A0A3B3UUN5_9TELE Loading...

Alcohol dehydrogenase 1-like

AlphaFold DB , UniProt , Accession A0A3B3UUN5, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 378 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	51.7	Low	92.1	Very high	231 Å²	231	88.4 Å²	88.4	100%	1.138	48%	0.48	S	S	*	.				0	140.2	0	-64.7	-174.2	-158.3	0	0	108.1	T3	M1-T3 PolarHBondContact O-N 3.02Å
2	S	81.7	Confident	92.6	Very high	87 Å²	87	81 Å²	81	61%	0.608	44%	0.44	S	S	*	.			trans	-68.4	126.7	178.2	174.1	0	0	0	0	111.2	A4 K6	S2-A4 PolarHBondContact OG-N 3.49Å; S2-K6 PolarHBondContact O-NZ 2.99Å
3	T	95.8	Very high	93.1	Very high	58 Å²	58	74.8 Å²	74.8	36%	0.356	41%	0.407	S	S	.	.			trans	-90.6	-9.6	176.8	41.4	0	0	0	0	113.2	M1 G5 K6 I8 R38 E76	M1-T3 PolarHBondContact O-N 3.02Å; T3-G5 PolarHBondContact O-N 2.86Å; T3-K6 PolarHBondContact O-N 3.28Å; T3-K6 VanDerWaalsContact O-N 3.16Å; T3-I8 HydrophobicContact CG2-CD1 4.34Å; T3-I8 HydrophobicContact CG2-CG1 4.26Å; T3-R38 PolarHBondContact O-NH2 2.74Å; T3-E76 VanDerWaalsContact C-OE1 3.26Å; T3-E76 VanDerWaalsContact CB-OE1 3.23Å; T3-E76 WeakPolarHBondContact CB-OE1 3.44Å; T3-E76 PolarHBondContact OG1-OE1 3.36Å
4	A	95.9	Very high	93.5	Very high	48 Å²	48	69.5 Å²	69.5	40%	0.397	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	134.9	179.6	0	0	0	0	0	111.4	S2 K6 E76	S2-A4 PolarHBondContact OG-N 3.49Å; A4-K6 PolarHBondContact O-N 3.36Å; A4-E76 PolarHBondContact N-OE1 2.72Å
5	G	96.5	Very high	93.8	Very high	63 Å²	63	64.9 Å²	64.9	65%	0.649	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	3.7	-178.9	0	0	0	0	0	115.4	T3	T3-G5 PolarHBondContact O-N 2.86Å
6	K	98.3	Very high	94.1	Very high	119 Å²	119	64.9 Å²	64.9	52%	0.517	35%	0.346	S	S	.	.	S	Bend	trans	-114.7	155.4	-179.7	-60.6	173.6	-174.6	165.1	0	111.1	S2 T3 A4 R38	S2-K6 PolarHBondContact O-NZ 2.99Å; T3-K6 PolarHBondContact O-N 3.28Å; T3-K6 VanDerWaalsContact O-N 3.16Å; A4-K6 PolarHBondContact O-N 3.36Å; K6-R38 PolarHBondContact O-NH1 2.83Å; K6-R38 PolarHBondContact O-NH2 2.72Å
7	V	98.6	Very high	94.3	Very high	85 Å²	85	63.4 Å²	63.4	52%	0.515	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-63.7	136	165.8	178	0	0	0	0	108.9	E28 V29	V7-E28 HydrophobicContact CG1-CB 3.83Å; V7-E28 HydrophobicContact CG1-CG 4.24Å; V7-V29 WeakPolarHBondContact CA-O 3.45Å
8	I	98.7	Very high	94.5	Very high	13 Å²	13	61.3 Å²	61.3	7%	0.067	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.8	171.9	-70.3	177	0	0	0	108.3	T3 C10 E28 V29 R38 Y151	T3-I8 HydrophobicContact CG2-CD1 4.34Å; T3-I8 HydrophobicContact CG2-CG1 4.26Å; I8-C10 HydrophobicContact CG2-CB 3.9Å; I8-E28 CarbonylContact O-C 3.56Å; I8-E28 WeakPolarHBondContact O-CA 3.37Å; I8-V29 PolarHBondContact N-O 3.46Å; I8-V29 PolarHBondContact O-N 2.77Å; I8-R38 VanDerWaalsContact CD1-CZ 3.41Å; I8-Y151 HydrophobicContact CD1-CD1 3.76Å; I8-Y151 HydrophobicContact CD1-CD2 4.45Å; I8-Y151 HydrophobicContact CD1-CE1 3.8Å; I8-Y151 HydrophobicContact CD1-CE2 4.5Å; I8-Y151 HydrophobicContact CD1-CG 4.1Å; I8-Y151 HydrophobicContact CG2-CD2 3.77Å; I8-Y151 HydrophobicContact CG2-CE2 4.05Å; I8-Y151 HydrophobicContact CG2-CG 4.2Å
9	R	98.5	Very high	94.5	Very high	162 Å²	162	63 Å²	63	61%	0.611	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.6	163.5	-74.1	179.5	177.3	-173.8	-0.2	108.5	E26 I27 E28	R9-E26 HydrophobicContact CB-CG 4.14Å; R9-E26 WeakPolarHBondContact CD-OE1 3.41Å; R9-I27 VanDerWaalsContact CA-O 3.31Å; R9-I27 WeakPolarHBondContact CA-O 3.25Å; R9-E28 HydrophobicContact CG-CG 3.98Å; R9-E28 IonicContact CZ-OE1 3.63Å; R9-E28 IonicContact NE-OE1 3.88Å; R9-E28 PolarHBondContact NE-OE1 3.16Å; R9-E28 IonicContact NH2-OE1 2.96Å; R9-E28 PolarHBondContact NH2-OE1 2.62Å
10	C	98.6	Very high	94.6	Very high	6 Å²	6	62.6 Å²	62.6	4%	0.041	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	170.9	-176.4	69.7	0	0	0	0	111.1	I8 E26 I27 E150 Y151	I8-C10 HydrophobicContact CG2-CB 3.9Å; C10-E26 WeakPolarHBondContact O-CA 3.35Å; C10-I27 PolarHBondContact N-O 2.76Å; C10-I27 VanDerWaalsContact N-O 3.08Å; C10-I27 PolarHBondContact O-N 3.19Å; C10-E150 HydrophobicContact CB-CB 3.93Å; C10-E150 WeakPolarHBondContact CB-OE2 3.43Å; C10-Y151 HydrophobicContact CB-CD2 3.78Å; C10-Y151 HydrophobicContact CB-CE2 4.36Å
11	R	98.5	Very high	94.8	Very high	100 Å²	100	64 Å²	64	38%	0.377	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	145	-179.2	-58.2	-179.3	-61.4	155	16.5	111.3	I24 E25 S149 E150 E354	R11-I24 HydrophobicContact CB-CG2 4.44Å; R11-E25 WeakPolarHBondContact CA-O 3.38Å; R11-S149 PolarHBondContact O-OG 3.01Å; R11-E150 HydrophobicContact CB-CG 4.29Å; R11-E150 IonicContact CZ-OE1 2.78Å; R11-E150 PolarHBondContact N-OE2 2.84Å; R11-E150 IonicContact NE-OE1 2.79Å; R11-E150 PolarHBondContact NE-OE1 2.99Å; R11-E150 IonicContact NH2-OE1 2.95Å; R11-E150 PolarHBondContact NH2-OE1 2.84Å; R11-E150 PolarHBondContact O-N 3.37Å; R11-E354 IonicContact CZ-OE1 2.72Å; R11-E354 IonicContact NH1-OE1 3.6Å; R11-E354 PolarHBondContact NH1-OE1 3.41Å; R11-E354 IonicContact NH2-OE1 3.56Å; R11-E354 PolarHBondContact NH2-OE1 3.25Å
12	A	98.8	Very high	97	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	153.4	170.8	0	0	0	0	0	110.8	V14 I24 E25 I27 V66 F148	A12-V14 HydrophobicContact CB-CG2 4.45Å; A12-I24 WeakPolarHBondContact O-CA 3.42Å; A12-E25 PolarHBondContact N-O 3.16Å; A12-E25 PolarHBondContact O-N 2.84Å; A12-I27 HydrophobicContact CB-CD1 3.62Å; A12-I27 HydrophobicContact CB-CG1 3.91Å; A12-I27 HydrophobicContact CB-CG2 3.92Å; A12-V66 HydrophobicContact CB-CG1 4.4Å; A12-V66 HydrophobicContact CB-CG2 4.06Å; A12-F148 CarbonylContact C-O 3.59Å; A12-F148 WeakPolarHBondContact CA-O 3.2Å
13	A	98.8	Very high	97.8	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.008	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	108.4	165.4	0	0	0	0	0	109.1	A22 T23 I24 F148 L353 V356	A13-A22 HydrophobicContact CB-CB 4.13Å; A13-T23 WeakPolarHBondContact CA-O 3.39Å; A13-I24 HydrophobicContact CB-CD1 3.96Å; A13-F148 HydrophobicContact CB-CB 4.11Å; A13-F148 PolarHBondContact N-O 2.81Å; A13-L353 HydrophobicContact CB-CD1 4.25Å; A13-V356 HydrophobicContact CB-CB 4.36Å; A13-V356 HydrophobicContact CB-CG1 3.81Å; A13-V356 HydrophobicContact CB-CG2 4.29Å
14	V	98.8	Very high	97.9	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.1	-179.7	-177	0	0	0	0	109.2	A12 W16 A22 T23 E25 I27 P64 V66 I139	A12-V14 HydrophobicContact CB-CG2 4.45Å; V14-W16 HydrophobicContact CG1-CD2 4.09Å; V14-W16 HydrophobicContact CG1-CG 4.39Å; V14-W16 HydrophobicContact CG1-CZ2 4.09Å; V14-A22 WeakPolarHBondContact O-CA 3.41Å; V14-T23 PolarHBondContact N-O 2.87Å; V14-T23 PolarHBondContact O-N 3.03Å; V14-E25 HydrophobicContact CB-CG 4.04Å; V14-E25 HydrophobicContact CG2-CB 3.89Å; V14-E25 HydrophobicContact CG2-CG 3.93Å; V14-I27 HydrophobicContact CG2-CG2 3.83Å; V14-P64 HydrophobicContact CG1-CB 4.46Å; V14-V66 HydrophobicContact CG2-CG2 4.13Å; V14-I139 HydrophobicContact CG1-CD1 4.4Å; V14-I139 HydrophobicContact CG1-CG2 4.29Å
15	S	98.4	Very high	98	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.007	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	113.2	167.7	-62.7	0	0	0	0	108.4	P64 T65	S15-P64 CarbonylContact O-C 3.5Å; S15-P64 VanDerWaalsContact O-CA 3.29Å; S15-P64 WeakPolarHBondContact O-CA 3.45Å; S15-T65 PolarHBondContact N-O 2.83Å; S15-T65 PolarHBondContact O-N 2.84Å
16	W	98.1	Very high	98.1	Very high	65 Å²	65	54.1 Å²	54.1	25%	0.246	27%	0.273	C	S	.	.			trans	-82.9	-28.7	-174.7	-73.8	98.9	0	0	0	113.8	V14 T23 E25 P64 C134 K135 K137 I139	V14-W16 HydrophobicContact CG1-CD2 4.09Å; V14-W16 HydrophobicContact CG1-CG 4.39Å; V14-W16 HydrophobicContact CG1-CZ2 4.09Å; W16-T23 PolarHBondContact NE1-OG1 3.37Å; W16-E25 HydrophobicContact CZ2-CG 4.35Å; W16-E25 PolarHBondContact NE1-OE1 3.25Å; W16-P64 HydrophobicContact CD2-CB 4.39Å; W16-P64 HydrophobicContact CE3-CB 3.69Å; W16-P64 HydrophobicContact CE3-CG 4.19Å; W16-P64 HydrophobicContact CZ3-CB 4.07Å; W16-P64 HydrophobicContact CZ3-CG 4.17Å; W16-C134 HydrophobicContact CH2-CB 4.27Å; W16-K135 HydrophobicContact CH2-CD 4.11Å; W16-K135 HydrophobicContact CZ2-CD 3.98Å; W16-K137 HydrophobicContact CZ3-CD 4.16Å; W16-I139 HydrophobicContact CH2-CD1 4.14Å; W16-I139 HydrophobicContact CZ3-CD1 4.11Å
17	A	97.6	Very high	98.2	Very high	38 Å²	38	48.5 Å²	48.5	31%	0.314	25%	0.249	S	C	.	.	S	Bend	trans	-152.6	160.5	-178.8	0	0	0	0	0	110.3	T20 F63	A17-T20 HydrophobicContact CB-CG2 4.14Å; A17-T20 PolarHBondContact N-OG1 2.84Å; A17-T20 PolarHBondContact O-OG1 3.44Å; A17-F63 VanDerWaalsContact C-CD1 3.48Å
18	P	97.1	Very high	98.2	Very high	27 Å²	27	47.8 Å²	47.8	18%	0.175	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	147.5	171	-21.3	30.4	0	0	0	112.3	T20 M58 E60 F63	P18-T20 PolarHBondContact O-N 2.54Å; P18-T20 VanDerWaalsContact O-N 3.09Å; P18-M58 HydrophobicContact CB-CB 3.72Å; P18-M58 HydrophobicContact CB-CG 3.94Å; P18-M58 HydrophobicContact CG-CB 4.37Å; P18-E60 HydrophobicContact CG-CG 4.14Å; P18-F63 HydrophobicContact CB-CE2 4.14Å; P18-F63 HydrophobicContact CB-CZ 4.36Å; P18-F63 HydrophobicContact CG-CD2 3.66Å; P18-F63 HydrophobicContact CG-CE2 3.62Å; P18-F63 HydrophobicContact CG-CG 4.35Å; P18-F63 HydrophobicContact CG-CZ 4.25Å
19	N	96.1	Very high	98.2	Very high	93 Å²	93	47.1 Å²	47.1	50%	0.497	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	32.1	175.2	-166.7	37.3	0	0	0	114.2	L54 M58	N19-L54 PolarHBondContact N-O 3.46Å; N19-M58 HydrophobicContact CB-SD 4.06Å
20	T	96.6	Very high	98.2	Very high	54 Å²	54	40.9 Å²	40.9	33%	0.331	22%	0.22	S	C	.	.	S	Bend	trans	-121.3	144.1	173.2	62	0	0	0	0	110.7	A17 P18	A17-T20 HydrophobicContact CB-CG2 4.14Å; A17-T20 PolarHBondContact N-OG1 2.84Å; A17-T20 PolarHBondContact O-OG1 3.44Å; P18-T20 PolarHBondContact O-N 2.54Å; P18-T20 VanDerWaalsContact O-N 3.09Å
21	P	97.3	Very high	98.2	Very high	93 Å²	93	42.4 Å²	42.4	60%	0.604	23%	0.23	S	C	*	.			trans	-56.1	141.2	174.1	-24.8	34.3	0	0	0	111.5	N357	P21-N357 WeakPolarHBondContact CA-OD1 3.49Å
22	A	98.1	Very high	98.2	Very high	5 Å²	5	38.4 Å²	38.4	4%	0.041	22%	0.217	C	C	.	.			trans	-68.1	141.8	173.1	0	0	0	0	0	109.9	A13 V14 V356 N357	A13-A22 HydrophobicContact CB-CB 4.13Å; V14-A22 WeakPolarHBondContact O-CA 3.41Å; A22-V356 HydrophobicContact CB-CG1 4.21Å; A22-N357 PolarHBondContact N-OD1 2.9Å; A22-N357 PolarHBondContact O-ND2 2.74Å
23	T	98.5	Very high	98.1	Very high	54 Å²	54	43.5 Å²	43.5	33%	0.331	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	138.5	173.8	61.9	0	0	0	0	110.2	A13 V14 W16 E25	A13-T23 WeakPolarHBondContact CA-O 3.39Å; V14-T23 PolarHBondContact N-O 2.87Å; V14-T23 PolarHBondContact O-N 3.03Å; W16-T23 PolarHBondContact NE1-OG1 3.37Å; T23-E25 PolarHBondContact O-N 2.74Å; T23-E25 WeakPolarHBondContact OG1-CG 3.23Å; T23-E25 PolarHBondContact OG1-OE1 3.45Å
24	I	98.6	Very high	98.1	Very high	64 Å²	64	47 Å²	47	33%	0.328	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.1	170.9	-55.9	-59.2	0	0	0	107.8	R11 A12 A13 L353 V356	R11-I24 HydrophobicContact CB-CG2 4.44Å; A12-I24 WeakPolarHBondContact O-CA 3.42Å; A13-I24 HydrophobicContact CB-CD1 3.96Å; I24-L353 HydrophobicContact CD1-CG 4.34Å; I24-V356 HydrophobicContact CD1-CG1 4.24Å
25	E	98.6	Very high	97.9	Very high	35 Å²	35	47.5 Å²	47.5	16%	0.164	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	154	-176.5	-59.2	-74.7	179.6	0	0	110.3	R11 A12 V14 W16 T23 I27 K135	R11-E25 WeakPolarHBondContact CA-O 3.38Å; A12-E25 PolarHBondContact N-O 3.16Å; A12-E25 PolarHBondContact O-N 2.84Å; V14-E25 HydrophobicContact CB-CG 4.04Å; V14-E25 HydrophobicContact CG2-CB 3.89Å; V14-E25 HydrophobicContact CG2-CG 3.93Å; W16-E25 HydrophobicContact CZ2-CG 4.35Å; W16-E25 PolarHBondContact NE1-OE1 3.25Å; T23-E25 PolarHBondContact O-N 2.74Å; T23-E25 WeakPolarHBondContact OG1-CG 3.23Å; T23-E25 PolarHBondContact OG1-OE1 3.45Å; E25-I27 HydrophobicContact CB-CG2 4.36Å; E25-K135 IonicContact OE1-NZ 2.68Å; E25-K135 PolarHBondContact OE1-NZ 3.33Å; E25-K135 WeakPolarHBondContact OE2-CE 3.48Å; E25-K135 IonicContact OE2-NZ 2.72Å; E25-K135 PolarHBondContact OE2-NZ 3.24Å
26	E	98.7	Very high	97.9	Very high	121 Å²	121	48.3 Å²	48.3	57%	0.565	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	125	159.1	-173.4	179.6	92.8	0	0	108.5	R9 C10 C134	R9-E26 HydrophobicContact CB-CG 4.14Å; R9-E26 WeakPolarHBondContact CD-OE1 3.41Å; C10-E26 WeakPolarHBondContact O-CA 3.35Å; E26-C134 PolarHBondContact O-SG 2.9Å; E26-C134 VanDerWaalsContact O-SG 3.38Å
27	I	98.8	Very high	97.9	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	157.3	176.6	71.1	162.4	0	0	0	110.5	R9 C10 A12 V14 E25 V29 F132 C134	R9-I27 VanDerWaalsContact CA-O 3.31Å; R9-I27 WeakPolarHBondContact CA-O 3.25Å; C10-I27 PolarHBondContact N-O 2.76Å; C10-I27 VanDerWaalsContact N-O 3.08Å; C10-I27 PolarHBondContact O-N 3.19Å; A12-I27 HydrophobicContact CB-CD1 3.62Å; A12-I27 HydrophobicContact CB-CG1 3.91Å; A12-I27 HydrophobicContact CB-CG2 3.92Å; V14-I27 HydrophobicContact CG2-CG2 3.83Å; E25-I27 HydrophobicContact CB-CG2 4.36Å; I27-V29 HydrophobicContact CD1-CG2 3.73Å; I27-V29 HydrophobicContact CG1-CG2 3.98Å; I27-F132 HydrophobicContact CD1-CB 4.48Å; I27-F132 HydrophobicContact CD1-CD1 3.93Å; I27-F132 HydrophobicContact CD1-CD2 4.25Å; I27-F132 HydrophobicContact CD1-CE1 4.14Å; I27-F132 HydrophobicContact CD1-CE2 4.41Å; I27-F132 HydrophobicContact CD1-CG 4Å; I27-F132 HydrophobicContact CD1-CZ 4.37Å; I27-C134 HydrophobicContact CB-CB 4.45Å; I27-C134 HydrophobicContact CG2-CB 3.87Å
28	E	98.8	Very high	98	Very high	69 Å²	69	43.4 Å²	43.4	32%	0.322	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	120.9	170.6	-67.7	179.8	163.8	0	0	109.4	V7 I8 R9 F132 T133	V7-E28 HydrophobicContact CG1-CB 3.83Å; V7-E28 HydrophobicContact CG1-CG 4.24Å; I8-E28 CarbonylContact O-C 3.56Å; I8-E28 WeakPolarHBondContact O-CA 3.37Å; R9-E28 HydrophobicContact CG-CG 3.98Å; R9-E28 IonicContact CZ-OE1 3.63Å; R9-E28 IonicContact NE-OE1 3.88Å; R9-E28 PolarHBondContact NE-OE1 3.16Å; R9-E28 IonicContact NH2-OE1 2.96Å; R9-E28 PolarHBondContact NH2-OE1 2.62Å; E28-F132 WeakPolarHBondContact O-CA 3.41Å; E28-T133 PolarHBondContact N-O 2.83Å; E28-T133 PolarHBondContact O-N 3.47Å
29	V	98.8	Very high	98.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.7	177.6	-175.6	0	0	0	0	109.1	V7 I8 I27 R131 F132 V153	V7-V29 WeakPolarHBondContact CA-O 3.45Å; I8-V29 PolarHBondContact N-O 3.46Å; I8-V29 PolarHBondContact O-N 2.77Å; I27-V29 HydrophobicContact CD1-CG2 3.73Å; I27-V29 HydrophobicContact CG1-CG2 3.98Å; V29-R131 WeakPolarHBondContact CA-O 3.41Å; V29-F132 HydrophobicContact CB-CD1 4.34Å; V29-F132 HydrophobicContact CB-CE1 4.3Å; V29-F132 HydrophobicContact CG1-CD1 4.12Å; V29-F132 HydrophobicContact CG1-CE1 3.81Å; V29-F132 HydrophobicContact CG2-CD1 3.8Å; V29-F132 HydrophobicContact CG2-CE1 3.67Å; V29-V153 HydrophobicContact CG1-CG2 3.8Å
30	A	98.7	Very high	98.2	Very high	30 Å²	30	39.7 Å²	39.7	25%	0.248	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-61.3	155.9	178.2	0	0	0	0	0	112	R38 R131 V153	A30-R38 PolarHBondContact O-NH1 2.94Å; A30-R131 HydrophobicContact CB-CB 4.11Å; A30-R131 PolarHBondContact N-O 2.86Å; A30-V153 WeakPolarHBondContact O-CG2 3.35Å
31	P	98.5	Very high	98.3	Very high	39 Å²	39	37.1 Å²	37.1	25%	0.253	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-64.9	155.8	171.5	28.8	-35.1	0	0	0	111.7
32	P	98.2	Very high	98.4	Very high	16 Å²	16	33 Å²	33	10%	0.104	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-66.6	134.7	178.4	27.3	-32.2	0	0	0	111.6	E36 R38 V153	P32-E36 HydrophobicContact CB-CB 3.77Å; P32-E36 WeakPolarHBondContact CB-O 3.1Å; P32-R38 HydrophobicContact CB-CB 4.41Å; P32-R38 HydrophobicContact CG-CB 4.07Å; P32-V153 HydrophobicContact CB-CG1 4.08Å
33	Q	97.8	Very high	98.4	Very high	106 Å²	106	32.9 Å²	32.9	50%	0.495	19%	0.185	S	C	.	.			trans	-86.1	-174.1	171.6	-59.1	-173.3	3.9	0	0	111.6	G35 E36 G79 R131	Q33-G35 PolarHBondContact O-N 2.84Å; Q33-E36 HydrophobicContact CB-CG 4.47Å; Q33-E36 WeakPolarHBondContact CB-OE2 3.34Å; Q33-E36 PolarHBondContact N-OE2 2.79Å; Q33-E36 WeakPolarHBondContact O-CB 3.36Å; Q33-E36 PolarHBondContact O-N 3.44Å; Q33-G79 WeakPolarHBondContact O-CA 3.42Å; Q33-R131 VanDerWaalsContact CD-CZ 3.49Å; Q33-R131 VanDerWaalsContact OE1-NH2 3.1Å
34	A	97.2	Very high	98.4	Very high	74 Å²	74	30.3 Å²	30.3	61%	0.612	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	127.4	-179.3	0	0	0	0	0	112	E36 P80	A34-E36 VanDerWaalsContact C-N 3.27Å; A34-E36 PolarHBondContact O-N 2.97Å; A34-P80 CarbonylContact C-O 3.51Å; A34-P80 VanDerWaalsContact CA-O 3.25Å; A34-P80 WeakPolarHBondContact CA-O 3.23Å; A34-P80 HydrophobicContact CB-CB 4.37Å
35	G	96	Very high	98.4	Very high	11 Å²	11	27.3 Å²	27.3	11%	0.113	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	14.3	-177.2	0	0	0	0	0	115.2	Q33 P80 N155 Q156	Q33-G35 PolarHBondContact O-N 2.84Å; G35-P80 PolarHBondContact N-O 3.18Å; G35-N155 PolarHBondContact O-ND2 2.87Å; G35-Q156 WeakPolarHBondContact O-CG 3.36Å; G35-Q156 PolarHBondContact O-N 3.39Å
36	E	98.3	Very high	98.3	Very high	18 Å²	18	25.6 Å²	25.6	8%	0.084	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	154.8	177.3	-56.4	-174.2	147.9	0	0	112.7	P32 Q33 A34 G79 V82 R131 V153 I154	P32-E36 HydrophobicContact CB-CB 3.77Å; P32-E36 WeakPolarHBondContact CB-O 3.1Å; Q33-E36 HydrophobicContact CB-CG 4.47Å; Q33-E36 WeakPolarHBondContact CB-OE2 3.34Å; Q33-E36 PolarHBondContact N-OE2 2.79Å; Q33-E36 WeakPolarHBondContact O-CB 3.36Å; Q33-E36 PolarHBondContact O-N 3.44Å; A34-E36 VanDerWaalsContact C-N 3.27Å; A34-E36 PolarHBondContact O-N 2.97Å; E36-G79 PolarHBondContact O-N 3.29Å; E36-V82 WeakPolarHBondContact O-CG2 3.22Å; E36-R131 IonicContact OE1-CZ 2.74Å; E36-R131 IonicContact OE1-NE 3.31Å; E36-R131 IonicContact OE1-NH2 3.87Å; E36-R131 PolarHBondContact OE1-NH2 3.01Å; E36-R131 IonicContact OE2-CZ 3.16Å; E36-R131 IonicContact OE2-NE 3.33Å; E36-R131 PolarHBondContact OE2-NE 3.44Å; E36-R131 IonicContact OE2-NH2 2.94Å; E36-R131 PolarHBondContact OE2-NH2 3.22Å; E36-R131 VanDerWaalsContact OE2-NH2 3.07Å; E36-V153 HydrophobicContact CB-CG1 3.81Å; E36-V153 HydrophobicContact CG-CG1 4.41Å; E36-I154 CarbonylContact C-O 3.58Å; E36-I154 WeakPolarHBondContact CA-O 3.36Å
37	V	98.6	Very high	98.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131	179.3	-176.1	0	0	0	0	107.4	I39 V75 V78 V82 F85 V153 I154 Q156	V37-I39 HydrophobicContact CG1-CG1 3.92Å; V37-V75 HydrophobicContact CG1-CB 4.32Å; V37-V75 HydrophobicContact CG1-CG1 3.68Å; V37-V75 HydrophobicContact CG1-CG2 3.82Å; V37-V78 HydrophobicContact CG1-CG1 4.26Å; V37-V78 HydrophobicContact CG2-CG1 4.39Å; V37-V82 HydrophobicContact CG2-CG1 4.05Å; V37-V82 HydrophobicContact CG2-CG2 4.33Å; V37-F85 HydrophobicContact CG2-CB 4.37Å; V37-F85 HydrophobicContact CG2-CD2 3.88Å; V37-F85 HydrophobicContact CG2-CG 4.21Å; V37-V153 WeakPolarHBondContact O-CA 3.43Å; V37-I154 PolarHBondContact N-O 3.26Å; V37-I154 PolarHBondContact O-N 3.2Å; V37-Q156 HydrophobicContact CG2-CB 4.06Å
38	R	98.8	Very high	98.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.9	169.7	-170.5	163.7	62.5	-174.6	2.6	109.6	T3 K6 I8 A30 P32 E76 S77 Y151 T152 V153	T3-R38 PolarHBondContact O-NH2 2.74Å; K6-R38 PolarHBondContact O-NH1 2.83Å; K6-R38 PolarHBondContact O-NH2 2.72Å; I8-R38 VanDerWaalsContact CD1-CZ 3.41Å; A30-R38 PolarHBondContact O-NH1 2.94Å; P32-R38 HydrophobicContact CB-CB 4.41Å; P32-R38 HydrophobicContact CG-CB 4.07Å; R38-E76 IonicContact CZ-OE2 3.36Å; R38-E76 IonicContact NE-OE2 2.88Å; R38-E76 PolarHBondContact NE-OE2 3.3Å; R38-E76 VanDerWaalsContact NH2-CD 3.34Å; R38-E76 IonicContact NH2-OE1 3.12Å; R38-E76 PolarHBondContact NH2-OE1 2.68Å; R38-E76 VanDerWaalsContact NH2-OE1 3.16Å; R38-E76 IonicContact NH2-OE2 2.62Å; R38-E76 PolarHBondContact NH2-OE2 3.48Å; R38-E76 PolarHBondContact O-N 2.95Å; R38-S77 PolarHBondContact N-O 3.39Å; R38-S77 PolarHBondContact O-N 2.91Å; R38-Y151 HydrophobicContact CG-CD1 4.44Å; R38-T152 CarbonylContact C-O 3.56Å; R38-T152 WeakPolarHBondContact CA-O 3.49Å; R38-V153 HydrophobicContact CB-CG2 4Å; R38-V153 HydrophobicContact CG-CG2 3.8Å
39	I	98.8	Very high	97.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.9	-173.3	-54.5	176.2	0	0	0	108.2	V37 I41 A91 P93 Y151 T152 I154 V159	V37-I39 HydrophobicContact CG1-CG1 3.92Å; I39-I41 HydrophobicContact CB-CD1 4.4Å; I39-I41 HydrophobicContact CG2-CD1 3.95Å; I39-A91 HydrophobicContact CD1-CB 4.37Å; I39-P93 HydrophobicContact CD1-CG 4.23Å; I39-Y151 WeakPolarHBondContact O-CA 3.44Å; I39-T152 HydrophobicContact CB-CG2 4.43Å; I39-T152 PolarHBondContact N-O 3.44Å; I39-T152 PolarHBondContact O-N 2.98Å; I39-I154 HydrophobicContact CD1-CD1 4.27Å; I39-V159 HydrophobicContact CD1-CG1 3.73Å; I39-V159 HydrophobicContact CD1-CG2 3.95Å
40	K	98.8	Very high	97.8	Very high	42 Å²	42	22.2 Å²	22.2	18%	0.183	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	111.4	164.9	-176.7	-173	172	-155.5	0	108	G73 I74 E150 Y151 P377 E378	K40-G73 CarbonylContact O-C 3.57Å; K40-G73 WeakPolarHBondContact O-CA 3.48Å; K40-I74 PolarHBondContact N-O 3.31Å; K40-I74 PolarHBondContact O-N 3.49Å; K40-E150 CarbonylContact C-O 3.57Å; K40-E150 WeakPolarHBondContact CA-O 3.47Å; K40-Y151 HydrophobicContact CB-CD1 3.99Å; K40-Y151 HydrophobicContact CB-CE1 3.54Å; K40-Y151 HydrophobicContact CD-CE1 4.42Å; K40-Y151 HydrophobicContact CG-CD1 4.48Å; K40-Y151 HydrophobicContact CG-CE1 3.83Å; K40-Y151 HydrophobicContact CG-CE2 4.37Å; K40-P377 VanDerWaalsContact CE-O 3.23Å; K40-P377 WeakPolarHBondContact CE-O 3.5Å; K40-P377 PolarHBondContact NZ-O 2.83Å; K40-E378 PolarHBondContact NZ-OXT 3.46Å
41	I	98.9	Very high	97.7	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	125.5	-177.7	-58.2	-61.1	0	0	0	109.4	I39 P93 T147 S149 E150 T152 V375 S376	I39-I41 HydrophobicContact CB-CD1 4.4Å; I39-I41 HydrophobicContact CG2-CD1 3.95Å; I41-P93 HydrophobicContact CD1-CG 3.98Å; I41-T147 HydrophobicContact CD1-CG2 4.23Å; I41-S149 VanDerWaalsContact CB-O 3.32Å; I41-S149 WeakPolarHBondContact CB-O 3.33Å; I41-S149 WeakPolarHBondContact CG1-O 3.4Å; I41-E150 PolarHBondContact N-O 3.21Å; I41-T152 HydrophobicContact CD1-CG2 3.76Å; I41-T152 HydrophobicContact CG1-CG2 3.95Å; I41-V375 HydrophobicContact CB-CG1 4.17Å; I41-V375 HydrophobicContact CG2-CB 4.11Å; I41-V375 HydrophobicContact CG2-CG1 4.21Å; I41-V375 HydrophobicContact CG2-CG2 4.07Å; I41-V375 WeakPolarHBondContact O-CB 3.28Å; I41-V375 WeakPolarHBondContact O-CG1 3.47Å; I41-S376 VanDerWaalsContact O-CB 3.22Å; I41-S376 WeakPolarHBondContact O-CB 3.48Å; I41-S376 PolarHBondContact O-N 3.46Å; I41-S376 PolarHBondContact O-OG 3.3Å
42	V	98.8	Very high	97.5	Very high	8 Å²	8	19.3 Å²	19.3	5%	0.048	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-46.8	179.8	170.4	0	0	0	0	109.9	A72 I74 L168 V375 S376 E378	V42-A72 PolarHBondContact N-O 3.23Å; V42-I74 HydrophobicContact CG2-CD1 4.26Å; V42-I74 HydrophobicContact CG2-CG1 4.35Å; V42-L168 HydrophobicContact CB-CB 4.18Å; V42-L168 HydrophobicContact CB-CD1 3.77Å; V42-L168 HydrophobicContact CG1-CB 4Å; V42-L168 HydrophobicContact CG1-CD1 4.07Å; V42-L168 HydrophobicContact CG2-CD1 3.65Å; V42-V375 PolarHBondContact O-N 2.93Å; V42-S376 PolarHBondContact O-N 2.94Å; V42-E378 HydrophobicContact CB-CG 4.37Å; V42-E378 HydrophobicContact CG1-CG 3.5Å; V42-E378 HydrophobicContact CG2-CG 4.03Å
43	A	98.7	Very high	97.3	Very high	2 Å²	2	18.6 Å²	18.6	2%	0.017	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.1	-179.7	0	0	0	0	0	111.1	G71 A72 D169 C172 V372 M373	A43-G71 CarbonylContact O-C 3.56Å; A43-G71 VanDerWaalsContact O-CA 3.26Å; A43-G71 WeakPolarHBondContact O-CA 3.46Å; A43-A72 PolarHBondContact N-O 2.9Å; A43-A72 VanDerWaalsContact N-O 3.16Å; A43-A72 PolarHBondContact O-N 2.86Å; A43-D169 HydrophobicContact CB-CB 4.31Å; A43-C172 HydrophobicContact CB-CB 4.47Å; A43-V372 HydrophobicContact CB-CG1 4.18Å; A43-M373 WeakPolarHBondContact CA-O 3.17Å
