Q248 R251 Y252	L237-M239 HydrophobicContact CD2-CE 3.83Å; L237-M239 HydrophobicContact CG-CE 4.15Å; L237-M239 PolarHBondContact O-N 3.41Å; M239-C243 HydrophobicContact CB-CB 4.48Å; M239-Q248 HydrophobicContact CE-CB 4.23Å; M239-Q248 HydrophobicContact CG-CG 4.1Å; M239-Q248 HydrophobicContact SD-CB 4.17Å; M239-Q248 HydrophobicContact SD-CG 3.92Å; M239-R251 HydrophobicContact CE-CB 4.15Å; M239-R251 HydrophobicContact SD-CB 4.2Å; M239-Y252 HydrophobicContact CE-CD2 3.57Å; M239-Y252 HydrophobicContact CE-CE1 4.45Å; M239-Y252 HydrophobicContact CE-CE2 3.29Å; M239-Y252 HydrophobicContact CE-CG 4.28Å
240	P	90.5	Very high	92.9	Very high	57 Å²	57	83.9 Å²	83.9	37%	0.37	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-56.7	146.2	168.8	-22.6	32.6	0	0	0	110.6	Q242 C243 R251	P240-Q242 PolarHBondContact O-N 2.99Å; P240-Q242 VanDerWaalsContact O-N 3.12Å; P240-C243 HydrophobicContact CB-CB 4.17Å; P240-C243 HydrophobicContact CG-CB 4.33Å; P240-C243 WeakPolarHBondContact O-CB 3.35Å; P240-C243 PolarHBondContact O-N 3.38Å; P240-R251 VanDerWaalsContact CD-CZ 3.49Å; P240-R251 VanDerWaalsContact CG-CZ 3.49Å
241	K	88.3	Confident	92.9	Very high	220 Å²	220	87.9 Å²	87.9	96%	0.957	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.9	-176.7	-68.1	-174.2	178.2	-179.1	0	113.5
242	Q	89.6	Confident	93	Very high	184 Å²	184	84.8 Å²	84.8	86%	0.86	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	23.9	-178.1	-64.2	176.5	-6.8	0	0	113	P240 T244	P240-Q242 PolarHBondContact O-N 2.99Å; P240-Q242 VanDerWaalsContact O-N 3.12Å; Q242-T244 PolarHBondContact O-N 3.47Å
243	C	89	Confident	93	Very high	14 Å²	14	84.5 Å²	84.5	10%	0.095	41%	0.405	C	S	.	.			trans	-73.4	115.5	-179	-163.1	0	0	0	0	111.1	M239 P240 Q247 Q248	M239-C243 HydrophobicContact CB-CB 4.48Å; P240-C243 HydrophobicContact CB-CB 4.17Å; P240-C243 HydrophobicContact CG-CB 4.33Å; P240-C243 WeakPolarHBondContact O-CB 3.35Å; P240-C243 PolarHBondContact O-N 3.38Å; C243-Q247 VanDerWaalsContact SG-C 3.59Å; C243-Q247 WeakPolarHBondContact SG-CB 3.24Å; C243-Q248 HydrophobicContact CB-CG 3.97Å; C243-Q248 PolarHBondContact O-NE2 2.92Å; C243-Q248 VanDerWaalsContact SG-CG 3.5Å; C243-Q248 PolarHBondContact SG-N 3.38Å; C243-Q248 VanDerWaalsContact SG-N 3.44Å
244	T	92.6	Very high	93	Very high	76 Å²	76	84.9 Å²	84.9	47%	0.466	41%	0.406	S	S	.	.			trans	-61.5	159.5	173.1	66.5	0	0	0	0	111.2	Q242 I246 Q247 Q248	Q242-T244 PolarHBondContact O-N 3.47Å; T244-I246 PolarHBondContact O-N 2.9Å; T244-Q247 PolarHBondContact O-N 2.72Å; T244-Q247 VanDerWaalsContact O-N 3.07Å; T244-Q247 VanDerWaalsContact OG1-CG 3.28Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.3Å; T244-Q247 PolarHBondContact OG1-N 3.43Å; T244-Q247 PolarHBondContact OG1-OE1 2.89Å; T244-Q248 WeakPolarHBondContact O-CG 3.33Å; T244-Q248 PolarHBondContact O-N 3.12Å
245	F	89.1	Confident	93.1	Very high	121 Å²	121	85.4 Å²	85.4	53%	0.531	41%	0.411	S	S	.	.	H	α-helix	trans	-55.8	-39.1	178	-174.8	-118.2	0	0	0	112.6	F194 T198 Q248 Q249	F194-F245 HydrophobicContact CD1-CZ 4.5Å; T198-F245 HydrophobicContact CG2-CE2 4.27Å; F245-Q248 WeakPolarHBondContact O-CB 3.4Å; F245-Q248 PolarHBondContact O-N 3.23Å; F245-Q249 VanDerWaalsContact CD1-NE2 3.29Å; F245-Q249 WeakPolarHBondContact O-CG 3.32Å; F245-Q249 PolarHBondContact O-N 3.27Å
246	I	91.3	Very high	93.2	Very high	109 Å²	109	83.1 Å²	83.1	56%	0.559	40%	0.395	S	S	*	.	H	α-helix	trans	-65.2	-43.3	176.8	-62.2	172.6	0	0	0	111	T244 Q248 Q249 E250	T244-I246 PolarHBondContact O-N 2.9Å; I246-Q248 VanDerWaalsContact C-N 3.31Å; I246-Q248 PolarHBondContact O-N 3.28Å; I246-Q249 WeakPolarHBondContact O-CB 3.2Å; I246-Q249 PolarHBondContact O-N 3.16Å; I246-E250 PolarHBondContact O-N 3.49Å
247	Q	94.1	Very high	93.5	Very high	99 Å²	99	76.2 Å²	76.2	46%	0.463	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-35.5	176.1	-71.9	167.5	-29.3	0	0	112	C243 T244 E250 R251	C243-Q247 VanDerWaalsContact SG-C 3.59Å; C243-Q247 WeakPolarHBondContact SG-CB 3.24Å; T244-Q247 PolarHBondContact O-N 2.72Å; T244-Q247 VanDerWaalsContact O-N 3.07Å; T244-Q247 VanDerWaalsContact OG1-CG 3.28Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.3Å; T244-Q247 PolarHBondContact OG1-N 3.43Å; T244-Q247 PolarHBondContact OG1-OE1 2.89Å; Q247-E250 PolarHBondContact O-N 2.64Å; Q247-R251 WeakPolarHBondContact O-CG 3.3Å; Q247-R251 PolarHBondContact O-N 2.94Å
248	Q	93.1	Very high	93.7	Very high	64 Å²	64	78.3 Å²	78.3	30%	0.299	38%	0.378	S	S	.	.	H	α-helix	trans	-64.3	-44.3	173.6	-65.9	179	42.5	0	0	111.1	M239 C243 T244 F245 I246 R251 Y252	M239-Q248 HydrophobicContact CE-CB 4.23Å; M239-Q248 HydrophobicContact CG-CG 4.1Å; M239-Q248 HydrophobicContact SD-CB 4.17Å; M239-Q248 HydrophobicContact SD-CG 3.92Å; C243-Q248 HydrophobicContact CB-CG 3.97Å; C243-Q248 PolarHBondContact O-NE2 2.92Å; C243-Q248 VanDerWaalsContact SG-CG 3.5Å; C243-Q248 PolarHBondContact SG-N 3.38Å; C243-Q248 VanDerWaalsContact SG-N 3.44Å; T244-Q248 WeakPolarHBondContact O-CG 3.33Å; T244-Q248 PolarHBondContact O-N 3.12Å; F245-Q248 WeakPolarHBondContact O-CB 3.4Å; F245-Q248 PolarHBondContact O-N 3.23Å; I246-Q248 VanDerWaalsContact C-N 3.31Å; I246-Q248 PolarHBondContact O-N 3.28Å; Q248-R251 PolarHBondContact O-N 3.27Å; Q248-Y252 VanDerWaalsContact O-CD2 3.31Å; Q248-Y252 WeakPolarHBondContact O-CD2 3.33Å; Q248-Y252 PolarHBondContact O-N 3.19Å
249	Q	94.9	Very high	93.9	Very high	6 Å²	6	70 Å²	70	3%	0.028	34%	0.343	C	S	.	.	H	α-helix	trans	-58.2	-47.6	175	-71.2	175.4	0.8	0	0	111.8	T198 L206 F245 I246 R251 Y252 A253	T198-Q249 HydrophobicContact CG2-CG 4.44Å; L206-Q249 HydrophobicContact CB-CB 4.4Å; L206-Q249 HydrophobicContact CD2-CB 4.25Å; L206-Q249 HydrophobicContact CD2-CG 4.1Å; L206-Q249 PolarHBondContact O-OE1 3Å; F245-Q249 VanDerWaalsContact CD1-NE2 3.29Å; F245-Q249 WeakPolarHBondContact O-CG 3.32Å; F245-Q249 PolarHBondContact O-N 3.27Å; I246-Q249 WeakPolarHBondContact O-CB 3.2Å; I246-Q249 PolarHBondContact O-N 3.16Å; Q249-R251 VanDerWaalsContact C-N 3.32Å; Q249-R251 PolarHBondContact O-N 3.21Å; Q249-Y252 PolarHBondContact O-N 3.1Å; Q249-A253 WeakPolarHBondContact O-CB 3.45Å; Q249-A253 PolarHBondContact O-N 2.97Å
250	E	96.2	Very high	94.2	Very high	80 Å²	80	69 Å²	69	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-36.1	-179.5	-176.2	53.4	-144.3	0	0	112.2	R207 I246 Q247 A253 T254	R207-E250 WeakPolarHBondContact CG-OE2 3.48Å; R207-E250 IonicContact CZ-OE1 3.82Å; R207-E250 IonicContact CZ-OE2 2.72Å; R207-E250 IonicContact NE-OE1 3.53Å; R207-E250 PolarHBondContact NE-OE1 3.39Å; R207-E250 VanDerWaalsContact NE-OE1 3.13Å; R207-E250 IonicContact NE-OE2 3.52Å; R207-E250 PolarHBondContact NE-OE2 2.82Å; R207-E250 IonicContact NH2-OE1 2.84Å; R207-E250 PolarHBondContact NH2-OE1 2.92Å; R207-E250 IonicContact NH2-OE2 3.39Å; I246-E250 PolarHBondContact O-N 3.49Å; Q247-E250 PolarHBondContact O-N 2.64Å; E250-A253 PolarHBondContact O-N 2.69Å; E250-T254 WeakPolarHBondContact O-CB 3.22Å; E250-T254 PolarHBondContact O-N 2.67Å; E250-T254 PolarHBondContact O-OG1 2.8Å; E250-T254 PolarHBondContact OE1-OG1 2.8Å
251	R	96.6	Very high	94.4	Very high	112 Å²	112	74.2 Å²	74.2	42%	0.423	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-45.8	173.8	-79.1	-176.8	167.5	-121.2	-6.5	112.1	L237 K238 M239 P240 Q247 Q248 Q249 T254 A255	L237-R251 HydrophobicContact CD2-CB 4.11Å; K238-R251 PolarHBondContact O-NH1 2.92Å; M239-R251 HydrophobicContact CE-CB 4.15Å; M239-R251 HydrophobicContact SD-CB 4.2Å; P240-R251 VanDerWaalsContact CD-CZ 3.49Å; P240-R251 VanDerWaalsContact CG-CZ 3.49Å; Q247-R251 WeakPolarHBondContact O-CG 3.3Å; Q247-R251 PolarHBondContact O-N 2.94Å; Q248-R251 PolarHBondContact O-N 3.27Å; Q249-R251 VanDerWaalsContact C-N 3.32Å; Q249-R251 PolarHBondContact O-N 3.21Å; R251-T254 PolarHBondContact O-N 2.7Å; R251-A255 WeakPolarHBondContact O-CB 3.38Å; R251-A255 PolarHBondContact O-N 3.25Å
252	Y	97.4	Very high	94.7	Very high	34 Å²	34	69.3 Å²	69.3	13%	0.133	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-42.7	173.7	-82.4	-65.4	0	0	0	111.9	W234 L237 M239 Q248 Q249 T254 A255 K256	W234-Y252 HydrophobicContact CB-CD1 4.24Å; W234-Y252 HydrophobicContact CB-CE1 4.38Å; W234-Y252 AromaticContact CD1-CD1 3.6Å; W234-Y252 AromaticContact CD1-CE1 3.72Å; W234-Y252 HydrophobicContact CG-CD1 4.1Å; W234-Y252 HydrophobicContact CG-CE1 4.38Å; L237-Y252 HydrophobicContact CB-CE1 4.41Å; L237-Y252 HydrophobicContact CD2-CD1 4.07Å; L237-Y252 HydrophobicContact CD2-CE1 4.28Å; L237-Y252 HydrophobicContact CD2-CG 4.42Å; M239-Y252 HydrophobicContact CE-CD2 3.57Å; M239-Y252 HydrophobicContact CE-CE1 4.45Å; M239-Y252 HydrophobicContact CE-CE2 3.29Å; M239-Y252 HydrophobicContact CE-CG 4.28Å; Q248-Y252 VanDerWaalsContact O-CD2 3.31Å; Q248-Y252 WeakPolarHBondContact O-CD2 3.33Å; Q248-Y252 PolarHBondContact O-N 3.19Å; Q249-Y252 PolarHBondContact O-N 3.1Å; Y252-T254 VanDerWaalsContact C-N 3.34Å; Y252-T254 PolarHBondContact O-N 3.5Å; Y252-A255 PolarHBondContact O-N 3.32Å; Y252-K256 WeakPolarHBondContact O-CB 3.42Å; Y252-K256 VanDerWaalsContact O-CG 3.24Å; Y252-K256 WeakPolarHBondContact O-CG 3.44Å; Y252-K256 PolarHBondContact O-N 3.26Å