44	T	98.8	Very high	97.3	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155.7	174.5	-176.4	0	0	0	0	109.3	E70 T147 F148 M373 V375	T44-E70 CarbonylContact C-O 3.52Å; T44-E70 VanDerWaalsContact CA-O 3.23Å; T44-E70 WeakPolarHBondContact CA-O 3.43Å; T44-E70 PolarHBondContact OG1-O 3.39Å; T44-E70 VanDerWaalsContact OG1-O 3.1Å; T44-T147 PolarHBondContact OG1-OG1 3.22Å; T44-F148 HydrophobicContact CG2-CD1 3.64Å; T44-F148 HydrophobicContact CG2-CE1 3.99Å; T44-M373 HydrophobicContact CG2-CB 4.11Å; T44-M373 HydrophobicContact CG2-CE 3.73Å; T44-M373 PolarHBondContact N-O 3.02Å; T44-M373 PolarHBondContact O-N 2.99Å; T44-V375 HydrophobicContact CG2-CG2 3.47Å; T44-V375 VanDerWaalsContact CG2-CG2 3.47Å
45	S	98.2	Very high	97.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	150.2	171.9	49.3	0	0	0	0	111.7	E70 L173 V371	S45-E70 PolarHBondContact N-O 3.36Å; S45-E70 WeakPolarHBondContact OG-CB 3.44Å; S45-E70 WeakPolarHBondContact OG-CG 3.41Å; S45-E70 PolarHBondContact OG-OE2 2.68Å; S45-L173 VanDerWaalsContact OG-CD2 3.28Å; S45-L173 WeakPolarHBondContact OG-CD2 3.05Å; S45-V371 VanDerWaalsContact CA-O 3.22Å; S45-V371 WeakPolarHBondContact CA-O 3.45Å; S45-V371 VanDerWaalsContact CB-O 3.25Å; S45-V371 WeakPolarHBondContact CB-O 3.38Å
46	V	97.3	Very high	96.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.076	C	C	.	.			trans	-76.1	134.8	170.8	-174	0	0	0	0	108.3	L51 F148 A359 I360 M363 R370 V371 M373	V46-L51 HydrophobicContact CG1-CD1 3.57Å; V46-F148 HydrophobicContact CB-CZ 4.44Å; V46-F148 HydrophobicContact CG2-CZ 3.93Å; V46-A359 HydrophobicContact CG2-CB 3.72Å; V46-I360 HydrophobicContact CG1-CG1 4.14Å; V46-M363 HydrophobicContact CB-CE 4.19Å; V46-M363 HydrophobicContact CG1-CE 4.24Å; V46-M363 HydrophobicContact CG1-SD 3.92Å; V46-M363 WeakPolarHBondContact O-CE 3.18Å; V46-R370 WeakPolarHBondContact O-CD 3.48Å; V46-V371 PolarHBondContact N-O 3.38Å; V46-M373 HydrophobicContact CG2-CE 3.84Å; V46-M373 HydrophobicContact CG2-SD 4.25Å
47	C	96.7	Very high	96.3	Very high	5 Å²	5	15.3 Å²	15.3	3%	0.034	8%	0.078	C	C	.	.			trans	-125.3	156.4	174.2	174.8	0	0	0	0	109.7	S49 D50 H69	C47-S49 PolarHBondContact O-N 3.06Å; C47-S49 VanDerWaalsContact O-N 3.15Å; C47-D50 WeakPolarHBondContact CA-OD2 3.46Å; C47-D50 WeakPolarHBondContact CB-OD2 3.38Å; C47-D50 PolarHBondContact N-OD2 3.18Å; C47-D50 WeakPolarHBondContact O-CB 3.37Å; C47-D50 PolarHBondContact O-N 2.73Å; C47-H69 VanDerWaalsContact CB-CE1 3.45Å; C47-H69 WeakPolarHBondContact CB-CE1 3.18Å
48	H	95.3	Very high	95.6	Very high	87 Å²	87	19.4 Å²	19.4	40%	0.403	10%	0.098	S	C	.	.	H	α-helix	trans	-61.1	-27	-177.9	-168.1	80.2	0	0	0	112.2	D50 L51 Y52 E56 M363	H48-D50 VanDerWaalsContact C-N 3.26Å; H48-D50 PolarHBondContact O-N 2.83Å; H48-L51 CarbonylContact O-C 3.58Å; H48-L51 WeakPolarHBondContact O-CB 3.32Å; H48-L51 PolarHBondContact O-N 2.85Å; H48-L51 VanDerWaalsContact O-N 3.12Å; H48-Y52 WeakPolarHBondContact O-CB 2.69Å; H48-Y52 PolarHBondContact O-N 2.71Å; H48-E56 IonicContact CE1-OE1 3.44Å; H48-E56 IonicContact NE2-OE1 3.2Å; H48-E56 PolarHBondContact NE2-OE1 2.95Å; H48-M363 HydrophobicContact CB-SD 4.46Å; H48-M363 PolarHBondContact N-SD 3Å; H48-M363 VanDerWaalsContact N-SD 3.39Å
49	S	95.3	Very high	95.1	Very high	27 Å²	27	21.6 Å²	21.6	19%	0.189	11%	0.112	C	C	.	.	H	α-helix	trans	-65.9	-25.6	173.4	-53.2	0	0	0	0	113.6	C47 H53	C47-S49 PolarHBondContact O-N 3.06Å; C47-S49 VanDerWaalsContact O-N 3.15Å; S49-H53 PolarHBondContact O-N 2.86Å
50	D	96.7	Very high	94.8	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-71	-40	171.6	-52.2	-68.1	0	0	0	110.2	C47 H48 L54 G68 H69 F142	C47-D50 WeakPolarHBondContact CA-OD2 3.46Å; C47-D50 WeakPolarHBondContact CB-OD2 3.38Å; C47-D50 PolarHBondContact N-OD2 3.18Å; C47-D50 WeakPolarHBondContact O-CB 3.37Å; C47-D50 PolarHBondContact O-N 2.73Å; H48-D50 VanDerWaalsContact C-N 3.26Å; H48-D50 PolarHBondContact O-N 2.83Å; D50-L54 WeakPolarHBondContact O-CB 3.49Å; D50-L54 PolarHBondContact O-N 2.89Å; D50-L54 VanDerWaalsContact O-N 3.1Å; D50-G68 VanDerWaalsContact OD1-CA 3.24Å; D50-G68 WeakPolarHBondContact OD1-CA 3.27Å; D50-G68 PolarHBondContact OD1-N 2.82Å; D50-H69 IonicContact OD1-CE1 3.05Å; D50-H69 IonicContact OD1-ND1 2.77Å; D50-H69 PolarHBondContact OD1-ND1 3.14Å; D50-H69 IonicContact OD2-CE1 2.88Å; D50-H69 PolarHBondContact OD2-CE1 2.9Å; D50-H69 IonicContact OD2-ND1 3.8Å; D50-H69 PolarHBondContact OD2-ND1 2.88Å; D50-F142 WeakPolarHBondContact OD1-CE1 3.19Å
51	L	95.9	Very high	94.6	Very high	3 Å²	3	33 Å²	33	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-40.8	173.7	-84	64	0	0	0	111.5	V46 H48 H53 L54 L55 I360 M363 R364	V46-L51 HydrophobicContact CG1-CD1 3.57Å; H48-L51 CarbonylContact O-C 3.58Å; H48-L51 WeakPolarHBondContact O-CB 3.32Å; H48-L51 PolarHBondContact O-N 2.85Å; H48-L51 VanDerWaalsContact O-N 3.12Å; L51-H53 VanDerWaalsContact C-N 3.34Å; L51-H53 PolarHBondContact O-N 3.46Å; L51-L54 PolarHBondContact O-N 2.72Å; L51-L55 HydrophobicContact CB-CD1 4.38Å; L51-L55 HydrophobicContact CG-CD1 4.19Å; L51-L55 WeakPolarHBondContact O-CA 3.21Å; L51-L55 VanDerWaalsContact O-CB 3.31Å; L51-L55 WeakPolarHBondContact O-CB 3.41Å; L51-L55 PolarHBondContact O-N 2.94Å; L51-I360 HydrophobicContact CD1-CB 4.49Å; L51-I360 HydrophobicContact CD1-CG1 4.29Å; L51-I360 HydrophobicContact CD1-CG2 4.09Å; L51-I360 HydrophobicContact CG-CG2 4.13Å; L51-M363 HydrophobicContact CD1-CB 4.42Å; L51-M363 HydrophobicContact CD1-CG 4.35Å; L51-M363 HydrophobicContact CD1-SD 4.12Å; L51-M363 HydrophobicContact CD2-CB 4.03Å; L51-M363 HydrophobicContact CD2-CG 3.83Å; L51-M363 HydrophobicContact CD2-SD 4.49Å; L51-R364 HydrophobicContact CD2-CB 4Å
52	Y	94.6	Very high	94.3	Very high	5 Å²	5	33 Å²	33	2%	0.02	17%	0.17	C	C	.	.	I	π-helix	trans	-54.3	-51.6	177.6	-179.2	-99.1	0	0	0	111	H48 E56 S57 M125 W296 D298 M299	H48-Y52 WeakPolarHBondContact O-CB 2.69Å; H48-Y52 PolarHBondContact O-N 2.71Å; Y52-E56 HydrophobicContact CD2-CB 3.93Å; Y52-E56 WeakPolarHBondContact CD2-OE2 3.43Å; Y52-E56 HydrophobicContact CE2-CB 4.3Å; Y52-E56 CarbonylContact O-C 3.58Å; Y52-E56 WeakPolarHBondContact O-CA 3.47Å; Y52-E56 WeakPolarHBondContact O-CB 3.35Å; Y52-E56 PolarHBondContact O-N 3.39Å; Y52-S57 PolarHBondContact O-N 2.8Å; Y52-M125 HydrophobicContact CD1-SD 4.13Å; Y52-W296 AromaticContact CD1-CD1 4Å; Y52-W296 AromaticContact CE1-CD1 3.88Å; Y52-W296 AromaticContact CE1-NE1 3.68Å; Y52-D298 PolarHBondContact OH-N 3.31Å; Y52-D298 VanDerWaalsContact OH-N 3.12Å; Y52-D298 PolarHBondContact OH-OD1 3.03Å; Y52-M299 WeakPolarHBondContact OH-CG 3.36Å
53	H	95	Very high	94.3	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.172	C	C	.	.	I	π-helix	trans	-65.5	-41	178.4	-174.8	73.7	0	0	0	112.3	S49 L51 F63 I124 M125 F142	S49-H53 PolarHBondContact O-N 2.86Å; L51-H53 VanDerWaalsContact C-N 3.34Å; L51-H53 PolarHBondContact O-N 3.46Å; H53-F63 AromaticContact CD2-CZ 3.71Å; H53-F63 AromaticContact NE2-CE2 3.66Å; H53-F63 AromaticContact NE2-CZ 3.71Å; H53-I124 PolarHBondContact CE1-O 3.28Å; H53-I124 VanDerWaalsContact CE1-O 3.25Å; H53-M125 HydrophobicContact CB-SD 4.05Å; H53-F142 HydrophobicContact CB-CD2 4.49Å; H53-F142 HydrophobicContact CB-CE2 3.65Å; H53-F142 HydrophobicContact CB-CZ 4.19Å; H53-F142 AromaticContact CG-CE2 3.67Å
54	L	96.1	Very high	94.2	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	18%	0.178	C	C	.	.	I	π-helix	trans	-73.5	-39.2	-176.6	-175	61.2	0	0	0	113.5	N19 D50 L51 F63 L67 I360	N19-L54 PolarHBondContact N-O 3.46Å; D50-L54 WeakPolarHBondContact O-CB 3.49Å; D50-L54 PolarHBondContact O-N 2.89Å; D50-L54 VanDerWaalsContact O-N 3.1Å; L51-L54 PolarHBondContact O-N 2.72Å; L54-F63 HydrophobicContact CD1-CE1 3.9Å; L54-F63 HydrophobicContact CD1-CZ 4.25Å; L54-L67 HydrophobicContact CB-CD1 4.11Å; L54-L67 HydrophobicContact CD1-CD1 4.48Å; L54-L67 HydrophobicContact CD2-CD1 4.22Å; L54-I360 HydrophobicContact CD2-CD1 4.01Å
55	L	94.2	Very high	94.2	Very high	31 Å²	31	34.7 Å²	34.7	16%	0.162	18%	0.179	C	C	.	.	I	π-helix	trans	-121.3	-21.7	-163	-55.4	179	0	0	0	114.1	L51 R364	L51-L55 HydrophobicContact CB-CD1 4.38Å; L51-L55 HydrophobicContact CG-CD1 4.19Å; L51-L55 WeakPolarHBondContact O-CA 3.21Å; L51-L55 VanDerWaalsContact O-CB 3.31Å; L51-L55 WeakPolarHBondContact O-CB 3.41Å; L51-L55 PolarHBondContact O-N 2.94Å; L55-R364 HydrophobicContact CD1-CG 4.47Å
56	E	90.3	Very high	94.2	Very high	87 Å²	87	34.7 Å²	34.7	41%	0.407	18%	0.179	S	C	.	.	I	π-helix	trans	-113	-62.4	-170.5	-59.3	178.5	-150.9	0	0	112.1	H48 Y52 M58	H48-E56 IonicContact CE1-OE1 3.44Å; H48-E56 IonicContact NE2-OE1 3.2Å; H48-E56 PolarHBondContact NE2-OE1 2.95Å; Y52-E56 HydrophobicContact CD2-CB 3.93Å; Y52-E56 WeakPolarHBondContact CD2-OE2 3.43Å; Y52-E56 HydrophobicContact CE2-CB 4.3Å; Y52-E56 CarbonylContact O-C 3.58Å; Y52-E56 WeakPolarHBondContact O-CA 3.47Å; Y52-E56 WeakPolarHBondContact O-CB 3.35Å; Y52-E56 PolarHBondContact O-N 3.39Å; E56-M58 VanDerWaalsContact C-N 3.32Å; E56-M58 PolarHBondContact O-N 2.83Å
57	S	87.1	Confident	94.3	Very high	19 Å²	19	34.8 Å²	34.8	13%	0.133	18%	0.179	C	C	.	.	I	π-helix	trans	-68.8	-35.4	-179.6	86.5	0	0	0	0	111.7	Y52 T59	Y52-S57 PolarHBondContact O-N 2.8Å; S57-T59 PolarHBondContact O-N 3.35Å; S57-T59 PolarHBondContact OG-OG1 2.85Å
58	M	83.7	Confident	94.3	Very high	85 Å²	85	34.6 Å²	34.6	42%	0.419	18%	0.178	S	C	.	.			trans	46.9	34.4	173.5	-63.4	-174.5	-71	0	0	114.5	P18 N19 E56 E60	P18-M58 HydrophobicContact CB-CB 3.72Å; P18-M58 HydrophobicContact CB-CG 3.94Å; P18-M58 HydrophobicContact CG-CB 4.37Å; N19-M58 HydrophobicContact CB-SD 4.06Å; E56-M58 VanDerWaalsContact C-N 3.32Å; E56-M58 PolarHBondContact O-N 2.83Å; M58-E60 PolarHBondContact O-N 2.88Å
59	T	88.6	Confident	94.5	Very high	46 Å²	46	30.5 Å²	30.5	28%	0.282	16%	0.159	S	C	.	.			trans	-71.7	103	-177.6	-39.3	0	0	0	0	109.7	S57 D61 G62 F63 I124	S57-T59 PolarHBondContact O-N 3.35Å; S57-T59 PolarHBondContact OG-OG1 2.85Å; T59-D61 PolarHBondContact O-N 2.96Å; T59-D61 VanDerWaalsContact O-N 3.14Å; T59-G62 PolarHBondContact O-N 2.94Å; T59-F63 WeakPolarHBondContact O-CD2 3.39Å; T59-I124 HydrophobicContact CG2-CG2 3.69Å
60	E	92.1	Very high	94.6	Very high	155 Å²	155	29.2 Å²	29.2	72%	0.724	15%	0.15	S	C	*	.	G	3₁₀ helix	trans	-53.4	-38.2	-171	-68.4	-174.1	170	0	0	113.7	P18 M58 G62 F63	P18-E60 HydrophobicContact CG-CG 4.14Å; M58-E60 PolarHBondContact O-N 2.88Å; E60-G62 PolarHBondContact O-N 3.28Å; E60-F63 PolarHBondContact O-N 3.44Å
61	D	93.8	Very high	94.7	Very high	127 Å²	127	29.1 Å²	29.1	68%	0.679	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-63.1	-12.2	177.9	-74	-20.6	0	0	0	114.1	T59 F63 I124	T59-D61 PolarHBondContact O-N 2.96Å; T59-D61 VanDerWaalsContact O-N 3.14Å; D61-F63 VanDerWaalsContact C-N 3.3Å; D61-I124 HydrophobicContact CB-CG2 3.9Å
62	G	94.3	Very high	94.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-77.9	-10	171.9	0	0	0	0	0	114.3	T59 E60 T65 H140	T59-G62 PolarHBondContact O-N 2.94Å; E60-G62 PolarHBondContact O-N 3.28Å; G62-T65 WeakPolarHBondContact O-CB 3.31Å; G62-H140 PolarHBondContact O-CD2 3.08Å
63	F	97.1	Very high	95	Very high	20 Å²	20	28.8 Å²	28.8	9%	0.088	15%	0.148	C	C	.	.			trans	-114.5	153.4	-172.7	-64.8	-97.1	0	0	0	112.5	A17 P18 H53 L54 T59 E60 D61 T65	A17-F63 VanDerWaalsContact C-CD1 3.48Å; P18-F63 HydrophobicContact CB-CE2 4.14Å; P18-F63 HydrophobicContact CB-CZ 4.36Å; P18-F63 HydrophobicContact CG-CD2 3.66Å; P18-F63 HydrophobicContact CG-CE2 3.62Å; P18-F63 HydrophobicContact CG-CG 4.35Å; P18-F63 HydrophobicContact CG-CZ 4.25Å; H53-F63 AromaticContact CD2-CZ 3.71Å; H53-F63 AromaticContact NE2-CE2 3.66Å; H53-F63 AromaticContact NE2-CZ 3.71Å; L54-F63 HydrophobicContact CD1-CE1 3.9Å; L54-F63 HydrophobicContact CD1-CZ 4.25Å; T59-F63 WeakPolarHBondContact O-CD2 3.39Å; E60-F63 PolarHBondContact O-N 3.44Å; D61-F63 VanDerWaalsContact C-N 3.3Å; F63-T65 HydrophobicContact CD1-CG2 3.93Å; F63-T65 HydrophobicContact CE1-CG2 3.94Å
64	P	97.9	Very high	95.2	Very high	25 Å²	25	30 Å²	30	16%	0.162	15%	0.154	C	C	.	.	S	Bend	cis	-73.5	150.4	-3.1	32.7	-37.4	0	0	0	112.1	V14 S15 W16 I139 H140	V14-P64 HydrophobicContact CG1-CB 4.46Å; S15-P64 CarbonylContact O-C 3.5Å; S15-P64 VanDerWaalsContact O-CA 3.29Å; S15-P64 WeakPolarHBondContact O-CA 3.45Å; W16-P64 HydrophobicContact CD2-CB 4.39Å; W16-P64 HydrophobicContact CE3-CB 3.69Å; W16-P64 HydrophobicContact CE3-CG 4.19Å; W16-P64 HydrophobicContact CZ3-CB 4.07Å; W16-P64 HydrophobicContact CZ3-CG 4.17Å; P64-I139 HydrophobicContact CB-CD1 3.86Å; P64-I139 HydrophobicContact CG-CD1 3.51Å; P64-H140 WeakPolarHBondContact O-CB 3.29Å; P64-H140 PolarHBondContact O-CD2 3.02Å; P64-H140 PolarHBondContact O-N 3.3Å
65	T	98.3	Very high	95.3	Very high	1 Å²	1	30 Å²	30	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	154.8	-174.6	-168.1	0	0	0	0	112.5	S15 G62 F63 L67 H140	S15-T65 PolarHBondContact N-O 2.83Å; S15-T65 PolarHBondContact O-N 2.84Å; G62-T65 WeakPolarHBondContact O-CB 3.31Å; F63-T65 HydrophobicContact CD1-CG2 3.93Å; F63-T65 HydrophobicContact CE1-CG2 3.94Å; T65-L67 HydrophobicContact CG2-CD2 3.58Å; T65-L67 HydrophobicContact CG2-CG 4.16Å; T65-H140 PolarHBondContact OG1-O 2.85Å
66	V	98.6	Very high	95.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.9	161.5	175.8	0	0	0	0	107.4	A12 V14 F132 I139 H140 F142 S146 F148	A12-V66 HydrophobicContact CB-CG1 4.4Å; A12-V66 HydrophobicContact CB-CG2 4.06Å; V14-V66 HydrophobicContact CG2-CG2 4.13Å; V66-F132 HydrophobicContact CB-CD2 4.09Å; V66-F132 HydrophobicContact CB-CE2 3.89Å; V66-F132 HydrophobicContact CG1-CE2 4.2Å; V66-F132 HydrophobicContact CG2-CD2 3.89Å; V66-F132 HydrophobicContact CG2-CE2 4.03Å; V66-I139 HydrophobicContact CG2-CG2 3.93Å; V66-H140 PolarHBondContact N-O 3.47Å; V66-H140 VanDerWaalsContact N-O 3.12Å; V66-F142 WeakPolarHBondContact O-CB 3.34Å; V66-F142 PolarHBondContact O-N 3.42Å; V66-S146 VanDerWaalsContact O-CB 3.28Å; V66-S146 WeakPolarHBondContact O-CB 3.11Å; V66-S146 PolarHBondContact O-OG 2.88Å; V66-F148 HydrophobicContact CG1-CB 4.16Å
67	L	98.5	Very high	96	Very high	2 Å²	2	26 Å²	26	1%	0.01	14%	0.136	C	C	.	.			trans	-78	-171.9	-179.1	-58.7	177.2	0	0	0	112.6	L54 T65 F142 S146 T147 F148	L54-L67 HydrophobicContact CB-CD1 4.11Å; L54-L67 HydrophobicContact CD1-CD1 4.48Å; L54-L67 HydrophobicContact CD2-CD1 4.22Å; T65-L67 HydrophobicContact CG2-CD2 3.58Å; T65-L67 HydrophobicContact CG2-CG 4.16Å; L67-F142 HydrophobicContact CD2-CB 4.27Å; L67-F142 HydrophobicContact CD2-CD1 4.46Å; L67-F142 HydrophobicContact CD2-CD2 4Å; L67-F142 HydrophobicContact CD2-CE2 4.46Å; L67-F142 HydrophobicContact CD2-CG 3.99Å; L67-S146 CarbonylContact O-C 3.57Å; L67-S146 WeakPolarHBondContact O-CA 2.98Å; L67-T147 PolarHBondContact O-N 3.48Å; L67-F148 HydrophobicContact CB-CD2 3.64Å; L67-F148 HydrophobicContact CB-CE2 3.76Å; L67-F148 HydrophobicContact CB-CG 4.48Å; L67-F148 WeakPolarHBondContact O-CB 3.43Å; L67-F148 WeakPolarHBondContact O-CG 3.46Å; L67-F148 PolarHBondContact O-N 3.26Å
68	G	98.3	Very high	96.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.			trans	92	125.9	174.7	0	0	0	0	0	112	D50 T145 S146 T147 F148	D50-G68 VanDerWaalsContact OD1-CA 3.24Å; D50-G68 WeakPolarHBondContact OD1-CA 3.27Å; D50-G68 PolarHBondContact OD1-N 2.82Å; G68-T145 PolarHBondContact O-OG1 3.2Å; G68-S146 CarbonylContact O-C 3.58Å; G68-S146 VanDerWaalsContact O-CA 3.25Å; G68-S146 WeakPolarHBondContact O-CA 3.35Å; G68-S146 PolarHBondContact O-N 3.3Å; G68-S146 VanDerWaalsContact O-N 3.11Å; G68-T147 WeakPolarHBondContact CA-OG1 3.44Å; G68-T147 PolarHBondContact O-N 3.38Å; G68-T147 PolarHBondContact O-OG1 3.05Å; G68-F148 VanDerWaalsContact CA-CE1 3.45Å
69	H	98	Very high	97.2	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.127	C	C	.	.			trans	-135.4	0.9	179.5	63.8	-76.8	0	0	0	113.6	C47 D50 F95 F142 M143 T145 T147 C176	C47-H69 VanDerWaalsContact CB-CE1 3.45Å; C47-H69 WeakPolarHBondContact CB-CE1 3.18Å; D50-H69 IonicContact OD1-CE1 3.05Å; D50-H69 IonicContact OD1-ND1 2.77Å; D50-H69 PolarHBondContact OD1-ND1 3.14Å; D50-H69 IonicContact OD2-CE1 2.88Å; D50-H69 PolarHBondContact OD2-CE1 2.9Å; D50-H69 IonicContact OD2-ND1 3.8Å; D50-H69 PolarHBondContact OD2-ND1 2.88Å; H69-F95 HydrophobicContact CB-CB 4.36Å; H69-F142 HydrophobicContact CB-CD1 4.35Å; H69-F142 HydrophobicContact CB-CE1 4.27Å; H69-F142 AromaticContact ND1-CE1 3.59Å; H69-M143 HydrophobicContact CB-SD 4.02Å; H69-T145 VanDerWaalsContact CA-OG1 3.27Å; H69-T145 WeakPolarHBondContact CA-OG1 3.46Å; H69-T145 WeakPolarHBondContact CB-OG1 3.49Å; H69-T147 PolarHBondContact N-OG1 3Å; H69-C176 PolarHBondContact NE2-SG 3.48Å
70	E	98.1	Very high	97.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	83.5	-178.5	-168.7	172.3	-129.2	0	0	108.5	T44 S45 C172 C176 G177 R370	T44-E70 CarbonylContact C-O 3.52Å; T44-E70 VanDerWaalsContact CA-O 3.23Å; T44-E70 WeakPolarHBondContact CA-O 3.43Å; T44-E70 PolarHBondContact OG1-O 3.39Å; T44-E70 VanDerWaalsContact OG1-O 3.1Å; S45-E70 PolarHBondContact N-O 3.36Å; S45-E70 WeakPolarHBondContact OG-CB 3.44Å; S45-E70 WeakPolarHBondContact OG-CG 3.41Å; S45-E70 PolarHBondContact OG-OE2 2.68Å; E70-C172 WeakPolarHBondContact CG-O 3.25Å; E70-C176 HydrophobicContact CB-CB 3.98Å; E70-C176 HydrophobicContact CG-CB 3.91Å; E70-G177 PolarHBondContact OE1-N 3.07Å; E70-R370 IonicContact OE1-NE 3.35Å; E70-R370 IonicContact OE1-NH2 3.5Å; E70-R370 IonicContact OE2-CZ 3.47Å; E70-R370 IonicContact OE2-NE 3.46Å; E70-R370 PolarHBondContact OE2-NE 2.74Å; E70-R370 IonicContact OE2-NH2 2.71Å
71	G	98.4	Very high	97.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	167.2	-173.3	0	0	0	0	0	114.3	A43 P93	A43-G71 CarbonylContact O-C 3.56Å; A43-G71 VanDerWaalsContact O-CA 3.26Å; A43-G71 WeakPolarHBondContact O-CA 3.46Å; G71-P93 WeakPolarHBondContact O-CD 3.49Å
72	A	98.8	Very high	98	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	146.6	172.8	0	0	0	0	0	110.3	V42 A43 A91 I92 L168 V171 C172	V42-A72 PolarHBondContact N-O 3.23Å; A43-A72 PolarHBondContact N-O 2.9Å; A43-A72 VanDerWaalsContact N-O 3.16Å; A43-A72 PolarHBondContact O-N 2.86Å; A72-A91 WeakPolarHBondContact CA-O 3.34Å; A72-I92 HydrophobicContact CB-CG1 3.91Å; A72-L168 HydrophobicContact CB-CB 4.14Å; A72-L168 HydrophobicContact CB-CD2 3.73Å; A72-V171 HydrophobicContact CB-CG2 4.34Å; A72-C172 HydrophobicContact CB-CB 3.87Å
73	G	98.8	Very high	98.1	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	-168	-172.8	0	0	0	0	0	113.4	K40 K90 A91	K40-G73 CarbonylContact O-C 3.57Å; K40-G73 WeakPolarHBondContact O-CA 3.48Å; G73-K90 WeakPolarHBondContact O-CA 3.32Å; G73-A91 PolarHBondContact N-O 3.14Å; G73-A91 PolarHBondContact O-N 2.88Å
74	I	98.8	Very high	98.1	Very high	28 Å²	28	25.5 Å²	25.5	14%	0.144	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	132	-178.1	-60.1	168	0	0	0	108.2	K40 V42 E76 D89 K90 L168 E378	K40-I74 PolarHBondContact N-O 3.31Å; K40-I74 PolarHBondContact O-N 3.49Å; V42-I74 HydrophobicContact CG2-CD1 4.26Å; V42-I74 HydrophobicContact CG2-CG1 4.35Å; I74-E76 PolarHBondContact O-N 2.77Å; I74-D89 CarbonylContact C-O 3.55Å; I74-D89 WeakPolarHBondContact CA-O 3.43Å; I74-K90 HydrophobicContact CG1-CG 4.26Å; I74-L168 HydrophobicContact CD1-CD1 4.33Å; I74-L168 HydrophobicContact CG1-CD1 3.93Å; I74-E378 HydrophobicContact CD1-CB 4.26Å; I74-E378 WeakPolarHBondContact CD1-OXT 3.39Å
75	V	98.8	Very high	98.1	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	122.9	176.1	176.6	0	0	0	0	109.2	V37 V78 F85 Q86 P87 G88 D89 A91	V37-V75 HydrophobicContact CG1-CB 4.32Å; V37-V75 HydrophobicContact CG1-CG1 3.68Å; V37-V75 HydrophobicContact CG1-CG2 3.82Å; V75-V78 HydrophobicContact CG1-CG1 3.83Å; V75-F85 HydrophobicContact CG2-CB 4.44Å; V75-F85 HydrophobicContact CG2-CD1 4.16Å; V75-Q86 WeakPolarHBondContact CB-O 3.41Å; V75-Q86 WeakPolarHBondContact CG1-O 3.28Å; V75-P87 CarbonylContact O-C 3.57Å; V75-P87 WeakPolarHBondContact O-CA 3.1Å; V75-G88 PolarHBondContact O-N 3.49Å; V75-D89 HydrophobicContact CB-CB 4.33Å; V75-D89 HydrophobicContact CG2-CB 4.02Å; V75-D89 PolarHBondContact N-O 3.19Å; V75-A91 HydrophobicContact CG2-CB 4.1Å
76	E	98.7	Very high	98.1	Very high	30 Å²	30	30.5 Å²	30.5	14%	0.14	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-46.6	176	178.6	-84.5	164.1	0	0	111.1	T3 A4 R38 I74 Y151	T3-E76 VanDerWaalsContact C-OE1 3.26Å; T3-E76 VanDerWaalsContact CB-OE1 3.23Å; T3-E76 WeakPolarHBondContact CB-OE1 3.44Å; T3-E76 PolarHBondContact OG1-OE1 3.36Å; A4-E76 PolarHBondContact N-OE1 2.72Å; R38-E76 IonicContact CZ-OE2 3.36Å; R38-E76 IonicContact NE-OE2 2.88Å; R38-E76 PolarHBondContact NE-OE2 3.3Å; R38-E76 VanDerWaalsContact NH2-CD 3.34Å; R38-E76 IonicContact NH2-OE1 3.12Å; R38-E76 PolarHBondContact NH2-OE1 2.68Å; R38-E76 VanDerWaalsContact NH2-OE1 3.16Å; R38-E76 IonicContact NH2-OE2 2.62Å; R38-E76 PolarHBondContact NH2-OE2 3.48Å; R38-E76 PolarHBondContact O-N 2.95Å; I74-E76 PolarHBondContact O-N 2.77Å; E76-Y151 HydrophobicContact CB-CD1 4.43Å; E76-Y151 HydrophobicContact CB-CE1 4.05Å; E76-Y151 HydrophobicContact CG-CE1 3.96Å
77	S	98.6	Very high	98.1	Very high	6 Å²	6	34.2 Å²	34.2	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	160.9	175.9	60	0	0	0	0	111.7	R38	R38-S77 PolarHBondContact N-O 3.39Å; R38-S77 PolarHBondContact O-N 2.91Å
78	V	98.7	Very high	98	Very high	49 Å²	49	36.6 Å²	36.6	30%	0.297	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.5	179.1	-61	0	0	0	0	109.8	V37 V75 V82 F85	V37-V78 HydrophobicContact CG1-CG1 4.26Å; V37-V78 HydrophobicContact CG2-CG1 4.39Å; V75-V78 HydrophobicContact CG1-CG1 3.83Å; V78-V82 HydrophobicContact CB-CB 3.97Å; V78-V82 HydrophobicContact CB-CG1 3.96Å; V78-V82 HydrophobicContact CB-CG2 4.44Å; V78-V82 HydrophobicContact CG1-CG1 3.96Å; V78-F85 HydrophobicContact CG1-CB 3.94Å
79	G	98.3	Very high	98.1	Very high	7 Å²	7	37.4 Å²	37.4	7%	0.072	24%	0.239	C	C	.	.			trans	-85.5	174.6	174.8	0	0	0	0	0	113	Q33 E36 V82	Q33-G79 WeakPolarHBondContact O-CA 3.42Å; E36-G79 PolarHBondContact O-N 3.29Å; G79-V82 PolarHBondContact O-N 2.99Å
80	P	98.1	Very high	98.1	Very high	95 Å²	95	38.8 Å²	38.8	62%	0.617	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	139.8	-179.6	-26.6	34.9	0	0	0	113.3	A34 G35 V82	A34-P80 CarbonylContact C-O 3.51Å; A34-P80 VanDerWaalsContact CA-O 3.25Å; A34-P80 WeakPolarHBondContact CA-O 3.23Å; A34-P80 HydrophobicContact CB-CB 4.37Å; G35-P80 PolarHBondContact N-O 3.18Å; P80-V82 VanDerWaalsContact C-N 3.27Å; P80-V82 PolarHBondContact O-N 3.33Å
81	G	96	Very high	98.1	Very high	64 Å²	64	38.8 Å²	38.8	66%	0.66	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	78	1.4	176.7	0	0	0	0	0	115.6
82	V	97.7	Very high	98.1	Very high	18 Å²	18	38.8 Å²	38.8	11%	0.109	25%	0.245	C	C	.	.			trans	-79.1	126.7	167.4	177.7	0	0	0	0	109.3	E36 V37 V78 G79 P80 F85 Q156	E36-V82 WeakPolarHBondContact O-CG2 3.22Å; V37-V82 HydrophobicContact CG2-CG1 4.05Å; V37-V82 HydrophobicContact CG2-CG2 4.33Å; V78-V82 HydrophobicContact CB-CB 3.97Å; V78-V82 HydrophobicContact CB-CG1 3.96Å; V78-V82 HydrophobicContact CB-CG2 4.44Å; V78-V82 HydrophobicContact CG1-CG1 3.96Å; G79-V82 PolarHBondContact O-N 2.99Å; P80-V82 VanDerWaalsContact C-N 3.27Å; P80-V82 PolarHBondContact O-N 3.33Å; V82-F85 HydrophobicContact CG1-CB 4Å; V82-F85 HydrophobicContact CG1-CD2 4Å; V82-Q156 HydrophobicContact CG2-CB 4.28Å
83	T	96.3	Very high	98.1	Very high	134 Å²	134	38.8 Å²	38.8	82%	0.822	25%	0.245	S	C	*	.			trans	-124.8	-18.8	-177.9	53.3	0	0	0	0	113.5
84	E	96	Very high	98	Very high	73 Å²	73	38.9 Å²	38.9	34%	0.341	25%	0.245	S	C	.	.	S	Bend	trans	-83.5	-15.5	-177.7	-171.2	176	155.6	0	0	113.3	K326	E84-K326 WeakPolarHBondContact OE1-CE 3.37Å; E84-K326 IonicContact OE1-NZ 2.98Å; E84-K326 PolarHBondContact OE1-NZ 3.02Å; E84-K326 IonicContact OE2-NZ 3.03Å; E84-K326 PolarHBondContact OE2-NZ 3.06Å
85	F	98	Very high	97.8	Very high	10 Å²	10	38.8 Å²	38.8	4%	0.044	24%	0.244	C	C	.	.			trans	-128.7	148.5	-173.4	-59.5	-83.3	0	0	0	111.6	V37 V75 V78 V82 Q156 V159 K161	V37-F85 HydrophobicContact CG2-CB 4.37Å; V37-F85 HydrophobicContact CG2-CD2 3.88Å; V37-F85 HydrophobicContact CG2-CG 4.21Å; V75-F85 HydrophobicContact CG2-CB 4.44Å; V75-F85 HydrophobicContact CG2-CD1 4.16Å; V78-F85 HydrophobicContact CG1-CB 3.94Å; V82-F85 HydrophobicContact CG1-CB 4Å; V82-F85 HydrophobicContact CG1-CD2 4Å; F85-Q156 HydrophobicContact CD2-CB 4.36Å; F85-Q156 HydrophobicContact CE2-CB 4.21Å; F85-V159 HydrophobicContact CD1-CG1 4.4Å; F85-V159 HydrophobicContact CE1-CB 4.28Å; F85-V159 HydrophobicContact CE1-CG1 3.64Å; F85-V159 HydrophobicContact CE2-CB 4.28Å; F85-V159 HydrophobicContact CE2-CG1 4.47Å; F85-V159 HydrophobicContact CZ-CB 3.81Å; F85-V159 HydrophobicContact CZ-CG1 3.7Å; F85-V159 WeakPolarHBondContact CZ-O 3.49Å; F85-K161 HydrophobicContact CD1-CB 4.22Å; F85-K161 HydrophobicContact CE1-CB 3.72Å
86	Q	97.9	Very high	97.6	Very high	122 Å²	122	39.3 Å²	39.3	57%	0.57	25%	0.246	S	C	*	.			trans	-136.6	158.7	168.5	62.2	179.4	41.9	0	0	110.5	V75 G88 D89	V75-Q86 WeakPolarHBondContact CB-O 3.41Å; V75-Q86 WeakPolarHBondContact CG1-O 3.28Å; Q86-G88 PolarHBondContact O-N 3.3Å; Q86-D89 WeakPolarHBondContact CG-OD2 3.5Å; Q86-D89 PolarHBondContact N-OD2 2.91Å; Q86-D89 WeakPolarHBondContact O-CB 3.5Å; Q86-D89 PolarHBondContact O-N 3.3Å
87	P	98.4	Very high	97.4	Very high	77 Å²	77	38.2 Å²	38.2	50%	0.5	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	135.9	171.8	-27.7	35.9	0	0	0	112.5	V75	V75-P87 CarbonylContact O-C 3.57Å; V75-P87 WeakPolarHBondContact O-CA 3.1Å
88	G	98.1	Very high	97.3	Very high	53 Å²	53	38.3 Å²	38.3	55%	0.546	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	92	-11.5	-178	0	0	0	0	0	115.2	V75 Q86 K90	V75-G88 PolarHBondContact O-N 3.49Å; Q86-G88 PolarHBondContact O-N 3.3Å; G88-K90 PolarHBondContact O-N 3.33Å
89	D	98.8	Very high	97.2	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.091	23%	0.231	C	C	.	.			trans	-65.8	132.4	174.3	-76.1	-23.5	0	0	0	111.2	I74 V75 Q86 K161	I74-D89 CarbonylContact C-O 3.55Å; I74-D89 WeakPolarHBondContact CA-O 3.43Å; V75-D89 HydrophobicContact CB-CB 4.33Å; V75-D89 HydrophobicContact CG2-CB 4.02Å; V75-D89 PolarHBondContact N-O 3.19Å; Q86-D89 WeakPolarHBondContact CG-OD2 3.5Å; Q86-D89 PolarHBondContact N-OD2 2.91Å; Q86-D89 WeakPolarHBondContact O-CB 3.5Å; Q86-D89 PolarHBondContact O-N 3.3Å; D89-K161 HydrophobicContact CB-CD 4.45Å; D89-K161 WeakPolarHBondContact OD1-CE 3.42Å; D89-K161 IonicContact OD1-NZ 2.76Å; D89-K161 PolarHBondContact OD1-NZ 3.37Å; D89-K161 WeakPolarHBondContact OD2-CE 3.43Å; D89-K161 IonicContact OD2-NZ 2.77Å; D89-K161 PolarHBondContact OD2-NZ 2.85Å
90	K	98.8	Very high	97.1	Very high	30 Å²	30	40.8 Å²	40.8	13%	0.13	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135.6	166.2	-74.9	-170.5	172.3	-175.1	0	109.6	G73 I74 G88 I162 P164 A166 L168 E378	G73-K90 WeakPolarHBondContact O-CA 3.32Å; I74-K90 HydrophobicContact CG1-CG 4.26Å; G88-K90 PolarHBondContact O-N 3.33Å; K90-I162 HydrophobicContact CB-CD1 4.12Å; K90-I162 HydrophobicContact CB-CG1 3.65Å; K90-I162 WeakPolarHBondContact O-CG1 3.34Å; K90-I162 PolarHBondContact O-N 3.3Å; K90-P164 WeakPolarHBondContact CD-O 3.45Å; K90-P164 WeakPolarHBondContact CE-O 3.27Å; K90-P164 PolarHBondContact NZ-O 2.89Å; K90-A166 PolarHBondContact NZ-O 3.25Å; K90-L168 HydrophobicContact CB-CD2 4.19Å; K90-L168 HydrophobicContact CD-CD1 4.17Å; K90-L168 HydrophobicContact CD-CD2 3.85Å; K90-L168 HydrophobicContact CD-CG 3.99Å; K90-L168 HydrophobicContact CG-CD1 4.26Å; K90-L168 HydrophobicContact CG-CD2 4.11Å; K90-L168 HydrophobicContact CG-CG 4.48Å; K90-E378 WeakPolarHBondContact CE-OE2 3.44Å; K90-E378 IonicContact NZ-OE1 2.62Å; K90-E378 IonicContact NZ-OE2 3.16Å; K90-E378 PolarHBondContact NZ-OE2 2.9Å
91	A	98.6	Very high	97	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	153.3	-174.4	0	0	0	0	0	113.3	I39 A72 G73 V75 V159 T160	I39-A91 HydrophobicContact CD1-CB 4.37Å; A72-A91 WeakPolarHBondContact CA-O 3.34Å; G73-A91 PolarHBondContact N-O 3.14Å; G73-A91 PolarHBondContact O-N 2.88Å; V75-A91 HydrophobicContact CG2-CB 4.1Å; A91-V159 HydrophobicContact CB-CG1 3.71Å; A91-T160 CarbonylContact C-O 3.58Å; A91-T160 WeakPolarHBondContact CA-O 3.29Å; A91-T160 WeakPolarHBondContact CB-O 3.38Å
92	I	98.8	Very high	97	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	118.9	172.6	-70.5	171.4	0	0	0	108.6	A72 L94 V159 T160 I162 V171 L174 V329 V333	A72-I92 HydrophobicContact CB-CG1 3.91Å; I92-L94 HydrophobicContact CG2-CD2 4.09Å; I92-V159 WeakPolarHBondContact O-CA 3.31Å; I92-T160 HydrophobicContact CB-CG2 3.84Å; I92-T160 HydrophobicContact CG2-CG2 4.45Å; I92-T160 PolarHBondContact N-O 2.79Å; I92-T160 PolarHBondContact O-N 3.26Å; I92-I162 HydrophobicContact CD1-CD1 4.15Å; I92-I162 HydrophobicContact CD1-CG2 3.97Å; I92-I162 HydrophobicContact CG1-CD1 4.1Å; I92-I162 HydrophobicContact CG1-CG2 4.17Å; I92-V171 HydrophobicContact CD1-CB 4.24Å; I92-V171 HydrophobicContact CD1-CG2 4.14Å; I92-V171 VanDerWaalsContact CD1-O 3.28Å; I92-V171 WeakPolarHBondContact CD1-O 3.37Å; I92-L174 HydrophobicContact CD1-CB 4.36Å; I92-V329 HydrophobicContact CB-CG1 4.33Å; I92-V329 HydrophobicContact CD1-CG1 3.75Å; I92-V329 HydrophobicContact CG2-CG1 4.15Å; I92-V333 HydrophobicContact CD1-CG2 4.02Å
93	P	98.3	Very high	97	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.4	138.9	161.5	-31.2	39.5	0	0	0	112.7	I39 I41 G71 T145 T147 I154	I39-P93 HydrophobicContact CD1-CG 4.23Å; I41-P93 HydrophobicContact CD1-CG 3.98Å; G71-P93 WeakPolarHBondContact O-CD 3.49Å; P93-T145 HydrophobicContact CB-CG2 3.99Å; P93-T147 HydrophobicContact CB-CG2 4.02Å; P93-T147 HydrophobicContact CG-CG2 3.93Å; P93-I154 HydrophobicContact CB-CD1 3.45Å; P93-I154 VanDerWaalsContact CB-CD1 3.45Å; P93-I154 HydrophobicContact CG-CD1 3.61Å
94	L	97.1	Very high	97	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.21	C	C	.	.			trans	-124.6	119.3	-179.8	-56.6	172.8	0	0	0	109.9	I92 L96 A158 T160 F320 A325 K326 V329	I92-L94 HydrophobicContact CG2-CD2 4.09Å; L94-L96 WeakPolarHBondContact CB-O 3.27Å; L94-L96 PolarHBondContact O-N 3.2Å; L94-A158 PolarHBondContact N-O 3.38Å; L94-A158 WeakPolarHBondContact O-CB 3.45Å; L94-T160 HydrophobicContact CD1-CG2 4.38Å; L94-T160 HydrophobicContact CD2-CG2 4.2Å; L94-T160 HydrophobicContact CG-CG2 4.47Å; L94-F320 HydrophobicContact CD2-CZ 4.44Å; L94-A325 HydrophobicContact CD1-CB 3.87Å; L94-K326 HydrophobicContact CD1-CB 4.39Å; L94-K326 HydrophobicContact CD1-CG 3.78Å; L94-V329 HydrophobicContact CD2-CB 4.21Å; L94-V329 HydrophobicContact CD2-CG1 4.43Å; L94-V329 HydrophobicContact CD2-CG2 3.68Å
95	F	93.3	Very high	97.1	Very high	27 Å²	27	39 Å²	39	12%	0.118	20%	0.198	C	C	.	.	S	Bend	trans	-66.1	-26.8	172.9	76.2	-92.9	0	0	0	112	H69 M143 T145 C176 M319 F320	H69-F95 HydrophobicContact CB-CB 4.36Å; F95-M143 HydrophobicContact CB-CB 4Å; F95-M143 HydrophobicContact CB-CE 3.77Å; F95-M143 HydrophobicContact CB-SD 4.23Å; F95-M143 HydrophobicContact CD2-CE 3.37Å; F95-M143 HydrophobicContact CE2-CE 4.1Å; F95-M143 HydrophobicContact CG-CE 3.72Å; F95-T145 HydrophobicContact CB-CG2 4.4Å; F95-C176 HydrophobicContact CE1-CB 4.24Å; F95-M319 HydrophobicContact CE2-SD 3.92Å; F95-M319 HydrophobicContact CZ-SD 4.38Å; F95-F320 HydrophobicContact CD1-CD2 4.48Å; F95-F320 HydrophobicContact CE1-CB 4.42Å; F95-F320 AromaticContact CE1-CD2 3.38Å; F95-F320 HydrophobicContact CE1-CD2 3.38Å; F95-F320 AromaticContact CE1-CE2 3.82Å; F95-F320 HydrophobicContact CE1-CE2 3.82Å; F95-F320 HydrophobicContact CE1-CG 4.06Å; F95-F320 HydrophobicContact CZ-CB 3.81Å; F95-F320 AromaticContact CZ-CD2 3.62Å; F95-F320 HydrophobicContact CZ-CD2 3.62Å; F95-F320 HydrophobicContact CZ-CE2 4.48Å; F95-F320 AromaticContact CZ-CG 3.95Å; F95-F320 HydrophobicContact CZ-CG 3.95Å
96	L	94.3	Very high	97.1	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.063	23%	0.228	C	C	.	.	S	Bend	trans	-99.3	121.9	172.2	-166.6	72	0	0	0	110.4	L94 N111 M319 F320 A325	L94-L96 WeakPolarHBondContact CB-O 3.27Å; L94-L96 PolarHBondContact O-N 3.2Å; L96-N111 HydrophobicContact CD2-CB 4.19Å; L96-N111 WeakPolarHBondContact CD2-ND2 3.33Å; L96-M319 HydrophobicContact CD1-CG 4.31Å; L96-F320 HydrophobicContact CB-CB 4.45Å; L96-F320 HydrophobicContact CB-CD1 4.43Å; L96-F320 HydrophobicContact CD2-CB 3.86Å; L96-F320 HydrophobicContact CD2-CD1 4.33Å; L96-A325 HydrophobicContact CB-CB 4.18Å; L96-A325 WeakPolarHBondContact O-CB 3.37Å
97	C	94.8	Very high	97	Very high	7 Å²	7	41 Å²	41	5%	0.047	21%	0.207	C	C	.	.			trans	-80.4	159.3	-178.6	-57.8	0	0	0	0	112.9	C113 A116 I157	C97-C113 HydrophobicContact CB-CB 4.17Å; C97-C113 WeakPolarHBondContact O-CB 3.44Å; C97-A116 HydrophobicContact CB-CB 3.66Å; C97-I157 CarbonylContact C-O 3.57Å; C97-I157 WeakPolarHBondContact CA-O 3.26Å; C97-I157 HydrophobicContact CB-CD1 3.92Å; C97-I157 HydrophobicContact CB-CG1 3.81Å
98	Q	97	Very high	96.9	Very high	9 Å²	9	43.3 Å²	43.3	4%	0.042	22%	0.222	C	C	.	.			trans	-142.7	99.1	166.5	-172.9	-174.1	-7	0	0	111.1	K100 I157 K324 K326 D327	Q98-K100 VanDerWaalsContact C-N 3.33Å; Q98-K100 HydrophobicContact CG-CG 4.1Å; Q98-K100 PolarHBondContact O-N 3.01Å; Q98-I157 PolarHBondContact N-O 3.11Å; Q98-K324 PolarHBondContact OE1-O 3.36Å; Q98-K326 HydrophobicContact CB-CB 4.39Å; Q98-K326 HydrophobicContact CB-CD 4.32Å; Q98-K326 HydrophobicContact CB-CG 4.06Å; Q98-D327 PolarHBondContact NE2-OD2 2.9Å
99	C	96	Very high	96.8	Very high	12 Å²	12	51.5 Å²	51.5	8%	0.081	24%	0.237	C	C	.	.			trans	-80.4	-9.4	-179.8	75.6	0	0	0	0	114.8	E101 C102 C105 C113 R115 I157	C99-E101 PolarHBondContact O-N 2.94Å; C99-C102 PolarHBondContact SG-N 3.21Å; C99-C102 VanDerWaalsContact SG-N 3.39Å; C99-C105 PolarHBondContact N-SG 3.06Å; C99-C105 VanDerWaalsContact N-SG 3.42Å; C99-C113 VanDerWaalsContact SG-SG 3.6Å; C99-R115 HydrophobicContact CB-CB 4.43Å; C99-I157 HydrophobicContact CB-CB 4.28Å; C99-I157 HydrophobicContact CB-CD1 4.34Å; C99-I157 HydrophobicContact CB-CG2 3.88Å
100	K	95.9	Very high	96.6	Very high	96 Å²	96	52.8 Å²	52.8	42%	0.417	25%	0.245	S	C	.	.	S	Bend	trans	61.6	-9.1	-177.4	-60.4	-175.2	172.4	-176.9	0	116.3	Q98 C105 D327	Q98-K100 VanDerWaalsContact C-N 3.33Å; Q98-K100 HydrophobicContact CG-CG 4.1Å; Q98-K100 PolarHBondContact O-N 3.01Å; K100-C105 PolarHBondContact N-SG 3.43Å; K100-D327 WeakPolarHBondContact CE-OD1 3.43Å; K100-D327 IonicContact NZ-OD1 2.74Å; K100-D327 PolarHBondContact NZ-OD1 2.9Å
101	E	96.1	Very high	96.5	Very high	110 Å²	110	52 Å²	52	51%	0.514	24%	0.243	S	C	.	.	S	Bend	trans	-105.7	-33.3	-173.7	-68.2	178.3	177.1	0	0	115	C99 K106 R115	C99-E101 PolarHBondContact O-N 2.94Å; E101-K106 WeakPolarHBondContact O-CD 3.38Å; E101-K106 WeakPolarHBondContact O-CE 3.38Å; E101-K106 PolarHBondContact O-NZ 2.79Å; E101-R115 IonicContact OE2-CZ 2.84Å; E101-R115 IonicContact OE2-NH1 2.74Å; E101-R115 PolarHBondContact OE2-NH1 3.2Å; E101-R115 IonicContact OE2-NH2 3.22Å; E101-R115 PolarHBondContact OE2-NH2 3.32Å
102	C	97.1	Very high	96.4	Very high	11 Å²	11	54.4 Å²	54.4	7%	0.074	25%	0.254	C	S	.	.	S	Bend	trans	-70.5	163.8	-175.9	72.3	0	0	0	0	112.5	C99 F104 C105 K106 E114	C99-C102 PolarHBondContact SG-N 3.21Å; C99-C102 VanDerWaalsContact SG-N 3.39Å; C102-F104 PolarHBondContact O-N 2.87Å; C102-C105 PolarHBondContact O-N 3.07Å; C102-C105 VanDerWaalsContact O-N 3.14Å; C102-C105 PolarHBondContact SG-N 2.78Å; C102-K106 PolarHBondContact O-N 3.26Å; C102-E114 HydrophobicContact CB-CB 3.9Å; C102-E114 PolarHBondContact SG-N 3.43Å
103	R	96.8	Very high	96.3	Very high	164 Å²	164	54.4 Å²	54.4	62%	0.619	25%	0.254	S	S	*	.	H	α-helix	trans	-58.5	-35.3	-178.5	68.6	-173.9	170.1	174.8	-1.4	112.7	S107 E114	R103-S107 WeakPolarHBondContact O-CB 3.48Å; R103-S107 PolarHBondContact O-N 3.07Å; R103-S107 VanDerWaalsContact O-N 3.08Å; R103-E114 IonicContact CZ-OE1 2.89Å; R103-E114 IonicContact NE-OE1 3.67Å; R103-E114 PolarHBondContact NE-OE1 2.8Å; R103-E114 IonicContact NE-OE2 3.66Å; R103-E114 IonicContact NH2-OE1 3.76Å; R103-E114 PolarHBondContact NH2-OE1 3.2Å
104	F	97.4	Very high	96.1	Very high	48 Å²	48	57.3 Å²	57.3	21%	0.211	27%	0.267	C	S	.	.	H	α-helix	trans	-74.9	-38.5	178.1	-62.7	-18.6	0	0	0	112.4	C102 K106 S107 T110 Q112 E114 W117 K324	C102-F104 PolarHBondContact O-N 2.87Å; F104-K106 VanDerWaalsContact C-N 3.31Å; F104-K106 PolarHBondContact O-N 3.08Å; F104-S107 PolarHBondContact O-N 3.22Å; F104-T110 HydrophobicContact CB-CG2 3.83Å; F104-T110 HydrophobicContact CD1-CG2 4.39Å; F104-T110 HydrophobicContact CG-CG2 4.18Å; F104-Q112 WeakPolarHBondContact CB-O 3.45Å; F104-Q112 WeakPolarHBondContact CD2-O 3.31Å; F104-Q112 WeakPolarHBondContact CG-O 3.38Å; F104-E114 HydrophobicContact CD2-CB 3.66Å; F104-E114 HydrophobicContact CD2-CG 4.42Å; F104-E114 HydrophobicContact CE2-CB 4.11Å; F104-E114 HydrophobicContact CE2-CG 4.4Å; F104-E114 HydrophobicContact CG-CB 4.27Å; F104-W117 AromaticContact CE2-CH2 3.86Å; F104-W117 HydrophobicContact CE2-CH2 3.86Å; F104-W117 HydrophobicContact CE2-CZ2 4.17Å; F104-W117 HydrophobicContact CE2-CZ3 4.17Å; F104-K324 PolarHBondContact O-NZ 2.83Å
105	C	97.4	Very high	95.8	Very high	13 Å²	13	62.7 Å²	62.7	9%	0.088	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-39.7	173.9	-81.2	0	0	0	0	111.9	C99 K100 C102 K324	C99-C105 PolarHBondContact N-SG 3.06Å; C99-C105 VanDerWaalsContact N-SG 3.42Å; K100-C105 PolarHBondContact N-SG 3.43Å; C102-C105 PolarHBondContact O-N 3.07Å; C102-C105 VanDerWaalsContact O-N 3.14Å; C102-C105 PolarHBondContact SG-N 2.78Å; C105-K324 PolarHBondContact O-NZ 3Å
106	K	97.5	Very high	95.5	Very high	155 Å²	155	61.8 Å²	61.8	67%	0.674	29%	0.285	S	S	*	.	H	α-helix	trans	-75.3	-21.4	177.8	-70	173.1	172.8	161.5	0	114.2	E101 C102 F104	E101-K106 WeakPolarHBondContact O-CD 3.38Å; E101-K106 WeakPolarHBondContact O-CE 3.38Å; E101-K106 PolarHBondContact O-NZ 2.79Å; C102-K106 PolarHBondContact O-N 3.26Å; F104-K106 VanDerWaalsContact C-N 3.31Å; F104-K106 PolarHBondContact O-N 3.08Å
107	S	97.3	Very high	94.9	Very high	18 Å²	18	68 Å²	68	13%	0.126	31%	0.308	C	S	.	.			trans	-80.3	136.1	178.7	175.5	0	0	0	0	111.3	R103 F104 R109 K324	R103-S107 WeakPolarHBondContact O-CB 3.48Å; R103-S107 PolarHBondContact O-N 3.07Å; R103-S107 VanDerWaalsContact O-N 3.08Å; F104-S107 PolarHBondContact O-N 3.22Å; S107-R109 PolarHBondContact O-N 2.92Å; S107-R109 WeakPolarHBondContact OG-CB 3.4Å; S107-R109 PolarHBondContact OG-N 2.79Å; S107-R109 PolarHBondContact OG-NE 3.34Å; S107-K324 WeakPolarHBondContact O-CE 3.36Å; S107-K324 PolarHBondContact O-NZ 3.37Å
108	P	95.3	Very high	94.4	Very high	127 Å²	127	73 Å²	73	83%	0.825	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-8	172.8	31.7	-35.7	0	0	0	113.2
109	R	95.2	Very high	93.8	Very high	224 Å²	224	77.5 Å²	77.5	85%	0.845	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-11.7	-171.3	-61.8	179.6	-72.7	176.5	-1.9	115.2	S107	S107-R109 PolarHBondContact O-N 2.92Å; S107-R109 WeakPolarHBondContact OG-CB 3.4Å; S107-R109 PolarHBondContact OG-N 2.79Å; S107-R109 PolarHBondContact OG-NE 3.34Å
110	T	96.1	Very high	93.3	Very high	44 Å²	44	77.9 Å²	77.9	27%	0.27	36%	0.356	S	S	.	.			trans	-156.7	153.2	-173.9	-176.1	0	0	0	0	111.3	F104 Q112 K324	F104-T110 HydrophobicContact CB-CG2 3.83Å; F104-T110 HydrophobicContact CD1-CG2 4.39Å; F104-T110 HydrophobicContact CG-CG2 4.18Å; T110-Q112 WeakPolarHBondContact OG1-CB 3.39Å; T110-Q112 PolarHBondContact OG1-N 2.82Å; T110-K324 WeakPolarHBondContact O-CE 3.46Å; T110-K324 PolarHBondContact O-NZ 3.39Å
111	N	96.7	Very high	92.9	Very high	15 Å²	15	77.2 Å²	77.2	8%	0.08	35%	0.351	C	S	.	.			trans	-100.6	-1.6	167.5	63.3	-20	0	0	0	114.1	L96 C113 M319 F323	L96-N111 HydrophobicContact CD2-CB 4.19Å; L96-N111 WeakPolarHBondContact CD2-ND2 3.33Å; N111-C113 PolarHBondContact O-N 2.64Å; N111-C113 VanDerWaalsContact O-N 3.1Å; N111-M319 PolarHBondContact ND2-O 3.24Å; N111-F323 WeakPolarHBondContact CB-O 3.28Å; N111-F323 PolarHBondContact ND2-O 2.92Å
112	Q	95.7	Very high	92.4	Very high	50 Å²	50	76.8 Å²	76.8	23%	0.234	35%	0.349	C	S	.	.			trans	-72.2	101.6	-177.9	-69	-70.1	-11.2	0	0	111.2	F104 T110 E114 W117 M319	F104-Q112 WeakPolarHBondContact CB-O 3.45Å; F104-Q112 WeakPolarHBondContact CD2-O 3.31Å; F104-Q112 WeakPolarHBondContact CG-O 3.38Å; T110-Q112 WeakPolarHBondContact OG1-CB 3.39Å; T110-Q112 PolarHBondContact OG1-N 2.82Å; Q112-E114 PolarHBondContact O-N 3.29Å; Q112-W117 HydrophobicContact CB-CZ2 4.38Å; Q112-M319 VanDerWaalsContact NE2-CB 3.34Å
113	C	96.3	Very high	91.8	Very high	0 Å²	0	81.9 Å²	81.9	0%	0	37%	0.372	C	S	.	.			trans	-69.4	122.8	178	175.1	0	0	0	0	111.2	C97 C99 N111 R115 A116	C97-C113 HydrophobicContact CB-CB 4.17Å; C97-C113 WeakPolarHBondContact O-CB 3.44Å; C99-C113 VanDerWaalsContact SG-SG 3.6Å; N111-C113 PolarHBondContact O-N 2.64Å; N111-C113 VanDerWaalsContact O-N 3.1Å; C113-R115 VanDerWaalsContact C-N 3.3Å; C113-R115 PolarHBondContact O-N 2.85Å; C113-A116 HydrophobicContact CB-CB 4.06Å; C113-A116 WeakPolarHBondContact O-CB 3.48Å; C113-A116 PolarHBondContact O-N 2.66Å
114	E	94.1	Very high	91.4	Very high	60 Å²	60	74.5 Å²	74.5	28%	0.28	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-59.6	-38.8	179.8	-177.4	169.9	-131.7	0	0	112.8	C102 R103 F104 Q112 A116 W117	C102-E114 HydrophobicContact CB-CB 3.9Å; C102-E114 PolarHBondContact SG-N 3.43Å; R103-E114 IonicContact CZ-OE1 2.89Å; R103-E114 IonicContact NE-OE1 3.67Å; R103-E114 PolarHBondContact NE-OE1 2.8Å; R103-E114 IonicContact NE-OE2 3.66Å; R103-E114 IonicContact NH2-OE1 3.76Å; R103-E114 PolarHBondContact NH2-OE1 3.2Å; F104-E114 HydrophobicContact CD2-CB 3.66Å; F104-E114 HydrophobicContact CD2-CG 4.42Å; F104-E114 HydrophobicContact CE2-CB 4.11Å; F104-E114 HydrophobicContact CE2-CG 4.4Å; F104-E114 HydrophobicContact CG-CB 4.27Å; Q112-E114 PolarHBondContact O-N 3.29Å; E114-A116 PolarHBondContact O-N 2.75Å; E114-W117 PolarHBondContact O-N 2.98Å
115	R	91.6	Very high	90.9	Very high	114 Å²	114	73.1 Å²	73.1	43%	0.43	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-69.7	-13.5	177.3	-67.5	-168.4	-178.2	158.7	3.7	113.4	C99 E101 C113 I157	C99-R115 HydrophobicContact CB-CB 4.43Å; E101-R115 IonicContact OE2-CZ 2.84Å; E101-R115 IonicContact OE2-NH1 2.74Å; E101-R115 PolarHBondContact OE2-NH1 3.2Å; E101-R115 IonicContact OE2-NH2 3.22Å; E101-R115 PolarHBondContact OE2-NH2 3.32Å; C113-R115 VanDerWaalsContact C-N 3.3Å; C113-R115 PolarHBondContact O-N 2.85Å; R115-I157 HydrophobicContact CB-CD1 4.42Å
116	A	86	Confident	90.6	Very high	8 Å²	8	72.5 Å²	72.5	7%	0.066	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-75.1	-34.9	178.4	0	0	0	0	0	111.5	C97 C113 E114 T118 R119 I120	C97-A116 HydrophobicContact CB-CB 3.66Å; C113-A116 HydrophobicContact CB-CB 4.06Å; C113-A116 WeakPolarHBondContact O-CB 3.48Å; C113-A116 PolarHBondContact O-N 2.66Å; E114-A116 PolarHBondContact O-N 2.75Å; A116-T118 PolarHBondContact O-N 3.1Å; A116-R119 WeakPolarHBondContact O-CB 3.08Å; A116-R119 PolarHBondContact O-N 3.03Å; A116-I120 PolarHBondContact O-N 3.06Å
117	W	83.2	Confident	90	Very high	143 Å²	143	65.3 Å²	65.3	54%	0.542	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.2	-172.9	-66.3	-2.8	0	0	0	113.1	F104 Q112 E114 R119	F104-W117 AromaticContact CE2-CH2 3.86Å; F104-W117 HydrophobicContact CE2-CH2 3.86Å; F104-W117 HydrophobicContact CE2-CZ2 4.17Å; F104-W117 HydrophobicContact CE2-CZ3 4.17Å; Q112-W117 HydrophobicContact CB-CZ2 4.38Å; E114-W117 PolarHBondContact O-N 2.98Å; W117-R119 VanDerWaalsContact C-N 3.32Å
118	T	83.2	Confident	89.5	Confident	111 Å²	111	67.7 Å²	67.7	68%	0.681	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	0.5	175.9	65.5	0	0	0	0	113.5	A116	A116-T118 PolarHBondContact O-N 3.1Å
119	R	83.9	Confident	89.2	Confident	104 Å²	104	66.6 Å²	66.6	39%	0.392	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-20.8	-175	-68.4	-175.7	174.7	-80.3	-0.1	113.6	A116 W117 V128 N155	A116-R119 WeakPolarHBondContact O-CB 3.08Å; A116-R119 PolarHBondContact O-N 3.03Å; W117-R119 VanDerWaalsContact C-N 3.32Å; R119-V128 WeakPolarHBondContact O-CG2 3.08Å; R119-V128 PolarHBondContact O-N 3.41Å; R119-N155 PolarHBondContact NH1-ND2 2.89Å
120	I	86.9	Confident	89.2	Confident	20 Å²	20	56.8 Å²	56.8	10%	0.103	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.1	179.1	-55.7	-60	0	0	0	108.5	A116 Q122	A116-I120 PolarHBondContact O-N 3.06Å; I120-Q122 PolarHBondContact O-N 2.55Å
121	R	86.7	Confident	89.3	Confident	83 Å²	83	55.6 Å²	55.6	31%	0.313	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	98.1	164.4	-71.8	-169.3	-65.9	174.8	11.7	107.6	E123 I124 M125 A126 V128 H140	R121-E123 VanDerWaalsContact C-N 3.29Å; R121-E123 WeakPolarHBondContact CA-OE2 3.36Å; R121-E123 VanDerWaalsContact CB-OE1 3.28Å; R121-E123 WeakPolarHBondContact CB-OE1 3.45Å; R121-E123 PolarHBondContact O-N 2.97Å; R121-I124 HydrophobicContact CB-CD1 4.16Å; R121-I124 HydrophobicContact CB-CG1 3.67Å; R121-I124 PolarHBondContact O-N 3.24Å; R121-M125 WeakPolarHBondContact O-CA 3.49Å; R121-M125 PolarHBondContact O-N 2.98Å; R121-A126 PolarHBondContact N-O 3.2Å; R121-A126 PolarHBondContact O-N 3.38Å; R121-A126 VanDerWaalsContact O-N 3.11Å; R121-V128 HydrophobicContact CG-CG2 4.03Å; R121-H140 PolarHBondContact NH2-CE1 3.34Å; R121-H140 PolarHBondContact NH2-ND1 3.16Å
122	Q	85.3	Confident	89.4	Confident	101 Å²	101	55 Å²	55	47%	0.472	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-63.4	-39.4	-172.6	-65.5	-67	-34	0	0	111.1	I120 I124 M125	I120-Q122 PolarHBondContact O-N 2.55Å; Q122-I124 PolarHBondContact O-N 3.39Å; Q122-I124 VanDerWaalsContact O-N 3.13Å; Q122-M125 PolarHBondContact O-N 3.34Å; Q122-M125 VanDerWaalsContact O-N 3.09Å
123	E	85.1	Confident	89.6	Confident	118 Å²	118	54.9 Å²	54.9	55%	0.551	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23.6	-178	69.1	-75.5	-179.4	0	0	114.1	R121	R121-E123 VanDerWaalsContact C-N 3.29Å; R121-E123 WeakPolarHBondContact CA-OE2 3.36Å; R121-E123 VanDerWaalsContact CB-OE1 3.28Å; R121-E123 WeakPolarHBondContact CB-OE1 3.45Å; R121-E123 PolarHBondContact O-N 2.97Å
124	I	88.4	Confident	89.7	Confident	9 Å²	9	55.1 Å²	55.1	5%	0.046	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-127.1	12.7	176.6	58.9	168.6	0	0	0	112.6	H53 T59 D61 R121 Q122 A126	H53-I124 PolarHBondContact CE1-O 3.28Å; H53-I124 VanDerWaalsContact CE1-O 3.25Å; T59-I124 HydrophobicContact CG2-CG2 3.69Å; D61-I124 HydrophobicContact CB-CG2 3.9Å; R121-I124 HydrophobicContact CB-CD1 4.16Å; R121-I124 HydrophobicContact CB-CG1 3.67Å; R121-I124 PolarHBondContact O-N 3.24Å; Q122-I124 PolarHBondContact O-N 3.39Å; Q122-I124 VanDerWaalsContact O-N 3.13Å; I124-A126 HydrophobicContact CD1-CB 4.06Å; I124-A126 HydrophobicContact CG1-CB 4.01Å; I124-A126 PolarHBondContact O-N 2.93Å
125	M	88.1	Confident	89.8	Confident	18 Å²	18	58.9 Å²	58.9	9%	0.089	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	37.5	179.4	-54.6	-176.4	74.2	0	0	114.3	Y52 H53 R121 Q122 F142 M143	Y52-M125 HydrophobicContact CD1-SD 4.13Å; H53-M125 HydrophobicContact CB-SD 4.05Å; R121-M125 WeakPolarHBondContact O-CA 3.49Å; R121-M125 PolarHBondContact O-N 2.98Å; Q122-M125 PolarHBondContact O-N 3.34Å; Q122-M125 VanDerWaalsContact O-N 3.09Å; M125-F142 HydrophobicContact CB-CD2 3.98Å; M125-F142 HydrophobicContact CB-CE2 3.57Å; M125-F142 HydrophobicContact CE-CE2 3.78Å; M125-F142 HydrophobicContact CE-CZ 3.67Å; M125-F142 HydrophobicContact CG-CE2 4.37Å; M125-F142 CarbonylContact O-C 3.56Å; M125-F142 WeakPolarHBondContact O-CA 3.48Å; M125-F142 WeakPolarHBondContact O-CD2 3.46Å; M125-F142 HydrophobicContact SD-CE2 3.93Å; M125-F142 HydrophobicContact SD-CZ 4.34Å; M125-M143 HydrophobicContact CB-CG 4.45Å; M125-M143 HydrophobicContact CE-CE 4.26Å; M125-M143 HydrophobicContact CE-CG 4.16Å; M125-M143 HydrophobicContact CE-SD 3.92Å; M125-M143 PolarHBondContact O-N 2.62Å