253	A	97.7	Very high	95	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-42.9	178	0	0	0	0	0	111.8	A203 L206 R207 Q249 E250 K256 V257	A203-A253 HydrophobicContact CB-CB 4.38Å; L206-A253 HydrophobicContact CB-CB 3.89Å; L206-A253 HydrophobicContact CD1-CB 4.2Å; R207-A253 HydrophobicContact CG-CB 3.93Å; Q249-A253 WeakPolarHBondContact O-CB 3.45Å; Q249-A253 PolarHBondContact O-N 2.97Å; E250-A253 PolarHBondContact O-N 2.69Å; A253-K256 PolarHBondContact O-N 2.92Å; A253-V257 WeakPolarHBondContact O-CG2 3.38Å; A253-V257 PolarHBondContact O-N 3.27Å
254	T	97.5	Very high	95.3	Very high	72 Å²	72	67.3 Å²	67.3	44%	0.442	33%	0.326	S	S	.	.	H	α-helix	trans	-64.5	-47.4	177	-64	0	0	0	0	111.5	R207 E250 R251 Y252 K256 V257 M258	R207-T254 PolarHBondContact NH2-OG1 3.32Å; E250-T254 WeakPolarHBondContact O-CB 3.22Å; E250-T254 PolarHBondContact O-N 2.67Å; E250-T254 PolarHBondContact O-OG1 2.8Å; E250-T254 PolarHBondContact OE1-OG1 2.8Å; R251-T254 PolarHBondContact O-N 2.7Å; Y252-T254 VanDerWaalsContact C-N 3.34Å; Y252-T254 PolarHBondContact O-N 3.5Å; T254-K256 VanDerWaalsContact C-N 3.29Å; T254-K256 PolarHBondContact O-N 3.17Å; T254-V257 PolarHBondContact O-N 2.68Å; T254-M258 PolarHBondContact O-N 3.31Å
255	A	97.4	Very high	95.5	Very high	15 Å²	15	66.5 Å²	66.5	12%	0.124	32%	0.319	C	S	.	.	H	α-helix	trans	-59.6	-41.3	176.5	0	0	0	0	0	111.8	W234 L237 R251 Y252 M258 C259	W234-A255 HydrophobicContact CB-CB 3.98Å; L237-A255 HydrophobicContact CD2-CB 4.28Å; R251-A255 WeakPolarHBondContact O-CB 3.38Å; R251-A255 PolarHBondContact O-N 3.25Å; Y252-A255 PolarHBondContact O-N 3.32Å; A255-M258 PolarHBondContact O-N 3.01Å; A255-C259 PolarHBondContact O-N 3.13Å; A255-C259 PolarHBondContact O-SG 3.31Å
256	K	97.4	Very high	95.8	Very high	1 Å²	1	60.9 Å²	60.9	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-50.9	176.2	-75.3	171.2	-178.4	-176.6	0	111.8	T198 L199 A201 A203 L206 F222 W234 Y252 A253 T254 M258 C259 T260	T198-K256 PolarHBondContact O-NZ 2.88Å; L199-K256 WeakPolarHBondContact O-CE 3.37Å; L199-K256 PolarHBondContact O-NZ 3.23Å; A201-K256 WeakPolarHBondContact O-CD 3.27Å; A201-K256 WeakPolarHBondContact O-CE 3.22Å; A201-K256 PolarHBondContact O-NZ 3.21Å; A203-K256 HydrophobicContact CB-CB 4.2Å; L206-K256 HydrophobicContact CD1-CD 3.96Å; F222-K256 HydrophobicContact CE2-CD 4.07Å; F222-K256 HydrophobicContact CE2-CG 4.35Å; W234-K256 HydrophobicContact CD2-CG 3.91Å; W234-K256 HydrophobicContact CE3-CG 3.95Å; W234-K256 HydrophobicContact CH2-CG 3.71Å; W234-K256 HydrophobicContact CZ2-CD 4.16Å; W234-K256 HydrophobicContact CZ2-CG 3.65Å; W234-K256 HydrophobicContact CZ3-CB 4.47Å; W234-K256 HydrophobicContact CZ3-CG 3.85Å; W234-K256 VanDerWaalsContact NE1-CE 3.34Å; Y252-K256 WeakPolarHBondContact O-CB 3.42Å; Y252-K256 VanDerWaalsContact O-CG 3.24Å; Y252-K256 WeakPolarHBondContact O-CG 3.44Å; Y252-K256 PolarHBondContact O-N 3.26Å; A253-K256 PolarHBondContact O-N 2.92Å; T254-K256 VanDerWaalsContact C-N 3.29Å; T254-K256 PolarHBondContact O-N 3.17Å; K256-M258 VanDerWaalsContact C-N 3.27Å; K256-M258 PolarHBondContact O-N 3.42Å; K256-C259 PolarHBondContact O-N 3.42Å; K256-C259 VanDerWaalsContact O-N 3.16Å; K256-T260 WeakPolarHBondContact O-CG2 3.27Å; K256-T260 PolarHBondContact O-N 3.48Å; K256-T260 PolarHBondContact O-OG1 2.96Å
257	V	96.7	Very high	96.2	Very high	43 Å²	43	56.3 Å²	56.3	26%	0.261	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-40.3	177.7	169.1	0	0	0	0	111.9	A203 A253 T254 T260 K261	A203-V257 HydrophobicContact CB-CG2 3.72Å; A253-V257 WeakPolarHBondContact O-CG2 3.38Å; A253-V257 PolarHBondContact O-N 3.27Å; T254-V257 PolarHBondContact O-N 2.68Å; V257-T260 WeakPolarHBondContact CA-OG1 3.32Å; V257-T260 PolarHBondContact O-OG1 3.45Å; V257-K261 HydrophobicContact CG1-CD 4.32Å; V257-K261 WeakPolarHBondContact O-CG 3.5Å; V257-K261 PolarHBondContact O-N 3.34Å
258	M	96.5	Very high	96.3	Very high	101 Å²	101	59.5 Å²	59.5	50%	0.498	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-45.3	177.1	-177.5	-113.9	-75.3	0	0	111.6	T254 A255 K256 K261 R262 L265	T254-M258 PolarHBondContact O-N 3.31Å; A255-M258 PolarHBondContact O-N 3.01Å; K256-M258 VanDerWaalsContact C-N 3.27Å; K256-M258 PolarHBondContact O-N 3.42Å; M258-K261 PolarHBondContact O-N 3.05Å; M258-R262 PolarHBondContact O-N 2.82Å; M258-L265 HydrophobicContact SD-CD1 3.94Å
259	C	96.4	Very high	96.5	Very high	8 Å²	8	59.5 Å²	59.5	5%	0.054	30%	0.3	C	S	.	.	H	α-helix	trans	-70.2	-38.5	179.2	-63.7	0	0	0	0	112.5	W234 A255 K256 K261 R262 L266	W234-C259 HydrophobicContact CE3-CB 4.31Å; W234-C259 HydrophobicContact CZ3-CB 3.74Å; A255-C259 PolarHBondContact O-N 3.13Å; A255-C259 PolarHBondContact O-SG 3.31Å; K256-C259 PolarHBondContact O-N 3.42Å; K256-C259 VanDerWaalsContact O-N 3.16Å; C259-K261 PolarHBondContact O-N 3.13Å; C259-R262 CarbonylContact O-C 3.43Å; C259-R262 PolarHBondContact O-N 3.15Å; C259-L266 HydrophobicContact CB-CB 4.11Å; C259-L266 HydrophobicContact CB-CD1 4.34Å; C259-L266 WeakPolarHBondContact O-CB 3.47Å
260	T	95.2	Very high	96.6	Very high	34 Å²	34	60.3 Å²	60.3	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-70.8	-18.1	179	58.5	0	0	0	0	113	W218 F222 K256 V257 R262 L266 M278	W218-T260 HydrophobicContact CE3-CG2 4.06Å; W218-T260 HydrophobicContact CH2-CG2 3.85Å; W218-T260 HydrophobicContact CZ3-CG2 3.53Å; F222-T260 HydrophobicContact CE1-CG2 4.26Å; F222-T260 HydrophobicContact CZ-CG2 4.06Å; K256-T260 WeakPolarHBondContact O-CG2 3.27Å; K256-T260 PolarHBondContact O-N 3.48Å; K256-T260 PolarHBondContact O-OG1 2.96Å; V257-T260 WeakPolarHBondContact CA-OG1 3.32Å; V257-T260 PolarHBondContact O-OG1 3.45Å; T260-R262 VanDerWaalsContact C-N 3.34Å; T260-L266 HydrophobicContact CG2-CD2 4.07Å; T260-M278 WeakPolarHBondContact O-CE 3.35Å
261	K	95.2	Very high	96.7	Very high	166 Å²	166	57 Å²	57	72%	0.722	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-8.1	169.8	-73.3	-179	176.1	-170.3	0	113.2	V257 M258 C259	V257-K261 HydrophobicContact CG1-CD 4.32Å; V257-K261 WeakPolarHBondContact O-CG 3.5Å; V257-K261 PolarHBondContact O-N 3.34Å; M258-K261 PolarHBondContact O-N 3.05Å; C259-K261 PolarHBondContact O-N 3.13Å
262	R	95.8	Very high	96.7	Very high	116 Å²	116	55.3 Å²	55.3	44%	0.438	30%	0.295	S	S	.	.			trans	-134.6	76.8	-173.6	-67.8	-171.7	64.8	174.4	1.4	109.6	M258 C259 T260 E264 L265 L266	M258-R262 PolarHBondContact O-N 2.82Å; C259-R262 CarbonylContact O-C 3.43Å; C259-R262 PolarHBondContact O-N 3.15Å; T260-R262 VanDerWaalsContact C-N 3.34Å; R262-E264 WeakPolarHBondContact CA-OE2 3.49Å; R262-E264 WeakPolarHBondContact CB-OE1 3.41Å; R262-E264 IonicContact CZ-OE1 2.68Å; R262-E264 VanDerWaalsContact CZ-OE1 3.28Å; R262-E264 IonicContact NE-OE1 2.82Å; R262-E264 PolarHBondContact NE-OE1 2.9Å; R262-E264 IonicContact NH2-OE1 3.13Å; R262-E264 PolarHBondContact NH2-OE1 2.79Å; R262-E264 PolarHBondContact O-N 2.84Å; R262-E264 VanDerWaalsContact O-N 3.08Å; R262-L265 HydrophobicContact CB-CB 4.23Å; R262-L265 HydrophobicContact CB-CD1 3.99Å; R262-L265 HydrophobicContact CB-CG 4.02Å; R262-L265 WeakPolarHBondContact O-CB 3.17Å; R262-L265 PolarHBondContact O-N 2.84Å; R262-L266 PolarHBondContact O-N 2.84Å
263	P	94.5	Very high	96.7	Very high	52 Å²	52	54.6 Å²	54.6	34%	0.338	29%	0.293	S	S	.	.	H	α-helix	trans	-50.2	-34	-177.7	-26.9	34.9	0	0	0	113.3	L265 L266 L267 M278	P263-L265 PolarHBondContact O-N 2.89Å; P263-L266 PolarHBondContact O-N 3.42Å; P263-L267 HydrophobicContact CB-CD1 4.32Å; P263-L267 VanDerWaalsContact O-CB 3.27Å; P263-L267 WeakPolarHBondContact O-CB 3.44Å; P263-L267 PolarHBondContact O-N 2.76Å; P263-M278 HydrophobicContact CB-CE 4.33Å; P263-M278 HydrophobicContact CB-SD 3.97Å; P263-M278 HydrophobicContact CG-CE 3.92Å; P263-M278 HydrophobicContact CG-SD 4.09Å
264	E	95.6	Very high	96.8	Very high	104 Å²	104	54.6 Å²	54.6	49%	0.486	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-25.1	177.9	78.8	-73.5	179.8	0	0	113.8	R262	R262-E264 WeakPolarHBondContact CA-OE2 3.49Å; R262-E264 WeakPolarHBondContact CB-OE1 3.41Å; R262-E264 IonicContact CZ-OE1 2.68Å; R262-E264 VanDerWaalsContact CZ-OE1 3.28Å; R262-E264 IonicContact NE-OE1 2.82Å; R262-E264 PolarHBondContact NE-OE1 2.9Å; R262-E264 IonicContact NH2-OE1 3.13Å; R262-E264 PolarHBondContact NH2-OE1 2.79Å; R262-E264 PolarHBondContact O-N 2.84Å; R262-E264 VanDerWaalsContact O-N 3.08Å
265	L	96.1	Very high	96.8	Very high	60 Å²	60	56.9 Å²	56.9	31%	0.314	30%	0.299	S	S	.	.	H	α-helix	trans	-87.4	-43.3	173.6	-63.6	-174.6	0	0	0	111.8	M258 R262 P263	M258-L265 HydrophobicContact SD-CD1 3.94Å; R262-L265 HydrophobicContact CB-CB 4.23Å; R262-L265 HydrophobicContact CB-CD1 3.99Å; R262-L265 HydrophobicContact CB-CG 4.02Å; R262-L265 WeakPolarHBondContact O-CB 3.17Å; R262-L265 PolarHBondContact O-N 2.84Å; P263-L265 PolarHBondContact O-N 2.89Å