126	A	89.6	Confident	90.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	147	-173.9	0	0	0	0	0	112.5	R121 I124 H140	R121-A126 PolarHBondContact N-O 3.2Å; R121-A126 PolarHBondContact O-N 3.38Å; R121-A126 VanDerWaalsContact O-N 3.11Å; I124-A126 HydrophobicContact CD1-CB 4.06Å; I124-A126 HydrophobicContact CG1-CB 4.01Å; I124-A126 PolarHBondContact O-N 2.93Å; A126-H140 HydrophobicContact CB-CB 4.11Å
127	G	85.3	Confident	90.6	Very high	5 Å²	5	62.9 Å²	62.9	5%	0.052	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	141.4	166.7	0	0	0	0	0	111.8	E129 Q141	G127-E129 CarbonylContact C-O 3.56Å; G127-E129 PolarHBondContact O-N 2.89Å; G127-Q141 PolarHBondContact N-O 3.45Å
128	V	86.1	Confident	91.3	Very high	68 Å²	68	62 Å²	62	41%	0.412	31%	0.312	S	S	.	.	S	Bend	trans	-60.9	-39.5	173.7	170.1	0	0	0	0	110.4	R119 R121 R138	R119-V128 WeakPolarHBondContact O-CG2 3.08Å; R119-V128 PolarHBondContact O-N 3.41Å; R121-V128 HydrophobicContact CG-CG2 4.03Å; V128-R138 PolarHBondContact O-NH2 3.32Å
129	E	90.4	Very high	92	Very high	104 Å²	104	56.8 Å²	56.8	49%	0.486	28%	0.28	S	S	.	.	S	Bend	trans	-104.8	160.2	171.9	-63.2	-168.2	-179.5	0	0	110.9	G127 R131 R138	G127-E129 CarbonylContact C-O 3.56Å; G127-E129 PolarHBondContact O-N 2.89Å; E129-R131 IonicContact OE2-CZ 2.72Å; E129-R131 VanDerWaalsContact OE2-CZ 3.31Å; E129-R131 IonicContact OE2-NH1 3.07Å; E129-R131 PolarHBondContact OE2-NH1 2.64Å; E129-R131 IonicContact OE2-NH2 3.37Å; E129-R131 PolarHBondContact OE2-NH2 2.84Å; E129-R138 VanDerWaalsContact C-NH2 3.33Å; E129-R138 VanDerWaalsContact CA-NH2 3.35Å
130	S	95.3	Very high	92.7	Very high	18 Å²	18	53 Å²	53	13%	0.126	27%	0.266	C	S	.	.			trans	-137.8	152.4	168.9	177.7	0	0	0	0	109.8	F132 I139	S130-F132 PolarHBondContact OG-N 2.89Å; S130-I139 WeakPolarHBondContact CB-O 3.07Å; S130-I139 PolarHBondContact OG-O 2.76Å
131	R	98.2	Very high	93.2	Very high	19 Å²	19	52.4 Å²	52.4	7%	0.072	26%	0.263	C	S	.	.			trans	-110	7.9	171	-60.9	-65.6	178.3	-97.3	-1.3	112.7	V29 A30 Q33 E36 E129 V153	V29-R131 WeakPolarHBondContact CA-O 3.41Å; A30-R131 HydrophobicContact CB-CB 4.11Å; A30-R131 PolarHBondContact N-O 2.86Å; Q33-R131 VanDerWaalsContact CD-CZ 3.49Å; Q33-R131 VanDerWaalsContact OE1-NH2 3.1Å; E36-R131 IonicContact OE1-CZ 2.74Å; E36-R131 IonicContact OE1-NE 3.31Å; E36-R131 IonicContact OE1-NH2 3.87Å; E36-R131 PolarHBondContact OE1-NH2 3.01Å; E36-R131 IonicContact OE2-CZ 3.16Å; E36-R131 IonicContact OE2-NE 3.33Å; E36-R131 PolarHBondContact OE2-NE 3.44Å; E36-R131 IonicContact OE2-NH2 2.94Å; E36-R131 PolarHBondContact OE2-NH2 3.22Å; E36-R131 VanDerWaalsContact OE2-NH2 3.07Å; E129-R131 IonicContact OE2-CZ 2.72Å; E129-R131 VanDerWaalsContact OE2-CZ 3.31Å; E129-R131 IonicContact OE2-NH1 3.07Å; E129-R131 PolarHBondContact OE2-NH1 2.64Å; E129-R131 IonicContact OE2-NH2 3.37Å; E129-R131 PolarHBondContact OE2-NH2 2.84Å; R131-V153 HydrophobicContact CB-CB 3.87Å; R131-V153 HydrophobicContact CB-CG1 4.49Å; R131-V153 HydrophobicContact CB-CG2 3.94Å; R131-V153 HydrophobicContact CG-CB 3.68Å; R131-V153 HydrophobicContact CG-CG1 3.78Å; R131-V153 HydrophobicContact CG-CG2 4.11Å
132	F	98.6	Very high	93.6	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132	-177.2	-63.4	-17.8	0	0	0	112.7	I27 E28 V29 V66 S130 I139 Q141 S146 Y151	I27-F132 HydrophobicContact CD1-CB 4.48Å; I27-F132 HydrophobicContact CD1-CD1 3.93Å; I27-F132 HydrophobicContact CD1-CD2 4.25Å; I27-F132 HydrophobicContact CD1-CE1 4.14Å; I27-F132 HydrophobicContact CD1-CE2 4.41Å; I27-F132 HydrophobicContact CD1-CG 4Å; I27-F132 HydrophobicContact CD1-CZ 4.37Å; E28-F132 WeakPolarHBondContact O-CA 3.41Å; V29-F132 HydrophobicContact CB-CD1 4.34Å; V29-F132 HydrophobicContact CB-CE1 4.3Å; V29-F132 HydrophobicContact CG1-CD1 4.12Å; V29-F132 HydrophobicContact CG1-CE1 3.81Å; V29-F132 HydrophobicContact CG2-CD1 3.8Å; V29-F132 HydrophobicContact CG2-CE1 3.67Å; V66-F132 HydrophobicContact CB-CD2 4.09Å; V66-F132 HydrophobicContact CB-CE2 3.89Å; V66-F132 HydrophobicContact CG1-CE2 4.2Å; V66-F132 HydrophobicContact CG2-CD2 3.89Å; V66-F132 HydrophobicContact CG2-CE2 4.03Å; S130-F132 PolarHBondContact OG-N 2.89Å; F132-I139 HydrophobicContact CB-CB 3.93Å; F132-I139 PolarHBondContact O-N 3.26Å; F132-Q141 HydrophobicContact CD2-CG 3.65Å; F132-Q141 HydrophobicContact CE2-CG 3.73Å; F132-Q141 HydrophobicContact CG-CG 4.18Å; F132-Q141 HydrophobicContact CZ-CG 4.31Å; F132-S146 VanDerWaalsContact CE2-CB 3.5Å; F132-Y151 WeakPolarHBondContact CE1-O 2.99Å; F132-Y151 WeakPolarHBondContact CZ-O 3.41Å
133	T	98.7	Very high	94	Very high	49 Å²	49	45.1 Å²	45.1	30%	0.301	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.1	169.3	-56.4	0	0	0	0	109	E28 K137	E28-T133 PolarHBondContact N-O 2.83Å; E28-T133 PolarHBondContact O-N 3.47Å; T133-K137 CarbonylContact C-O 3.5Å; T133-K137 VanDerWaalsContact CA-O 3.29Å; T133-K137 WeakPolarHBondContact CA-O 3.47Å; T133-K137 WeakPolarHBondContact CG2-O 3.04Å
134	C	98.6	Very high	94.4	Very high	4 Å²	4	40.3 Å²	40.3	3%	0.027	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.8	170.3	-173.8	0	0	0	0	108.8	W16 E26 I27 G136 K137 I139	W16-C134 HydrophobicContact CH2-CB 4.27Å; E26-C134 PolarHBondContact O-SG 2.9Å; E26-C134 VanDerWaalsContact O-SG 3.38Å; I27-C134 HydrophobicContact CB-CB 4.45Å; I27-C134 HydrophobicContact CG2-CB 3.87Å; C134-G136 PolarHBondContact O-N 3.05Å; C134-G136 VanDerWaalsContact O-N 3.17Å; C134-K137 PolarHBondContact N-O 3.33Å; C134-K137 WeakPolarHBondContact O-CB 3.21Å; C134-K137 PolarHBondContact O-N 3.35Å; C134-I139 HydrophobicContact CB-CD1 3.82Å; C134-I139 HydrophobicContact CB-CG1 3.64Å
135	K	97.6	Very high	94.8	Very high	140 Å²	140	39.9 Å²	39.9	61%	0.609	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	39.9	-179.3	-59.3	171.6	-173.9	167.2	0	112.9	W16 E25 K137	W16-K135 HydrophobicContact CH2-CD 4.11Å; W16-K135 HydrophobicContact CZ2-CD 3.98Å; E25-K135 IonicContact OE1-NZ 2.68Å; E25-K135 PolarHBondContact OE1-NZ 3.33Å; E25-K135 WeakPolarHBondContact OE2-CE 3.48Å; E25-K135 IonicContact OE2-NZ 2.72Å; E25-K135 PolarHBondContact OE2-NZ 3.24Å; K135-K137 PolarHBondContact O-N 3.04Å
136	G	96.6	Very high	95.3	Very high	76 Å²	76	39 Å²	39	78%	0.784	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	3.2	-178.2	0	0	0	0	0	115.4	C134	C134-G136 PolarHBondContact O-N 3.05Å; C134-G136 VanDerWaalsContact O-N 3.17Å
137	K	97.1	Very high	95.7	Very high	129 Å²	129	39 Å²	39	56%	0.561	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	141	177.4	-62.7	-178.3	178.8	-176.4	0	110.5	W16 T133 C134 K135	W16-K137 HydrophobicContact CZ3-CD 4.16Å; T133-K137 CarbonylContact C-O 3.5Å; T133-K137 VanDerWaalsContact CA-O 3.29Å; T133-K137 WeakPolarHBondContact CA-O 3.47Å; T133-K137 WeakPolarHBondContact CG2-O 3.04Å; C134-K137 PolarHBondContact N-O 3.33Å; C134-K137 WeakPolarHBondContact O-CB 3.21Å; C134-K137 PolarHBondContact O-N 3.35Å; K135-K137 PolarHBondContact O-N 3.04Å
138	R	96.9	Very high	96.3	Very high	126 Å²	126	38.9 Å²	38.9	48%	0.475	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	132.8	168.1	179.5	178.9	174.4	-175.1	-3.5	109	V128 E129	V128-R138 PolarHBondContact O-NH2 3.32Å; E129-R138 VanDerWaalsContact C-NH2 3.33Å; E129-R138 VanDerWaalsContact CA-NH2 3.35Å
139	I	98.3	Very high	96.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.9	175.1	-49.8	-57.5	0	0	0	108.5	V14 W16 P64 V66 S130 F132 C134	V14-I139 HydrophobicContact CG1-CD1 4.4Å; V14-I139 HydrophobicContact CG1-CG2 4.29Å; W16-I139 HydrophobicContact CH2-CD1 4.14Å; W16-I139 HydrophobicContact CZ3-CD1 4.11Å; P64-I139 HydrophobicContact CB-CD1 3.86Å; P64-I139 HydrophobicContact CG-CD1 3.51Å; V66-I139 HydrophobicContact CG2-CG2 3.93Å; S130-I139 WeakPolarHBondContact CB-O 3.07Å; S130-I139 PolarHBondContact OG-O 2.76Å; F132-I139 HydrophobicContact CB-CB 3.93Å; F132-I139 PolarHBondContact O-N 3.26Å; C134-I139 HydrophobicContact CB-CD1 3.82Å; C134-I139 HydrophobicContact CB-CG1 3.64Å
140	H	98	Very high	97.3	Very high	24 Å²	24	32.1 Å²	32.1	11%	0.111	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	147.6	178	-71.3	-59.8	0	0	0	112	G62 P64 T65 V66 R121 A126	G62-H140 PolarHBondContact O-CD2 3.08Å; P64-H140 WeakPolarHBondContact O-CB 3.29Å; P64-H140 PolarHBondContact O-CD2 3.02Å; P64-H140 PolarHBondContact O-N 3.3Å; T65-H140 PolarHBondContact OG1-O 2.85Å; V66-H140 PolarHBondContact N-O 3.47Å; V66-H140 VanDerWaalsContact N-O 3.12Å; R121-H140 PolarHBondContact NH2-CE1 3.34Å; R121-H140 PolarHBondContact NH2-ND1 3.16Å; A126-H140 HydrophobicContact CB-CB 4.11Å
141	Q	97.1	Very high	97.5	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.042	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	106.5	168.7	-76.1	-177.6	-96.9	0	0	110	G127 F132 M143 G144 S146 T152 V153	G127-Q141 PolarHBondContact N-O 3.45Å; F132-Q141 HydrophobicContact CD2-CG 3.65Å; F132-Q141 HydrophobicContact CE2-CG 3.73Å; F132-Q141 HydrophobicContact CG-CG 4.18Å; F132-Q141 HydrophobicContact CZ-CG 4.31Å; Q141-M143 PolarHBondContact O-N 3.1Å; Q141-G144 PolarHBondContact O-N 3.11Å; Q141-S146 VanDerWaalsContact C-OG 3.28Å; Q141-S146 WeakPolarHBondContact CA-OG 3.49Å; Q141-T152 PolarHBondContact NE2-OG1 2.8Å; Q141-V153 PolarHBondContact NE2-O 3.07Å
142	F	96.9	Very high	97.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-58.5	124.1	178	-177.5	-112.6	0	0	0	112	D50 H53 V66 L67 H69 M125 G144 T145 S146	D50-F142 WeakPolarHBondContact OD1-CE1 3.19Å; H53-F142 HydrophobicContact CB-CD2 4.49Å; H53-F142 HydrophobicContact CB-CE2 3.65Å; H53-F142 HydrophobicContact CB-CZ 4.19Å; H53-F142 AromaticContact CG-CE2 3.67Å; V66-F142 WeakPolarHBondContact O-CB 3.34Å; V66-F142 PolarHBondContact O-N 3.42Å; L67-F142 HydrophobicContact CD2-CB 4.27Å; L67-F142 HydrophobicContact CD2-CD1 4.46Å; L67-F142 HydrophobicContact CD2-CD2 4Å; L67-F142 HydrophobicContact CD2-CE2 4.46Å; L67-F142 HydrophobicContact CD2-CG 3.99Å; H69-F142 HydrophobicContact CB-CD1 4.35Å; H69-F142 HydrophobicContact CB-CE1 4.27Å; H69-F142 AromaticContact ND1-CE1 3.59Å; M125-F142 HydrophobicContact CB-CD2 3.98Å; M125-F142 HydrophobicContact CB-CE2 3.57Å; M125-F142 HydrophobicContact CE-CE2 3.78Å; M125-F142 HydrophobicContact CE-CZ 3.67Å; M125-F142 HydrophobicContact CG-CE2 4.37Å; M125-F142 CarbonylContact O-C 3.56Å; M125-F142 WeakPolarHBondContact O-CA 3.48Å; M125-F142 WeakPolarHBondContact O-CD2 3.46Å; M125-F142 HydrophobicContact SD-CE2 3.93Å; M125-F142 HydrophobicContact SD-CZ 4.34Å; F142-G144 PolarHBondContact O-N 2.99Å; F142-T145 PolarHBondContact O-N 2.98Å; F142-T145 PolarHBondContact O-OG1 2.84Å; F142-T145 VanDerWaalsContact O-OG1 3.07Å; F142-S146 PolarHBondContact N-OG 2.98Å; F142-S146 PolarHBondContact O-N 2.98Å
143	M	93.5	Very high	97.5	Very high	30 Å²	30	32.4 Å²	32.4	15%	0.148	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	23.4	-176.7	-54.5	179.2	81.9	0	0	114.3	H69 F95 M125 Q141 T145	H69-M143 HydrophobicContact CB-SD 4.02Å; F95-M143 HydrophobicContact CB-CB 4Å; F95-M143 HydrophobicContact CB-CE 3.77Å; F95-M143 HydrophobicContact CB-SD 4.23Å; F95-M143 HydrophobicContact CD2-CE 3.37Å; F95-M143 HydrophobicContact CE2-CE 4.1Å; F95-M143 HydrophobicContact CG-CE 3.72Å; M125-M143 HydrophobicContact CB-CG 4.45Å; M125-M143 HydrophobicContact CE-CE 4.26Å; M125-M143 HydrophobicContact CE-CG 4.16Å; M125-M143 HydrophobicContact CE-SD 3.92Å; M125-M143 PolarHBondContact O-N 2.62Å; Q141-M143 PolarHBondContact O-N 3.1Å; M143-T145 VanDerWaalsContact C-N 3.26Å; M143-T145 PolarHBondContact O-N 3Å
144	G	92.3	Very high	97.4	Very high	18 Å²	18	30.2 Å²	30.2	19%	0.186	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	18.8	-175.4	0	0	0	0	0	115	Q141 F142	Q141-G144 PolarHBondContact O-N 3.11Å; F142-G144 PolarHBondContact O-N 2.99Å
145	T	96.8	Very high	97.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122	-58.5	-176.3	52.2	0	0	0	0	112.8	G68 H69 P93 F95 F142 M143 T152	G68-T145 PolarHBondContact O-OG1 3.2Å; H69-T145 VanDerWaalsContact CA-OG1 3.27Å; H69-T145 WeakPolarHBondContact CA-OG1 3.46Å; H69-T145 WeakPolarHBondContact CB-OG1 3.49Å; P93-T145 HydrophobicContact CB-CG2 3.99Å; F95-T145 HydrophobicContact CB-CG2 4.4Å; F142-T145 PolarHBondContact O-N 2.98Å; F142-T145 PolarHBondContact O-OG1 2.84Å; F142-T145 VanDerWaalsContact O-OG1 3.07Å; M143-T145 VanDerWaalsContact C-N 3.26Å; M143-T145 PolarHBondContact O-N 3Å; T145-T152 WeakPolarHBondContact O-CB 3.45Å; T145-T152 WeakPolarHBondContact O-CG2 3.46Å; T145-T152 PolarHBondContact O-OG1 3.06Å
146	S	98.4	Very high	97.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.141	C	C	.	.			trans	47.7	67.3	178.4	-66.7	0	0	0	0	115.5	V66 L67 G68 F132 Q141 F142	V66-S146 VanDerWaalsContact O-CB 3.28Å; V66-S146 WeakPolarHBondContact O-CB 3.11Å; V66-S146 PolarHBondContact O-OG 2.88Å; L67-S146 CarbonylContact O-C 3.57Å; L67-S146 WeakPolarHBondContact O-CA 2.98Å; G68-S146 CarbonylContact O-C 3.58Å; G68-S146 VanDerWaalsContact O-CA 3.25Å; G68-S146 WeakPolarHBondContact O-CA 3.35Å; G68-S146 PolarHBondContact O-N 3.3Å; G68-S146 VanDerWaalsContact O-N 3.11Å; F132-S146 VanDerWaalsContact CE2-CB 3.5Å; Q141-S146 VanDerWaalsContact C-OG 3.28Å; Q141-S146 WeakPolarHBondContact CA-OG 3.49Å; F142-S146 PolarHBondContact N-OG 2.98Å; F142-S146 PolarHBondContact O-N 2.98Å
147	T	98.8	Very high	97.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.108	C	C	.	.			trans	-86.7	-3.3	-174.7	61.6	0	0	0	0	113.9	I41 T44 L67 G68 H69 P93 S149	I41-T147 HydrophobicContact CD1-CG2 4.23Å; T44-T147 PolarHBondContact OG1-OG1 3.22Å; L67-T147 PolarHBondContact O-N 3.48Å; G68-T147 WeakPolarHBondContact CA-OG1 3.44Å; G68-T147 PolarHBondContact O-N 3.38Å; G68-T147 PolarHBondContact O-OG1 3.05Å; H69-T147 PolarHBondContact N-OG1 3Å; P93-T147 HydrophobicContact CB-CG2 4.02Å; P93-T147 HydrophobicContact CG-CG2 3.93Å; T147-S149 PolarHBondContact O-N 2.75Å
148	F	98.8	Very high	97.2	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.009	8%	0.084	C	C	.	.	S	Bend	trans	-80.2	40	169.3	-62.3	-4.4	0	0	0	112.2	A12 A13 T44 V46 V66 L67 G68 L353 V356 M373	A12-F148 CarbonylContact C-O 3.59Å; A12-F148 WeakPolarHBondContact CA-O 3.2Å; A13-F148 HydrophobicContact CB-CB 4.11Å; A13-F148 PolarHBondContact N-O 2.81Å; T44-F148 HydrophobicContact CG2-CD1 3.64Å; T44-F148 HydrophobicContact CG2-CE1 3.99Å; V46-F148 HydrophobicContact CB-CZ 4.44Å; V46-F148 HydrophobicContact CG2-CZ 3.93Å; V66-F148 HydrophobicContact CG1-CB 4.16Å; L67-F148 HydrophobicContact CB-CD2 3.64Å; L67-F148 HydrophobicContact CB-CE2 3.76Å; L67-F148 HydrophobicContact CB-CG 4.48Å; L67-F148 WeakPolarHBondContact O-CB 3.43Å; L67-F148 WeakPolarHBondContact O-CG 3.46Å; L67-F148 PolarHBondContact O-N 3.26Å; G68-F148 VanDerWaalsContact CA-CE1 3.45Å; F148-L353 HydrophobicContact CB-CD1 4.15Å; F148-V356 HydrophobicContact CD2-CG2 3.92Å; F148-V356 HydrophobicContact CE2-CG2 3.98Å; F148-M373 HydrophobicContact CD1-CE 3.7Å; F148-M373 HydrophobicContact CE1-CE 3.52Å; F148-M373 HydrophobicContact CE2-CE 4.44Å; F148-M373 HydrophobicContact CG-CE 4.27Å; F148-M373 HydrophobicContact CZ-CE 3.94Å
149	S	98.8	Very high	97.3	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.062	C	C	.	.	B	Isolated β-bridge	trans	-144.9	145.8	177.1	-179.5	0	0	0	0	110.2	R11 I41 T147 Y151	R11-S149 PolarHBondContact O-OG 3.01Å; I41-S149 VanDerWaalsContact CB-O 3.32Å; I41-S149 WeakPolarHBondContact CB-O 3.33Å; I41-S149 WeakPolarHBondContact CG1-O 3.4Å; T147-S149 PolarHBondContact O-N 2.75Å; S149-Y151 PolarHBondContact O-N 3.16Å; S149-Y151 PolarHBondContact OG-N 3.18Å; S149-Y151 PolarHBondContact OG-O 3.16Å; S149-Y151 VanDerWaalsContact OG-O 3.06Å
150	E	98.8	Very high	97.3	Very high	30 Å²	30	12 Å²	12	14%	0.14	6%	0.063	C	C	.	.	S	Bend	trans	-57.9	-31.4	175	-67.6	177.8	155.1	0	0	112.8	C10 R11 K40 I41 V375	C10-E150 HydrophobicContact CB-CB 3.93Å; C10-E150 WeakPolarHBondContact CB-OE2 3.43Å; R11-E150 HydrophobicContact CB-CG 4.29Å; R11-E150 IonicContact CZ-OE1 2.78Å; R11-E150 PolarHBondContact N-OE2 2.84Å; R11-E150 IonicContact NE-OE1 2.79Å; R11-E150 PolarHBondContact NE-OE1 2.99Å; R11-E150 IonicContact NH2-OE1 2.95Å; R11-E150 PolarHBondContact NH2-OE1 2.84Å; R11-E150 PolarHBondContact O-N 3.37Å; K40-E150 CarbonylContact C-O 3.57Å; K40-E150 WeakPolarHBondContact CA-O 3.47Å; I41-E150 PolarHBondContact N-O 3.21Å; E150-V375 HydrophobicContact CB-CG1 4.39Å; E150-V375 HydrophobicContact CG-CG1 4.04Å
151	Y	98.9	Very high	97.3	Very high	41 Å²	41	14.9 Å²	14.9	16%	0.161	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137.8	175	-68.3	-95.3	0	0	0	111.5	I8 C10 R38 I39 K40 E76 F132 S149	I8-Y151 HydrophobicContact CD1-CD1 3.76Å; I8-Y151 HydrophobicContact CD1-CD2 4.45Å; I8-Y151 HydrophobicContact CD1-CE1 3.8Å; I8-Y151 HydrophobicContact CD1-CE2 4.5Å; I8-Y151 HydrophobicContact CD1-CG 4.1Å; I8-Y151 HydrophobicContact CG2-CD2 3.77Å; I8-Y151 HydrophobicContact CG2-CE2 4.05Å; I8-Y151 HydrophobicContact CG2-CG 4.2Å; C10-Y151 HydrophobicContact CB-CD2 3.78Å; C10-Y151 HydrophobicContact CB-CE2 4.36Å; R38-Y151 HydrophobicContact CG-CD1 4.44Å; I39-Y151 WeakPolarHBondContact O-CA 3.44Å; K40-Y151 HydrophobicContact CB-CD1 3.99Å; K40-Y151 HydrophobicContact CB-CE1 3.54Å; K40-Y151 HydrophobicContact CD-CE1 4.42Å; K40-Y151 HydrophobicContact CG-CD1 4.48Å; K40-Y151 HydrophobicContact CG-CE1 3.83Å; K40-Y151 HydrophobicContact CG-CE2 4.37Å; E76-Y151 HydrophobicContact CB-CD1 4.43Å; E76-Y151 HydrophobicContact CB-CE1 4.05Å; E76-Y151 HydrophobicContact CG-CE1 3.96Å; F132-Y151 WeakPolarHBondContact CE1-O 2.99Å; F132-Y151 WeakPolarHBondContact CZ-O 3.41Å; S149-Y151 PolarHBondContact O-N 3.16Å; S149-Y151 PolarHBondContact OG-N 3.18Å; S149-Y151 PolarHBondContact OG-O 3.16Å; S149-Y151 VanDerWaalsContact OG-O 3.06Å
152	T	98.7	Very high	97.4	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155	172.2	-172.6	0	0	0	0	111	R38 I39 I41 Q141 T145 I154	R38-T152 CarbonylContact C-O 3.56Å; R38-T152 WeakPolarHBondContact CA-O 3.49Å; I39-T152 HydrophobicContact CB-CG2 4.43Å; I39-T152 PolarHBondContact N-O 3.44Å; I39-T152 PolarHBondContact O-N 2.98Å; I41-T152 HydrophobicContact CD1-CG2 3.76Å; I41-T152 HydrophobicContact CG1-CG2 3.95Å; Q141-T152 PolarHBondContact NE2-OG1 2.8Å; T145-T152 WeakPolarHBondContact O-CB 3.45Å; T145-T152 WeakPolarHBondContact O-CG2 3.46Å; T145-T152 PolarHBondContact O-OG1 3.06Å; T152-I154 HydrophobicContact CG2-CD1 3.73Å; T152-I154 HydrophobicContact CG2-CG1 3.92Å
153	V	98.6	Very high	97.4	Very high	3 Å²	3	18.7 Å²	18.7	2%	0.018	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.1	175.5	-178.8	0	0	0	0	109	V29 A30 P32 E36 V37 R38 R131 Q141	V29-V153 HydrophobicContact CG1-CG2 3.8Å; A30-V153 WeakPolarHBondContact O-CG2 3.35Å; P32-V153 HydrophobicContact CB-CG1 4.08Å; E36-V153 HydrophobicContact CB-CG1 3.81Å; E36-V153 HydrophobicContact CG-CG1 4.41Å; V37-V153 WeakPolarHBondContact O-CA 3.43Å; R38-V153 HydrophobicContact CB-CG2 4Å; R38-V153 HydrophobicContact CG-CG2 3.8Å; R131-V153 HydrophobicContact CB-CB 3.87Å; R131-V153 HydrophobicContact CB-CG1 4.49Å; R131-V153 HydrophobicContact CB-CG2 3.94Å; R131-V153 HydrophobicContact CG-CB 3.68Å; R131-V153 HydrophobicContact CG-CG1 3.78Å; R131-V153 HydrophobicContact CG-CG2 4.11Å; Q141-V153 PolarHBondContact NE2-O 3.07Å
154	I	96.8	Very high	97.6	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.015	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.2	-171	-53.9	-177.1	0	0	0	109.1	E36 V37 I39 P93 T152 A158 V159	E36-I154 CarbonylContact C-O 3.58Å; E36-I154 WeakPolarHBondContact CA-O 3.36Å; V37-I154 PolarHBondContact N-O 3.26Å; V37-I154 PolarHBondContact O-N 3.2Å; I39-I154 HydrophobicContact CD1-CD1 4.27Å; P93-I154 HydrophobicContact CB-CD1 3.45Å; P93-I154 VanDerWaalsContact CB-CD1 3.45Å; P93-I154 HydrophobicContact CG-CD1 3.61Å; T152-I154 HydrophobicContact CG2-CD1 3.73Å; T152-I154 HydrophobicContact CG2-CG1 3.92Å; I154-A158 HydrophobicContact CG2-CB 3.72Å; I154-V159 HydrophobicContact CB-CG2 3.78Å; I154-V159 HydrophobicContact CG2-CG2 3.59Å
155	N	96.2	Very high	97.9	Very high	25 Å²	25	24.8 Å²	24.8	13%	0.134	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	137.9	172.2	-165	-87.4	0	0	0	110.9	G35 R119 I157 A158	G35-N155 PolarHBondContact O-ND2 2.87Å; R119-N155 PolarHBondContact NH1-ND2 2.89Å; N155-I157 HydrophobicContact CB-CG1 4.47Å; N155-I157 PolarHBondContact O-N 2.91Å; N155-I157 VanDerWaalsContact OD1-CG1 3.31Å; N155-I157 WeakPolarHBondContact OD1-CG1 3.29Å; N155-I157 PolarHBondContact OD1-N 3.27Å; N155-A158 WeakPolarHBondContact O-CA 3.3Å; N155-A158 WeakPolarHBondContact O-CB 3.22Å; N155-A158 PolarHBondContact O-N 2.6Å
156	Q	96.5	Very high	97.9	Very high	37 Å²	37	24.8 Å²	24.8	17%	0.173	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-57.9	-21.4	-174.9	69.3	178.1	-43.5	0	0	114.8	G35 V37 V82 F85 A158 K326	G35-Q156 WeakPolarHBondContact O-CG 3.36Å; G35-Q156 PolarHBondContact O-N 3.39Å; V37-Q156 HydrophobicContact CG2-CB 4.06Å; V82-Q156 HydrophobicContact CG2-CB 4.28Å; F85-Q156 HydrophobicContact CD2-CB 4.36Å; F85-Q156 HydrophobicContact CE2-CB 4.21Å; Q156-A158 PolarHBondContact O-N 2.84Å; Q156-K326 WeakPolarHBondContact O-CE 3.41Å; Q156-K326 PolarHBondContact O-NZ 2.95Å
157	I	96.2	Very high	97.9	Very high	19 Å²	19	26.5 Å²	26.5	10%	0.097	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-73.6	-12.3	175.4	72.8	179.1	0	0	0	112.9	C97 Q98 C99 R115 N155	C97-I157 CarbonylContact C-O 3.57Å; C97-I157 WeakPolarHBondContact CA-O 3.26Å; C97-I157 HydrophobicContact CB-CD1 3.92Å; C97-I157 HydrophobicContact CB-CG1 3.81Å; Q98-I157 PolarHBondContact N-O 3.11Å; C99-I157 HydrophobicContact CB-CB 4.28Å; C99-I157 HydrophobicContact CB-CD1 4.34Å; C99-I157 HydrophobicContact CB-CG2 3.88Å; R115-I157 HydrophobicContact CB-CD1 4.42Å; N155-I157 HydrophobicContact CB-CG1 4.47Å; N155-I157 PolarHBondContact O-N 2.91Å; N155-I157 VanDerWaalsContact OD1-CG1 3.31Å; N155-I157 WeakPolarHBondContact OD1-CG1 3.29Å; N155-I157 PolarHBondContact OD1-N 3.27Å
158	A	96.7	Very high	97.9	Very high	7 Å²	7	26.5 Å²	26.5	6%	0.058	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-116.1	26.4	-175.9	0	0	0	0	0	111.8	L94 I154 N155 Q156	L94-A158 PolarHBondContact N-O 3.38Å; L94-A158 WeakPolarHBondContact O-CB 3.45Å; I154-A158 HydrophobicContact CG2-CB 3.72Å; N155-A158 WeakPolarHBondContact O-CA 3.3Å; N155-A158 WeakPolarHBondContact O-CB 3.22Å; N155-A158 PolarHBondContact O-N 2.6Å; Q156-A158 PolarHBondContact O-N 2.84Å
159	V	98.1	Very high	97.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	138.4	178	-177.6	0	0	0	0	107.2	I39 F85 A91 I92 I154 K326	I39-V159 HydrophobicContact CD1-CG1 3.73Å; I39-V159 HydrophobicContact CD1-CG2 3.95Å; F85-V159 HydrophobicContact CD1-CG1 4.4Å; F85-V159 HydrophobicContact CE1-CB 4.28Å; F85-V159 HydrophobicContact CE1-CG1 3.64Å; F85-V159 HydrophobicContact CE2-CB 4.28Å; F85-V159 HydrophobicContact CE2-CG1 4.47Å; F85-V159 HydrophobicContact CZ-CB 3.81Å; F85-V159 HydrophobicContact CZ-CG1 3.7Å; F85-V159 WeakPolarHBondContact CZ-O 3.49Å; A91-V159 HydrophobicContact CB-CG1 3.71Å; I92-V159 WeakPolarHBondContact O-CA 3.31Å; I154-V159 HydrophobicContact CB-CG2 3.78Å; I154-V159 HydrophobicContact CG2-CG2 3.59Å; V159-K326 WeakPolarHBondContact O-CE 3.46Å
160	T	98.1	Very high	97.9	Very high	4 Å²	4	32.1 Å²	32.1	3%	0.025	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.9	168.7	-165.8	0	0	0	0	111.2	A91 I92 L94 I162 K326 V329	A91-T160 CarbonylContact C-O 3.58Å; A91-T160 WeakPolarHBondContact CA-O 3.29Å; A91-T160 WeakPolarHBondContact CB-O 3.38Å; I92-T160 HydrophobicContact CB-CG2 3.84Å; I92-T160 HydrophobicContact CG2-CG2 4.45Å; I92-T160 PolarHBondContact N-O 2.79Å; I92-T160 PolarHBondContact O-N 3.26Å; L94-T160 HydrophobicContact CD1-CG2 4.38Å; L94-T160 HydrophobicContact CD2-CG2 4.2Å; L94-T160 HydrophobicContact CG-CG2 4.47Å; T160-I162 HydrophobicContact CG2-CG2 3.93Å; T160-K326 PolarHBondContact OG1-O 2.93Å; T160-V329 HydrophobicContact CG2-CB 3.85Å; T160-V329 HydrophobicContact CG2-CG1 3.54Å