266	L	97.4	Very high	96.8	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-69.7	-44	-177.4	179.3	57	0	0	0	112.1	W218 F222 I225 P233 W234 C259 T260 R262 P263 K268 M278	W218-L266 HydrophobicContact CZ3-CD2 4.45Å; F222-L266 HydrophobicContact CD1-CD1 4.27Å; F222-L266 HydrophobicContact CE1-CD1 4.13Å; F222-L266 HydrophobicContact CE1-CD2 4.14Å; I225-L266 HydrophobicContact CD1-CD1 3.88Å; I225-L266 HydrophobicContact CD1-CG 3.92Å; P233-L266 HydrophobicContact CG-CD1 4.27Å; W234-L266 HydrophobicContact CH2-CD1 3.77Å; W234-L266 HydrophobicContact CZ3-CD1 3.89Å; C259-L266 HydrophobicContact CB-CB 4.11Å; C259-L266 HydrophobicContact CB-CD1 4.34Å; C259-L266 WeakPolarHBondContact O-CB 3.47Å; T260-L266 HydrophobicContact CG2-CD2 4.07Å; R262-L266 PolarHBondContact O-N 2.84Å; P263-L266 PolarHBondContact O-N 3.42Å; L266-K268 VanDerWaalsContact C-N 3.35Å; L266-M278 HydrophobicContact CD2-CE 3.94Å; L266-M278 HydrophobicContact CD2-SD 3.93Å
267	L	97.9	Very high	96.8	Very high	12 Å²	12	58.6 Å²	58.6	6%	0.063	30%	0.304	C	S	.	.	S	Bend	trans	-96.2	14.4	-173.3	-56.3	180	0	0	0	112.5	I225 P263 G269 C270 Y274 E275 M278	I225-L267 HydrophobicContact CD1-CD2 3.72Å; I225-L267 HydrophobicContact CG1-CD2 4.27Å; P263-L267 HydrophobicContact CB-CD1 4.32Å; P263-L267 VanDerWaalsContact O-CB 3.27Å; P263-L267 WeakPolarHBondContact O-CB 3.44Å; P263-L267 PolarHBondContact O-N 2.76Å; L267-G269 PolarHBondContact O-N 2.79Å; L267-C270 HydrophobicContact CB-CB 4.15Å; L267-C270 VanDerWaalsContact O-CB 3.23Å; L267-C270 WeakPolarHBondContact O-CB 3.41Å; L267-C270 PolarHBondContact O-N 3.24Å; L267-Y274 HydrophobicContact CD2-CD2 4.49Å; L267-E275 HydrophobicContact CD1-CB 4.22Å; L267-E275 HydrophobicContact CD1-CG 3.61Å; L267-M278 HydrophobicContact CD1-CB 4.28Å; L267-M278 HydrophobicContact CD1-SD 3.89Å; L267-M278 HydrophobicContact CG-SD 4.17Å
268	K	97	Very high	96.8	Very high	167 Å²	167	56.8 Å²	56.8	73%	0.726	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	114.6	177.6	-175.6	174.2	-178.4	170.8	0	111	L266	L266-K268 VanDerWaalsContact C-N 3.35Å
269	G	96.6	Very high	96.8	Very high	64 Å²	64	55 Å²	55	66%	0.66	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	5.1	-178.7	0	0	0	0	0	114.8	L267	L267-G269 PolarHBondContact O-N 2.79Å
270	C	98.2	Very high	96.9	Very high	23 Å²	23	58.5 Å²	58.5	16%	0.155	30%	0.303	C	S	.	.	S	Bend	trans	-83.1	158.3	171	-64	0	0	0	0	110.9	L267 Y274	L267-C270 HydrophobicContact CB-CB 4.15Å; L267-C270 VanDerWaalsContact O-CB 3.23Å; L267-C270 WeakPolarHBondContact O-CB 3.41Å; L267-C270 PolarHBondContact O-N 3.24Å; C270-Y274 HydrophobicContact CB-CD2 3.58Å; C270-Y274 HydrophobicContact CB-CE2 4.23Å; C270-Y274 HydrophobicContact CB-CG 4.13Å
271	P	97.7	Very high	96.9	Very high	9 Å²	9	56.9 Å²	56.9	6%	0.058	29%	0.293	C	S	.	.			trans	-69.6	152.8	170.9	33.3	-37.8	0	0	0	110.9	L123 F127 E273 Y274	L123-P271 HydrophobicContact CD2-CB 4.42Å; L123-P271 HydrophobicContact CD2-CG 4.27Å; F127-P271 HydrophobicContact CE1-CG 3.95Å; F127-P271 HydrophobicContact CE2-CB 4.41Å; F127-P271 HydrophobicContact CE2-CG 4.27Å; F127-P271 HydrophobicContact CZ-CB 3.74Å; F127-P271 HydrophobicContact CZ-CG 3.48Å; F127-P271 VanDerWaalsContact CZ-CG 3.48Å; P271-E273 WeakPolarHBondContact CB-OE2 3.34Å; P271-E273 PolarHBondContact O-N 2.91Å; P271-E273 VanDerWaalsContact O-N 3.12Å; P271-Y274 HydrophobicContact CG-CD1 3.89Å; P271-Y274 HydrophobicContact CG-CE1 3.8Å; P271-Y274 HydrophobicContact CG-CG 4.28Å; P271-Y274 PolarHBondContact O-N 2.76Å
272	P	96.9	Very high	96.8	Very high	77 Å²	77	52.1 Å²	52.1	50%	0.5	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.8	-172.5	25.5	-36.1	0	0	0	113.8	Y274 E275	P272-Y274 PolarHBondContact O-N 2.68Å; P272-Y274 VanDerWaalsContact O-N 3.11Å; P272-E275 WeakPolarHBondContact O-CB 3.47Å; P272-E275 PolarHBondContact O-N 2.9Å
273	E	98.2	Very high	96.6	Very high	19 Å²	19	53.9 Å²	53.9	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-57.2	-26	174.4	-69.2	75	-167	0	0	112.9	F127 P271 E275 E276 V277 A298 K301 R305	F127-E273 HydrophobicContact CE1-CB 3.98Å; F127-E273 HydrophobicContact CE1-CG 4.28Å; F127-E273 HydrophobicContact CZ-CB 4.27Å; F127-E273 HydrophobicContact CZ-CG 4.26Å; P271-E273 WeakPolarHBondContact CB-OE2 3.34Å; P271-E273 PolarHBondContact O-N 2.91Å; P271-E273 VanDerWaalsContact O-N 3.12Å; E273-E275 VanDerWaalsContact C-N 3.27Å; E273-E275 PolarHBondContact O-N 3.36Å; E273-E276 PolarHBondContact O-N 3.13Å; E273-V277 WeakPolarHBondContact O-CG2 3.39Å; E273-V277 PolarHBondContact O-N 2.92Å; E273-A298 WeakPolarHBondContact CB-O 3.39Å; E273-A298 VanDerWaalsContact CG-O 3.28Å; E273-A298 WeakPolarHBondContact CG-O 3.31Å; E273-K301 HydrophobicContact CG-CB 4.46Å; E273-R305 VanDerWaalsContact CD-NH1 3.26Å; E273-R305 IonicContact OE1-CZ 3.01Å; E273-R305 IonicContact OE1-NE 3.72Å; E273-R305 IonicContact OE1-NH1 2.71Å; E273-R305 PolarHBondContact OE1-NH1 2.9Å; E273-R305 IonicContact OE1-NH2 3.43Å; E273-R305 PolarHBondContact OE1-NH2 3.45Å; E273-R305 IonicContact OE2-CZ 3.27Å; E273-R305 VanDerWaalsContact OE2-CZ 3.27Å; E273-R305 IonicContact OE2-NH1 3Å; E273-R305 PolarHBondContact OE2-NH1 2.82Å; E273-R305 IonicContact OE2-NH2 3.24Å; E273-R305 PolarHBondContact OE2-NH2 3.21Å
274	Y	98.3	Very high	96.7	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-71.8	-23	179.5	-74.6	16.8	0	0	0	112.4	F127 L224 I225 T228 L267 C270 P271 P272 M278 L299	F127-Y274 HydrophobicContact CD1-CE1 4.21Å; F127-Y274 HydrophobicContact CE1-CD1 4.33Å; F127-Y274 AromaticContact CE1-CE1 3.81Å; F127-Y274 HydrophobicContact CE1-CE1 3.81Å; L224-Y274 VanDerWaalsContact CD1-OH 3.28Å; L224-Y274 WeakPolarHBondContact CD1-OH 3.19Å; L224-Y274 HydrophobicContact CD2-CE1 3.91Å; L224-Y274 HydrophobicContact CD2-CE2 4.17Å; L224-Y274 HydrophobicContact CG-CE1 4.36Å; L224-Y274 HydrophobicContact CG-CE2 3.91Å; L224-Y274 WeakPolarHBondContact CG-OH 3.49Å; I225-Y274 HydrophobicContact CG1-CD2 4.12Å; I225-Y274 HydrophobicContact CG1-CE2 4.3Å; T228-Y274 HydrophobicContact CG2-CE2 4.26Å; T228-Y274 PolarHBondContact OG1-OH 3.03Å; L267-Y274 HydrophobicContact CD2-CD2 4.49Å; C270-Y274 HydrophobicContact CB-CD2 3.58Å; C270-Y274 HydrophobicContact CB-CE2 4.23Å; C270-Y274 HydrophobicContact CB-CG 4.13Å; P271-Y274 HydrophobicContact CG-CD1 3.89Å; P271-Y274 HydrophobicContact CG-CE1 3.8Å; P271-Y274 HydrophobicContact CG-CG 4.28Å; P271-Y274 PolarHBondContact O-N 2.76Å; P272-Y274 PolarHBondContact O-N 2.68Å; P272-Y274 VanDerWaalsContact O-N 3.11Å; Y274-M278 VanDerWaalsContact O-CB 3.28Å; Y274-M278 WeakPolarHBondContact O-CB 3.23Å; Y274-M278 PolarHBondContact O-N 3.43Å; Y274-L299 HydrophobicContact CD1-CD2 3.98Å; Y274-L299 HydrophobicContact CE1-CD2 3.61Å
275	E	97.6	Very high	96.8	Very high	119 Å²	119	53 Å²	53	56%	0.556	29%	0.286	S	S	*	.	H	α-helix	trans	-66.6	-43.5	171.5	-67	-177.6	-177	0	0	110.4	L267 P272 E273 M278 S279	L267-E275 HydrophobicContact CD1-CB 4.22Å; L267-E275 HydrophobicContact CD1-CG 3.61Å; P272-E275 WeakPolarHBondContact O-CB 3.47Å; P272-E275 PolarHBondContact O-N 2.9Å; E273-E275 VanDerWaalsContact C-N 3.27Å; E273-E275 PolarHBondContact O-N 3.36Å; E275-M278 PolarHBondContact O-N 3Å; E275-S279 PolarHBondContact O-N 3.45Å
276	E	97.3	Very high	96.9	Very high	53 Å²	53	51.1 Å²	51.1	25%	0.248	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-47	174.6	-166	-173.8	165.9	0	0	110.7	E273 M278 S279 Y280 A298 K301	E273-E276 PolarHBondContact O-N 3.13Å; E276-M278 VanDerWaalsContact C-N 3.31Å; E276-M278 PolarHBondContact O-N 3.15Å; E276-S279 WeakPolarHBondContact O-CB 3.44Å; E276-S279 PolarHBondContact O-N 3.47Å; E276-S279 VanDerWaalsContact O-N 3.16Å; E276-S279 PolarHBondContact O-OG 3.36Å; E276-Y280 HydrophobicContact CG-CE2 3.7Å; E276-Y280 WeakPolarHBondContact O-CD2 3.33Å; E276-Y280 PolarHBondContact O-N 3.02Å; E276-Y280 PolarHBondContact OE1-OH 3.08Å; E276-A298 HydrophobicContact CB-CB 4.16Å; E276-A298 HydrophobicContact CG-CB 4.12Å; E276-K301 IonicContact OE1-NZ 2.8Å; E276-K301 PolarHBondContact OE1-NZ 2.92Å; E276-K301 IonicContact OE2-NZ 2.77Å; E276-K301 PolarHBondContact OE2-NZ 3.44Å
277	V	98.3	Very high	96.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-54.1	-48	173.7	167.4	0	0	0	0	111.5	W220 L221 E273 S279 Y280 M281 I295 A298 L299	W220-V277 HydrophobicContact CH2-CG1 4.08Å; W220-V277 HydrophobicContact CZ3-CG1 3.78Å; L221-V277 HydrophobicContact CD1-CG1 4.15Å; E273-V277 WeakPolarHBondContact O-CG2 3.39Å; E273-V277 PolarHBondContact O-N 2.92Å; V277-S279 VanDerWaalsContact C-N 3.3Å; V277-S279 PolarHBondContact O-N 2.79Å; V277-Y280 PolarHBondContact O-N 3.37Å; V277-M281 HydrophobicContact CG1-SD 3.96Å; V277-M281 WeakPolarHBondContact O-CG 3.29Å; V277-I295 HydrophobicContact CG1-CG2 3.94Å; V277-I295 HydrophobicContact CG2-CG2 4.18Å; V277-A298 HydrophobicContact CG2-CB 3.78Å; V277-L299 HydrophobicContact CG2-CD2 3.94Å; V277-L299 HydrophobicContact CG2-CG 4.13Å
278	M	97.5	Very high	96.9	Very high	4 Å²	4	58 Å²	58	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-37	-178.9	-175	172.7	171.9	0	0	111.5	W218 L221 T260 P263 L266 L267 Y274 E275 E276 Y280 M281 T282	W218-M278 HydrophobicContact CH2-CE 4.38Å; W218-M278 HydrophobicContact CH2-CG 4.38Å; L221-M278 HydrophobicContact CD2-CB 4.46Å; T260-M278 WeakPolarHBondContact O-CE 3.35Å; P263-M278 HydrophobicContact CB-CE 4.33Å; P263-M278 HydrophobicContact CB-SD 3.97Å; P263-M278 HydrophobicContact CG-CE 3.92Å; P263-M278 HydrophobicContact CG-SD 4.09Å; L266-M278 HydrophobicContact CD2-CE 3.94Å; L266-M278 HydrophobicContact CD2-SD 3.93Å; L267-M278 HydrophobicContact CD1-CB 4.28Å; L267-M278 HydrophobicContact CD1-SD 3.89Å; L267-M278 HydrophobicContact CG-SD 4.17Å; Y274-M278 VanDerWaalsContact O-CB 3.28Å; Y274-M278 WeakPolarHBondContact O-CB 3.23Å; Y274-M278 PolarHBondContact O-N 3.43Å; E275-M278 PolarHBondContact O-N 3Å; E276-M278 VanDerWaalsContact C-N 3.31Å; E276-M278 PolarHBondContact O-N 3.15Å; M278-Y280 VanDerWaalsContact C-N 3.25Å; M278-Y280 PolarHBondContact O-N 3.37Å; M278-M281 WeakPolarHBondContact O-CA 3.41Å; M278-M281 WeakPolarHBondContact O-CB 3.24Å; M278-M281 PolarHBondContact O-N 2.84Å; M278-T282 HydrophobicContact CE-CG2 4.46Å; M278-T282 HydrophobicContact CG-CG2 4.23Å; M278-T282 WeakPolarHBondContact O-CG2 3.35Å; M278-T282 PolarHBondContact O-N 2.85Å; M278-T282 VanDerWaalsContact O-N 3.14Å
279	S	96.4	Very high	96.9	Very high	65 Å²	65	57 Å²	57	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-32.5	177.7	80.6	0	0	0	0	113.3	E275 E276 V277 M281 T282	E275-S279 PolarHBondContact O-N 3.45Å; E276-S279 WeakPolarHBondContact O-CB 3.44Å; E276-S279 PolarHBondContact O-N 3.47Å; E276-S279 VanDerWaalsContact O-N 3.16Å; E276-S279 PolarHBondContact O-OG 3.36Å; V277-S279 VanDerWaalsContact C-N 3.3Å; V277-S279 PolarHBondContact O-N 2.79Å; S279-M281 PolarHBondContact O-N 3.13Å; S279-T282 PolarHBondContact O-OG1 3.41Å
280	Y	96.9	Very high	97	Very high	80 Å²	80	54.1 Å²	54.1	31%	0.314	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.3	175	-60.1	-54.5	0	0	0	113.6	E276 V277 M278 A294 I295 A298	E276-Y280 HydrophobicContact CG-CE2 3.7Å; E276-Y280 WeakPolarHBondContact O-CD2 3.33Å; E276-Y280 PolarHBondContact O-N 3.02Å; E276-Y280 PolarHBondContact OE1-OH 3.08Å; V277-Y280 PolarHBondContact O-N 3.37Å; M278-Y280 VanDerWaalsContact C-N 3.25Å; M278-Y280 PolarHBondContact O-N 3.37Å; Y280-A294 HydrophobicContact CD1-CB 4.08Å; Y280-A294 HydrophobicContact CD2-CB 3.94Å; Y280-A294 HydrophobicContact CE1-CB 3.87Å; Y280-A294 HydrophobicContact CE2-CB 3.72Å; Y280-A294 HydrophobicContact CG-CB 4.13Å; Y280-I295 HydrophobicContact CD2-CG1 4.22Å; Y280-A298 HydrophobicContact CE2-CB 4.42Å
281	M	96.1	Very high	97	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-26	-173.9	-64.7	174.6	50.1	0	0	114	I217 W218 W220 L221 V277 M278 S279 E283 L284 I295	I217-M281 HydrophobicContact CG2-CE 3.8Å; I217-M281 HydrophobicContact CG2-CG 4.03Å; I217-M281 HydrophobicContact CG2-SD 3.78Å; I217-M281 VanDerWaalsContact O-CE 3.32Å; I217-M281 WeakPolarHBondContact O-CE 3.49Å; W218-M281 HydrophobicContact CB-CE 4.46Å; W218-M281 HydrophobicContact CD2-CE 3.65Å; W218-M281 HydrophobicContact CE3-CE 3.61Å; W218-M281 HydrophobicContact CG-CE 4.05Å; W218-M281 HydrophobicContact CH2-CB 4.35Å; W218-M281 HydrophobicContact CH2-CE 4.47Å; W218-M281 HydrophobicContact CZ2-CB 4.04Å; W218-M281 HydrophobicContact CZ3-CE 4.04Å; W220-M281 HydrophobicContact CZ3-SD 4.37Å; L221-M281 HydrophobicContact CB-CE 3.66Å; L221-M281 HydrophobicContact CB-SD 4.07Å; L221-M281 HydrophobicContact CD2-CE 3.72Å; L221-M281 HydrophobicContact CD2-SD 3.84Å; L221-M281 HydrophobicContact CG-CE 4.33Å; L221-M281 HydrophobicContact CG-SD 4.46Å; V277-M281 HydrophobicContact CG1-SD 3.96Å; V277-M281 WeakPolarHBondContact O-CG 3.29Å; M278-M281 WeakPolarHBondContact O-CA 3.41Å; M278-M281 WeakPolarHBondContact O-CB 3.24Å; M278-M281 PolarHBondContact O-N 2.84Å; S279-M281 PolarHBondContact O-N 3.13Å; M281-E283 VanDerWaalsContact C-N 3.3Å; M281-E283 PolarHBondContact O-N 3.31Å; M281-L284 HydrophobicContact CB-CD1 4.23Å; M281-L284 HydrophobicContact CG-CD1 4.35Å; M281-L284 WeakPolarHBondContact O-CB 3.45Å; M281-L284 WeakPolarHBondContact O-CG 3.49Å; M281-L284 PolarHBondContact O-N 3.12Å; M281-I295 HydrophobicContact CG-CD1 4.2Å
282	T	93.5	Very high	97	Very high	66 Å²	66	57.5 Å²	57.5	41%	0.405	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-36.7	-173.4	52.6	0	0	0	0	113.2	M278 S279	M278-T282 HydrophobicContact CE-CG2 4.46Å; M278-T282 HydrophobicContact CG-CG2 4.23Å; M278-T282 WeakPolarHBondContact O-CG2 3.35Å; M278-T282 PolarHBondContact O-N 2.85Å; M278-T282 VanDerWaalsContact O-N 3.14Å; S279-T282 PolarHBondContact O-OG1 3.41Å
283	E	91.7	Very high	97.1	Very high	153 Å²	153	59.5 Å²	59.5	72%	0.715	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	7.7	-177.5	-59.4	-51.5	128.9	0	0	114.1	M281 L285	M281-E283 VanDerWaalsContact C-N 3.3Å; M281-E283 PolarHBondContact O-N 3.31Å; E283-L285 PolarHBondContact O-N 3.47Å; E283-L285 VanDerWaalsContact O-N 3.14Å
284	L	96.8	Very high	97.1	Very high	20 Å²	20	59.3 Å²	59.3	11%	0.105	29%	0.288	C	S	.	.			trans	-69.4	115.2	-178	-66.3	176.2	0	0	0	112.1	R214 M281 P290	R214-L284 HydrophobicContact CB-CB 3.68Å; R214-L284 HydrophobicContact CB-CD1 4.13Å; R214-L284 VanDerWaalsContact CD-O 3.24Å; R214-L284 WeakPolarHBondContact CD-O 3.3Å; R214-L284 PolarHBondContact NH1-O 3.33Å; M281-L284 HydrophobicContact CB-CD1 4.23Å; M281-L284 HydrophobicContact CG-CD1 4.35Å; M281-L284 WeakPolarHBondContact O-CB 3.45Å; M281-L284 WeakPolarHBondContact O-CG 3.49Å; M281-L284 PolarHBondContact O-N 3.12Å; L284-P290 HydrophobicContact CD1-CB 4.24Å; L284-P290 HydrophobicContact CD1-CG 4.18Å; L284-P290 HydrophobicContact CD2-CB 4.49Å
285	L	97.4	Very high	97.1	Very high	117 Å²	117	59.3 Å²	59.3	61%	0.613	29%	0.288	S	S	*	.			trans	-90.1	170.7	172.4	-56.3	-179.8	0	0	0	111	E283 Y287 S288	E283-L285 PolarHBondContact O-N 3.47Å; E283-L285 VanDerWaalsContact O-N 3.14Å; L285-Y287 PolarHBondContact O-N 2.83Å; L285-S288 PolarHBondContact N-OG 3.08Å; L285-S288 WeakPolarHBondContact O-CB 3.35Å; L285-S288 PolarHBondContact O-N 3.12Å; L285-S288 PolarHBondContact O-OG 3.49Å
286	F	97.6	Very high	97.1	Very high	22 Å²	22	57.1 Å²	57.1	10%	0.096	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-37.4	-176.3	-179.9	-98.5	0	0	0	113.1	H185 P188 D210 S212	H185-F286 AromaticContact CE1-CD1 3.96Å; H185-F286 AromaticContact CE1-CE1 3.29Å; H185-F286 WeakPolarHBondContact CE1-CE1 3.26Å; H185-F286 AromaticContact CE1-CZ 3.54Å; H185-F286 AromaticContact ND1-CE1 3.6Å; H185-F286 PolarHBondContact NE2-O 3.24Å; P188-F286 HydrophobicContact CB-CD1 4.23Å; P188-F286 HydrophobicContact CB-CD2 4.43Å; P188-F286 HydrophobicContact CB-CE1 3.74Å; P188-F286 HydrophobicContact CB-CE2 3.98Å; P188-F286 HydrophobicContact CB-CZ 3.61Å; P188-F286 HydrophobicContact CG-CD1 4.31Å; P188-F286 HydrophobicContact CG-CE1 4.08Å; P188-F286 HydrophobicContact CG-CZ 4.44Å; D210-F286 HydrophobicContact CB-CE2 3.93Å; D210-F286 HydrophobicContact CB-CZ 4.27Å; D210-F286 VanDerWaalsContact O-CE2 3.31Å; D210-F286 WeakPolarHBondContact O-CE2 3.31Å; S212-F286 WeakPolarHBondContact CB-O 3.35Å; S212-F286 PolarHBondContact OG-O 3.07Å
287	Y	97.8	Very high	97.2	Very high	124 Å²	124	57.1 Å²	57.1	49%	0.486	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.7	179.7	-60.5	-66.5	0	0	0	113.7	H185 P188 R213 L285	H185-Y287 HydrophobicContact CB-CD1 3.85Å; H185-Y287 HydrophobicContact CB-CE1 4.23Å; H185-Y287 AromaticContact CG-CD1 3.66Å; H185-Y287 AromaticContact ND1-CD1 3.8Å; H185-Y287 AromaticContact ND1-CE1 3.88Å; P188-Y287 WeakPolarHBondContact CD-OH 3.45Å; R213-Y287 PolarHBondContact NH2-O 3.06Å; L285-Y287 PolarHBondContact O-N 2.83Å
288	S	97.1	Very high	97.2	Very high	34 Å²	34	57.1 Å²	57.1	24%	0.238	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-59.8	144.5	-175.4	-62.1	0	0	0	0	111.4	R213 L285	R213-S288 PolarHBondContact NE-O 3.47Å; R213-S288 PolarHBondContact NH2-O 3.11Å; L285-S288 PolarHBondContact N-OG 3.08Å; L285-S288 WeakPolarHBondContact O-CB 3.35Å; L285-S288 PolarHBondContact O-N 3.12Å; L285-S288 PolarHBondContact O-OG 3.49Å
289	R	97.2	Very high	97.2	Very high	148 Å²	148	56.9 Å²	56.9	56%	0.558	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-93.9	117.3	163	177.5	178.9	168.2	112.6	-5.6	106.6	Y138 Y292	Y138-R289 PolarHBondContact OH-NH2 2.88Å; R289-Y292 HydrophobicContact CG-CE2 4.3Å