161	K	98.4	Very high	97.9	Very high	85 Å²	85	30.7 Å²	30.7	37%	0.37	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	135.9	171.5	-178.7	171.3	179.3	157	0	108.6	F85 D89	F85-K161 HydrophobicContact CD1-CB 4.22Å; F85-K161 HydrophobicContact CE1-CB 3.72Å; D89-K161 HydrophobicContact CB-CD 4.45Å; D89-K161 WeakPolarHBondContact OD1-CE 3.42Å; D89-K161 IonicContact OD1-NZ 2.76Å; D89-K161 PolarHBondContact OD1-NZ 3.37Å; D89-K161 WeakPolarHBondContact OD2-CE 3.43Å; D89-K161 IonicContact OD2-NZ 2.77Å; D89-K161 PolarHBondContact OD2-NZ 2.85Å
162	I	98.6	Very high	97.8	Very high	10 Å²	10	28.7 Å²	28.7	5%	0.051	17%	0.165	C	C	.	.			trans	-124.5	170.5	-176.3	65.3	164.9	0	0	0	111.5	K90 I92 T160 A166 L168 V171 V333	K90-I162 HydrophobicContact CB-CD1 4.12Å; K90-I162 HydrophobicContact CB-CG1 3.65Å; K90-I162 WeakPolarHBondContact O-CG1 3.34Å; K90-I162 PolarHBondContact O-N 3.3Å; I92-I162 HydrophobicContact CD1-CD1 4.15Å; I92-I162 HydrophobicContact CD1-CG2 3.97Å; I92-I162 HydrophobicContact CG1-CD1 4.1Å; I92-I162 HydrophobicContact CG1-CG2 4.17Å; T160-I162 HydrophobicContact CG2-CG2 3.93Å; I162-A166 HydrophobicContact CD1-CB 3.87Å; I162-L168 HydrophobicContact CD1-CD2 3.88Å; I162-V171 HydrophobicContact CD1-CG2 3.7Å; I162-V333 HydrophobicContact CB-CG1 4.29Å; I162-V333 HydrophobicContact CB-CG2 4.21Å; I162-V333 HydrophobicContact CG2-CG2 3.86Å
163	D	98	Very high	97.8	Very high	78 Å²	78	28.7 Å²	28.7	42%	0.417	17%	0.165	S	C	.	.			trans	-60.4	132.8	179	-166.4	-63.6	0	0	0	111.1	A165 A166 V333 L337	D163-A165 PolarHBondContact O-N 3.17Å; D163-A165 VanDerWaalsContact OD1-CB 3.28Å; D163-A165 WeakPolarHBondContact OD1-CB 3.23Å; D163-A165 PolarHBondContact OD1-N 2.8Å; D163-A166 WeakPolarHBondContact O-CB 3.46Å; D163-A166 PolarHBondContact O-N 3.22Å; D163-V333 HydrophobicContact CB-CG1 4.36Å; D163-L337 HydrophobicContact CB-CD1 3.67Å
164	P	97.7	Very high	97.8	Very high	103 Å²	103	28.6 Å²	28.6	67%	0.669	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.8	-179.9	26.1	-35.6	0	0	0	113.8	K90 A166	K90-P164 WeakPolarHBondContact CD-O 3.45Å; K90-P164 WeakPolarHBondContact CE-O 3.27Å; K90-P164 PolarHBondContact NZ-O 2.89Å; P164-A166 VanDerWaalsContact C-N 3.28Å
165	A	97.5	Very high	97.9	Very high	73 Å²	73	28.4 Å²	28.4	60%	0.603	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-6.4	175.8	0	0	0	0	0	113.3	D163	D163-A165 PolarHBondContact O-N 3.17Å; D163-A165 VanDerWaalsContact OD1-CB 3.28Å; D163-A165 WeakPolarHBondContact OD1-CB 3.23Å; D163-A165 PolarHBondContact OD1-N 2.8Å
166	A	98.3	Very high	98	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-66.5	127.6	-178.8	0	0	0	0	0	111.9	K90 I162 D163 P164 L168 V171 V333	K90-A166 PolarHBondContact NZ-O 3.25Å; I162-A166 HydrophobicContact CD1-CB 3.87Å; D163-A166 WeakPolarHBondContact O-CB 3.46Å; D163-A166 PolarHBondContact O-N 3.22Å; P164-A166 VanDerWaalsContact C-N 3.28Å; A166-L168 PolarHBondContact O-N 2.9Å; A166-V171 HydrophobicContact CB-CG1 4.11Å; A166-V171 HydrophobicContact CB-CG2 4.13Å; A166-V333 HydrophobicContact CB-CG1 3.85Å
167	P	98.3	Very high	97.9	Very high	36 Å²	36	25.8 Å²	25.8	23%	0.234	15%	0.151	C	C	.	.			trans	-74.7	112.3	174.1	29.3	-32.7	0	0	0	110	D169 K170 V171 F336	P167-D169 VanDerWaalsContact C-N 3.27Å; P167-D169 WeakPolarHBondContact CB-OD1 3.36Å; P167-D169 PolarHBondContact O-N 3.37Å; P167-K170 HydrophobicContact CB-CD 4.35Å; P167-K170 HydrophobicContact CB-CG 4.32Å; P167-K170 HydrophobicContact CG-CB 4.17Å; P167-K170 HydrophobicContact CG-CD 3.89Å; P167-K170 HydrophobicContact CG-CG 4.16Å; P167-K170 PolarHBondContact O-N 3.49Å; P167-V171 WeakPolarHBondContact O-CG2 3.35Å; P167-V171 PolarHBondContact O-N 3.07Å; P167-F336 HydrophobicContact CG-CE1 3.71Å; P167-F336 HydrophobicContact CG-CZ 4.3Å
168	L	98.7	Very high	98	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.7	-28.5	-168.9	-66.3	177.6	0	0	0	113.1	V42 A72 I74 K90 I162 A166 K170 V171 C172 E378	V42-L168 HydrophobicContact CB-CB 4.18Å; V42-L168 HydrophobicContact CB-CD1 3.77Å; V42-L168 HydrophobicContact CG1-CB 4Å; V42-L168 HydrophobicContact CG1-CD1 4.07Å; V42-L168 HydrophobicContact CG2-CD1 3.65Å; A72-L168 HydrophobicContact CB-CB 4.14Å; A72-L168 HydrophobicContact CB-CD2 3.73Å; I74-L168 HydrophobicContact CD1-CD1 4.33Å; I74-L168 HydrophobicContact CG1-CD1 3.93Å; K90-L168 HydrophobicContact CB-CD2 4.19Å; K90-L168 HydrophobicContact CD-CD1 4.17Å; K90-L168 HydrophobicContact CD-CD2 3.85Å; K90-L168 HydrophobicContact CD-CG 3.99Å; K90-L168 HydrophobicContact CG-CD1 4.26Å; K90-L168 HydrophobicContact CG-CD2 4.11Å; K90-L168 HydrophobicContact CG-CG 4.48Å; I162-L168 HydrophobicContact CD1-CD2 3.88Å; A166-L168 PolarHBondContact O-N 2.9Å; L168-K170 PolarHBondContact O-N 3.1Å; L168-V171 HydrophobicContact CD2-CG2 4.32Å; L168-C172 WeakPolarHBondContact O-CB 3.36Å; L168-C172 PolarHBondContact O-N 2.8Å; L168-E378 HydrophobicContact CD1-CG 4.13Å
169	D	98.1	Very high	98.1	Very high	70 Å²	70	24.6 Å²	24.6	37%	0.374	14%	0.143	S	C	.	.	H	α-helix	trans	-68.8	-12.4	173.8	64	-30	0	0	0	114	A43 P167 V372	A43-D169 HydrophobicContact CB-CB 4.31Å; P167-D169 VanDerWaalsContact C-N 3.27Å; P167-D169 WeakPolarHBondContact CB-OD1 3.36Å; P167-D169 PolarHBondContact O-N 3.37Å; D169-V372 WeakPolarHBondContact O-CG1 3.39Å
170	K	98.4	Very high	98.1	Very high	50 Å²	50	25.2 Å²	25.2	22%	0.217	15%	0.147	C	C	.	.	H	α-helix	trans	-108.7	-48.3	174.6	-53.2	-174.4	-177.8	-166	0	111.9	P167 L168 C172 L173 F336 L343 D344 I347	P167-K170 HydrophobicContact CB-CD 4.35Å; P167-K170 HydrophobicContact CB-CG 4.32Å; P167-K170 HydrophobicContact CG-CB 4.17Å; P167-K170 HydrophobicContact CG-CD 3.89Å; P167-K170 HydrophobicContact CG-CG 4.16Å; P167-K170 PolarHBondContact O-N 3.49Å; L168-K170 PolarHBondContact O-N 3.1Å; K170-C172 PolarHBondContact O-N 3Å; K170-L173 WeakPolarHBondContact O-CG 3.46Å; K170-L173 PolarHBondContact O-N 3.24Å; K170-F336 HydrophobicContact CB-CE1 4.33Å; K170-F336 HydrophobicContact CB-CZ 4.1Å; K170-F336 HydrophobicContact CD-CE1 4.37Å; K170-F336 HydrophobicContact CD-CZ 3.68Å; K170-L343 HydrophobicContact CB-CB 4.48Å; K170-L343 HydrophobicContact CB-CD1 4.43Å; K170-D344 WeakPolarHBondContact CD-OD1 3.27Å; K170-D344 WeakPolarHBondContact CE-OD1 3.25Å; K170-D344 IonicContact NZ-OD1 2.74Å; K170-D344 PolarHBondContact NZ-OD1 3.28Å; K170-D344 IonicContact NZ-OD2 2.86Å; K170-D344 PolarHBondContact NZ-OD2 2.93Å; K170-I347 HydrophobicContact CB-CD1 4.48Å; K170-I347 HydrophobicContact CG-CD1 4.18Å
171	V	98.6	Very high	98.2	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-73.5	-10.9	-173.6	-57.6	0	0	0	0	113.5	A72 I92 I162 A166 P167 L168 L173 L174 V333 F336 L343	A72-V171 HydrophobicContact CB-CG2 4.34Å; I92-V171 HydrophobicContact CD1-CB 4.24Å; I92-V171 HydrophobicContact CD1-CG2 4.14Å; I92-V171 VanDerWaalsContact CD1-O 3.28Å; I92-V171 WeakPolarHBondContact CD1-O 3.37Å; I162-V171 HydrophobicContact CD1-CG2 3.7Å; A166-V171 HydrophobicContact CB-CG1 4.11Å; A166-V171 HydrophobicContact CB-CG2 4.13Å; P167-V171 WeakPolarHBondContact O-CG2 3.35Å; P167-V171 PolarHBondContact O-N 3.07Å; L168-V171 HydrophobicContact CD2-CG2 4.32Å; V171-L173 PolarHBondContact O-N 2.83Å; V171-L174 HydrophobicContact CB-CD1 4.19Å; V171-L174 HydrophobicContact CG1-CD1 4.37Å; V171-L174 VanDerWaalsContact O-CB 3.3Å; V171-L174 WeakPolarHBondContact O-CB 3.28Å; V171-L174 PolarHBondContact O-N 3.02Å; V171-V333 HydrophobicContact CB-CG2 4.27Å; V171-V333 HydrophobicContact CG1-CG1 4.44Å; V171-V333 HydrophobicContact CG1-CG2 4.41Å; V171-F336 HydrophobicContact CG1-CD1 3.73Å; V171-F336 HydrophobicContact CG1-CE1 4.04Å; V171-L343 HydrophobicContact CG1-CD1 4.25Å
172	C	98.4	Very high	98.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-52.9	-34.8	169.8	59.4	0	0	0	0	112.5	A43 E70 A72 L168 K170 L174 G175	A43-C172 HydrophobicContact CB-CB 4.47Å; E70-C172 WeakPolarHBondContact CG-O 3.25Å; A72-C172 HydrophobicContact CB-CB 3.87Å; L168-C172 WeakPolarHBondContact O-CB 3.36Å; L168-C172 PolarHBondContact O-N 2.8Å; K170-C172 PolarHBondContact O-N 3Å; C172-L174 PolarHBondContact O-N 2.72Å; C172-L174 VanDerWaalsContact O-N 3.11Å; C172-G175 PolarHBondContact O-N 3.09Å
173	L	98.5	Very high	98.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-62.6	-17.5	177.3	-56.9	-172.2	0	0	0	114	S45 K170 V171 G175 I178 L343 F346 I347 R370 V372	S45-L173 VanDerWaalsContact OG-CD2 3.28Å; S45-L173 WeakPolarHBondContact OG-CD2 3.05Å; K170-L173 WeakPolarHBondContact O-CG 3.46Å; K170-L173 PolarHBondContact O-N 3.24Å; V171-L173 PolarHBondContact O-N 2.83Å; L173-G175 VanDerWaalsContact C-N 3.27Å; L173-I178 HydrophobicContact CB-CG1 3.74Å; L173-I178 PolarHBondContact O-N 2.96Å; L173-L343 HydrophobicContact CB-CD2 4.48Å; L173-F346 HydrophobicContact CD1-CB 3.94Å; L173-I347 HydrophobicContact CD1-CD1 4.41Å; L173-I347 HydrophobicContact CD1-CG1 3.8Å; L173-R370 HydrophobicContact CD2-CB 4.06Å; L173-R370 HydrophobicContact CD2-CG 3.84Å; L173-V372 HydrophobicContact CD2-CG2 4.08Å
174	L	98.6	Very high	98.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-80.1	-10.3	176.7	-60.8	177.2	0	0	0	112.5	I92 V171 C172 C176 I178 C179 V329 M332 V333 L343	I92-L174 HydrophobicContact CD1-CB 4.36Å; V171-L174 HydrophobicContact CB-CD1 4.19Å; V171-L174 HydrophobicContact CG1-CD1 4.37Å; V171-L174 VanDerWaalsContact O-CB 3.3Å; V171-L174 WeakPolarHBondContact O-CB 3.28Å; V171-L174 PolarHBondContact O-N 3.02Å; C172-L174 PolarHBondContact O-N 2.72Å; C172-L174 VanDerWaalsContact O-N 3.11Å; L174-C176 VanDerWaalsContact C-N 3.27Å; L174-C176 PolarHBondContact O-N 2.89Å; L174-I178 HydrophobicContact CD2-CB 4.05Å; L174-I178 HydrophobicContact CD2-CG2 3.93Å; L174-C179 PolarHBondContact O-SG 3.39Å; L174-V329 HydrophobicContact CB-CG1 4.18Å; L174-V329 WeakPolarHBondContact O-CG2 3.25Å; L174-M332 HydrophobicContact CD1-CB 4.04Å; L174-M332 HydrophobicContact CD2-CB 3.94Å; L174-M332 HydrophobicContact CD2-CE 4.26Å; L174-V333 HydrophobicContact CD1-CB 4.26Å; L174-V333 HydrophobicContact CD1-CG2 3.55Å; L174-L343 HydrophobicContact CD1-CD1 4.17Å; L174-L343 HydrophobicContact CD2-CD1 4.35Å; L174-L343 HydrophobicContact CD2-CD2 3.81Å; L174-L343 HydrophobicContact CG-CD1 4.08Å; L174-L343 HydrophobicContact CG-CD2 4.3Å
175	G	97.6	Very high	98.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-71.4	-19.5	173.5	0	0	0	0	0	113.7	C172 L173 F320	C172-G175 PolarHBondContact O-N 3.09Å; L173-G175 VanDerWaalsContact C-N 3.27Å; G175-F320 VanDerWaalsContact O-CE2 3.23Å; G175-F320 WeakPolarHBondContact O-CE2 3.22Å
176	C	97.8	Very high	98.4	Very high	7 Å²	7	12.2 Å²	12.2	5%	0.047	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-145.2	-91.4	177.2	-174.1	0	0	0	0	113.3	H69 E70 F95 L174 I178 C179 T180	H69-C176 PolarHBondContact NE2-SG 3.48Å; E70-C176 HydrophobicContact CB-CB 3.98Å; E70-C176 HydrophobicContact CG-CB 3.91Å; F95-C176 HydrophobicContact CE1-CB 4.24Å; L174-C176 VanDerWaalsContact C-N 3.27Å; L174-C176 PolarHBondContact O-N 2.89Å; C176-I178 PolarHBondContact O-N 3.29Å; C176-C179 PolarHBondContact O-N 3.31Å; C176-T180 WeakPolarHBondContact O-CB 3.38Å; C176-T180 PolarHBondContact O-N 3.27Å; C176-T180 PolarHBondContact O-OG1 2.6Å
177	G	95.8	Very high	98.4	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64	-40.5	-152.7	0	0	0	0	0	114	E70 T180 G181	E70-G177 PolarHBondContact OE1-N 3.07Å; G177-T180 PolarHBondContact O-N 2.89Å; G177-G181 PolarHBondContact O-N 2.72Å
178	I	98.3	Very high	98.4	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-69.4	-48.1	-177.8	-54.1	-59.3	0	0	0	110.8	L173 L174 C176 T180 G181 Y182 A208 M211 M332 V341 L343 F346	L173-I178 HydrophobicContact CB-CG1 3.74Å; L173-I178 PolarHBondContact O-N 2.96Å; L174-I178 HydrophobicContact CD2-CB 4.05Å; L174-I178 HydrophobicContact CD2-CG2 3.93Å; C176-I178 PolarHBondContact O-N 3.29Å; I178-T180 VanDerWaalsContact C-N 3.28Å; I178-T180 PolarHBondContact O-N 2.92Å; I178-G181 PolarHBondContact O-N 3.49Å; I178-Y182 WeakPolarHBondContact O-CB 3.42Å; I178-Y182 PolarHBondContact O-N 3.42Å; I178-A208 HydrophobicContact CB-CB 4.47Å; I178-A208 HydrophobicContact CD1-CB 4.09Å; I178-A208 HydrophobicContact CG2-CB 4.29Å; I178-M211 HydrophobicContact CG2-CE 3.93Å; I178-M332 HydrophobicContact CG2-CE 4.43Å; I178-V341 HydrophobicContact CG2-CG1 4.42Å; I178-L343 HydrophobicContact CB-CD2 4.25Å; I178-L343 HydrophobicContact CG1-CD2 3.87Å; I178-L343 HydrophobicContact CG2-CD2 3.87Å; I178-F346 HydrophobicContact CD1-CB 4.19Å; I178-F346 HydrophobicContact CD1-CD1 3.3Å; I178-F346 HydrophobicContact CD1-CD2 3.77Å; I178-F346 HydrophobicContact CD1-CE1 3.42Å; I178-F346 VanDerWaalsContact CD1-CE1 3.42Å; I178-F346 HydrophobicContact CD1-CE2 3.9Å; I178-F346 HydrophobicContact CD1-CG 3.48Å; I178-F346 VanDerWaalsContact CD1-CG 3.48Å; I178-F346 HydrophobicContact CD1-CZ 3.73Å
179	C	98.6	Very high	98.4	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.5	-39.8	175.6	-74.7	0	0	0	0	111.4	L174 C176 G183 F320 F323	L174-C179 PolarHBondContact O-SG 3.39Å; C176-C179 PolarHBondContact O-N 3.31Å; C179-G183 WeakPolarHBondContact O-CA 3.28Å; C179-G183 PolarHBondContact O-N 2.83Å; C179-F320 HydrophobicContact CB-CD2 4.25Å; C179-F320 HydrophobicContact CB-CE1 4.43Å; C179-F320 HydrophobicContact CB-CE2 3.62Å; C179-F320 HydrophobicContact CB-CZ 3.75Å; C179-F323 HydrophobicContact CB-CD2 4.06Å; C179-F323 HydrophobicContact CB-CE2 4.28Å; C179-F323 WeakPolarHBondContact O-CD2 3.34Å; C179-F323 WeakPolarHBondContact O-CE2 3.31Å
180	T	98.8	Very high	98.4	Very high	14 Å²	14	18.1 Å²	18.1	9%	0.086	9%	0.089	C	C	.	.	H	α-helix	trans	-58.7	-56.4	177.3	-63.9	0	0	0	0	111.8	C176 G177 I178 A184 V205 V294 G321	C176-T180 WeakPolarHBondContact O-CB 3.38Å; C176-T180 PolarHBondContact O-N 3.27Å; C176-T180 PolarHBondContact O-OG1 2.6Å; G177-T180 PolarHBondContact O-N 2.89Å; I178-T180 VanDerWaalsContact C-N 3.28Å; I178-T180 PolarHBondContact O-N 2.92Å; T180-A184 VanDerWaalsContact O-CB 3.26Å; T180-A184 WeakPolarHBondContact O-CB 3.43Å; T180-A184 PolarHBondContact O-N 3.13Å; T180-V205 HydrophobicContact CG2-CG1 3.9Å; T180-V294 HydrophobicContact CG2-CG1 3.42Å; T180-V294 VanDerWaalsContact CG2-CG1 3.42Å; T180-G321 WeakPolarHBondContact O-CA 3.47Å
181	G	98.7	Very high	98.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-68.7	-51	-177.8	0	0	0	0	0	113.3	G177 I178 G183 A184 A185 V205 A209	G177-G181 PolarHBondContact O-N 2.72Å; I178-G181 PolarHBondContact O-N 3.49Å; G181-G183 VanDerWaalsContact C-N 3.33Å; G181-G183 PolarHBondContact O-N 3.1Å; G181-A184 WeakPolarHBondContact O-CB 3.24Å; G181-A184 PolarHBondContact O-N 3.4Å; G181-A184 VanDerWaalsContact O-N 3.17Å; G181-A185 PolarHBondContact O-N 2.82Å; G181-V205 VanDerWaalsContact CA-O 3.27Å; G181-V205 WeakPolarHBondContact CA-O 3.33Å; G181-A209 VanDerWaalsContact O-CA 3.31Å; G181-A209 WeakPolarHBondContact O-CA 3.41Å
182	Y	98.9	Very high	98.4	Very high	39 Å²	39	22.7 Å²	22.7	15%	0.153	11%	0.112	C	C	.	.	H	α-helix	trans	-59.1	-47.2	-178.8	-174.3	-87.9	0	0	0	110.9	I178 A184 A185 V186 A208 M211 G212 A215 F323 M332	I178-Y182 WeakPolarHBondContact O-CB 3.42Å; I178-Y182 PolarHBondContact O-N 3.42Å; Y182-A184 PolarHBondContact O-N 3.16Å; Y182-A185 PolarHBondContact O-N 3.45Å; Y182-V186 HydrophobicContact CD1-CG1 4.27Å; Y182-V186 HydrophobicContact CD1-CG2 3.82Å; Y182-V186 HydrophobicContact CE1-CB 4.42Å; Y182-V186 HydrophobicContact CE1-CG1 3.86Å; Y182-V186 HydrophobicContact CE1-CG2 3.7Å; Y182-V186 WeakPolarHBondContact O-CG2 3.29Å; Y182-V186 PolarHBondContact O-N 3.34Å; Y182-A208 WeakPolarHBondContact CA-O 3.49Å; Y182-A208 PolarHBondContact N-O 3.12Å; Y182-M211 HydrophobicContact CD2-CE 3.9Å; Y182-M211 HydrophobicContact CD2-CG 4.19Å; Y182-M211 HydrophobicContact CE2-CG 4.32Å; Y182-G212 VanDerWaalsContact CD2-CA 3.49Å; Y182-A215 HydrophobicContact CE2-CB 3.78Å; Y182-A215 WeakPolarHBondContact OH-CB 3.21Å; Y182-F323 HydrophobicContact CD1-CZ 4.25Å; Y182-M332 HydrophobicContact CD1-CE 3.84Å; Y182-M332 HydrophobicContact CD1-SD 3.98Å; Y182-M332 HydrophobicContact CE1-CE 4.31Å; Y182-M332 HydrophobicContact CE1-SD 4.1Å; Y182-M332 HydrophobicContact CG-CE 3.98Å
183	G	98.8	Very high	98.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.5	-33.4	177.8	0	0	0	0	0	113.5	C179 G181 A185 V186 N187 T188 G321 F323	C179-G183 WeakPolarHBondContact O-CA 3.28Å; C179-G183 PolarHBondContact O-N 2.83Å; G181-G183 VanDerWaalsContact C-N 3.33Å; G181-G183 PolarHBondContact O-N 3.1Å; G183-A185 PolarHBondContact O-N 3.02Å; G183-V186 PolarHBondContact O-N 3.29Å; G183-N187 WeakPolarHBondContact CA-ND2 3.46Å; G183-N187 WeakPolarHBondContact O-CA 3.45Å; G183-N187 VanDerWaalsContact O-CB 3.29Å; G183-N187 WeakPolarHBondContact O-CB 3.27Å; G183-N187 PolarHBondContact O-N 3.3Å; G183-T188 PolarHBondContact O-N 3.09Å; G183-G321 VanDerWaalsContact C-CA 3.44Å; G183-G321 CarbonylContact C-O 3.54Å; G183-G321 WeakPolarHBondContact CA-O 3.36Å; G183-F323 VanDerWaalsContact CA-CE2 3.45Å
184	A	98.9	Very high	98.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.17	C	C	.	.	I	π-helix	trans	-59.3	-40.3	175.6	0	0	0	0	0	111	T180 G181 Y182 T188 A189 L268 V292 V294 G321	T180-A184 VanDerWaalsContact O-CB 3.26Å; T180-A184 WeakPolarHBondContact O-CB 3.43Å; T180-A184 PolarHBondContact O-N 3.13Å; G181-A184 WeakPolarHBondContact O-CB 3.24Å; G181-A184 PolarHBondContact O-N 3.4Å; G181-A184 VanDerWaalsContact O-N 3.17Å; Y182-A184 PolarHBondContact O-N 3.16Å; A184-T188 WeakPolarHBondContact O-CB 3.38Å; A184-A189 WeakPolarHBondContact O-CB 3.35Å; A184-A189 PolarHBondContact O-N 3.01Å; A184-L268 HydrophobicContact CB-CD2 3.81Å; A184-V292 HydrophobicContact CB-CG1 4.44Å; A184-V294 HydrophobicContact CB-CG1 4.29Å; A184-V294 HydrophobicContact CB-CG2 3.53Å; A184-G321 VanDerWaalsContact N-CA 3.34Å
185	A	98.9	Very high	98.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.173	C	C	.	.	I	π-helix	trans	-70.4	-57.1	173.4	0	0	0	0	0	112.5	G181 Y182 G183 A189 K190 V191 L268	G181-A185 PolarHBondContact O-N 2.82Å; Y182-A185 PolarHBondContact O-N 3.45Å; G183-A185 PolarHBondContact O-N 3.02Å; A185-A189 WeakPolarHBondContact O-CB 3.44Å; A185-K190 PolarHBondContact O-N 3.48Å; A185-V191 HydrophobicContact CB-CG2 4.21Å; A185-V191 PolarHBondContact O-N 2.99Å; A185-V191 VanDerWaalsContact O-N 3.16Å; A185-L268 HydrophobicContact CB-CD2 4.14Å
186	V	98.6	Very high	98.5	Very high	41 Å²	41	30.3 Å²	30.3	25%	0.248	18%	0.178	C	C	.	.	I	π-helix	trans	-80.2	-34.4	-168.1	-53.9	0	0	0	0	114	Y182 G183 G212 A216	Y182-V186 HydrophobicContact CD1-CG1 4.27Å; Y182-V186 HydrophobicContact CD1-CG2 3.82Å; Y182-V186 HydrophobicContact CE1-CB 4.42Å; Y182-V186 HydrophobicContact CE1-CG1 3.86Å; Y182-V186 HydrophobicContact CE1-CG2 3.7Å; Y182-V186 WeakPolarHBondContact O-CG2 3.29Å; Y182-V186 PolarHBondContact O-N 3.34Å; G183-V186 PolarHBondContact O-N 3.29Å; V186-G212 WeakPolarHBondContact CG1-O 3.27Å; V186-A216 HydrophobicContact CG1-CB 4.49Å
187	N	98.5	Very high	98.6	Very high	59 Å²	59	30 Å²	30	32%	0.316	18%	0.176	S	C	.	.	I	π-helix	trans	-99.2	-41.7	-175	-56.5	-44.6	0	0	0	112.6	G183 K190 G321 F323	G183-N187 WeakPolarHBondContact CA-ND2 3.46Å; G183-N187 WeakPolarHBondContact O-CA 3.45Å; G183-N187 VanDerWaalsContact O-CB 3.29Å; G183-N187 WeakPolarHBondContact O-CB 3.27Å; G183-N187 PolarHBondContact O-N 3.3Å; N187-K190 VanDerWaalsContact O-CG 3.27Å; N187-K190 WeakPolarHBondContact O-CG 3.45Å; N187-G321 WeakPolarHBondContact CB-O 3.06Å; N187-G321 PolarHBondContact ND2-O 2.82Å; N187-F323 WeakPolarHBondContact ND2-CD1 3.11Å; N187-F323 VanDerWaalsContact ND2-CE1 3.29Å; N187-F323 WeakPolarHBondContact ND2-CE1 3.49Å; N187-F323 WeakPolarHBondContact ND2-CE2 3.34Å; N187-F323 VanDerWaalsContact ND2-CZ 3.31Å; N187-F323 WeakPolarHBondContact ND2-CZ 3.28Å
188	T	98.7	Very high	98.7	Very high	22 Å²	22	30 Å²	30	14%	0.135	18%	0.176	C	C	.	.	I	π-helix	trans	-92.3	-54.5	-169.7	-55	0	0	0	0	112.5	G183 A184 K190 V292 K316 S318	G183-T188 PolarHBondContact O-N 3.09Å; A184-T188 WeakPolarHBondContact O-CB 3.38Å; T188-K190 VanDerWaalsContact C-N 3.31Å; T188-V292 HydrophobicContact CG2-CG1 3.91Å; T188-V292 HydrophobicContact CG2-CG2 4.39Å; T188-K316 HydrophobicContact CG2-CD 3.86Å; T188-K316 HydrophobicContact CG2-CG 4.16Å; T188-S318 WeakPolarHBondContact CB-OG 3.33Å; T188-S318 PolarHBondContact OG1-OG 3.06Å
189	A	98.7	Very high	98.7	Very high	5 Å²	5	30 Å²	30	4%	0.041	18%	0.176	C	C	.	.	I	π-helix	trans	-66.4	-39.7	171	0	0	0	0	0	110	A184 A185 V191 F266 V292	A184-A189 WeakPolarHBondContact O-CB 3.35Å; A184-A189 PolarHBondContact O-N 3.01Å; A185-A189 WeakPolarHBondContact O-CB 3.44Å; A189-V191 HydrophobicContact CB-CG2 4.01Å; A189-F266 HydrophobicContact CB-CD1 3.89Å; A189-F266 WeakPolarHBondContact O-CE1 3.23Å; A189-V292 HydrophobicContact CB-CG2 3.77Å
190	K	98.6	Very high	98.7	Very high	144 Å²	144	30.1 Å²	30.1	63%	0.626	18%	0.177	S	C	*	.			trans	57.9	53	-170.4	-56.8	-177.5	178.5	-177.4	0	110.3	A185 N187 T188 E192	A185-K190 PolarHBondContact O-N 3.48Å; N187-K190 VanDerWaalsContact O-CG 3.27Å; N187-K190 WeakPolarHBondContact O-CG 3.45Å; T188-K190 VanDerWaalsContact C-N 3.31Å; K190-E192 PolarHBondContact O-N 3.17Å
191	V	98.9	Very high	98.7	Very high	13 Å²	13	29.9 Å²	29.9	8%	0.079	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-48.2	135.5	178.2	172.4	0	0	0	0	110	A185 A189 S195 A216 A218 F266	A185-V191 HydrophobicContact CB-CG2 4.21Å; A185-V191 PolarHBondContact O-N 2.99Å; A185-V191 VanDerWaalsContact O-N 3.16Å; A189-V191 HydrophobicContact CB-CG2 4.01Å; V191-S195 WeakPolarHBondContact CG1-OG 3.5Å; V191-A216 HydrophobicContact CB-CB 3.71Å; V191-A216 HydrophobicContact CG1-CB 3.72Å; V191-A218 HydrophobicContact CG1-CB 3.96Å; V191-F266 HydrophobicContact CB-CD2 4.4Å; V191-F266 HydrophobicContact CG1-CD2 4.32Å; V191-F266 HydrophobicContact CG2-CB 4.18Å; V191-F266 HydrophobicContact CG2-CD1 4.36Å; V191-F266 HydrophobicContact CG2-CD2 4.14Å; V191-F266 HydrophobicContact CG2-CG 3.96Å
192	E	98.4	Very high	98.7	Very high	132 Å²	132	29.9 Å²	29.9	62%	0.617	18%	0.177	S	C	*	.	P	Polyproline II helix	trans	-101.7	148.4	-176.1	-63.1	175.5	178	0	0	110.6	K190 G194 S195 F266	K190-E192 PolarHBondContact O-N 3.17Å; E192-G194 PolarHBondContact O-N 2.93Å; E192-S195 WeakPolarHBondContact O-CB 3.1Å; E192-S195 PolarHBondContact O-N 2.99Å; E192-S195 VanDerWaalsContact O-N 3.14Å; E192-S195 PolarHBondContact O-OG 3.42Å; E192-F266 HydrophobicContact CB-CE2 4.36Å; E192-F266 HydrophobicContact CG-CE2 4.4Å; E192-F266 HydrophobicContact CG-CZ 4.08Å
193	A	98.7	Very high	98.6	Very high	85 Å²	85	29.9 Å²	29.9	70%	0.702	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	133.9	174.8	0	0	0	0	0	110.3	S195 A216 G217	A193-S195 VanDerWaalsContact C-N 3.28Å; A193-S195 PolarHBondContact O-N 3.17Å; A193-A216 PolarHBondContact N-O 3.29Å; A193-G217 CarbonylContact C-O 3.5Å; A193-G217 WeakPolarHBondContact CA-O 3.01Å
194	G	98.5	Very high	98.5	Very high	51 Å²	51	29.9 Å²	29.9	53%	0.526	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-10.7	-177.3	0	0	0	0	0	114.9	E192 G217 S219	E192-G194 PolarHBondContact O-N 2.93Å; G194-G217 PolarHBondContact N-O 3.11Å; G194-S219 WeakPolarHBondContact O-CB 3.41Å; G194-S219 PolarHBondContact O-OG 3.39Å