290	P	98.1	Very high	97.3	Very high	2 Å²	2	57 Å²	57	1%	0.013	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-54.8	144.3	173.3	-24.9	34	0	0	0	111.4	R213 I217 L284 Y292	R213-P290 HydrophobicContact CB-CG 3.99Å; I217-P290 HydrophobicContact CG1-CB 4.04Å; I217-P290 HydrophobicContact CG1-CG 3.75Å; L284-P290 HydrophobicContact CD1-CB 4.24Å; L284-P290 HydrophobicContact CD1-CG 4.18Å; L284-P290 HydrophobicContact CD2-CB 4.49Å; P290-Y292 VanDerWaalsContact C-N 3.25Å; P290-Y292 HydrophobicContact CB-CD2 4.3Å; P290-Y292 HydrophobicContact CB-CE1 4.34Å; P290-Y292 HydrophobicContact CB-CE2 3.91Å; P290-Y292 HydrophobicContact CG-CE2 4.2Å; P290-Y292 WeakPolarHBondContact O-CD2 3.43Å; P290-Y292 VanDerWaalsContact O-CE2 3.25Å; P290-Y292 WeakPolarHBondContact O-CE2 3.5Å; P290-Y292 PolarHBondContact O-N 3.12Å
291	N	98	Very high	97.4	Very high	88 Å²	88	57.7 Å²	57.7	47%	0.471	28%	0.277	S	S	.	.			trans	-82.6	75.6	173.3	-167.8	-13.2	0	0	0	109.7	E293 A294 I295	N291-E293 PolarHBondContact O-N 2.88Å; N291-A294 HydrophobicContact CB-CB 4.07Å; N291-A294 VanDerWaalsContact CG-CB 3.41Å; N291-A294 WeakPolarHBondContact ND2-CB 2.69Å; N291-A294 PolarHBondContact O-N 2.97Å; N291-A294 PolarHBondContact OD1-N 3.11Å; N291-A294 VanDerWaalsContact OD1-N 3.14Å; N291-I295 WeakPolarHBondContact O-CG1 3.41Å; N291-I295 PolarHBondContact O-N 2.8Å; N291-I295 VanDerWaalsContact O-N 3.1Å
292	Y	98.4	Very high	97.5	Very high	15 Å²	15	57.7 Å²	57.7	6%	0.059	28%	0.277	C	S	.	.	H	α-helix	trans	-54.3	-36.5	-178.1	-58.6	-92.8	0	0	0	112.2	L134 Y138 H141 I217 R289 P290 I295 R296	L134-Y292 HydrophobicContact CD1-CD1 4Å; L134-Y292 HydrophobicContact CG-CD1 4.37Å; Y138-Y292 AromaticContact CD2-CD1 3.91Å; Y138-Y292 HydrophobicContact CD2-CD1 3.91Å; Y138-Y292 AromaticContact CD2-CD2 3.45Å; Y138-Y292 HydrophobicContact CD2-CD2 3.45Å; Y138-Y292 VanDerWaalsContact CD2-CD2 3.45Å; Y138-Y292 HydrophobicContact CD2-CE1 4.17Å; Y138-Y292 AromaticContact CD2-CE2 3.78Å; Y138-Y292 HydrophobicContact CD2-CE2 3.78Å; Y138-Y292 AromaticContact CD2-CG 3.54Å; Y138-Y292 HydrophobicContact CD2-CG 3.54Å; Y138-Y292 AromaticContact CE2-CD2 3.93Å; Y138-Y292 HydrophobicContact CE2-CD2 3.93Å; Y138-Y292 HydrophobicContact CE2-CE2 4.31Å; Y138-Y292 HydrophobicContact CE2-CG 4.35Å; Y138-Y292 HydrophobicContact CG-CD1 4.26Å; Y138-Y292 HydrophobicContact CG-CD2 4.48Å; Y138-Y292 HydrophobicContact CG-CG 4.17Å; H141-Y292 AromaticContact ND1-CE1 3.69Å; H141-Y292 AromaticContact ND1-CZ 3.63Å; H141-Y292 PolarHBondContact ND1-OH 2.7Å; I217-Y292 HydrophobicContact CD1-CD1 4.37Å; I217-Y292 HydrophobicContact CD1-CE1 3.77Å; I217-Y292 HydrophobicContact CG1-CE1 4.4Å; R289-Y292 HydrophobicContact CG-CE2 4.3Å; P290-Y292 VanDerWaalsContact C-N 3.25Å; P290-Y292 HydrophobicContact CB-CD2 4.3Å; P290-Y292 HydrophobicContact CB-CE1 4.34Å; P290-Y292 HydrophobicContact CB-CE2 3.91Å; P290-Y292 HydrophobicContact CG-CE2 4.2Å; P290-Y292 WeakPolarHBondContact O-CD2 3.43Å; P290-Y292 VanDerWaalsContact O-CE2 3.25Å; P290-Y292 WeakPolarHBondContact O-CE2 3.5Å; P290-Y292 PolarHBondContact O-N 3.12Å; Y292-I295 PolarHBondContact O-N 2.92Å; Y292-R296 VanDerWaalsContact O-CB 3.31Å; Y292-R296 WeakPolarHBondContact O-CB 3.23Å; Y292-R296 PolarHBondContact O-N 2.82Å
293	E	98.2	Very high	97.7	Very high	119 Å²	119	55 Å²	55	56%	0.556	26%	0.26	S	S	*	.	H	α-helix	trans	-70	-42.9	-178.9	-169.8	55.6	-148.3	0	0	112.2	N291 I295 R296 S297	N291-E293 PolarHBondContact O-N 2.88Å; E293-I295 VanDerWaalsContact C-N 3.35Å; E293-I295 PolarHBondContact O-N 2.91Å; E293-R296 PolarHBondContact O-N 3.27Å; E293-R296 IonicContact OE2-NE 3.62Å; E293-S297 WeakPolarHBondContact O-CB 3.49Å; E293-S297 PolarHBondContact O-N 2.81Å
294	A	98.2	Very high	97.9	Very high	16 Å²	16	51.5 Å²	51.5	13%	0.132	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-39.7	175.6	0	0	0	0	0	112.1	Y280 N291 S297 A298	Y280-A294 HydrophobicContact CD1-CB 4.08Å; Y280-A294 HydrophobicContact CD2-CB 3.94Å; Y280-A294 HydrophobicContact CE1-CB 3.87Å; Y280-A294 HydrophobicContact CE2-CB 3.72Å; Y280-A294 HydrophobicContact CG-CB 4.13Å; N291-A294 HydrophobicContact CB-CB 4.07Å; N291-A294 VanDerWaalsContact CG-CB 3.41Å; N291-A294 WeakPolarHBondContact ND2-CB 2.69Å; N291-A294 PolarHBondContact O-N 2.97Å; N291-A294 PolarHBondContact OD1-N 3.11Å; N291-A294 VanDerWaalsContact OD1-N 3.14Å; A294-S297 PolarHBondContact O-N 3.44Å; A294-A298 WeakPolarHBondContact O-CB 3.35Å; A294-A298 PolarHBondContact O-N 3.03Å
295	I	98.5	Very high	97.9	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-46.7	174.6	-64.1	170.4	0	0	0	110.5	L134 I217 W220 V277 Y280 M281 N291 Y292 E293 S297 A298 L299	L134-I295 HydrophobicContact CD1-CG2 4.2Å; L134-I295 HydrophobicContact CD2-CB 3.86Å; L134-I295 HydrophobicContact CD2-CG2 3.5Å; L134-I295 HydrophobicContact CG-CG2 4.49Å; I217-I295 HydrophobicContact CG2-CD1 4.1Å; W220-I295 HydrophobicContact CH2-CG2 3.36Å; W220-I295 HydrophobicContact CZ2-CG2 4.33Å; W220-I295 HydrophobicContact CZ3-CG2 3.68Å; V277-I295 HydrophobicContact CG1-CG2 3.94Å; V277-I295 HydrophobicContact CG2-CG2 4.18Å; Y280-I295 HydrophobicContact CD2-CG1 4.22Å; M281-I295 HydrophobicContact CG-CD1 4.2Å; N291-I295 WeakPolarHBondContact O-CG1 3.41Å; N291-I295 PolarHBondContact O-N 2.8Å; N291-I295 VanDerWaalsContact O-N 3.1Å; Y292-I295 PolarHBondContact O-N 2.92Å; E293-I295 VanDerWaalsContact C-N 3.35Å; E293-I295 PolarHBondContact O-N 2.91Å; I295-S297 VanDerWaalsContact C-N 3.34Å; I295-S297 PolarHBondContact O-N 3.35Å; I295-A298 PolarHBondContact O-N 3.25Å; I295-L299 WeakPolarHBondContact O-CG 3.26Å; I295-L299 PolarHBondContact O-N 3.48Å; I295-L299 VanDerWaalsContact O-N 3.16Å
296	R	98.6	Very high	97.9	Very high	73 Å²	73	50.5 Å²	50.5	28%	0.275	23%	0.234	S	C	.	.	H	α-helix	trans	-57	-48.3	175.3	-179.9	-157	-72.4	-86.7	4.5	110.9	I131 L134 D135 Y292 E293 A298 L299 Q300	I131-R296 HydrophobicContact CG2-CG 4.25Å; L134-R296 HydrophobicContact CD2-CB 4.22Å; D135-R296 VanDerWaalsContact CG-NH1 3.31Å; D135-R296 IonicContact OD1-CZ 2.86Å; D135-R296 IonicContact OD1-NE 3.2Å; D135-R296 IonicContact OD1-NH1 2.94Å; D135-R296 PolarHBondContact OD1-NH1 3.03Å; D135-R296 IonicContact OD1-NH2 2.79Å; D135-R296 PolarHBondContact OD1-NH2 2.88Å; D135-R296 IonicContact OD2-CZ 2.68Å; D135-R296 IonicContact OD2-NH1 3.12Å; D135-R296 PolarHBondContact OD2-NH1 2.94Å; D135-R296 IonicContact OD2-NH2 3.55Å; D135-R296 PolarHBondContact OD2-NH2 2.81Å; Y292-R296 VanDerWaalsContact O-CB 3.31Å; Y292-R296 WeakPolarHBondContact O-CB 3.23Å; Y292-R296 PolarHBondContact O-N 2.82Å; E293-R296 PolarHBondContact O-N 3.27Å; E293-R296 IonicContact OE2-NE 3.62Å; R296-A298 PolarHBondContact O-N 2.98Å; R296-L299 PolarHBondContact O-N 3.26Å; R296-Q300 WeakPolarHBondContact O-CB 3.45Å; R296-Q300 PolarHBondContact O-N 2.79Å
297	S	98.5	Very high	97.8	Very high	53 Å²	53	54.1 Å²	54.1	37%	0.371	25%	0.25	S	S	.	.	H	α-helix	trans	-60.2	-43.6	179.9	-175.5	0	0	0	0	111.8	E293 A294 I295 L299 Q300 K301	E293-S297 WeakPolarHBondContact O-CB 3.49Å; E293-S297 PolarHBondContact O-N 2.81Å; A294-S297 PolarHBondContact O-N 3.44Å; I295-S297 VanDerWaalsContact C-N 3.34Å; I295-S297 PolarHBondContact O-N 3.35Å; S297-L299 VanDerWaalsContact C-N 3.35Å; S297-L299 PolarHBondContact O-N 3.06Å; S297-Q300 PolarHBondContact O-N 3.4Å; S297-Q300 VanDerWaalsContact O-N 3.16Å; S297-K301 WeakPolarHBondContact O-CG 3.24Å; S297-K301 PolarHBondContact O-N 3.32Å
298	A	98.5	Very high	97.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-42.8	175.6	0	0	0	0	0	112.3	E273 E276 V277 Y280 A294 I295 R296	E273-A298 WeakPolarHBondContact CB-O 3.39Å; E273-A298 VanDerWaalsContact CG-O 3.28Å; E273-A298 WeakPolarHBondContact CG-O 3.31Å; E276-A298 HydrophobicContact CB-CB 4.16Å; E276-A298 HydrophobicContact CG-CB 4.12Å; V277-A298 HydrophobicContact CG2-CB 3.78Å; Y280-A298 HydrophobicContact CE2-CB 4.42Å; A294-A298 WeakPolarHBondContact O-CB 3.35Å; A294-A298 PolarHBondContact O-N 3.03Å; I295-A298 PolarHBondContact O-N 3.25Å; R296-A298 PolarHBondContact O-N 2.98Å
299	L	98.6	Very high	97.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.2	-36.5	174.9	-63.2	177.1	0	0	0	112.6	F127 I131 W220 L224 Y274 V277 I295 R296 S297 K301 G302 I303	F127-L299 HydrophobicContact CD1-CB 4.14Å; F127-L299 HydrophobicContact CD1-CD2 3.78Å; F127-L299 WeakPolarHBondContact CD1-O 3.1Å; F127-L299 HydrophobicContact CE1-CD2 4.07Å; I131-L299 HydrophobicContact CD1-CB 4.08Å; I131-L299 HydrophobicContact CG1-CB 3.7Å; I131-L299 HydrophobicContact CG1-CD1 3.97Å; W220-L299 HydrophobicContact CH2-CD1 3.85Å; W220-L299 HydrophobicContact CZ2-CD1 3.73Å; L224-L299 HydrophobicContact CD2-CD1 4.45Å; L224-L299 HydrophobicContact CD2-CD2 4.1Å; Y274-L299 HydrophobicContact CD1-CD2 3.98Å; Y274-L299 HydrophobicContact CE1-CD2 3.61Å; V277-L299 HydrophobicContact CG2-CD2 3.94Å; V277-L299 HydrophobicContact CG2-CG 4.13Å; I295-L299 WeakPolarHBondContact O-CG 3.26Å; I295-L299 PolarHBondContact O-N 3.48Å; I295-L299 VanDerWaalsContact O-N 3.16Å; R296-L299 PolarHBondContact O-N 3.26Å; S297-L299 VanDerWaalsContact C-N 3.35Å; S297-L299 PolarHBondContact O-N 3.06Å; L299-K301 PolarHBondContact O-N 2.97Å; L299-G302 WeakPolarHBondContact O-CA 3.39Å; L299-G302 PolarHBondContact O-N 3.44Å; L299-G302 VanDerWaalsContact O-N 3.1Å; L299-I303 PolarHBondContact O-N 2.75Å
300	Q	98.3	Very high	97.3	Very high	67 Å²	67	50.1 Å²	50.1	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-39.4	178.1	-173.9	58.3	53.4	0	0	111.8	I131 R296 S297 G302 I303 D304	I131-Q300 HydrophobicContact CD1-CB 4.43Å; R296-Q300 WeakPolarHBondContact O-CB 3.45Å; R296-Q300 PolarHBondContact O-N 2.79Å; S297-Q300 PolarHBondContact O-N 3.4Å; S297-Q300 VanDerWaalsContact O-N 3.16Å; Q300-G302 PolarHBondContact O-N 3.14Å; Q300-I303 WeakPolarHBondContact O-CB 3.32Å; Q300-I303 PolarHBondContact O-N 3.15Å; Q300-D304 PolarHBondContact NE2-OD1 3.29Å; Q300-D304 VanDerWaalsContact O-CG 3.25Å; Q300-D304 PolarHBondContact O-N 2.75Å
301	K	98.2	Very high	96.8	Very high	95 Å²	95	53.5 Å²	53.5	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-54.2	-38	171.9	-66.9	173.1	-166.5	172.5	0	111.9	E273 E276 S297 L299 D304 R305	E273-K301 HydrophobicContact CG-CB 4.46Å; E276-K301 IonicContact OE1-NZ 2.8Å; E276-K301 PolarHBondContact OE1-NZ 2.92Å; E276-K301 IonicContact OE2-NZ 2.77Å; E276-K301 PolarHBondContact OE2-NZ 3.44Å; S297-K301 WeakPolarHBondContact O-CG 3.24Å; S297-K301 PolarHBondContact O-N 3.32Å; L299-K301 PolarHBondContact O-N 2.97Å; K301-D304 PolarHBondContact O-N 3.44Å; K301-R305 WeakPolarHBondContact O-CB 3.33Å; K301-R305 PolarHBondContact O-N 3.3Å
302	G	97.7	Very high	96.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.9	-45.9	175.7	0	0	0	0	0	112.4	L299 Q300 R305 L306	L299-G302 WeakPolarHBondContact O-CA 3.39Å; L299-G302 PolarHBondContact O-N 3.44Å; L299-G302 VanDerWaalsContact O-N 3.1Å; Q300-G302 PolarHBondContact O-N 3.14Å; G302-R305 PolarHBondContact O-N 3.21Å; G302-L306 WeakPolarHBondContact O-CG 3.04Å; G302-L306 PolarHBondContact O-N 3.45Å; G302-L306 VanDerWaalsContact O-N 3.11Å
303	I	97.5	Very high	95.7	Very high	10 Å²	10	56.9 Å²	56.9	5%	0.051	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-45.4	174.2	-67.3	178.2	0	0	0	110.9	Y124 F127 I131 L299 Q300 R305 L306 K307	Y124-I303 HydrophobicContact CD2-CG2 4.41Å; Y124-I303 HydrophobicContact CE2-CG2 3.97Å; F127-I303 HydrophobicContact CB-CD1 3.98Å; F127-I303 HydrophobicContact CB-CG1 3.53Å; F127-I303 HydrophobicContact CD2-CG1 4.46Å; F127-I303 HydrophobicContact CG-CG1 4.19Å; I131-I303 HydrophobicContact CD1-CD1 3.69Å; L299-I303 PolarHBondContact O-N 2.75Å; Q300-I303 WeakPolarHBondContact O-CB 3.32Å; Q300-I303 PolarHBondContact O-N 3.15Å; I303-R305 VanDerWaalsContact C-N 3.34Å; I303-R305 PolarHBondContact O-N 3.13Å; I303-L306 PolarHBondContact O-N 3.29Å; I303-K307 HydrophobicContact CG2-CD 4.13Å; I303-K307 WeakPolarHBondContact O-CG 3.28Å; I303-K307 PolarHBondContact O-N 3.33Å
304	D	97.2	Very high	95.3	Very high	78 Å²	78	55.5 Å²	55.5	42%	0.417	33%	0.325	S	S	.	.	H	α-helix	trans	-65.7	-38.6	-177.6	-61.8	-21.3	0	0	0	111.3	Q300 K301 K307 A308	Q300-D304 PolarHBondContact NE2-OD1 3.29Å; Q300-D304 VanDerWaalsContact O-CG 3.25Å; Q300-D304 PolarHBondContact O-N 2.75Å; K301-D304 PolarHBondContact O-N 3.44Å; D304-K307 PolarHBondContact O-N 3Å; D304-A308 WeakPolarHBondContact O-CB 3.48Å; D304-A308 PolarHBondContact O-N 2.66Å
305	R	97	Very high	95.1	Very high	95 Å²	95	55 Å²	55	36%	0.358	32%	0.32	S	S	.	.	H	α-helix	trans	-60.2	-46.6	172.3	-177	-172.1	66.1	-150.3	-15.4	112	E273 K301 G302 I303 K307 A308 G309	E273-R305 VanDerWaalsContact CD-NH1 3.26Å; E273-R305 IonicContact OE1-CZ 3.01Å; E273-R305 IonicContact OE1-NE 3.72Å; E273-R305 IonicContact OE1-NH1 2.71Å; E273-R305 PolarHBondContact OE1-NH1 2.9Å; E273-R305 IonicContact OE1-NH2 3.43Å; E273-R305 PolarHBondContact OE1-NH2 3.45Å; E273-R305 IonicContact OE2-CZ 3.27Å; E273-R305 VanDerWaalsContact OE2-CZ 3.27Å; E273-R305 IonicContact OE2-NH1 3Å; E273-R305 PolarHBondContact OE2-NH1 2.82Å; E273-R305 IonicContact OE2-NH2 3.24Å; E273-R305 PolarHBondContact OE2-NH2 3.21Å; K301-R305 WeakPolarHBondContact O-CB 3.33Å; K301-R305 PolarHBondContact O-N 3.3Å; G302-R305 PolarHBondContact O-N 3.21Å; I303-R305 VanDerWaalsContact C-N 3.34Å; I303-R305 PolarHBondContact O-N 3.13Å; R305-K307 VanDerWaalsContact C-N 3.34Å; R305-A308 PolarHBondContact O-N 3.4Å; R305-G309 PolarHBondContact O-N 2.9Å
306	L	96.4	Very high	94.7	Very high	21 Å²	21	56.1 Å²	56.1	11%	0.11	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-42.1	179.8	-64.9	177.7	0	0	0	111.2	L123 F127 G302 I303 G309 G310 E311	L123-L306 HydrophobicContact CB-CD1 3.82Å; L123-L306 HydrophobicContact CD1-CD2 4.47Å; F127-L306 HydrophobicContact CD2-CD1 3.93Å; F127-L306 HydrophobicContact CE2-CD1 4.06Å; G302-L306 WeakPolarHBondContact O-CG 3.04Å; G302-L306 PolarHBondContact O-N 3.45Å; G302-L306 VanDerWaalsContact O-N 3.11Å; I303-L306 PolarHBondContact O-N 3.29Å; L306-G309 CarbonylContact O-C 3.56Å; L306-G309 PolarHBondContact O-N 2.86Å; L306-G310 PolarHBondContact O-N 2.81Å; L306-E311 HydrophobicContact CB-CB 4.08Å; L306-E311 WeakPolarHBondContact CD2-OE2 3.28Å; L306-E311 VanDerWaalsContact O-CB 3.29Å; L306-E311 WeakPolarHBondContact O-CB 3.25Å; L306-E311 PolarHBondContact O-N 3.18Å
307	K	95.3	Very high	94.3	Very high	99 Å²	99	52.7 Å²	52.7	43%	0.43	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-44.2	174.6	-72.2	175.8	179.3	175.2	0	112.4	I303 D304 R305 G309 G310	I303-K307 HydrophobicContact CG2-CD 4.13Å; I303-K307 WeakPolarHBondContact O-CG 3.28Å; I303-K307 PolarHBondContact O-N 3.33Å; D304-K307 PolarHBondContact O-N 3Å; R305-K307 VanDerWaalsContact C-N 3.34Å; K307-G309 PolarHBondContact O-N 2.89Å; K307-G310 PolarHBondContact O-N 3.37Å
308	A	95.3	Very high	93.8	Very high	91 Å²	91	53.1 Å²	53.1	75%	0.752	31%	0.308	S	S	*	.	H	α-helix	trans	-62.8	-29.4	176.3	0	0	0	0	0	112.4	D304 R305 G310	D304-A308 WeakPolarHBondContact O-CB 3.48Å; D304-A308 PolarHBondContact O-N 2.66Å; R305-A308 PolarHBondContact O-N 3.4Å; A308-G310 VanDerWaalsContact C-N 3.26Å; A308-G310 PolarHBondContact O-N 3.41Å
309	G	95	Very high	92.9	Very high	69 Å²	69	55.4 Å²	55.4	71%	0.711	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	2.7	171.7	0	0	0	0	0	115.2	R305 L306 K307	R305-G309 PolarHBondContact O-N 2.9Å; L306-G309 CarbonylContact O-C 3.56Å; L306-G309 PolarHBondContact O-N 2.86Å; K307-G309 PolarHBondContact O-N 2.89Å
310	G	92.4	Very high	92	Very high	61 Å²	61	55.8 Å²	55.8	63%	0.629	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	7.8	179.1	0	0	0	0	0	115.3	L306 K307 A308 T312	L306-G310 PolarHBondContact O-N 2.81Å; K307-G310 PolarHBondContact O-N 3.37Å; A308-G310 VanDerWaalsContact C-N 3.26Å; A308-G310 PolarHBondContact O-N 3.41Å; G310-T312 PolarHBondContact O-N 3.06Å
311	E	87.6	Confident	90.7	Very high	73 Å²	73	53.8 Å²	53.8	34%	0.341	32%	0.317	S	S	.	.			trans	-69.5	126.3	175.1	-168.1	170.7	163.2	0	0	110.3	Y124 L306	Y124-E311 WeakPolarHBondContact CB-OE1 3.4Å; L306-E311 HydrophobicContact CB-CB 4.08Å; L306-E311 WeakPolarHBondContact CD2-OE2 3.28Å; L306-E311 VanDerWaalsContact O-CB 3.29Å; L306-E311 WeakPolarHBondContact O-CB 3.25Å; L306-E311 PolarHBondContact O-N 3.18Å
312	T	86	Confident	89.3	Confident	109 Å²	109	57.5 Å²	57.5	67%	0.669	33%	0.328	S	S	*	.			trans	-75.6	125.9	177.3	-59.5	0	0	0	0	109.6	G310 Q314	G310-T312 PolarHBondContact O-N 3.06Å; T312-Q314 PolarHBondContact O-N 3.12Å
313	P	85.7	Confident	87.8	Confident	65 Å²	65	64 Å²	64	42%	0.422	36%	0.356	S	S	.	.			trans	-68.9	92.4	-179.2	27.1	-34	0	0	0	111	Y124	Y124-P313 HydrophobicContact CD2-CB 4.3Å; Y124-P313 HydrophobicContact CE1-CB 4.12Å; Y124-P313 HydrophobicContact CE2-CB 3.42Å; Y124-P313 VanDerWaalsContact CE2-CB 3.42Å; Y124-P313 VanDerWaalsContact CZ-CA 3.42Å; Y124-P313 WeakPolarHBondContact OH-CB 3.41Å
314	Q	90.7	Very high	85.9	Confident	90 Å²	90	64.6 Å²	64.6	42%	0.421	36%	0.359	S	S	.	.			trans	-138.5	131.9	178.4	-171.7	174.7	47.2	0	0	110.8	Y124 T312 T319	Y124-Q314 WeakPolarHBondContact CD1-O 3.4Å; T312-Q314 PolarHBondContact O-N 3.12Å; Q314-T319 PolarHBondContact NE2-OG1 3.24Å; Q314-T319 PolarHBondContact OE1-OG1 3.06Å