195	S	98.6	Very high	98.5	Very high	8 Å²	8	31.2 Å²	31.2	6%	0.056	20%	0.197	C	C	.	.			trans	-70	164	-179.6	70.9	0	0	0	0	113.8	V191 E192 A193 A218 S219 R220	V191-S195 WeakPolarHBondContact CG1-OG 3.5Å; E192-S195 WeakPolarHBondContact O-CB 3.1Å; E192-S195 PolarHBondContact O-N 2.99Å; E192-S195 VanDerWaalsContact O-N 3.14Å; E192-S195 PolarHBondContact O-OG 3.42Å; A193-S195 VanDerWaalsContact C-N 3.28Å; A193-S195 PolarHBondContact O-N 3.17Å; S195-A218 CarbonylContact O-C 3.55Å; S195-A218 WeakPolarHBondContact O-CA 3.38Å; S195-S219 PolarHBondContact O-N 3.34Å; S195-S219 PolarHBondContact O-OG 3.48Å; S195-R220 PolarHBondContact O-N 3.01Å
196	S	98.8	Very high	98.5	Very high	16 Å²	16	31.3 Å²	31.3	11%	0.112	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137	171.4	60.4	0	0	0	0	111.1	R220 V264 D265 F266	S196-R220 CarbonylContact C-O 3.52Å; S196-R220 WeakPolarHBondContact CA-O 3.25Å; S196-V264 WeakPolarHBondContact OG-CA 3.22Å; S196-D265 PolarHBondContact N-OD2 2.93Å; S196-D265 WeakPolarHBondContact O-CB 3.4Å; S196-D265 PolarHBondContact O-N 3.02Å; S196-D265 VanDerWaalsContact O-N 3.08Å; S196-D265 PolarHBondContact OG-N 3.09Å; S196-D265 VanDerWaalsContact OG-N 3.08Å; S196-D265 PolarHBondContact OG-OD2 3.23Å; S196-F266 PolarHBondContact O-N 2.78Å
197	C	98.9	Very high	98.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.8	179.6	-57.7	0	0	0	0	111.9	C213 R220 I221 I222 F266	C197-C213 HydrophobicContact CB-CB 4.27Å; C197-R220 PolarHBondContact N-O 3.47Å; C197-I221 HydrophobicContact CB-CG1 4.44Å; C197-I221 WeakPolarHBondContact O-CA 3.29Å; C197-I222 PolarHBondContact O-N 2.98Å; C197-F266 CarbonylContact C-O 3.52Å; C197-F266 WeakPolarHBondContact CA-O 3.37Å
198	A	98.9	Very high	98.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.9	163.8	0	0	0	0	0	110.3	F200 I222 I256 V264 F266 S267 L268	A198-F200 HydrophobicContact CB-CD2 4.46Å; A198-F200 HydrophobicContact CB-CE2 3.75Å; A198-F200 HydrophobicContact CB-CZ 4.37Å; A198-I222 CarbonylContact C-O 3.56Å; A198-I222 WeakPolarHBondContact CA-O 3.33Å; A198-I222 HydrophobicContact CB-CB 4.49Å; A198-I256 HydrophobicContact CB-CD1 4.2Å; A198-V264 HydrophobicContact CB-CB 4.44Å; A198-V264 HydrophobicContact CB-CG1 3.98Å; A198-V264 HydrophobicContact CB-CG2 3.78Å; A198-F266 PolarHBondContact N-O 2.81Å; A198-S267 CarbonylContact O-C 3.45Å; A198-S267 VanDerWaalsContact O-CA 3.26Å; A198-S267 WeakPolarHBondContact O-CA 3.32Å; A198-L268 PolarHBondContact O-N 3.23Å
199	V	98.9	Very high	98.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116.5	178.2	-176.7	0	0	0	0	109.2	G206 A209 V210 I221 I222 V224 L268	V199-G206 WeakPolarHBondContact CG1-O 3.41Å; V199-A209 HydrophobicContact CG1-CB 4.03Å; V199-A209 HydrophobicContact CG2-CB 4.42Å; V199-V210 HydrophobicContact CB-CG2 3.96Å; V199-V210 HydrophobicContact CG1-CG2 4.17Å; V199-V210 HydrophobicContact CG2-CG2 3.9Å; V199-I221 HydrophobicContact CG2-CG2 4.5Å; V199-I222 PolarHBondContact N-O 3Å; V199-V224 PolarHBondContact O-N 2.99Å; V199-L268 WeakPolarHBondContact CA-O 3.41Å; V199-L268 HydrophobicContact CG2-CD1 4.17Å
200	F	98.9	Very high	98.5	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.8	-177.2	-63.5	-103.3	0	0	0	110.8	A198 V224 V252 I256 L268 C270 V276 A280 S283	A198-F200 HydrophobicContact CB-CD2 4.46Å; A198-F200 HydrophobicContact CB-CE2 3.75Å; A198-F200 HydrophobicContact CB-CZ 4.37Å; F200-V224 HydrophobicContact CD1-CB 3.91Å; F200-V224 HydrophobicContact CD1-CG1 3.75Å; F200-V224 HydrophobicContact CD1-CG2 4.22Å; F200-V224 HydrophobicContact CE1-CB 4.29Å; F200-V224 HydrophobicContact CE1-CG1 4Å; F200-V224 HydrophobicContact CE1-CG2 4.17Å; F200-V224 HydrophobicContact CG-CB 4.26Å; F200-V224 HydrophobicContact CZ-CG2 4.42Å; F200-V252 HydrophobicContact CE1-CG1 3.94Å; F200-V252 HydrophobicContact CE1-CG2 4.32Å; F200-I256 HydrophobicContact CE1-CD1 3.99Å; F200-I256 HydrophobicContact CE2-CD1 4.31Å; F200-I256 HydrophobicContact CZ-CD1 3.45Å; F200-I256 VanDerWaalsContact CZ-CD1 3.45Å; F200-L268 PolarHBondContact N-O 3.16Å; F200-C270 WeakPolarHBondContact O-CA 3.48Å; F200-C270 WeakPolarHBondContact O-CB 3.45Å; F200-C270 PolarHBondContact O-N 2.88Å; F200-V276 HydrophobicContact CB-CG1 3.66Å; F200-V276 HydrophobicContact CD1-CG1 3.93Å; F200-V276 HydrophobicContact CG-CG1 4.07Å; F200-A280 HydrophobicContact CD2-CB 3.71Å; F200-A280 HydrophobicContact CE2-CB 3.73Å; F200-A280 HydrophobicContact CG-CB 4.32Å; F200-A280 HydrophobicContact CZ-CB 4.33Å; F200-S283 WeakPolarHBondContact CZ-OG 3.48Å
201	G	98.3	Very high	98.5	Very high	9 Å²	9	19.1 Å²	19.1	9%	0.093	14%	0.136	C	C	.	.			trans	87.1	122	-174.9	0	0	0	0	0	111.9	G206 V224	G201-G206 VanDerWaalsContact O-CA 3.31Å; G201-G206 WeakPolarHBondContact O-CA 3.13Å; G201-V224 PolarHBondContact N-O 2.96Å
202	L	97.9	Very high	98.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	13%	0.132	C	C	.	.			trans	-115.5	39.2	-173.8	-57.7	173.5	0	0	0	112.1	L207 V210 A223 D225 K230 A234 F242	L202-L207 HydrophobicContact CB-CD2 4.2Å; L202-L207 HydrophobicContact CB-CG 4.41Å; L202-L207 HydrophobicContact CD2-CD2 4.4Å; L202-L207 WeakPolarHBondContact O-CD1 3.48Å; L202-L207 WeakPolarHBondContact O-CG 3.44Å; L202-V210 HydrophobicContact CD2-CG2 4.26Å; L202-A223 HydrophobicContact CD1-CB 3.75Å; L202-A223 HydrophobicContact CD2-CB 3.78Å; L202-A223 HydrophobicContact CG-CB 4.37Å; L202-D225 HydrophobicContact CB-CB 4.15Å; L202-D225 WeakPolarHBondContact CB-OD2 3.44Å; L202-D225 HydrophobicContact CD1-CB 3.63Å; L202-D225 HydrophobicContact CG-CB 3.83Å; L202-D225 PolarHBondContact N-OD2 3.34Å; L202-K230 HydrophobicContact CB-CB 3.83Å; L202-K230 HydrophobicContact CB-CG 4.28Å; L202-K230 HydrophobicContact CD1-CB 3.98Å; L202-A234 HydrophobicContact CD1-CB 3.97Å; L202-A234 HydrophobicContact CD2-CB 4.31Å; L202-F242 HydrophobicContact CD1-CD2 3.93Å; L202-F242 HydrophobicContact CD1-CE2 3.62Å
203	G	96.4	Very high	98.6	Very high	38 Å²	38	12.2 Å²	12.2	39%	0.392	10%	0.103	S	C	.	.	S	Bend	trans	-69.9	-176.6	156.7	0	0	0	0	0	111.4	V205 G206 L207	G203-V205 VanDerWaalsContact C-N 3.25Å; G203-V205 PolarHBondContact O-N 2.91Å; G203-V205 VanDerWaalsContact O-N 3.16Å; G203-G206 PolarHBondContact O-N 2.83Å; G203-L207 WeakPolarHBondContact O-CB 3.26Å; G203-L207 WeakPolarHBondContact O-CG 3.24Å; G203-L207 PolarHBondContact O-N 2.71Å
204	A	97.5	Very high	98.6	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-58.2	-35.3	-175.9	0	0	0	0	0	114	A208 F346 V369 R370	A204-A208 VanDerWaalsContact O-CB 3.27Å; A204-A208 WeakPolarHBondContact O-CB 3.39Å; A204-A208 PolarHBondContact O-N 2.96Å; A204-F346 HydrophobicContact CB-CD1 4.13Å; A204-F346 WeakPolarHBondContact O-CE1 3.46Å; A204-V369 HydrophobicContact CB-CG1 3.9Å; A204-R370 HydrophobicContact CB-CG 3.81Å
205	V	98.6	Very high	98.6	Very high	28 Å²	28	14.1 Å²	14.1	17%	0.17	9%	0.092	C	C	.	.	H	α-helix	trans	-65.1	-50.7	177.2	178.8	0	0	0	0	110.7	T180 G181 G203 A208 A209 C270 V294	T180-V205 HydrophobicContact CG2-CG1 3.9Å; G181-V205 VanDerWaalsContact CA-O 3.27Å; G181-V205 WeakPolarHBondContact CA-O 3.33Å; G203-V205 VanDerWaalsContact C-N 3.25Å; G203-V205 PolarHBondContact O-N 2.91Å; G203-V205 VanDerWaalsContact O-N 3.16Å; V205-A208 WeakPolarHBondContact O-CB 3.49Å; V205-A208 PolarHBondContact O-N 3.04Å; V205-A209 PolarHBondContact O-N 2.86Å; V205-C270 HydrophobicContact CG1-CB 4.21Å; V205-V294 HydrophobicContact CG1-CG1 3.65Å
206	G	98.8	Very high	98.6	Very high	1 Å²	1	15 Å²	15	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-66.1	-39.8	178.8	0	0	0	0	0	113.2	V199 G201 G203 A208 A209 V210	V199-G206 WeakPolarHBondContact CG1-O 3.41Å; G201-G206 VanDerWaalsContact O-CA 3.31Å; G201-G206 WeakPolarHBondContact O-CA 3.13Å; G203-G206 PolarHBondContact O-N 2.83Å; G206-A208 VanDerWaalsContact C-N 3.26Å; G206-A208 PolarHBondContact O-N 3.43Å; G206-A209 CarbonylContact O-C 3.56Å; G206-A209 WeakPolarHBondContact O-CA 3.32Å; G206-A209 WeakPolarHBondContact O-CB 3.2Å; G206-A209 PolarHBondContact O-N 2.78Å; G206-V210 WeakPolarHBondContact O-CG2 3.47Å; G206-V210 PolarHBondContact O-N 2.79Å
207	L	98.8	Very high	98.6	Very high	1 Å²	1	16 Å²	16	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-36.1	172.6	-71.1	174.5	0	0	0	111.9	L202 G203 V210 M211 K233 A234 L237 F346 V369	L202-L207 HydrophobicContact CB-CD2 4.2Å; L202-L207 HydrophobicContact CB-CG 4.41Å; L202-L207 HydrophobicContact CD2-CD2 4.4Å; L202-L207 WeakPolarHBondContact O-CD1 3.48Å; L202-L207 WeakPolarHBondContact O-CG 3.44Å; G203-L207 WeakPolarHBondContact O-CB 3.26Å; G203-L207 WeakPolarHBondContact O-CG 3.24Å; G203-L207 PolarHBondContact O-N 2.71Å; L207-V210 PolarHBondContact O-N 2.74Å; L207-M211 PolarHBondContact O-N 3.32Å; L207-K233 HydrophobicContact CD1-CG 3.81Å; L207-K233 HydrophobicContact CD2-CG 4.23Å; L207-A234 HydrophobicContact CD2-CB 3.86Å; L207-L237 HydrophobicContact CB-CD1 3.71Å; L207-L237 HydrophobicContact CD1-CD1 4.44Å; L207-L237 HydrophobicContact CD2-CD1 4.12Å; L207-L237 HydrophobicContact CG-CD1 4.29Å; L207-F346 HydrophobicContact CB-CD1 4.31Å; L207-F346 HydrophobicContact CB-CE1 3.56Å; L207-F346 HydrophobicContact CB-CZ 4.28Å; L207-V369 HydrophobicContact CD1-CG1 3.79Å; L207-V369 HydrophobicContact CD1-CG2 3.99Å
208	A	98.8	Very high	98.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-71.2	-33.1	172.9	0	0	0	0	0	112.5	I178 Y182 A204 V205 G206 M211 G212 F346	I178-A208 HydrophobicContact CB-CB 4.47Å; I178-A208 HydrophobicContact CD1-CB 4.09Å; I178-A208 HydrophobicContact CG2-CB 4.29Å; Y182-A208 WeakPolarHBondContact CA-O 3.49Å; Y182-A208 PolarHBondContact N-O 3.12Å; A204-A208 VanDerWaalsContact O-CB 3.27Å; A204-A208 WeakPolarHBondContact O-CB 3.39Å; A204-A208 PolarHBondContact O-N 2.96Å; V205-A208 WeakPolarHBondContact O-CB 3.49Å; V205-A208 PolarHBondContact O-N 3.04Å; G206-A208 VanDerWaalsContact C-N 3.26Å; G206-A208 PolarHBondContact O-N 3.43Å; A208-M211 PolarHBondContact O-N 2.9Å; A208-G212 PolarHBondContact O-N 2.91Å; A208-F346 HydrophobicContact CB-CE1 4.08Å; A208-F346 HydrophobicContact CB-CZ 4.14Å
209	A	98.9	Very high	98.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.1	-41.3	171	0	0	0	0	0	112	G181 V199 V205 G206 G212 C213 L268	G181-A209 VanDerWaalsContact O-CA 3.31Å; G181-A209 WeakPolarHBondContact O-CA 3.41Å; V199-A209 HydrophobicContact CG1-CB 4.03Å; V199-A209 HydrophobicContact CG2-CB 4.42Å; V205-A209 PolarHBondContact O-N 2.86Å; G206-A209 CarbonylContact O-C 3.56Å; G206-A209 WeakPolarHBondContact O-CA 3.32Å; G206-A209 WeakPolarHBondContact O-CB 3.2Å; G206-A209 PolarHBondContact O-N 2.78Å; A209-G212 PolarHBondContact O-N 3.4Å; A209-C213 PolarHBondContact O-N 3.13Å; A209-C213 PolarHBondContact O-SG 3.11Å; A209-L268 HydrophobicContact CB-CD2 4.15Å
210	V	98.9	Very high	98.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.4	-49.2	171.3	168.2	0	0	0	0	110.5	V199 L202 G206 L207 G212 C213 K214 I221 L237 A239	V199-V210 HydrophobicContact CB-CG2 3.96Å; V199-V210 HydrophobicContact CG1-CG2 4.17Å; V199-V210 HydrophobicContact CG2-CG2 3.9Å; L202-V210 HydrophobicContact CD2-CG2 4.26Å; G206-V210 WeakPolarHBondContact O-CG2 3.47Å; G206-V210 PolarHBondContact O-N 2.79Å; L207-V210 PolarHBondContact O-N 2.74Å; V210-G212 VanDerWaalsContact C-N 3.29Å; V210-G212 PolarHBondContact O-N 3.09Å; V210-C213 PolarHBondContact O-N 3.06Å; V210-K214 PolarHBondContact O-N 2.94Å; V210-I221 HydrophobicContact CB-CG2 4.47Å; V210-I221 HydrophobicContact CG1-CG2 4.15Å; V210-I221 HydrophobicContact CG2-CG2 4.17Å; V210-L237 HydrophobicContact CG1-CB 4.38Å; V210-A239 HydrophobicContact CG1-CB 4.16Å; V210-A239 VanDerWaalsContact CG1-N 3.35Å
211	M	98.8	Very high	98.5	Very high	14 Å²	14	23.6 Å²	23.6	7%	0.069	16%	0.156	C	C	.	.	H	α-helix	trans	-58.7	-40.5	175.7	179.9	174.9	61.6	0	0	112	I178 Y182 L207 A208 K214 A215 V341 K342 F346	I178-M211 HydrophobicContact CG2-CE 3.93Å; Y182-M211 HydrophobicContact CD2-CE 3.9Å; Y182-M211 HydrophobicContact CD2-CG 4.19Å; Y182-M211 HydrophobicContact CE2-CG 4.32Å; L207-M211 PolarHBondContact O-N 3.32Å; A208-M211 PolarHBondContact O-N 2.9Å; M211-K214 PolarHBondContact O-N 3.41Å; M211-A215 WeakPolarHBondContact O-CB 3.22Å; M211-A215 PolarHBondContact O-N 2.9Å; M211-V341 HydrophobicContact CE-CG1 3.79Å; M211-V341 HydrophobicContact SD-CG1 4.29Å; M211-K342 HydrophobicContact SD-CB 3.88Å; M211-F346 HydrophobicContact CE-CE2 4.05Å; M211-F346 HydrophobicContact CE-CZ 4.05Å; M211-F346 HydrophobicContact SD-CE2 4.3Å
212	G	98.8	Very high	98.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.1	-42	176.1	0	0	0	0	0	113.4	Y182 V186 A208 A209 V210 K214 A215 A216	Y182-G212 VanDerWaalsContact CD2-CA 3.49Å; V186-G212 WeakPolarHBondContact CG1-O 3.27Å; A208-G212 PolarHBondContact O-N 2.91Å; A209-G212 PolarHBondContact O-N 3.4Å; V210-G212 VanDerWaalsContact C-N 3.29Å; V210-G212 PolarHBondContact O-N 3.09Å; G212-K214 VanDerWaalsContact C-N 3.33Å; G212-K214 PolarHBondContact O-N 3.47Å; G212-A215 PolarHBondContact O-N 3.06Å; G212-A216 WeakPolarHBondContact O-CB 3.37Å; G212-A216 PolarHBondContact O-N 2.98Å
213	C	98.9	Very high	98.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.7	-43.1	175.3	-64.1	0	0	0	0	111	C197 A209 V210 A216 G217 A218 I221	C197-C213 HydrophobicContact CB-CB 4.27Å; A209-C213 PolarHBondContact O-N 3.13Å; A209-C213 PolarHBondContact O-SG 3.11Å; V210-C213 PolarHBondContact O-N 3.06Å; C213-A216 PolarHBondContact O-N 2.72Å; C213-G217 PolarHBondContact O-N 3.25Å; C213-A218 HydrophobicContact CB-CB 4.26Å; C213-A218 WeakPolarHBondContact O-CB 3.46Å; C213-A218 PolarHBondContact O-N 2.83Å; C213-A218 VanDerWaalsContact O-N 3.1Å; C213-I221 HydrophobicContact CB-CD1 3.75Å; C213-I221 HydrophobicContact CB-CG1 4Å; C213-I221 HydrophobicContact CB-CG2 4.48Å
214	K	98.8	Very high	98.7	Very high	118 Å²	118	21.6 Å²	21.6	51%	0.513	14%	0.135	S	C	.	.	H	α-helix	trans	-63.5	-44.3	175.1	175.8	167.8	173.9	178.9	0	111.8	V210 M211 G212 A216 G217 I221 G238	V210-K214 PolarHBondContact O-N 2.94Å; M211-K214 PolarHBondContact O-N 3.41Å; G212-K214 VanDerWaalsContact C-N 3.33Å; G212-K214 PolarHBondContact O-N 3.47Å; K214-A216 PolarHBondContact O-N 3.42Å; K214-G217 PolarHBondContact O-N 3.07Å; K214-I221 HydrophobicContact CB-CD1 3.88Å; K214-G238 VanDerWaalsContact CD-CA 3.4Å
215	A	98.5	Very high	98.8	Very high	59 Å²	59	22.8 Å²	22.8	49%	0.488	14%	0.141	S	C	.	.	H	α-helix	trans	-62.6	-30.9	177.5	0	0	0	0	0	112.7	Y182 M211 G212 G217	Y182-A215 HydrophobicContact CE2-CB 3.78Å; Y182-A215 WeakPolarHBondContact OH-CB 3.21Å; M211-A215 WeakPolarHBondContact O-CB 3.22Å; M211-A215 PolarHBondContact O-N 2.9Å; G212-A215 PolarHBondContact O-N 3.06Å; A215-G217 VanDerWaalsContact C-N 3.28Å
216	A	98.7	Very high	98.7	Very high	27 Å²	27	26 Å²	26	22%	0.223	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.2	173.8	0	0	0	0	0	114.1	V186 V191 A193 G212 C213 K214	V186-A216 HydrophobicContact CG1-CB 4.49Å; V191-A216 HydrophobicContact CB-CB 3.71Å; V191-A216 HydrophobicContact CG1-CB 3.72Å; A193-A216 PolarHBondContact N-O 3.29Å; G212-A216 WeakPolarHBondContact O-CB 3.37Å; G212-A216 PolarHBondContact O-N 2.98Å; C213-A216 PolarHBondContact O-N 2.72Å; K214-A216 PolarHBondContact O-N 3.42Å
217	G	98.6	Very high	98.6	Very high	35 Å²	35	27.8 Å²	27.8	36%	0.361	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	22.4	176.6	0	0	0	0	0	115.1	A193 G194 C213 K214 A215 S219	A193-G217 CarbonylContact C-O 3.5Å; A193-G217 WeakPolarHBondContact CA-O 3.01Å; G194-G217 PolarHBondContact N-O 3.11Å; C213-G217 PolarHBondContact O-N 3.25Å; K214-G217 PolarHBondContact O-N 3.07Å; A215-G217 VanDerWaalsContact C-N 3.28Å; G217-S219 PolarHBondContact O-N 3.45Å
218	A	98.8	Very high	98.4	Very high	16 Å²	16	31.2 Å²	31.2	13%	0.132	19%	0.188	C	C	.	.			trans	-55.1	136.4	172.2	0	0	0	0	0	111	V191 S195 C213 I221	V191-A218 HydrophobicContact CG1-CB 3.96Å; S195-A218 CarbonylContact O-C 3.55Å; S195-A218 WeakPolarHBondContact O-CA 3.38Å; C213-A218 HydrophobicContact CB-CB 4.26Å; C213-A218 WeakPolarHBondContact O-CB 3.46Å; C213-A218 PolarHBondContact O-N 2.83Å; C213-A218 VanDerWaalsContact O-N 3.1Å; A218-I221 HydrophobicContact CB-CD1 4.14Å; A218-I221 HydrophobicContact CB-CG1 3.84Å
219	S	98.3	Very high	98.2	Very high	78 Å²	78	37.7 Å²	37.7	55%	0.545	22%	0.222	S	C	.	.	S	Bend	trans	-81	-30.6	-178.6	62.7	0	0	0	0	112.5	G194 S195 G217	G194-S219 WeakPolarHBondContact O-CB 3.41Å; G194-S219 PolarHBondContact O-OG 3.39Å; S195-S219 PolarHBondContact O-N 3.34Å; S195-S219 PolarHBondContact O-OG 3.48Å; G217-S219 PolarHBondContact O-N 3.45Å
220	R	98.8	Very high	98	Very high	68 Å²	68	38.8 Å²	38.8	26%	0.257	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	130.3	180	-164.7	178.6	-172.3	179.6	0.1	110.1	S195 S196 C197 I222 T240 D241 M259	S195-R220 PolarHBondContact O-N 3.01Å; S196-R220 CarbonylContact C-O 3.52Å; S196-R220 WeakPolarHBondContact CA-O 3.25Å; C197-R220 PolarHBondContact N-O 3.47Å; R220-I222 HydrophobicContact CG-CG1 4.43Å; R220-T240 VanDerWaalsContact CG-OG1 3.31Å; R220-T240 WeakPolarHBondContact CG-OG1 3.4Å; R220-D241 VanDerWaalsContact CG-OD2 3.25Å; R220-D241 WeakPolarHBondContact CG-OD2 3.45Å; R220-D241 IonicContact CZ-OD1 3.11Å; R220-D241 IonicContact CZ-OD2 3.52Å; R220-D241 IonicContact NE-OD1 3.62Å; R220-D241 PolarHBondContact NE-OD1 3.2Å; R220-D241 IonicContact NE-OD2 3.39Å; R220-D241 PolarHBondContact NE-OD2 3Å; R220-D241 IonicContact NH2-OD1 3.33Å; R220-D241 PolarHBondContact NH2-OD1 3.07Å; R220-D241 IonicContact NH2-OD2 2.8Å; R220-M259 PolarHBondContact NH1-O 3.18Å
221	I	98.9	Very high	98	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	104.3	-179.3	-57	166.2	0	0	0	107.9	C197 V199 V210 C213 K214 A218 G238 A239 T240 D241	C197-I221 HydrophobicContact CB-CG1 4.44Å; C197-I221 WeakPolarHBondContact O-CA 3.29Å; V199-I221 HydrophobicContact CG2-CG2 4.5Å; V210-I221 HydrophobicContact CB-CG2 4.47Å; V210-I221 HydrophobicContact CG1-CG2 4.15Å; V210-I221 HydrophobicContact CG2-CG2 4.17Å; C213-I221 HydrophobicContact CB-CD1 3.75Å; C213-I221 HydrophobicContact CB-CG1 4Å; C213-I221 HydrophobicContact CB-CG2 4.48Å; K214-I221 HydrophobicContact CB-CD1 3.88Å; A218-I221 HydrophobicContact CB-CD1 4.14Å; A218-I221 HydrophobicContact CB-CG1 3.84Å; I221-G238 WeakPolarHBondContact CD1-O 3.41Å; I221-A239 WeakPolarHBondContact O-CA 3.49Å; I221-T240 PolarHBondContact N-OG1 2.94Å; I221-T240 PolarHBondContact O-N 3.18Å; I221-T240 PolarHBondContact O-OG1 3.32Å; I221-D241 PolarHBondContact O-N 2.91Å
222	I	98.9	Very high	97.9	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	109.1	179.3	-52.8	173.5	0	0	0	108.3	C197 A198 V199 R220 V224 D241 L243 I256 M259 T260 V264	C197-I222 PolarHBondContact O-N 2.98Å; A198-I222 CarbonylContact C-O 3.56Å; A198-I222 WeakPolarHBondContact CA-O 3.33Å; A198-I222 HydrophobicContact CB-CB 4.49Å; V199-I222 PolarHBondContact N-O 3Å; R220-I222 HydrophobicContact CG-CG1 4.43Å; I222-V224 HydrophobicContact CG2-CG2 4.13Å; I222-D241 HydrophobicContact CB-CB 4.48Å; I222-D241 HydrophobicContact CG1-CB 4.19Å; I222-D241 HydrophobicContact CG2-CB 4.38Å; I222-L243 HydrophobicContact CG2-CB 4.06Å; I222-I256 HydrophobicContact CD1-CG2 4.26Å; I222-M259 HydrophobicContact CD1-CE 4.15Å; I222-M259 HydrophobicContact CG1-CE 4.46Å; I222-M259 HydrophobicContact CG2-CE 4.38Å; I222-T260 HydrophobicContact CD1-CG2 3.75Å; I222-V264 HydrophobicContact CD1-CG1 4.17Å
223	A	98.9	Very high	97.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.7	175.7	0	0	0	0	0	109.9	L202 A234 A239 D241 F242 L243	L202-A223 HydrophobicContact CD1-CB 3.75Å; L202-A223 HydrophobicContact CD2-CB 3.78Å; L202-A223 HydrophobicContact CG-CB 4.37Å; A223-A234 HydrophobicContact CB-CB 3.83Å; A223-A239 HydrophobicContact CB-CB 3.64Å; A223-D241 PolarHBondContact N-O 3.3Å; A223-F242 HydrophobicContact CB-CD2 4.29Å; A223-F242 CarbonylContact O-C 3.6Å; A223-F242 WeakPolarHBondContact O-CA 3.2Å; A223-F242 WeakPolarHBondContact O-CD2 3.4Å; A223-L243 PolarHBondContact O-N 3.28Å
224	V	98.9	Very high	97.7	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.03	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	116.8	-173.7	-172.8	0	0	0	0	110.1	V199 F200 G201 I222 L243 P245 V252 I256	V199-V224 PolarHBondContact O-N 2.99Å; F200-V224 HydrophobicContact CD1-CB 3.91Å; F200-V224 HydrophobicContact CD1-CG1 3.75Å; F200-V224 HydrophobicContact CD1-CG2 4.22Å; F200-V224 HydrophobicContact CE1-CB 4.29Å; F200-V224 HydrophobicContact CE1-CG1 4Å; F200-V224 HydrophobicContact CE1-CG2 4.17Å; F200-V224 HydrophobicContact CG-CB 4.26Å; F200-V224 HydrophobicContact CZ-CG2 4.42Å; G201-V224 PolarHBondContact N-O 2.96Å; I222-V224 HydrophobicContact CG2-CG2 4.13Å; V224-L243 WeakPolarHBondContact CA-O 3.45Å; V224-L243 HydrophobicContact CG2-CB 4.32Å; V224-L243 HydrophobicContact CG2-CD2 4.37Å; V224-P245 HydrophobicContact CG1-CG 3.83Å; V224-V252 HydrophobicContact CG1-CG2 3.86Å; V224-I256 HydrophobicContact CG2-CD1 4.08Å
225	D	98.5	Very high	97.7	Very high	26 Å²	26	49 Å²	49	14%	0.139	28%	0.277	C	S	.	.			trans	-153.2	150.8	176	-155.4	-66.2	0	0	0	111.3	L202 N227 F242 L243 N244	L202-D225 HydrophobicContact CB-CB 4.15Å; L202-D225 WeakPolarHBondContact CB-OD2 3.44Å; L202-D225 HydrophobicContact CD1-CB 3.63Å; L202-D225 HydrophobicContact CG-CB 3.83Å; L202-D225 PolarHBondContact N-OD2 3.34Å; D225-N227 VanDerWaalsContact C-N 3.29Å; D225-N227 WeakPolarHBondContact OD1-CB 3.41Å; D225-N227 PolarHBondContact OD1-N 3.34Å; D225-F242 HydrophobicContact CB-CE2 3.98Å; D225-F242 HydrophobicContact CB-CZ 4.29Å; D225-L243 PolarHBondContact N-O 3.39Å; D225-N244 VanDerWaalsContact O-CA 3.3Å; D225-N244 WeakPolarHBondContact O-CA 3.25Å
226	I	97.4	Very high	97.7	Very high	95 Å²	95	50.4 Å²	50.4	49%	0.487	27%	0.273	S	S	.	.	S	Bend	trans	-79	-14.4	175.8	60.7	169.4	0	0	0	113.1	N244 P245 K246	I226-N244 WeakPolarHBondContact CA-OD1 3.49Å; I226-P245 HydrophobicContact CG2-CG 4.42Å; I226-K246 HydrophobicContact CB-CD 4.35Å; I226-K246 HydrophobicContact CG2-CG 4.47Å
227	N	95.9	Very high	97.6	Very high	39 Å²	39	49.3 Å²	49.3	21%	0.209	26%	0.264	C	S	.	.			trans	-100.9	108.7	177.7	-176.4	-6.6	0	0	0	110.2	D225 D229 K230	D225-N227 VanDerWaalsContact C-N 3.29Å; D225-N227 WeakPolarHBondContact OD1-CB 3.41Å; D225-N227 PolarHBondContact OD1-N 3.34Å; N227-D229 PolarHBondContact O-N 3.12Å; N227-D229 VanDerWaalsContact OD1-CB 3.3Å; N227-D229 WeakPolarHBondContact OD1-CB 3.33Å; N227-D229 PolarHBondContact OD1-N 2.95Å; N227-K230 HydrophobicContact CB-CG 4.15Å; N227-K230 PolarHBondContact O-N 3.13Å
228	P	96	Very high	97.6	Very high	73 Å²	73	48.1 Å²	48.1	47%	0.474	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-64.2	-22.8	-178.8	27.9	-35.3	0	0	0	113.4	K230 A231 F242	P228-K230 PolarHBondContact O-N 3.46Å; P228-A231 VanDerWaalsContact O-CB 3.25Å; P228-A231 WeakPolarHBondContact O-CB 3.37Å; P228-A231 PolarHBondContact O-N 3.1Å; P228-F242 HydrophobicContact CB-CE1 4.39Å
229	D	94.8	Very high	97.6	Very high	136 Å²	136	47.9 Å²	47.9	73%	0.727	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-64.2	-16.3	179.9	-60.7	-18.6	0	0	0	112.5	N227 A231	N227-D229 PolarHBondContact O-N 3.12Å; N227-D229 VanDerWaalsContact OD1-CB 3.3Å; N227-D229 WeakPolarHBondContact OD1-CB 3.33Å; N227-D229 PolarHBondContact OD1-N 2.95Å; D229-A231 VanDerWaalsContact C-N 3.34Å
230	K	94.9	Very high	97.6	Very high	23 Å²	23	47.9 Å²	47.9	10%	0.1	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-80.2	-14.4	177.2	-56.1	-62	-179.9	-171.8	0	113.2	L202 N227 P228 E232 K233 A234 S366 C368	L202-K230 HydrophobicContact CB-CB 3.83Å; L202-K230 HydrophobicContact CB-CG 4.28Å; L202-K230 HydrophobicContact CD1-CB 3.98Å; N227-K230 HydrophobicContact CB-CG 4.15Å; N227-K230 PolarHBondContact O-N 3.13Å; P228-K230 PolarHBondContact O-N 3.46Å; K230-E232 PolarHBondContact O-N 2.64Å; K230-K233 PolarHBondContact O-N 3.41Å; K230-A234 WeakPolarHBondContact O-CB 3.41Å; K230-A234 PolarHBondContact O-N 3.25Å; K230-S366 PolarHBondContact NZ-O 2.97Å; K230-C368 PolarHBondContact NZ-O 3.09Å