315	L	93.4	Very high	83.8	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.026	36%	0.361	C	S	.	.			trans	-80.1	135.3	178.3	-57.9	165.9	0	0	0	109.5	Y124 T125 Y128 T165 W317 E318	Y124-L315 HydrophobicContact CD1-CD2 4.36Å; Y124-L315 HydrophobicContact CE1-CD2 3.94Å; Y124-L315 HydrophobicContact CE1-CG 4.4Å; T125-L315 HydrophobicContact CG2-CD2 4.36Å; Y128-L315 HydrophobicContact CD1-CD1 4.08Å; Y128-L315 HydrophobicContact CD1-CD2 3.55Å; Y128-L315 HydrophobicContact CD1-CG 4.47Å; Y128-L315 HydrophobicContact CD2-CD2 4.06Å; Y128-L315 HydrophobicContact CE1-CD1 3.85Å; Y128-L315 HydrophobicContact CE1-CD2 4.2Å; Y128-L315 HydrophobicContact CE2-CD1 4.4Å; Y128-L315 HydrophobicContact CG-CD1 4.46Å; Y128-L315 HydrophobicContact CG-CD2 3.48Å; Y128-L315 VanDerWaalsContact CG-CD2 3.48Å; T165-L315 HydrophobicContact CG2-CD1 4.03Å; L315-W317 HydrophobicContact CB-CD2 4.04Å; L315-W317 HydrophobicContact CB-CE3 4.38Å; L315-W317 HydrophobicContact CB-CH2 4.39Å; L315-W317 HydrophobicContact CB-CZ2 4.05Å; L315-W317 HydrophobicContact CD1-CH2 4.34Å; L315-W317 HydrophobicContact CD1-CZ2 3.61Å; L315-W317 HydrophobicContact CD2-CH2 4.04Å; L315-W317 HydrophobicContact CD2-CZ2 4.14Å; L315-W317 HydrophobicContact CG-CH2 4.49Å; L315-W317 HydrophobicContact CG-CZ2 4.14Å; L315-W317 PolarHBondContact O-N 3.23Å; L315-E318 HydrophobicContact CB-CG 4.01Å; L315-E318 WeakPolarHBondContact CB-OE2 3.29Å; L315-E318 PolarHBondContact N-OE2 3.07Å; L315-E318 WeakPolarHBondContact O-CB 3.28Å; L315-E318 PolarHBondContact O-N 3.22Å
316	E	91.1	Very high	81.5	Confident	25 Å²	25	67.7 Å²	67.7	12%	0.117	38%	0.379	C	S	.	.	H	α-helix	trans	-57.1	-31.2	-174.9	-80.2	179.4	109.5	0	0	113.3	I110 K116 F121 T122 T125 A320	I110-E316 HydrophobicContact CD1-CB 3.94Å; I110-E316 HydrophobicContact CG2-CB 4.23Å; K116-E316 IonicContact NZ-OE1 2.66Å; K116-E316 PolarHBondContact NZ-OE1 3.31Å; F121-E316 WeakPolarHBondContact CA-OE2 3.17Å; F121-E316 WeakPolarHBondContact CB-OE2 3.13Å; F121-E316 WeakPolarHBondContact CD1-OE2 3.08Å; T122-E316 VanDerWaalsContact CG2-CD 3.48Å; T122-E316 HydrophobicContact CG2-CG 3.85Å; T122-E316 PolarHBondContact N-OE2 3.32Å; T125-E316 PolarHBondContact OG1-N 3.23Å; E316-A320 WeakPolarHBondContact O-CB 3.34Å; E316-A320 PolarHBondContact O-N 3.3Å
317	W	89.9	Confident	78.9	Confident	0 Å²	0	72 Å²	72	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-77.3	-24.1	179.2	60.2	86	0	0	0	114.2	L106 I110 F121 T125 Y128 I129 I157 L164 I167 L315 T319 A320 M321	L106-W317 HydrophobicContact CD1-CB 3.9Å; L106-W317 HydrophobicContact CD2-CB 4Å; L106-W317 HydrophobicContact CD2-CD2 3.87Å; L106-W317 HydrophobicContact CD2-CE3 3.63Å; L106-W317 HydrophobicContact CD2-CG 4.06Å; L106-W317 HydrophobicContact CD2-CZ3 4.28Å; L106-W317 HydrophobicContact CG-CB 4.34Å; I110-W317 HydrophobicContact CD1-CB 4.21Å; F121-W317 HydrophobicContact CD1-CZ3 4.42Å; F121-W317 AromaticContact CE1-CE3 3.93Å; F121-W317 HydrophobicContact CE1-CE3 3.93Å; F121-W317 AromaticContact CE1-CZ3 4Å; F121-W317 HydrophobicContact CE1-CZ3 4Å; F121-W317 HydrophobicContact CZ-CZ3 4.41Å; T125-W317 HydrophobicContact CG2-CE3 3.89Å; T125-W317 HydrophobicContact CG2-CH2 3.93Å; T125-W317 HydrophobicContact CG2-CZ3 3.2Å; Y128-W317 HydrophobicContact CD1-CH2 4.26Å; Y128-W317 HydrophobicContact CD1-CZ2 4.42Å; Y128-W317 HydrophobicContact CE1-CZ2 4.35Å; I129-W317 HydrophobicContact CD1-CH2 4.28Å; I129-W317 HydrophobicContact CD1-CZ3 4Å; I129-W317 HydrophobicContact CG1-CH2 3.94Å; I129-W317 HydrophobicContact CG1-CZ3 4.18Å; I157-W317 HydrophobicContact CD1-CG 4.22Å; I157-W317 HydrophobicContact CG2-CD2 4.41Å; I157-W317 HydrophobicContact CG2-CZ2 4.02Å; L164-W317 PolarHBondContact O-NE1 3.27Å; I167-W317 HydrophobicContact CD1-CH2 4.43Å; L315-W317 HydrophobicContact CB-CD2 4.04Å; L315-W317 HydrophobicContact CB-CE3 4.38Å; L315-W317 HydrophobicContact CB-CH2 4.39Å; L315-W317 HydrophobicContact CB-CZ2 4.05Å; L315-W317 HydrophobicContact CD1-CH2 4.34Å; L315-W317 HydrophobicContact CD1-CZ2 3.61Å; L315-W317 HydrophobicContact CD2-CH2 4.04Å; L315-W317 HydrophobicContact CD2-CZ2 4.14Å; L315-W317 HydrophobicContact CG-CH2 4.49Å; L315-W317 HydrophobicContact CG-CZ2 4.14Å; L315-W317 PolarHBondContact O-N 3.23Å; W317-T319 PolarHBondContact O-N 3.12Å; W317-A320 PolarHBondContact O-N 2.99Å; W317-M321 HydrophobicContact CB-CG 4.49Å; W317-M321 VanDerWaalsContact O-CB 3.24Å; W317-M321 WeakPolarHBondContact O-CB 3.32Å; W317-M321 WeakPolarHBondContact O-CG 3.42Å; W317-M321 PolarHBondContact O-N 2.99Å
318	E	87.2	Confident	76.5	Confident	63 Å²	63	73.8 Å²	73.8	29%	0.294	42%	0.421	S	S	.	.	H	α-helix	trans	-61.1	-37.8	173.7	-67.9	175.8	118.5	0	0	110.4	L315 R322	L315-E318 HydrophobicContact CB-CG 4.01Å; L315-E318 WeakPolarHBondContact CB-OE2 3.29Å; L315-E318 PolarHBondContact N-OE2 3.07Å; L315-E318 WeakPolarHBondContact O-CB 3.28Å; L315-E318 PolarHBondContact O-N 3.22Å; E318-R322 WeakPolarHBondContact O-CG 3.46Å
319	T	80.5	Confident	73.9	Confident	47 Å²	47	71 Å²	71	29%	0.288	40%	0.396	S	S	.	.	H	α-helix	trans	-81.3	-42.7	176.2	-53.9	0	0	0	0	111.9	Q314 W317 R322	Q314-T319 PolarHBondContact NE2-OG1 3.24Å; Q314-T319 PolarHBondContact OE1-OG1 3.06Å; W317-T319 PolarHBondContact O-N 3.12Å; T319-R322 PolarHBondContact O-N 3.01Å
320	A	79.3	Confident	71.4	Confident	9 Å²	9	71 Å²	71	7%	0.074	38%	0.384	C	S	.	.	H	α-helix	trans	-66.8	-37.8	-177.9	0	0	0	0	0	112.9	I110 L113 E316 W317 R322 K323 I324	I110-A320 HydrophobicContact CG1-CB 3.99Å; L113-A320 HydrophobicContact CD1-CB 4.06Å; E316-A320 WeakPolarHBondContact O-CB 3.34Å; E316-A320 PolarHBondContact O-N 3.3Å; W317-A320 PolarHBondContact O-N 2.99Å; A320-R322 VanDerWaalsContact C-N 3.26Å; A320-R322 PolarHBondContact O-N 3.42Å; A320-K323 WeakPolarHBondContact O-CB 3.36Å; A320-K323 PolarHBondContact O-N 3.25Å; A320-I324 PolarHBondContact O-N 3.02Å
321	M	70.5	Confident	69	Low	25 Å²	25	69 Å²	69	12%	0.123	36%	0.36	C	S	.	.	H	α-helix	trans	-67	-25.5	178.8	-67.4	-61.1	176.8	0	0	113.2	L106 I157 W317 K323 I324	L106-M321 HydrophobicContact CD1-CE 3.61Å; I157-M321 HydrophobicContact CD1-CE 3.96Å; W317-M321 HydrophobicContact CB-CG 4.49Å; W317-M321 VanDerWaalsContact O-CB 3.24Å; W317-M321 WeakPolarHBondContact O-CB 3.32Å; W317-M321 WeakPolarHBondContact O-CG 3.42Å; W317-M321 PolarHBondContact O-N 2.99Å; M321-K323 VanDerWaalsContact C-N 3.26Å; M321-K323 PolarHBondContact O-N 2.76Å; M321-I324 HydrophobicContact CE-CD1 4.45Å; M321-I324 HydrophobicContact SD-CD1 3.39Å; M321-I324 WeakPolarHBondContact SD-CD1 3.33Å
322	R	70.6	Confident	66.3	Low	173 Å²	173	70.3 Å²	70.3	65%	0.653	38%	0.377	S	S	*	.	H	α-helix	trans	-68.9	-24.7	171	-68.5	175.5	-179.4	173.7	2.6	113.1	E318 T319 A320	E318-R322 WeakPolarHBondContact O-CG 3.46Å; T319-R322 PolarHBondContact O-N 3.01Å; A320-R322 VanDerWaalsContact C-N 3.26Å; A320-R322 PolarHBondContact O-N 3.42Å
323	K	64.8	Low	63.7	Low	137 Å²	137	66.6 Å²	66.6	60%	0.596	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-10.9	-179.1	-62.6	-177.8	-180	-178.5	0	113.5	A320 M321 P325	A320-K323 WeakPolarHBondContact O-CB 3.36Å; A320-K323 PolarHBondContact O-N 3.25Å; M321-K323 VanDerWaalsContact C-N 3.26Å; M321-K323 PolarHBondContact O-N 2.76Å; K323-P325 WeakPolarHBondContact O-CD 3.09Å
324	I	58.8	Low	61.2	Low	21 Å²	21	71 Å²	71	11%	0.108	36%	0.362	C	S	.	.	S	Bend	trans	-82.1	122.5	-176.6	-70.4	157.6	0	0	0	109.1	K109 L113 A320 M321 Q328	K109-I324 HydrophobicContact CD-CD1 4Å; L113-I324 HydrophobicContact CD1-CD1 4.46Å; L113-I324 HydrophobicContact CD1-CG1 4.39Å; A320-I324 PolarHBondContact O-N 3.02Å; M321-I324 HydrophobicContact CE-CD1 4.45Å; M321-I324 HydrophobicContact SD-CD1 3.39Å; M321-I324 WeakPolarHBondContact SD-CD1 3.33Å; I324-Q328 HydrophobicContact CG2-CB 4.15Å
325	P	51.6	Low	58.2	Low	72 Å²	72	71.1 Å²	71.1	47%	0.468	37%	0.373	S	S	.	.			trans	-56.5	140.5	178	-23.7	33	0	0	0	111.6	K323 S327 Q328 S329	K323-P325 WeakPolarHBondContact O-CD 3.09Å; P325-S327 PolarHBondContact O-N 3.31Å; P325-Q328 PolarHBondContact O-N 2.94Å; P325-S329 PolarHBondContact O-N 3.45Å
326	K	49.3	Very low	55.3	Low	167 Å²	167	78.4 Å²	78.4	73%	0.726	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-27.9	-179.4	-68.1	-176.3	177.1	-178.2	0	113.7	Q328 S329	K326-Q328 VanDerWaalsContact C-N 3.31Å; K326-Q328 PolarHBondContact O-N 2.84Å; K326-S329 PolarHBondContact O-OG 3.04Å
327	S	41.5	Very low	52.3	Low	110 Å²	110	81.3 Å²	81.3	77%	0.769	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-17.5	178.2	58.2	0	0	0	0	114.5	P325	P325-S327 PolarHBondContact O-N 3.31Å
328	Q	44.4	Very low	49.4	Very low	138 Å²	138	86.4 Å²	86.4	65%	0.645	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-7.6	179.4	-65.7	-173.5	3.9	0	0	113.4	I324 P325 K326 S330	I324-Q328 HydrophobicContact CG2-CB 4.15Å; P325-Q328 PolarHBondContact O-N 2.94Å; K326-Q328 VanDerWaalsContact C-N 3.31Å; K326-Q328 PolarHBondContact O-N 2.84Å; Q328-S330 PolarHBondContact O-N 3.02Å
329	S	42.3	Very low	46.6	Very low	33 Å²	33	89.6 Å²	89.6	23%	0.231	50%	0.499	C	S	.	.			trans	-82.5	107.9	166	64.7	0	0	0	0	108.5	P325 K326 T331	P325-S329 PolarHBondContact O-N 3.45Å; K326-S329 PolarHBondContact O-OG 3.04Å; S329-T331 PolarHBondContact O-N 3.36Å; S329-T331 PolarHBondContact OG-O 3.13Å
330	S	41.2	Very low	44.3	Very low	67 Å²	67	94.4 Å²	94.4	47%	0.469	53%	0.529	S	S	.	.	S	Bend	trans	-69.7	18.2	176.9	50.8	0	0	0	0	115.3	K35 Q328	K35-S330 PolarHBondContact NZ-O 3.24Å; Q328-S330 PolarHBondContact O-N 3.02Å