231	A	96.9	Very high	97.6	Very high	20 Å²	20	46.8 Å²	46.8	17%	0.165	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-48.9	-172.9	0	0	0	0	0	113.1	P228 D229 K233 A234 K235 F242	P228-A231 VanDerWaalsContact O-CB 3.25Å; P228-A231 WeakPolarHBondContact O-CB 3.37Å; P228-A231 PolarHBondContact O-N 3.1Å; D229-A231 VanDerWaalsContact C-N 3.34Å; A231-K233 VanDerWaalsContact C-N 3.35Å; A231-K233 PolarHBondContact O-N 3.14Å; A231-A234 PolarHBondContact O-N 2.83Å; A231-K235 WeakPolarHBondContact O-CB 3.33Å; A231-K235 PolarHBondContact O-N 3.37Å; A231-F242 HydrophobicContact CB-CB 4Å; A231-F242 HydrophobicContact CB-CD1 3.75Å; A231-F242 HydrophobicContact CB-CD2 3.68Å; A231-F242 HydrophobicContact CB-CE1 4.11Å; A231-F242 HydrophobicContact CB-CE2 4.06Å; A231-F242 HydrophobicContact CB-CG 3.51Å; A231-F242 HydrophobicContact CB-CZ 4.27Å
232	E	96.9	Very high	97.6	Very high	136 Å²	136	49.8 Å²	49.8	64%	0.636	26%	0.259	S	S	*	.	H	α-helix	trans	-63.4	-41.2	-177.8	-73	-57.4	126.4	0	0	112	K230 K235 E236	K230-E232 PolarHBondContact O-N 2.64Å; E232-K235 PolarHBondContact O-N 3.14Å; E232-E236 PolarHBondContact O-N 3.39Å
233	K	96.5	Very high	97.6	Very high	58 Å²	58	50 Å²	50	25%	0.252	26%	0.26	S	S	.	.	H	α-helix	trans	-66.3	-40.5	176.6	-175.6	58.4	59.8	178.4	0	111.8	L207 K230 A231 K235 E236 L237 E345	L207-K233 HydrophobicContact CD1-CG 3.81Å; L207-K233 HydrophobicContact CD2-CG 4.23Å; K230-K233 PolarHBondContact O-N 3.41Å; A231-K233 VanDerWaalsContact C-N 3.35Å; A231-K233 PolarHBondContact O-N 3.14Å; K233-K235 VanDerWaalsContact C-N 3.34Å; K233-E236 WeakPolarHBondContact CD-OE2 3.48Å; K233-E236 WeakPolarHBondContact CE-OE2 3.47Å; K233-E236 IonicContact NZ-OE2 3.01Å; K233-E236 PolarHBondContact NZ-OE2 2.85Å; K233-E236 PolarHBondContact O-N 3.04Å; K233-L237 HydrophobicContact CD-CD1 4.33Å; K233-L237 HydrophobicContact CG-CD1 4.4Å; K233-L237 PolarHBondContact O-N 3.44Å; K233-E345 PolarHBondContact NZ-O 3.11Å
234	A	98.3	Very high	97.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-42.2	175.8	0	0	0	0	0	111.5	L202 L207 A223 K230 A231 L237 G238 A239	L202-A234 HydrophobicContact CD1-CB 3.97Å; L202-A234 HydrophobicContact CD2-CB 4.31Å; L207-A234 HydrophobicContact CD2-CB 3.86Å; A223-A234 HydrophobicContact CB-CB 3.83Å; K230-A234 WeakPolarHBondContact O-CB 3.41Å; K230-A234 PolarHBondContact O-N 3.25Å; A231-A234 PolarHBondContact O-N 2.83Å; A234-L237 PolarHBondContact O-N 3.05Å; A234-G238 PolarHBondContact O-N 2.88Å; A234-A239 HydrophobicContact CB-CB 3.88Å; A234-A239 WeakPolarHBondContact O-CB 3.4Å; A234-A239 PolarHBondContact O-N 3.35Å
235	K	98.4	Very high	97.5	Very high	133 Å²	133	52.4 Å²	52.4	58%	0.578	28%	0.275	S	S	*	.	H	α-helix	trans	-61.7	-44.7	175.9	-175.6	-179.1	178.9	-176.9	0	112.3	A231 E232 K233 L237 G238	A231-K235 WeakPolarHBondContact O-CB 3.33Å; A231-K235 PolarHBondContact O-N 3.37Å; E232-K235 PolarHBondContact O-N 3.14Å; K233-K235 VanDerWaalsContact C-N 3.34Å; K235-L237 PolarHBondContact O-N 3.18Å; K235-G238 PolarHBondContact O-N 2.86Å
236	E	97.6	Very high	97.5	Very high	88 Å²	88	58.1 Å²	58.1	41%	0.411	30%	0.298	S	S	.	.	H	α-helix	trans	-55.1	-40.3	174.7	-175.7	-175.5	-175.1	0	0	112	E232 K233 E345	E232-E236 PolarHBondContact O-N 3.39Å; K233-E236 WeakPolarHBondContact CD-OE2 3.48Å; K233-E236 WeakPolarHBondContact CE-OE2 3.47Å; K233-E236 IonicContact NZ-OE2 3.01Å; K233-E236 PolarHBondContact NZ-OE2 2.85Å; K233-E236 PolarHBondContact O-N 3.04Å; E236-E345 WeakPolarHBondContact OE1-CG 3.42Å
237	L	98.1	Very high	97.5	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-84.7	-15.1	-178.3	-69.4	173.3	0	0	0	114.1	L207 V210 K233 A234 K235 K342 E345 F346	L207-L237 HydrophobicContact CB-CD1 3.71Å; L207-L237 HydrophobicContact CD1-CD1 4.44Å; L207-L237 HydrophobicContact CD2-CD1 4.12Å; L207-L237 HydrophobicContact CG-CD1 4.29Å; V210-L237 HydrophobicContact CG1-CB 4.38Å; K233-L237 HydrophobicContact CD-CD1 4.33Å; K233-L237 HydrophobicContact CG-CD1 4.4Å; K233-L237 PolarHBondContact O-N 3.44Å; A234-L237 PolarHBondContact O-N 3.05Å; K235-L237 PolarHBondContact O-N 3.18Å; L237-K342 HydrophobicContact CD2-CB 4.36Å; L237-K342 HydrophobicContact CD2-CD 4.04Å; L237-E345 HydrophobicContact CD2-CB 4.26Å; L237-F346 HydrophobicContact CD1-CE1 4Å; L237-F346 HydrophobicContact CD1-CE2 4.06Å; L237-F346 HydrophobicContact CD1-CZ 3.63Å; L237-F346 HydrophobicContact CD2-CE2 4Å; L237-F346 HydrophobicContact CD2-CZ 4.23Å
238	G	98.3	Very high	97.5	Very high	10 Å²	10	61.2 Å²	61.2	10%	0.103	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	141.1	-2.1	169.2	0	0	0	0	0	117.5	K214 I221 A234 K235 T240	K214-G238 VanDerWaalsContact CD-CA 3.4Å; I221-G238 WeakPolarHBondContact CD1-O 3.41Å; A234-G238 PolarHBondContact O-N 2.88Å; K235-G238 PolarHBondContact O-N 2.86Å; G238-T240 PolarHBondContact O-N 3.44Å
239	A	98.8	Very high	97.5	Very high	11 Å²	11	64 Å²	64	9%	0.091	33%	0.334	C	S	.	.			trans	-61	136.8	176.8	0	0	0	0	0	110.9	V210 I221 A223 A234	V210-A239 HydrophobicContact CG1-CB 4.16Å; V210-A239 VanDerWaalsContact CG1-N 3.35Å; I221-A239 WeakPolarHBondContact O-CA 3.49Å; A223-A239 HydrophobicContact CB-CB 3.64Å; A234-A239 HydrophobicContact CB-CB 3.88Å; A234-A239 WeakPolarHBondContact O-CB 3.4Å; A234-A239 PolarHBondContact O-N 3.35Å
240	T	98.8	Very high	97.5	Very high	78 Å²	78	62.7 Å²	62.7	48%	0.479	32%	0.324	S	S	.	.	S	Bend	trans	-94.9	-30.6	175.6	56.9	0	0	0	0	111.6	R220 I221 G238	R220-T240 VanDerWaalsContact CG-OG1 3.31Å; R220-T240 WeakPolarHBondContact CG-OG1 3.4Å; I221-T240 PolarHBondContact N-OG1 2.94Å; I221-T240 PolarHBondContact O-N 3.18Å; I221-T240 PolarHBondContact O-OG1 3.32Å; G238-T240 PolarHBondContact O-N 3.44Å
241	D	98.6	Very high	97.7	Very high	44 Å²	44	64.6 Å²	64.6	24%	0.235	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	151.4	-179	-52.5	-112.5	0	0	0	108.8	R220 I221 I222 A223 M259	R220-D241 VanDerWaalsContact CG-OD2 3.25Å; R220-D241 WeakPolarHBondContact CG-OD2 3.45Å; R220-D241 IonicContact CZ-OD1 3.11Å; R220-D241 IonicContact CZ-OD2 3.52Å; R220-D241 IonicContact NE-OD1 3.62Å; R220-D241 PolarHBondContact NE-OD1 3.2Å; R220-D241 IonicContact NE-OD2 3.39Å; R220-D241 PolarHBondContact NE-OD2 3Å; R220-D241 IonicContact NH2-OD1 3.33Å; R220-D241 PolarHBondContact NH2-OD1 3.07Å; R220-D241 IonicContact NH2-OD2 2.8Å; I221-D241 PolarHBondContact O-N 2.91Å; I222-D241 HydrophobicContact CB-CB 4.48Å; I222-D241 HydrophobicContact CG1-CB 4.19Å; I222-D241 HydrophobicContact CG2-CB 4.38Å; A223-D241 PolarHBondContact N-O 3.3Å; D241-M259 HydrophobicContact CB-CE 4.16Å
242	F	98.8	Very high	97.7	Very high	66 Å²	66	64.5 Å²	64.5	29%	0.289	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137	169.2	177.9	-99.6	0	0	0	109.1	L202 A223 D225 P228 A231 N244	L202-F242 HydrophobicContact CD1-CD2 3.93Å; L202-F242 HydrophobicContact CD1-CE2 3.62Å; A223-F242 HydrophobicContact CB-CD2 4.29Å; A223-F242 CarbonylContact O-C 3.6Å; A223-F242 WeakPolarHBondContact O-CA 3.2Å; A223-F242 WeakPolarHBondContact O-CD2 3.4Å; D225-F242 HydrophobicContact CB-CE2 3.98Å; D225-F242 HydrophobicContact CB-CZ 4.29Å; P228-F242 HydrophobicContact CB-CE1 4.39Å; A231-F242 HydrophobicContact CB-CB 4Å; A231-F242 HydrophobicContact CB-CD1 3.75Å; A231-F242 HydrophobicContact CB-CD2 3.68Å; A231-F242 HydrophobicContact CB-CE1 4.11Å; A231-F242 HydrophobicContact CB-CE2 4.06Å; A231-F242 HydrophobicContact CB-CG 3.51Å; A231-F242 HydrophobicContact CB-CZ 4.27Å; F242-N244 HydrophobicContact CE1-CB 3.97Å; F242-N244 HydrophobicContact CZ-CB 4.42Å
243	L	98.6	Very high	97.7	Very high	6 Å²	6	59.8 Å²	59.8	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	116.4	-178.4	179.1	64.4	0	0	0	109.7	I222 A223 V224 D225 P245 H248 V252 V255 I256 M259	I222-L243 HydrophobicContact CG2-CB 4.06Å; A223-L243 PolarHBondContact O-N 3.28Å; V224-L243 WeakPolarHBondContact CA-O 3.45Å; V224-L243 HydrophobicContact CG2-CB 4.32Å; V224-L243 HydrophobicContact CG2-CD2 4.37Å; D225-L243 PolarHBondContact N-O 3.39Å; L243-P245 WeakPolarHBondContact O-CD 3.31Å; L243-H248 WeakPolarHBondContact CD1-NE2 2.92Å; L243-V252 HydrophobicContact CD2-CG2 3.54Å; L243-V252 HydrophobicContact CG-CG2 4.23Å; L243-V255 HydrophobicContact CD1-CG1 3.82Å; L243-V255 HydrophobicContact CD2-CB 4.47Å; L243-V255 HydrophobicContact CD2-CG1 4.22Å; L243-I256 HydrophobicContact CD2-CD1 4.11Å; L243-I256 HydrophobicContact CD2-CG1 3.58Å; L243-M259 HydrophobicContact CD2-SD 4.42Å
244	N	98.4	Very high	97.8	Very high	12 Å²	12	61.4 Å²	61.4	6%	0.064	32%	0.322	C	S	.	.			trans	-96.7	114.5	170.2	-179.6	-5.8	0	0	0	109.8	D225 I226 F242 K246 D247 H248	D225-N244 VanDerWaalsContact O-CA 3.3Å; D225-N244 WeakPolarHBondContact O-CA 3.25Å; I226-N244 WeakPolarHBondContact CA-OD1 3.49Å; F242-N244 HydrophobicContact CE1-CB 3.97Å; F242-N244 HydrophobicContact CZ-CB 4.42Å; N244-K246 PolarHBondContact O-N 2.86Å; N244-K246 WeakPolarHBondContact OD1-CB 3.27Å; N244-K246 PolarHBondContact OD1-N 3.47Å; N244-D247 WeakPolarHBondContact CB-OD2 3.48Å; N244-D247 PolarHBondContact O-N 2.93Å; N244-H248 PolarHBondContact O-CD2 3.49Å
245	P	97.7	Very high	97.8	Very high	42 Å²	42	62.2 Å²	62.2	27%	0.273	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-55.8	-25.4	-179.9	-25.6	34.4	0	0	0	114.3	V224 I226 L243 D247 H248 V252	V224-P245 HydrophobicContact CG1-CG 3.83Å; I226-P245 HydrophobicContact CG2-CG 4.42Å; L243-P245 WeakPolarHBondContact O-CD 3.31Å; P245-D247 VanDerWaalsContact C-N 3.25Å; P245-D247 PolarHBondContact O-N 3.15Å; P245-H248 PolarHBondContact O-N 3.46Å; P245-V252 HydrophobicContact CB-CB 4.27Å; P245-V252 HydrophobicContact CB-CG2 4.35Å; P245-V252 HydrophobicContact CG-CB 4.32Å; P245-V252 HydrophobicContact CG-CG2 3.98Å
246	K	97.1	Very high	97.8	Very high	146 Å²	146	55.9 Å²	55.9	64%	0.635	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-72.6	-16.7	-179.6	-65.5	179.7	174.2	173.8	0	113.9	I226 N244 H248	I226-K246 HydrophobicContact CB-CD 4.35Å; I226-K246 HydrophobicContact CG2-CG 4.47Å; N244-K246 PolarHBondContact O-N 2.86Å; N244-K246 WeakPolarHBondContact OD1-CB 3.27Å; N244-K246 PolarHBondContact OD1-N 3.47Å; K246-H248 PolarHBondContact O-N 2.84Å
247	D	97.4	Very high	97.8	Very high	119 Å²	119	53.6 Å²	53.6	64%	0.636	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-86.6	2.3	-179.4	-61.2	-21.2	0	0	0	112.1	N244 P245	N244-D247 WeakPolarHBondContact CB-OD2 3.48Å; N244-D247 PolarHBondContact O-N 2.93Å; P245-D247 VanDerWaalsContact C-N 3.25Å; P245-D247 PolarHBondContact O-N 3.15Å
248	H	96.4	Very high	97.8	Very high	81 Å²	81	56.5 Å²	56.5	38%	0.375	32%	0.324	S	S	.	.			trans	-128.4	141.6	-176	-60.6	-88.3	0	0	0	111.5	L243 N244 P245 K246 V255	L243-H248 WeakPolarHBondContact CD1-NE2 2.92Å; N244-H248 PolarHBondContact O-CD2 3.49Å; P245-H248 PolarHBondContact O-N 3.46Å; K246-H248 PolarHBondContact O-N 2.84Å; H248-V255 HydrophobicContact CB-CG2 3.91Å
249	S	95.4	Very high	97.8	Very high	130 Å²	130	58.9 Å²	58.9	91%	0.909	33%	0.333	S	S	*	.	S	Bend	trans	-81.5	-23.2	172	55.1	0	0	0	0	113
250	Q	96.8	Very high	97.7	Very high	110 Å²	110	59.8 Å²	59.8	51%	0.514	34%	0.338	S	S	.	.	S	Bend	trans	-84.6	152.8	178.5	-63.9	179.5	-59.4	0	0	111.1	V252 V255	Q250-V252 PolarHBondContact O-N 2.78Å; Q250-V255 HydrophobicContact CB-CG2 4.1Å
251	P	97.2	Very high	97.6	Very high	63 Å²	63	59.4 Å²	59.4	41%	0.409	35%	0.35	S	S	.	.			trans	-53.9	138.6	169.8	-23.9	33.7	0	0	0	111.7	H253 E254 V255	P251-H253 WeakPolarHBondContact CB-CE1 3.46Å; P251-H253 PolarHBondContact O-N 3.1Å; P251-H253 VanDerWaalsContact O-N 3.09Å; P251-E254 HydrophobicContact CB-CG 4.34Å; P251-E254 HydrophobicContact CG-CG 4.45Å; P251-E254 WeakPolarHBondContact O-CB 3.29Å; P251-E254 PolarHBondContact O-N 3.35Å; P251-V255 PolarHBondContact O-N 3.3Å
252	V	97.9	Very high	97.5	Very high	18 Å²	18	58.8 Å²	58.8	11%	0.109	35%	0.353	C	S	.	.	H	α-helix	trans	-55.7	-33.6	-174.9	68.3	0	0	0	0	113.4	F200 V224 L243 P245 Q250 E254 V255 I256	F200-V252 HydrophobicContact CE1-CG1 3.94Å; F200-V252 HydrophobicContact CE1-CG2 4.32Å; V224-V252 HydrophobicContact CG1-CG2 3.86Å; L243-V252 HydrophobicContact CD2-CG2 3.54Å; L243-V252 HydrophobicContact CG-CG2 4.23Å; P245-V252 HydrophobicContact CB-CB 4.27Å; P245-V252 HydrophobicContact CB-CG2 4.35Å; P245-V252 HydrophobicContact CG-CB 4.32Å; P245-V252 HydrophobicContact CG-CG2 3.98Å; Q250-V252 PolarHBondContact O-N 2.78Å; V252-E254 VanDerWaalsContact C-N 3.34Å; V252-E254 PolarHBondContact O-N 2.81Å; V252-V255 PolarHBondContact O-N 3.12Å; V252-I256 HydrophobicContact CG2-CD1 4.16Å; V252-I256 WeakPolarHBondContact O-CG1 3.46Å; V252-I256 PolarHBondContact O-N 3.01Å
253	H	97.8	Very high	97.4	Very high	36 Å²	36	55.6 Å²	55.6	17%	0.167	34%	0.34	C	S	.	.	H	α-helix	trans	-67.6	-32.6	178.1	63.6	-101.8	0	0	0	112.7	P251 S257 E282	P251-H253 WeakPolarHBondContact CB-CE1 3.46Å; P251-H253 PolarHBondContact O-N 3.1Å; P251-H253 VanDerWaalsContact O-N 3.09Å; H253-S257 WeakPolarHBondContact O-CB 3.27Å; H253-S257 PolarHBondContact O-N 2.9Å; H253-E282 HydrophobicContact CB-CB 3.95Å; H253-E282 IonicContact CE1-OE2 3.56Å; H253-E282 PolarHBondContact CE1-OE2 2.82Å; H253-E282 IonicContact CG-OE2 2.85Å; H253-E282 IonicContact ND1-OE2 3.99Å; H253-E282 PolarHBondContact ND1-OE2 2.89Å; H253-E282 IonicContact NE2-OE2 3.96Å
254	E	98.1	Very high	97.5	Very high	92 Å²	92	55.3 Å²	55.3	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-70.6	-39.9	174.2	-63.4	-174.1	-177.4	0	0	110.9	P251 V252 S257 G258	P251-E254 HydrophobicContact CB-CG 4.34Å; P251-E254 HydrophobicContact CG-CG 4.45Å; P251-E254 WeakPolarHBondContact O-CB 3.29Å; P251-E254 PolarHBondContact O-N 3.35Å; V252-E254 VanDerWaalsContact C-N 3.34Å; V252-E254 PolarHBondContact O-N 2.81Å; E254-S257 WeakPolarHBondContact O-CB 3.44Å; E254-S257 PolarHBondContact O-N 3.07Å; E254-G258 PolarHBondContact O-N 3.25Å
255	V	98.5	Very high	97.5	Very high	17 Å²	17	56.4 Å²	56.4	10%	0.103	34%	0.344	C	S	.	.	H	α-helix	trans	-60.4	-48.1	174.9	-177.2	0	0	0	0	110.3	L243 H248 Q250 P251 V252 S257 G258 M259	L243-V255 HydrophobicContact CD1-CG1 3.82Å; L243-V255 HydrophobicContact CD2-CB 4.47Å; L243-V255 HydrophobicContact CD2-CG1 4.22Å; H248-V255 HydrophobicContact CB-CG2 3.91Å; Q250-V255 HydrophobicContact CB-CG2 4.1Å; P251-V255 PolarHBondContact O-N 3.3Å; V252-V255 PolarHBondContact O-N 3.12Å; V255-S257 VanDerWaalsContact C-N 3.34Å; V255-S257 PolarHBondContact O-N 2.89Å; V255-G258 PolarHBondContact O-N 3.5Å; V255-M259 HydrophobicContact CG1-SD 4.14Å; V255-M259 VanDerWaalsContact O-CG 3.3Å; V255-M259 WeakPolarHBondContact O-CG 3.45Å; V255-M259 PolarHBondContact O-N 3.43Å
256	I	98.6	Very high	97.5	Very high	0 Å²	0	55 Å²	55	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-60.7	-43.7	176.3	-69.1	166.5	0	0	0	110.9	A198 F200 I222 V224 L243 V252 G258 M259 T260 V264	A198-I256 HydrophobicContact CB-CD1 4.2Å; F200-I256 HydrophobicContact CE1-CD1 3.99Å; F200-I256 HydrophobicContact CE2-CD1 4.31Å; F200-I256 HydrophobicContact CZ-CD1 3.45Å; F200-I256 VanDerWaalsContact CZ-CD1 3.45Å; I222-I256 HydrophobicContact CD1-CG2 4.26Å; V224-I256 HydrophobicContact CG2-CD1 4.08Å; L243-I256 HydrophobicContact CD2-CD1 4.11Å; L243-I256 HydrophobicContact CD2-CG1 3.58Å; V252-I256 HydrophobicContact CG2-CD1 4.16Å; V252-I256 WeakPolarHBondContact O-CG1 3.46Å; V252-I256 PolarHBondContact O-N 3.01Å; I256-G258 VanDerWaalsContact C-N 3.33Å; I256-G258 PolarHBondContact O-N 2.48Å; I256-M259 PolarHBondContact O-N 3.04Å; I256-T260 HydrophobicContact CG2-CG2 4.39Å; I256-T260 WeakPolarHBondContact O-CB 3.47Å; I256-T260 WeakPolarHBondContact O-CG2 3.49Å; I256-T260 PolarHBondContact O-N 3.29Å; I256-T260 PolarHBondContact O-OG1 2.96Å; I256-V264 HydrophobicContact CG2-CG1 3.84Å
257	S	97.8	Very high	97.6	Very high	40 Å²	40	48 Å²	48	28%	0.28	30%	0.303	S	S	.	.	H	α-helix	trans	-58.9	-44.4	176.8	-171.1	0	0	0	0	111.5	H253 E254 V255 M259 T260 G261 G262	H253-S257 WeakPolarHBondContact O-CB 3.27Å; H253-S257 PolarHBondContact O-N 2.9Å; E254-S257 WeakPolarHBondContact O-CB 3.44Å; E254-S257 PolarHBondContact O-N 3.07Å; V255-S257 VanDerWaalsContact C-N 3.34Å; V255-S257 PolarHBondContact O-N 2.89Å; S257-M259 PolarHBondContact O-N 3.14Å; S257-T260 PolarHBondContact O-N 3.18Å; S257-T260 PolarHBondContact O-OG1 3.41Å; S257-G261 PolarHBondContact O-N 3.5Å; S257-G262 PolarHBondContact O-N 2.83Å; S257-G262 WeakPolarHBondContact OG-CA 3.39Å; S257-G262 PolarHBondContact OG-O 2.87Å
258	G	97.8	Very high	97.7	Very high	66 Å²	66	42.4 Å²	42.4	68%	0.68	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-39.1	174.4	0	0	0	0	0	113.5	E254 V255 I256 T260	E254-G258 PolarHBondContact O-N 3.25Å; V255-G258 PolarHBondContact O-N 3.5Å; I256-G258 VanDerWaalsContact C-N 3.33Å; I256-G258 PolarHBondContact O-N 2.48Å; G258-T260 VanDerWaalsContact C-N 3.3Å; G258-T260 PolarHBondContact O-N 3.22Å
259	M	97.5	Very high	97.8	Very high	59 Å²	59	38.5 Å²	38.5	29%	0.291	26%	0.255	S	S	.	.	H	α-helix	trans	-66.7	-29.8	177.2	-70.8	171.7	71.4	0	0	113.2	R220 I222 D241 L243 V255 I256 S257	R220-M259 PolarHBondContact NH1-O 3.18Å; I222-M259 HydrophobicContact CD1-CE 4.15Å; I222-M259 HydrophobicContact CG1-CE 4.46Å; I222-M259 HydrophobicContact CG2-CE 4.38Å; D241-M259 HydrophobicContact CB-CE 4.16Å; L243-M259 HydrophobicContact CD2-SD 4.42Å; V255-M259 HydrophobicContact CG1-SD 4.14Å; V255-M259 VanDerWaalsContact O-CG 3.3Å; V255-M259 WeakPolarHBondContact O-CG 3.45Å; V255-M259 PolarHBondContact O-N 3.43Å; I256-M259 PolarHBondContact O-N 3.04Å; S257-M259 PolarHBondContact O-N 3.14Å
260	T	97.6	Very high	98	Very high	30 Å²	30	33.2 Å²	33.2	18%	0.184	22%	0.218	C	C	.	.	H	α-helix	trans	-111.8	-3.3	-168.2	54.2	0	0	0	0	113.7	I222 I256 S257 G258 G263 V264	I222-T260 HydrophobicContact CD1-CG2 3.75Å; I256-T260 HydrophobicContact CG2-CG2 4.39Å; I256-T260 WeakPolarHBondContact O-CB 3.47Å; I256-T260 WeakPolarHBondContact O-CG2 3.49Å; I256-T260 PolarHBondContact O-N 3.29Å; I256-T260 PolarHBondContact O-OG1 2.96Å; S257-T260 PolarHBondContact O-N 3.18Å; S257-T260 PolarHBondContact O-OG1 3.41Å; G258-T260 VanDerWaalsContact C-N 3.3Å; G258-T260 PolarHBondContact O-N 3.22Å; T260-G263 WeakPolarHBondContact CB-O 3.15Å; T260-G263 WeakPolarHBondContact OG1-CA 3.36Å; T260-G263 PolarHBondContact OG1-N 2.71Å; T260-G263 PolarHBondContact OG1-O 3.48Å; T260-G263 VanDerWaalsContact OG1-O 3.08Å; T260-V264 HydrophobicContact CG2-CG1 3.85Å
261	G	96.1	Very high	98	Very high	71 Å²	71	31.1 Å²	31.1	73%	0.732	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.4	30.2	-177	0	0	0	0	0	113.4	S257	S257-G261 PolarHBondContact O-N 3.5Å
262	G	95.8	Very high	97.9	Very high	30 Å²	30	28.9 Å²	28.9	31%	0.309	20%	0.201	S	C	.	.	S	Bend	trans	145.6	-22.8	173.8	0	0	0	0	0	115.4	S257 M285	S257-G262 PolarHBondContact O-N 2.83Å; S257-G262 WeakPolarHBondContact OG-CA 3.39Å; S257-G262 PolarHBondContact OG-O 2.87Å; G262-M285 VanDerWaalsContact C-SD 3.51Å
263	G	98.3	Very high	97.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	21%	0.214	C	C	.	.			trans	145.4	171.7	-177.4	0	0	0	0	0	111.4	T260 S283 M285	T260-G263 WeakPolarHBondContact CB-O 3.15Å; T260-G263 WeakPolarHBondContact OG1-CA 3.36Å; T260-G263 PolarHBondContact OG1-N 2.71Å; T260-G263 PolarHBondContact OG1-O 3.48Å; T260-G263 VanDerWaalsContact OG1-O 3.08Å; G263-S283 CarbonylContact C-O 3.47Å; G263-S283 WeakPolarHBondContact CA-O 3.28Å; G263-M285 WeakPolarHBondContact O-CE 3.17Å; G263-M285 WeakPolarHBondContact O-CG 3.3Å
264	V	98.9	Very high	97.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-86.3	155.5	174.1	-69.6	0	0	0	0	112.3	S196 A198 I222 I256 T260 F266 S283 S284 M285	S196-V264 WeakPolarHBondContact OG-CA 3.22Å; A198-V264 HydrophobicContact CB-CB 4.44Å; A198-V264 HydrophobicContact CB-CG1 3.98Å; A198-V264 HydrophobicContact CB-CG2 3.78Å; I222-V264 HydrophobicContact CD1-CG1 4.17Å; I256-V264 HydrophobicContact CG2-CG1 3.84Å; T260-V264 HydrophobicContact CG2-CG1 3.85Å; V264-F266 VanDerWaalsContact CG2-O 3.28Å; V264-F266 WeakPolarHBondContact CG2-O 3.48Å; V264-S283 PolarHBondContact N-O 2.95Å; V264-S284 CarbonylContact O-C 3.6Å; V264-S284 VanDerWaalsContact O-CA 3.25Å; V264-S284 WeakPolarHBondContact O-CA 3.35Å; V264-M285 PolarHBondContact O-N 3.23Å
265	D	98.9	Very high	97.8	Very high	35 Å²	35	31.5 Å²	31.5	19%	0.187	22%	0.216	C	C	.	.	S	Bend	trans	-68	-39.7	172.9	-57.3	-65.1	0	0	0	111.1	S196 W288 G289 V290	S196-D265 PolarHBondContact N-OD2 2.93Å; S196-D265 WeakPolarHBondContact O-CB 3.4Å; S196-D265 PolarHBondContact O-N 3.02Å; S196-D265 VanDerWaalsContact O-N 3.08Å; S196-D265 PolarHBondContact OG-N 3.09Å; S196-D265 VanDerWaalsContact OG-N 3.08Å; S196-D265 PolarHBondContact OG-OD2 3.23Å; D265-W288 PolarHBondContact OD1-NE1 2.7Å; D265-G289 WeakPolarHBondContact O-CA 3.49Å; D265-V290 PolarHBondContact O-N 3.23Å
266	F	98.9	Very high	97.7	Very high	12 Å²	12	32.5 Å²	32.5	5%	0.053	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	131.5	-179.9	-57.3	-83.9	0	0	0	111.6	A189 V191 E192 S196 C197 A198 V264 V290	A189-F266 HydrophobicContact CB-CD1 3.89Å; A189-F266 WeakPolarHBondContact O-CE1 3.23Å; V191-F266 HydrophobicContact CB-CD2 4.4Å; V191-F266 HydrophobicContact CG1-CD2 4.32Å; V191-F266 HydrophobicContact CG2-CB 4.18Å; V191-F266 HydrophobicContact CG2-CD1 4.36Å; V191-F266 HydrophobicContact CG2-CD2 4.14Å; V191-F266 HydrophobicContact CG2-CG 3.96Å; E192-F266 HydrophobicContact CB-CE2 4.36Å; E192-F266 HydrophobicContact CG-CE2 4.4Å; E192-F266 HydrophobicContact CG-CZ 4.08Å; S196-F266 PolarHBondContact O-N 2.78Å; C197-F266 CarbonylContact C-O 3.52Å; C197-F266 WeakPolarHBondContact CA-O 3.37Å; A198-F266 PolarHBondContact N-O 2.81Å; V264-F266 VanDerWaalsContact CG2-O 3.28Å; V264-F266 WeakPolarHBondContact CG2-O 3.48Å; F266-V290 CarbonylContact C-O 3.56Å; F266-V290 VanDerWaalsContact CA-O 3.28Å; F266-V290 WeakPolarHBondContact CA-O 3.5Å; F266-V290 HydrophobicContact CD1-CB 3.75Å; F266-V290 HydrophobicContact CD1-CG1 4.34Å; F266-V290 HydrophobicContact CD1-CG2 4.3Å; F266-V290 HydrophobicContact CE1-CB 4Å; F266-V290 HydrophobicContact CE1-CG2 4.03Å
267	S	98.9	Very high	97.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.2	167.7	65.4	0	0	0	0	111.4	A198 A280 V290 S291 V292	A198-S267 CarbonylContact O-C 3.45Å; A198-S267 VanDerWaalsContact O-CA 3.26Å; A198-S267 WeakPolarHBondContact O-CA 3.32Å; S267-A280 VanDerWaalsContact CB-O 3.32Å; S267-A280 WeakPolarHBondContact CB-O 3.37Å; S267-A280 VanDerWaalsContact OG-C 3.28Å; S267-A280 PolarHBondContact OG-O 2.8Å; S267-V290 PolarHBondContact N-O 2.86Å; S267-S291 CarbonylContact O-C 3.55Å; S267-S291 WeakPolarHBondContact O-CA 3.31Å; S267-S291 WeakPolarHBondContact OG-CA 3.39Å; S267-S291 WeakPolarHBondContact OG-CB 3.49Å; S267-S291 PolarHBondContact OG-OG 2.9Å; S267-V292 PolarHBondContact O-N 3.35Å
268	L	98.9	Very high	97.8	Very high	0 Å²	0	34 Å²	34	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	117.7	178.8	-61	98.9	0	0	0	109.1	A184 A185 A198 V199 F200 A209 V292	A184-L268 HydrophobicContact CB-CD2 3.81Å; A185-L268 HydrophobicContact CB-CD2 4.14Å; A198-L268 PolarHBondContact O-N 3.23Å; V199-L268 WeakPolarHBondContact CA-O 3.41Å; V199-L268 HydrophobicContact CG2-CD1 4.17Å; F200-L268 PolarHBondContact N-O 3.16Å; A209-L268 HydrophobicContact CB-CD2 4.15Å; L268-V292 WeakPolarHBondContact CA-O 3.43Å; L268-V292 HydrophobicContact CG-CB 4.42Å