331	T	43.1	Very low	42	Very low	21 Å²	21	99.6 Å²	99.6	13%	0.129	56%	0.559	C	S	.	*	S	Bend	trans	-153.1	123.4	178.8	4.4	0	0	0	0	106.3	L98 C159 S329 L333	L98-T331 HydrophobicContact CD2-CG2 4.14Å; C159-T331 HydrophobicContact CB-CG2 4.32Å; S329-T331 PolarHBondContact O-N 3.36Å; S329-T331 PolarHBondContact OG-O 3.13Å; T331-L333 PolarHBondContact O-N 2.94Å
332	S	30.5	Very low	40.2	Very low	100 Å²	100	103 Å²	103	70%	0.699	58%	0.583	S	S	*	*			trans	-51.1	98.5	175.9	170.5	0	0	0	0	110.2
333	L	32.2	Very low	38.6	Very low	30 Å²	30	100.2 Å²	100.2	16%	0.157	59%	0.587	C	S	.	*			trans	-91.6	126.2	166.5	-72.6	168.3	0	0	0	106.5	L164 T331	L164-L333 HydrophobicContact CD2-CD2 4.41Å; T331-L333 PolarHBondContact O-N 2.94Å
334	Y	31.3	Very low	37.3	Very low	157 Å²	157	98.7 Å²	98.7	62%	0.616	59%	0.591	S	S	*	*			trans	84.7	75.1	-175.7	-50.4	-77.4	0	0	0	116
335	S	29.1	Very low	36.3	Very low	93 Å²	93	103.7 Å²	103.7	65%	0.65	62%	0.623	S	S	*	*			trans	-144.7	123	149.6	177.1	0	0	0	0	108.9
336	L	32.3	Very low	35.8	Very low	158 Å²	158	106.8 Å²	106.8	83%	0.827	64%	0.635	S	S	*	*			trans	72	94.4	169.4	-63	162.8	0	0	0	118.2
337	A	27.5	Very low	35.2	Very low	86 Å²	86	104.6 Å²	104.6	71%	0.711	64%	0.635	S	S	*	*			trans	-50.9	145.1	137.7	0	0	0	0	0	109.8
338	S	28.6	Very low	35.1	Very low	107 Å²	107	104.3 Å²	104.3	75%	0.748	63%	0.631	S	S	*	*			trans	85	87.2	168.3	-26.4	0	0	0	0	116.3
339	T	29.7	Very low	35.2	Very low	130 Å²	130	103.7 Å²	103.7	80%	0.798	64%	0.639	S	S	*	*				170.7	107.7	124.9	32.6	0	0	0	0	108.9	V341	T339-V341 PolarHBondContact O-N 3.07Å; T339-V341 VanDerWaalsContact O-N 3.12Å
340	V	30.8	Very low	35.2	Very low	149 Å²	149	107.6 Å²	107.6	90%	0.903	67%	0.666	S	S	*	*			trans	-71.1	101.7	166	176.6	0	0	0	0	106.6
341	V	32.7	Very low	35.3	Very low	118 Å²	118	108.7 Å²	108.7	72%	0.715	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-101.1	119	165.6	-175	0	0	0	0	107.1	T339	T339-V341 PolarHBondContact O-N 3.07Å; T339-V341 VanDerWaalsContact O-N 3.12Å
342	P	32.3	Very low	36	Very low	96 Å²	96	113.1 Å²	113.1	62%	0.623	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.3	156.6	175.8	28.4	-32.5	0	0	0	110.1
343	P	37.3	Very low	37.4	Very low	114 Å²	114	113.9 Å²	113.9	74%	0.74	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-60.3	142.1	178.2	25.9	-32.3	0	0	0	109.8	T345	P343-T345 PolarHBondContact O-N 3.41Å
344	P	37.3	Very low	38.6	Very low	105 Å²	105	118.8 Å²	118.8	68%	0.682	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-62.4	127.9	178.1	25.1	-30.8	0	0	0	109	L346	P344-L346 PolarHBondContact O-N 2.81Å; P344-L346 VanDerWaalsContact O-N 3.11Å
345	T	36.4	Very low	40	Very low	127 Å²	127	116.8 Å²	116.8	78%	0.779	75%	0.753	S	S	*	*			trans	-53.8	114.2	162.4	35.5	0	0	0	0	108	P343 V347	P343-T345 PolarHBondContact O-N 3.41Å; T345-V347 PolarHBondContact O-N 2.82Å
346	L	41.1	Very low	41.7	Very low	137 Å²	137	116.6 Å²	116.6	72%	0.717	76%	0.757	S	S	*	*			trans	-61.6	103	168.1	-83.7	166.9	0	0	0	108	P344	P344-L346 PolarHBondContact O-N 2.81Å; P344-L346 VanDerWaalsContact O-N 3.11Å
347	V	38.4	Very low	43.3	Very low	120 Å²	120	114.7 Å²	114.7	73%	0.727	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-67.8	128	161.4	-175.5	0	0	0	0	106.2	T345	T345-V347 PolarHBondContact O-N 2.82Å
348	P	38.3	Very low	45.1	Very low	104 Å²	104	116 Å²	116	68%	0.675	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-63.5	145.3	175.6	25.8	-30.1	0	0	0	109.4	S350	P348-S350 PolarHBondContact O-N 3.29Å
349	P	46.4	Very low	47.1	Very low	125 Å²	125	116.3 Å²	116.3	81%	0.812	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59.2	130.5	177	24.3	-31.4	0	0	0	109.6	A351	P349-A351 PolarHBondContact O-N 2.81Å
350	S	43.2	Very low	49.1	Very low	115 Å²	115	116.2 Å²	116.2	80%	0.804	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-52.5	133.6	171.9	47.4	0	0	0	0	110.5	P348	P348-S350 PolarHBondContact O-N 3.29Å
351	A	43.8	Very low	50.4	Low	90 Å²	90	116.8 Å²	116.8	74%	0.744	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-54.4	141.9	179.6	0	0	0	0	0	111.8	P349	P349-A351 PolarHBondContact O-N 2.81Å
352	P	57.3	Low	52	Low	114 Å²	114	116.1 Å²	116.1	74%	0.74	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-64.2	152.2	170.9	28.1	-32.3	0	0	0	110.3
353	P	60.1	Low	53.5	Low	117 Å²	117	118 Å²	118	76%	0.76	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-60.9	150.1	177.2	26	-32.8	0	0	0	110.8	S355	P353-S355 PolarHBondContact O-N 2.98Å
354	P	57.6	Low	54.2	Low	132 Å²	132	119.1 Å²	119.1	86%	0.857	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-64.3	123.2	-175.8	25.6	-32.3	0	0	0	110.6
355	S	60.8	Low	54.6	Low	115 Å²	115	119.3 Å²	119.3	80%	0.804	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-70.5	139.3	167.9	50.3	0	0	0	0	110.2	P353	P353-S355 PolarHBondContact O-N 2.98Å
356	A	63.6	Low	54.8	Low	89 Å²	89	119 Å²	119	74%	0.736	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-50.9	146.6	-178.5	0	0	0	0	0	113.3
357	P	67	Low	54.8	Low	118 Å²	118	121.4 Å²	121.4	77%	0.766	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-67	145.1	-178.2	27.5	-32.5	0	0	0	111.1
358	P	64.4	Low	54.7	Low	114 Å²	114	123.8 Å²	123.8	74%	0.74	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-67.7	153.8	171.8	29	-32.6	0	0	0	110.8
359	P	71.7	Confident	54.3	Low	113 Å²	113	127.7 Å²	127.7	73%	0.734	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.6	154.1	176	26.6	-33.2	0	0	0	111.8
360	P	71.1	Confident	53.7	Low	128 Å²	128	126 Å²	126	83%	0.831	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-68.4	135.7	-175.8	19	-18	0	0	0	111.7
361	L	57.9	Low	53.2	Low	162 Å²	162	130.3 Å²	130.3	85%	0.848	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-76.2	145.2	170.5	-75.8	164.7	0	0	0	110.5
362	P	65.8	Low	52.4	Low	103 Å²	103	135.3 Å²	135.3	67%	0.669	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69	155	177.4	28.2	-33.3	0	0	0	112.3
363	P	63.7	Low	51.2	Low	136 Å²	136	137 Å²	137	88%	0.883	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.6	131.8	-173.9	27.4	-33.1	0	0	0	112.2
364	V	51.6	Low	49.8	Very low	138 Å²	138	134.8 Å²	134.8	84%	0.836	80%	0.804	S	S	*	*			trans	-104.6	129.3	170.3	179.2	0	0	0	0	108.8
365	S	47.4	Very low	48.3	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	81%	0.808	S	S	*	*			trans	-73.2	147.9	178.1	47.2	0	0	0	0	112.4
366	P	40	Very low	46.7	Very low	121 Å²	121	139.1 Å²	139.1	79%	0.786	81%	0.813	S	S	*	*			trans	-99.6	126.8	-168.5	34	-27.6	0	0	0	112.8
367	K	40.2	Very low	45.1	Very low	188 Å²	188	140 Å²	140	82%	0.817	81%	0.814	S	S	*	*			trans	-151.7	124.6	150.6	-79.1	-160.5	177.9	173.3	0	113.5
368	Q	35.9	Very low	43.2	Very low	169 Å²	169	142.5 Å²	142.5	79%	0.79	82%	0.82	S	S	*	*			trans	84.8	93.8	140.4	-67.6	175.3	-48.7	0	0	121
369	E	31.6	Very low	41.4	Very low	187 Å²	187	148.8 Å²	148.8	87%	0.874	83%	0.829	S	S	*	*				45.7	135.9	119.6	-79.1	-177.3	153.2	0	0	123.9
370	A	32	Very low	39.3	Very low	89 Å²	89	152.9 Å²	152.9	74%	0.736	84%	0.835	S	S	*	*			trans	86.5	102.5	143.6	0	0	0	0	0	120
371	K	32.8	Very low	37.3	Very low	206 Å²	206	153 Å²	153	90%	0.896	83%	0.834	S	S	*	*				171.7	127.2	101	-93.9	174.6	179.1	175	0	112.3
372	Q	27.4	Very low	36.1	Very low	195 Å²	195	152.9 Å²	152.9	91%	0.911	83%	0.832	S	S	*	*			trans	-67	121.9	166.6	-107	175	-6.3	0	0	111
373	V	33.1	Very low	34.4	Very low	149 Å²	149	160.9 Å²	160.9	90%	0.903	86%	0.856	S	S	*	*			trans	-159.2	131.3	148.1	-176.7	0	0	0	0	109.7
374	G	29.2	Very low	33	Very low	70 Å²	70	162.1 Å²	162.1	72%	0.722	86%	0.855	S	S	*	*			trans	102.7	95.7	139.5	0	0	0	0	0	118.2	M376	G374-M376 PolarHBondContact O-N 3.18Å; G374-M376 VanDerWaalsContact O-N 3.08Å
375	V	27.4	Very low	32	Very low	154 Å²	154	163.4 Å²	163.4	93%	0.933	86%	0.856	S	S	*	*			trans	-69.1	98.2	163.6	-178	0	0	0	0	109.1
376	M	27.2	Very low	31.1	Very low	184 Å²	184	166.4 Å²	166.4	91%	0.906	86%	0.861	S	S	*	*			trans	-140.8	101.6	162.5	-95.8	-130	-76.2	0	0	108.4	G374	G374-M376 PolarHBondContact O-N 3.18Å; G374-M376 VanDerWaalsContact O-N 3.08Å
377	S	30	Very low	30.6	Very low	108 Å²	108	169.1 Å²	169.1	76%	0.755	87%	0.866	S	S	*	*			trans	-168	112.6	158.2	57.9	0	0	0	0	110.9
378	L	27.7	Very low	30	Very low	171 Å²	171	167.9 Å²	167.9	90%	0.895	87%	0.869	S	S	*	*			trans	-165.7	68.3	137.6	-101.7	157.9	0	0	0	107.6
379	W	25.8	Very low	29.6	Very low	245 Å²	245	167.9 Å²	167.9	93%	0.928	87%	0.874	S	S	*	*			trans	-138	99.8	156.6	-86	87.1	0	0	0	106.3
380	K	28.4	Very low	29.5	Very low	199 Å²	199	166.5 Å²	166.5	87%	0.865	87%	0.874	S	S	*	*			trans	-166.6	145	156.4	-110.6	172.2	-174.9	-179	0	108.1
381	V	29	Very low	29.3	Very low	132 Å²	132	172.5 Å²	172.5	80%	0.8	89%	0.885	S	S	*	*			trans	84.7	87.6	177.1	-157.3	0	0	0	0	114.1
382	I	32.5	Very low	29	Very low	159 Å²	159	169.7 Å²	169.7	82%	0.815	88%	0.884	S	S	*	*				-165.7	116.7	105.2	-82.2	152.9	0	0	0	105.7
383	K	30.6	Very low	29.1	Very low	270 Å²	270	167.4 Å²	167.4	100%	1.174	88%	0.882	S	S	*	*			trans	-68.9	0	163.2	-89.2	-174.3	173.5	-178.9	0	109.5

Retrieved 383 of 383 residues in 340.9 ms (Link to these results)

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