269	E	98.8	Very high	97.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	120.4	175.1	-168.3	-80.4	156	0	0	109.7	V271 G272 N273 V276 M277 A280 V292 V294 G295	E269-V271 VanDerWaalsContact OE1-CA 3.28Å; E269-V271 WeakPolarHBondContact OE1-CA 3.47Å; E269-V271 WeakPolarHBondContact OE1-CB 3.5Å; E269-V271 PolarHBondContact OE1-N 3.18Å; E269-G272 PolarHBondContact OE1-N 3.2Å; E269-N273 PolarHBondContact OE1-N 3.35Å; E269-V276 HydrophobicContact CG-CB 4.25Å; E269-V276 HydrophobicContact CG-CG1 3.82Å; E269-M277 HydrophobicContact CB-CG 4.38Å; E269-M277 HydrophobicContact CG-CB 4.35Å; E269-M277 HydrophobicContact CG-CG 3.74Å; E269-A280 HydrophobicContact CB-CB 3.93Å; E269-A280 HydrophobicContact CG-CB 4.47Å; E269-V292 PolarHBondContact N-O 2.85Å; E269-V294 CarbonylContact O-C 3.59Å; E269-V294 VanDerWaalsContact O-CA 3.3Å; E269-V294 WeakPolarHBondContact O-CA 3.24Å; E269-V294 WeakPolarHBondContact O-CB 3.25Å; E269-V294 PolarHBondContact O-N 2.97Å; E269-G295 PolarHBondContact O-N 2.77Å; E269-G295 WeakPolarHBondContact OE2-CA 3.35Å; E269-G295 PolarHBondContact OE2-N 2.75Å
270	C	98.5	Very high	97.8	Very high	19 Å²	19	29.3 Å²	29.3	13%	0.128	18%	0.184	C	C	.	.			trans	-127.5	25.4	-172.9	-61.8	0	0	0	0	112.5	F200 V205	F200-C270 WeakPolarHBondContact O-CA 3.48Å; F200-C270 WeakPolarHBondContact O-CB 3.45Å; F200-C270 PolarHBondContact O-N 2.88Å; V205-C270 HydrophobicContact CG1-CB 4.21Å
271	V	97	Very high	97.9	Very high	66 Å²	66	27.9 Å²	27.9	40%	0.4	18%	0.175	S	C	.	.	S	Bend	trans	-104.1	-47.2	-179.2	-175.1	0	0	0	0	111.3	E269 N273 V276	E269-V271 VanDerWaalsContact OE1-CA 3.28Å; E269-V271 WeakPolarHBondContact OE1-CA 3.47Å; E269-V271 WeakPolarHBondContact OE1-CB 3.5Å; E269-V271 PolarHBondContact OE1-N 3.18Å; V271-N273 HydrophobicContact CG1-CB 4.07Å; V271-V276 HydrophobicContact CG2-CG1 4.19Å
272	G	95.4	Very high	98	Very high	16 Å²	16	26 Å²	26	17%	0.165	15%	0.147	C	C	.	.			trans	95.2	21.5	-169.3	0	0	0	0	0	112.8	E269 T297	E269-G272 PolarHBondContact OE1-N 3.2Å; G272-T297 WeakPolarHBondContact O-CG2 3.43Å
273	N	96.4	Very high	98.1	Very high	73 Å²	73	24.5 Å²	24.5	39%	0.39	13%	0.132	S	C	.	.			trans	-111.5	124.5	179.1	-179.2	-71.3	0	0	0	111	E269 V271 E275 V276 M277	E269-N273 PolarHBondContact OE1-N 3.35Å; V271-N273 HydrophobicContact CG1-CB 4.07Å; N273-E275 VanDerWaalsContact C-N 3.3Å; N273-E275 PolarHBondContact O-N 3.22Å; N273-E275 WeakPolarHBondContact OD1-CB 3.41Å; N273-E275 PolarHBondContact OD1-N 3.2Å; N273-V276 HydrophobicContact CB-CB 4.15Å; N273-V276 HydrophobicContact CB-CG2 3.83Å; N273-V276 CarbonylContact O-C 3.58Å; N273-V276 WeakPolarHBondContact O-CA 3.27Å; N273-V276 WeakPolarHBondContact O-CB 3.35Å; N273-V276 PolarHBondContact O-N 3.33Å; N273-V276 PolarHBondContact OD1-N 2.9Å; N273-M277 WeakPolarHBondContact O-CG 3.46Å; N273-M277 PolarHBondContact O-N 2.94Å
274	V	97.1	Very high	98.1	Very high	21 Å²	21	24.5 Å²	24.5	13%	0.127	13%	0.132	C	C	.	.	H	α-helix	trans	-62.4	-30.5	-172.8	-59.5	0	0	0	0	114.5	M277 R278 T297 F300 I302	V274-M277 HydrophobicContact CG1-SD 4.48Å; V274-M277 WeakPolarHBondContact O-CB 3.41Å; V274-M277 PolarHBondContact O-N 2.84Å; V274-R278 PolarHBondContact O-N 3.06Å; V274-T297 HydrophobicContact CG1-CG2 4.2Å; V274-F300 HydrophobicContact CG1-CB 3.73Å; V274-F300 HydrophobicContact CG2-CB 4.23Å; V274-I302 HydrophobicContact CB-CB 4.46Å; V274-I302 HydrophobicContact CB-CG1 3.89Å; V274-I302 HydrophobicContact CB-CG2 4.4Å; V274-I302 HydrophobicContact CG1-CG1 3.65Å
275	E	97.3	Very high	98.1	Very high	107 Å²	107	26 Å²	26	50%	0.5	14%	0.14	S	C	.	.	H	α-helix	trans	-75.6	-32.9	175.4	-64.2	-58.7	153	0	0	111.8	N273 R278 S279	N273-E275 VanDerWaalsContact C-N 3.3Å; N273-E275 PolarHBondContact O-N 3.22Å; N273-E275 WeakPolarHBondContact OD1-CB 3.41Å; N273-E275 PolarHBondContact OD1-N 3.2Å; E275-R278 IonicContact OE2-NH1 2.99Å; E275-R278 PolarHBondContact OE2-NH1 2.8Å; E275-S279 WeakPolarHBondContact O-CB 3.36Å; E275-S279 PolarHBondContact O-N 3.08Å; E275-S279 PolarHBondContact O-OG 2.87Å
276	V	98.2	Very high	98	Very high	38 Å²	38	28.9 Å²	28.9	23%	0.23	15%	0.152	C	C	.	.	H	α-helix	trans	-69.7	-37.1	171.1	-174	0	0	0	0	110.2	F200 E269 V271 N273 S279 A280	F200-V276 HydrophobicContact CB-CG1 3.66Å; F200-V276 HydrophobicContact CD1-CG1 3.93Å; F200-V276 HydrophobicContact CG-CG1 4.07Å; E269-V276 HydrophobicContact CG-CB 4.25Å; E269-V276 HydrophobicContact CG-CG1 3.82Å; V271-V276 HydrophobicContact CG2-CG1 4.19Å; N273-V276 HydrophobicContact CB-CB 4.15Å; N273-V276 HydrophobicContact CB-CG2 3.83Å; N273-V276 CarbonylContact O-C 3.58Å; N273-V276 WeakPolarHBondContact O-CA 3.27Å; N273-V276 WeakPolarHBondContact O-CB 3.35Å; N273-V276 PolarHBondContact O-N 3.33Å; N273-V276 PolarHBondContact OD1-N 2.9Å; V276-S279 PolarHBondContact O-N 3.32Å; V276-A280 WeakPolarHBondContact O-CB 3.49Å; V276-A280 PolarHBondContact O-N 2.86Å
277	M	98.6	Very high	97.8	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.02	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-44.9	173.9	-66	174.7	-174.6	0	0	111.7	E269 N273 V274 A280 L281 V293 T297 I302 W315	E269-M277 HydrophobicContact CB-CG 4.38Å; E269-M277 HydrophobicContact CG-CB 4.35Å; E269-M277 HydrophobicContact CG-CG 3.74Å; N273-M277 WeakPolarHBondContact O-CG 3.46Å; N273-M277 PolarHBondContact O-N 2.94Å; V274-M277 HydrophobicContact CG1-SD 4.48Å; V274-M277 WeakPolarHBondContact O-CB 3.41Å; V274-M277 PolarHBondContact O-N 2.84Å; M277-A280 PolarHBondContact O-N 2.86Å; M277-L281 PolarHBondContact O-N 2.84Å; M277-V293 HydrophobicContact CE-CG1 3.64Å; M277-V293 HydrophobicContact CG-CG1 4.1Å; M277-V293 HydrophobicContact CG-CG2 4.35Å; M277-V293 HydrophobicContact SD-CG1 3.73Å; M277-T297 HydrophobicContact CE-CG2 3.9Å; M277-I302 HydrophobicContact CB-CD1 4.34Å; M277-I302 HydrophobicContact CB-CG2 4.42Å; M277-I302 HydrophobicContact SD-CD1 3.31Å; M277-I302 WeakPolarHBondContact SD-CD1 3.49Å; M277-I302 HydrophobicContact SD-CG1 3.95Å; M277-W315 HydrophobicContact CB-CZ2 4.35Å
278	R	98.1	Very high	97.8	Very high	68 Å²	68	38.3 Å²	38.3	26%	0.257	20%	0.2	S	C	.	.	H	α-helix	trans	-59.4	-50.6	171.2	171.7	-172.8	-89.8	160.6	-11.7	111	V274 E275 A280 L281 E282 A303 I304	V274-R278 PolarHBondContact O-N 3.06Å; E275-R278 IonicContact OE2-NH1 2.99Å; E275-R278 PolarHBondContact OE2-NH1 2.8Å; R278-A280 VanDerWaalsContact C-N 3.28Å; R278-A280 PolarHBondContact O-N 2.84Å; R278-L281 WeakPolarHBondContact O-CB 3.37Å; R278-L281 PolarHBondContact O-N 2.89Å; R278-L281 VanDerWaalsContact O-N 3.1Å; R278-E282 HydrophobicContact CG-CG 4.23Å; R278-E282 WeakPolarHBondContact CG-OE1 3.47Å; R278-E282 IonicContact NE-OE1 3.36Å; R278-E282 WeakPolarHBondContact O-CG 3.42Å; R278-E282 PolarHBondContact O-N 2.88Å; R278-A303 PolarHBondContact NE-O 3.02Å; R278-A303 PolarHBondContact NH2-O 3.22Å; R278-I304 HydrophobicContact CG-CG2 4.42Å
279	S	98.3	Very high	97.8	Very high	25 Å²	25	38.3 Å²	38.3	18%	0.175	20%	0.2	C	C	.	.	H	α-helix	trans	-60.5	-38.1	-177.9	-63.2	0	0	0	0	112.2	E275 V276 E282 S283	E275-S279 WeakPolarHBondContact O-CB 3.36Å; E275-S279 PolarHBondContact O-N 3.08Å; E275-S279 PolarHBondContact O-OG 2.87Å; V276-S279 PolarHBondContact O-N 3.32Å; S279-E282 PolarHBondContact O-N 3.08Å; S279-S283 VanDerWaalsContact O-CB 3.29Å; S279-S283 WeakPolarHBondContact O-CB 3.48Å; S279-S283 PolarHBondContact O-N 2.87Å; S279-S283 PolarHBondContact O-OG 2.88Å
280	A	98.7	Very high	97.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-45.6	174.5	0	0	0	0	0	111.2	F200 S267 E269 V276 M277 R278 S283	F200-A280 HydrophobicContact CD2-CB 3.71Å; F200-A280 HydrophobicContact CE2-CB 3.73Å; F200-A280 HydrophobicContact CG-CB 4.32Å; F200-A280 HydrophobicContact CZ-CB 4.33Å; S267-A280 VanDerWaalsContact CB-O 3.32Å; S267-A280 WeakPolarHBondContact CB-O 3.37Å; S267-A280 VanDerWaalsContact OG-C 3.28Å; S267-A280 PolarHBondContact OG-O 2.8Å; E269-A280 HydrophobicContact CB-CB 3.93Å; E269-A280 HydrophobicContact CG-CB 4.47Å; V276-A280 WeakPolarHBondContact O-CB 3.49Å; V276-A280 PolarHBondContact O-N 2.86Å; M277-A280 PolarHBondContact O-N 2.86Å; R278-A280 VanDerWaalsContact C-N 3.28Å; R278-A280 PolarHBondContact O-N 2.84Å; A280-S283 PolarHBondContact O-N 2.88Å; A280-S283 PolarHBondContact O-OG 2.88Å
281	L	98.8	Very high	97.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-48.9	174.8	178.7	66.1	0	0	0	111.7	M277 R278 S283 S284 S291 I304 H308 L309 R313 W315	M277-L281 PolarHBondContact O-N 2.84Å; R278-L281 WeakPolarHBondContact O-CB 3.37Å; R278-L281 PolarHBondContact O-N 2.89Å; R278-L281 VanDerWaalsContact O-N 3.1Å; L281-S283 VanDerWaalsContact C-N 3.25Å; L281-S283 PolarHBondContact O-N 2.64Å; L281-S284 PolarHBondContact O-N 3.28Å; L281-S284 VanDerWaalsContact O-N 3.16Å; L281-S284 PolarHBondContact O-OG 3.35Å; L281-S291 WeakPolarHBondContact CA-OG 3.36Å; L281-S291 PolarHBondContact N-OG 3.37Å; L281-I304 HydrophobicContact CD2-CB 4.37Å; L281-I304 HydrophobicContact CD2-CD1 3.55Å; L281-I304 HydrophobicContact CD2-CG2 3.96Å; L281-H308 HydrophobicContact CD2-CB 4.25Å; L281-L309 HydrophobicContact CD1-CD2 4.36Å; L281-L309 HydrophobicContact CD2-CD2 4.34Å; L281-R313 HydrophobicContact CD1-CB 4.13Å; L281-R313 WeakPolarHBondContact O-CD 3.4Å; L281-R313 PolarHBondContact O-NE 2.84Å; L281-W315 HydrophobicContact CD1-CB 3.92Å; L281-W315 HydrophobicContact CD1-CD2 4.46Å; L281-W315 HydrophobicContact CD1-CG 3.88Å; L281-W315 HydrophobicContact CD2-CD2 3.99Å; L281-W315 HydrophobicContact CD2-CE3 4.13Å; L281-W315 HydrophobicContact CD2-CG 4.27Å
282	E	98.4	Very high	97.9	Very high	31 Å²	31	35.1 Å²	35.1	15%	0.145	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-27.9	-178	-69.9	175.8	172.6	0	0	112.6	H253 R278 S279 S284 H308	H253-E282 HydrophobicContact CB-CB 3.95Å; H253-E282 IonicContact CE1-OE2 3.56Å; H253-E282 PolarHBondContact CE1-OE2 2.82Å; H253-E282 IonicContact CG-OE2 2.85Å; H253-E282 IonicContact ND1-OE2 3.99Å; H253-E282 PolarHBondContact ND1-OE2 2.89Å; H253-E282 IonicContact NE2-OE2 3.96Å; R278-E282 HydrophobicContact CG-CG 4.23Å; R278-E282 WeakPolarHBondContact CG-OE1 3.47Å; R278-E282 IonicContact NE-OE1 3.36Å; R278-E282 WeakPolarHBondContact O-CG 3.42Å; R278-E282 PolarHBondContact O-N 2.88Å; S279-E282 PolarHBondContact O-N 3.08Å; E282-S284 VanDerWaalsContact C-N 3.27Å; E282-S284 PolarHBondContact O-N 2.99Å; E282-H308 IonicContact OE1-CE1 3.01Å; E282-H308 IonicContact OE1-NE2 2.64Å
283	S	98.6	Very high	98.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.7	176.3	74.7	0	0	0	0	114.4	F200 G263 V264 S279 A280 L281	F200-S283 WeakPolarHBondContact CZ-OG 3.48Å; G263-S283 CarbonylContact C-O 3.47Å; G263-S283 WeakPolarHBondContact CA-O 3.28Å; V264-S283 PolarHBondContact N-O 2.95Å; S279-S283 VanDerWaalsContact O-CB 3.29Å; S279-S283 WeakPolarHBondContact O-CB 3.48Å; S279-S283 PolarHBondContact O-N 2.87Å; S279-S283 PolarHBondContact O-OG 2.88Å; A280-S283 PolarHBondContact O-N 2.88Å; A280-S283 PolarHBondContact O-OG 2.88Å; L281-S283 VanDerWaalsContact C-N 3.25Å; L281-S283 PolarHBondContact O-N 2.64Å
284	S	98.4	Very high	98.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-84.8	153	179.3	70	0	0	0	0	112.1	V264 L281 E282 E286 R313	V264-S284 CarbonylContact O-C 3.6Å; V264-S284 VanDerWaalsContact O-CA 3.25Å; V264-S284 WeakPolarHBondContact O-CA 3.35Å; L281-S284 PolarHBondContact O-N 3.28Å; L281-S284 VanDerWaalsContact O-N 3.16Å; L281-S284 PolarHBondContact O-OG 3.35Å; E282-S284 VanDerWaalsContact C-N 3.27Å; E282-S284 PolarHBondContact O-N 2.99Å; S284-E286 PolarHBondContact O-N 3.39Å; S284-R313 VanDerWaalsContact O-CZ 3.27Å; S284-R313 PolarHBondContact O-NE 2.75Å; S284-R313 PolarHBondContact O-NH2 2.91Å; S284-R313 WeakPolarHBondContact OG-CD 3.41Å; S284-R313 PolarHBondContact OG-NE 2.77Å
285	M	98.2	Very high	98.1	Very high	31 Å²	31	32.7 Å²	32.7	15%	0.153	17%	0.167	C	C	.	.			trans	-53.1	134.4	177.8	-79.8	-62.4	-166.4	0	0	111.9	G262 G263 V264 A287 W288 G289 R313	G262-M285 VanDerWaalsContact C-SD 3.51Å; G263-M285 WeakPolarHBondContact O-CE 3.17Å; G263-M285 WeakPolarHBondContact O-CG 3.3Å; V264-M285 PolarHBondContact O-N 3.23Å; M285-A287 VanDerWaalsContact C-N 3.34Å; M285-A287 PolarHBondContact O-N 3.19Å; M285-W288 HydrophobicContact CB-CD2 4.35Å; M285-W288 HydrophobicContact CB-CZ2 4.27Å; M285-W288 HydrophobicContact CE-CZ2 4.36Å; M285-W288 HydrophobicContact CG-CZ2 3.91Å; M285-W288 HydrophobicContact SD-CZ2 4.3Å; M285-G289 VanDerWaalsContact O-CA 3.24Å; M285-G289 WeakPolarHBondContact O-CA 3.26Å; M285-G289 PolarHBondContact O-N 3.48Å; M285-R313 WeakPolarHBondContact O-CG 3.48Å
286	E	95.8	Very high	97.9	Very high	95 Å²	95	32.2 Å²	32.2	44%	0.444	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-35.3	-172.4	-179.6	160.4	-169.3	0	0	114.6	S284 C311 G312 R313	S284-E286 PolarHBondContact O-N 3.39Å; E286-C311 HydrophobicContact CG-CB 3.49Å; E286-C311 VanDerWaalsContact CG-CB 3.49Å; E286-C311 CarbonylContact O-C 3.46Å; E286-C311 VanDerWaalsContact O-C 3.32Å; E286-C311 VanDerWaalsContact O-O 3.11Å; E286-C311 WeakPolarHBondContact OE1-CB 3.45Å; E286-C311 PolarHBondContact OE1-SG 3.49Å; E286-G312 CarbonylContact O-C 2.99Å; E286-G312 PolarHBondContact O-N 3.41Å; E286-R313 VanDerWaalsContact CA-CZ 3.4Å; E286-R313 PolarHBondContact O-N 2.74Å
287	A	96.2	Very high	97.5	Very high	59 Å²	59	32 Å²	32	49%	0.488	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-27	-171.7	0	0	0	0	0	114.9	M285 C311 G312	M285-A287 VanDerWaalsContact C-N 3.34Å; M285-A287 PolarHBondContact O-N 3.19Å; A287-C311 WeakPolarHBondContact CA-O 3.28Å; A287-G312 CarbonylContact O-C 3.53Å; A287-G312 WeakPolarHBondContact O-CA 3.28Å
288	W	98.1	Very high	97	Very high	152 Å²	152	36.4 Å²	36.4	58%	0.576	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-143.3	-2.2	-176.6	60.9	83.7	0	0	0	114.5	D265 M285 V290	D265-W288 PolarHBondContact OD1-NE1 2.7Å; M285-W288 HydrophobicContact CB-CD2 4.35Å; M285-W288 HydrophobicContact CB-CZ2 4.27Å; M285-W288 HydrophobicContact CE-CZ2 4.36Å; M285-W288 HydrophobicContact CG-CZ2 3.91Å; M285-W288 HydrophobicContact SD-CZ2 4.3Å; W288-V290 PolarHBondContact O-N 3.32Å
289	G	98.8	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.			trans	-59.3	137.8	-173.5	0	0	0	0	0	112.5	D265 M285 R313 T314	D265-G289 WeakPolarHBondContact O-CA 3.49Å; M285-G289 VanDerWaalsContact O-CA 3.24Å; M285-G289 WeakPolarHBondContact O-CA 3.26Å; M285-G289 PolarHBondContact O-N 3.48Å; G289-R313 CarbonylContact O-C 3.56Å; G289-R313 VanDerWaalsContact O-CA 3.28Å; G289-R313 WeakPolarHBondContact O-CA 3.18Å; G289-T314 PolarHBondContact O-N 2.88Å
290	V	98.9	Very high	96.1	Very high	17 Å²	17	43.7 Å²	43.7	10%	0.103	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118	177.5	-179.6	0	0	0	0	109.2	D265 F266 S267 W288 V292 T314 K316	D265-V290 PolarHBondContact O-N 3.23Å; F266-V290 CarbonylContact C-O 3.56Å; F266-V290 VanDerWaalsContact CA-O 3.28Å; F266-V290 WeakPolarHBondContact CA-O 3.5Å; F266-V290 HydrophobicContact CD1-CB 3.75Å; F266-V290 HydrophobicContact CD1-CG1 4.34Å; F266-V290 HydrophobicContact CD1-CG2 4.3Å; F266-V290 HydrophobicContact CE1-CB 4Å; F266-V290 HydrophobicContact CE1-CG2 4.03Å; S267-V290 PolarHBondContact N-O 2.86Å; W288-V290 PolarHBondContact O-N 3.32Å; V290-V292 HydrophobicContact CG1-CG2 4.21Å; V290-T314 WeakPolarHBondContact CA-O 3.36Å; V290-K316 HydrophobicContact CG1-CD 4.28Å
291	S	98.9	Very high	95.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.5	173.7	-173.2	0	0	0	0	110.7	S267 L281 T314 W315 K316	S267-S291 CarbonylContact O-C 3.55Å; S267-S291 WeakPolarHBondContact O-CA 3.31Å; S267-S291 WeakPolarHBondContact OG-CA 3.39Å; S267-S291 WeakPolarHBondContact OG-CB 3.49Å; S267-S291 PolarHBondContact OG-OG 2.9Å; L281-S291 WeakPolarHBondContact CA-OG 3.36Å; L281-S291 PolarHBondContact N-OG 3.37Å; S291-T314 PolarHBondContact N-O 2.68Å; S291-W315 WeakPolarHBondContact O-CA 3.43Å; S291-K316 PolarHBondContact O-N 2.89Å
292	V	98.9	Very high	95.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119.9	-177.5	-174.5	0	0	0	0	110.3	A184 T188 A189 S267 L268 E269 V290 V294 K316	A184-V292 HydrophobicContact CB-CG1 4.44Å; T188-V292 HydrophobicContact CG2-CG1 3.91Å; T188-V292 HydrophobicContact CG2-CG2 4.39Å; A189-V292 HydrophobicContact CB-CG2 3.77Å; S267-V292 PolarHBondContact O-N 3.35Å; L268-V292 WeakPolarHBondContact CA-O 3.43Å; L268-V292 HydrophobicContact CG-CB 4.42Å; E269-V292 PolarHBondContact N-O 2.85Å; V290-V292 HydrophobicContact CG1-CG2 4.21Å; V292-V294 HydrophobicContact CG1-CG2 3.93Å; V292-K316 CarbonylContact C-O 3.32Å; V292-K316 VanDerWaalsContact CA-O 3.28Å; V292-K316 WeakPolarHBondContact CA-O 3.47Å; V292-K316 HydrophobicContact CG2-CD 4.37Å; V292-K316 HydrophobicContact CG2-CG 4.02Å
293	V	98.8	Very high	95.5	Very high	27 Å²	27	55.9 Å²	55.9	16%	0.164	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	120.6	170.8	-177.6	0	0	0	0	109	M277 W315 K316 G317 S318	M277-V293 HydrophobicContact CE-CG1 3.64Å; M277-V293 HydrophobicContact CG-CG1 4.1Å; M277-V293 HydrophobicContact CG-CG2 4.35Å; M277-V293 HydrophobicContact SD-CG1 3.73Å; V293-W315 HydrophobicContact CG2-CZ2 4.1Å; V293-K316 PolarHBondContact N-O 2.92Å; V293-G317 CarbonylContact O-C 3.52Å; V293-G317 WeakPolarHBondContact O-CA 3.5Å; V293-S318 PolarHBondContact O-N 3.04Å
294	V	98.6	Very high	95.4	Very high	18 Å²	18	57.7 Å²	57.7	11%	0.109	30%	0.3	C	S	.	.			trans	-120.6	-33.7	179.3	-166.8	0	0	0	0	110.8	T180 A184 V205 E269 V292	T180-V294 HydrophobicContact CG2-CG1 3.42Å; T180-V294 VanDerWaalsContact CG2-CG1 3.42Å; A184-V294 HydrophobicContact CB-CG1 4.29Å; A184-V294 HydrophobicContact CB-CG2 3.53Å; V205-V294 HydrophobicContact CG1-CG1 3.65Å; E269-V294 CarbonylContact O-C 3.59Å; E269-V294 VanDerWaalsContact O-CA 3.3Å; E269-V294 WeakPolarHBondContact O-CA 3.24Å; E269-V294 WeakPolarHBondContact O-CB 3.25Å; E269-V294 PolarHBondContact O-N 2.97Å; V292-V294 HydrophobicContact CG1-CG2 3.93Å
295	G	96.7	Very high	95.2	Very high	14 Å²	14	64.4 Å²	64.4	14%	0.144	33%	0.325	C	S	.	.	S	Bend	trans	-57.7	141.2	172.9	0	0	0	0	0	112.1	E269	E269-G295 PolarHBondContact O-N 2.77Å; E269-G295 WeakPolarHBondContact OE2-CA 3.35Å; E269-G295 PolarHBondContact OE2-N 2.75Å
296	W	91.9	Very high	95.2	Very high	98 Å²	98	67.3 Å²	67.3	37%	0.371	35%	0.347	S	S	.	.			trans	-101.4	128.7	-177.3	-179.8	-92.5	0	0	0	111.2	Y52 M319	Y52-W296 AromaticContact CD1-CD1 4Å; Y52-W296 AromaticContact CE1-CD1 3.88Å; Y52-W296 AromaticContact CE1-NE1 3.68Å; W296-M319 HydrophobicContact CE3-CE 3.79Å; W296-M319 HydrophobicContact CZ3-CE 3.56Å
297	T	89.9	Confident	95.2	Very high	34 Å²	34	68.7 Å²	68.7	21%	0.209	35%	0.348	C	S	.	.			trans	-158.7	145.7	164	-175	0	0	0	0	108.7	G272 V274 M277 M299	G272-T297 WeakPolarHBondContact O-CG2 3.43Å; V274-T297 HydrophobicContact CG1-CG2 4.2Å; M277-T297 HydrophobicContact CE-CG2 3.9Å; T297-M299 PolarHBondContact OG1-N 3.09Å
298	D	88.1	Confident	95.2	Very high	95 Å²	95	66.6 Å²	66.6	51%	0.508	33%	0.328	S	S	.	.	S	Bend	trans	-125.4	11.6	170	66.4	-13.8	0	0	0	112.6	Y52	Y52-D298 PolarHBondContact OH-N 3.31Å; Y52-D298 VanDerWaalsContact OH-N 3.12Å; Y52-D298 PolarHBondContact OH-OD1 3.03Å
299	M	87.4	Confident	95.2	Very high	101 Å²	101	62.7 Å²	62.7	50%	0.498	32%	0.318	S	S	.	.	S	Bend	trans	-90	-21.7	-174.6	-65.5	-63	-69.5	0	0	114	Y52 T297	Y52-M299 WeakPolarHBondContact OH-CG 3.36Å; T297-M299 PolarHBondContact OG1-N 3.09Å
300	F	90.5	Very high	95.2	Very high	145 Å²	145	69.6 Å²	69.6	64%	0.636	35%	0.353	S	S	*	.	S	Bend	trans	-137.6	143.1	-169.7	-55.4	-70.5	0	0	0	111.9	V274	V274-F300 HydrophobicContact CG1-CB 3.73Å; V274-F300 HydrophobicContact CG2-CB 4.23Å
301	D	94.6	Very high	95.1	Very high	160 Å²	160	71.6 Å²	71.6	86%	0.856	37%	0.367	S	S	*	.			trans	-75	150.9	170	-69.7	-38.5	0	0	0	111.3
302	I	94.1	Very high	95.1	Very high	65 Å²	65	73 Å²	73	33%	0.333	38%	0.383	S	S	.	.			trans	-107.4	123	171.9	-43.2	159.5	0	0	0	109.2	V274 M277 W315	V274-I302 HydrophobicContact CB-CB 4.46Å; V274-I302 HydrophobicContact CB-CG1 3.89Å; V274-I302 HydrophobicContact CB-CG2 4.4Å; V274-I302 HydrophobicContact CG1-CG1 3.65Å; M277-I302 HydrophobicContact CB-CD1 4.34Å; M277-I302 HydrophobicContact CB-CG2 4.42Å; M277-I302 HydrophobicContact SD-CD1 3.31Å; M277-I302 WeakPolarHBondContact SD-CD1 3.49Å; M277-I302 HydrophobicContact SD-CG1 3.95Å; I302-W315 HydrophobicContact CB-CH2 3.99Å; I302-W315 HydrophobicContact CD1-CH2 4.04Å; I302-W315 HydrophobicContact CD1-CZ2 4.21Å; I302-W315 HydrophobicContact CG2-CH2 3.54Å; I302-W315 HydrophobicContact CG2-CZ2 4.09Å
303	A	94.3	Very high	95	Very high	63 Å²	63	74.1 Å²	74.1	52%	0.521	39%	0.387	S	S	.	.			trans	-103.2	134	176.9	0	0	0	0	0	111	R278	R278-A303 PolarHBondContact NE-O 3.02Å; R278-A303 PolarHBondContact NH2-O 3.22Å
304	I	95.5	Very high	95	Very high	37 Å²	37	75.9 Å²	75.9	19%	0.19	40%	0.398	C	S	.	.			trans	-138.7	157.1	171.8	61.5	163.2	0	0	0	110.6	R278 L281 P306 L309 W315	R278-I304 HydrophobicContact CG-CG2 4.42Å; L281-I304 HydrophobicContact CD2-CB 4.37Å; L281-I304 HydrophobicContact CD2-CD1 3.55Å; L281-I304 HydrophobicContact CD2-CG2 3.96Å; I304-P306 WeakPolarHBondContact O-CD 3.17Å; I304-L309 HydrophobicContact CD1-CD1 3.91Å; I304-L309 HydrophobicContact CD1-CD2 4.27Å; I304-L309 HydrophobicContact CD1-CG 3.9Å; I304-W315 HydrophobicContact CD1-CE3 3.74Å; I304-W315 HydrophobicContact CD1-CZ3 3.68Å; I304-W315 HydrophobicContact CG1-CZ3 4.1Å; I304-W315 HydrophobicContact CG2-CH2 4Å; I304-W315 HydrophobicContact CG2-CZ3 4.05Å
305	R	95.9	Very high	95	Very high	141 Å²	141	78.3 Å²	78.3	53%	0.532	41%	0.405	S	S	.	.			trans	-74.6	126.2	169.8	-59	-179.5	172.6	151.3	-7.9	109.1	R307 H308	R305-R307 HydrophobicContact CB-CG 4.12Å; R305-R307 VanDerWaalsContact CD-CZ 3.42Å; R305-R307 PolarHBondContact O-N 3.24Å; R305-H308 WeakPolarHBondContact O-CB 3.32Å; R305-H308 PolarHBondContact O-CD2 2.98Å; R305-H308 PolarHBondContact O-N 3.4Å
306	P	97.3	Very high	95.1	Very high	92 Å²	92	81.3 Å²	81.3	60%	0.597	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.4	-176.7	-29.5	36	0	0	0	114.7	I304 H308 L309 I310	I304-P306 WeakPolarHBondContact O-CD 3.17Å; P306-H308 PolarHBondContact O-N 3.12Å; P306-H308 VanDerWaalsContact O-N 3.11Å; P306-L309 PolarHBondContact O-N 3.49Å; P306-I310 HydrophobicContact CB-CD1 4.3Å; P306-I310 PolarHBondContact O-N 3.42Å; P306-I310 VanDerWaalsContact O-N 3.09Å
307	R	96.6	Very high	95.4	Very high	124 Å²	124	79.4 Å²	79.4	47%	0.468	42%	0.424	S	S	.	.	H	α-helix	trans	-53.4	-31.4	175.5	75.8	177.4	-170.4	-126.9	1.6	113.2	R305 L309 I310 C311	R305-R307 HydrophobicContact CB-CG 4.12Å; R305-R307 VanDerWaalsContact CD-CZ 3.42Å; R305-R307 PolarHBondContact O-N 3.24Å; R307-L309 PolarHBondContact O-N 3.09Å; R307-I310 PolarHBondContact O-N 3.03Å; R307-C311 WeakPolarHBondContact O-CB 3.47Å; R307-C311 PolarHBondContact O-N 3.42Å; R307-C311 PolarHBondContact O-SG 2.88Å
308	H	96.5	Very high	95.8	Very high	15 Å²	15	78.2 Å²	78.2	7%	0.069	42%	0.418	C	S	.	.	H	α-helix	trans	-59.5	-34.7	179.7	-68.6	-65.6	0	0	0	111.7	L281 E282 R305 P306 R313	L281-H308 HydrophobicContact CD2-CB 4.25Å; E282-H308 IonicContact OE1-CE1 3.01Å; E282-H308 IonicContact OE1-NE2 2.64Å; R305-H308 WeakPolarHBondContact O-CB 3.32Å; R305-H308 PolarHBondContact O-CD2 2.98Å; R305-H308 PolarHBondContact O-N 3.4Å; P306-H308 PolarHBondContact O-N 3.12Å; P306-H308 VanDerWaalsContact O-N 3.11Å; H308-R313 VanDerWaalsContact O-CB 3.22Å; H308-R313 WeakPolarHBondContact O-CB 3.28Å; H308-R313 WeakPolarHBondContact O-CD 3.49Å; H308-R313 VanDerWaalsContact O-CG 3.31Å; H308-R313 WeakPolarHBondContact O-CG 3.31Å
309	L	98.2	Very high	96.2	Very high	71 Å²	71	76.4 Å²	76.4	37%	0.372	41%	0.407	S	S	.	.	H	α-helix	trans	-87.4	-42.7	177.2	-56.8	-178.5	0	0	0	112	L281 I304 P306 R307 C311 G312 W315	L281-L309 HydrophobicContact CD1-CD2 4.36Å; L281-L309 HydrophobicContact CD2-CD2 4.34Å; I304-L309 HydrophobicContact CD1-CD1 3.91Å; I304-L309 HydrophobicContact CD1-CD2 4.27Å; I304-L309 HydrophobicContact CD1-CG 3.9Å; P306-L309 PolarHBondContact O-N 3.49Å; R307-L309 PolarHBondContact O-N 3.09Å; L309-C311 PolarHBondContact O-N 3.34Å; L309-G312 PolarHBondContact O-N 3.25Å; L309-W315 HydrophobicContact CD2-CB 3.8Å
310	I	97.8	Very high	96.7	Very high	144 Å²	144	71.6 Å²	71.6	74%	0.738	38%	0.383	S	S	*	.	H	α-helix	trans	-57.6	-36.5	-179.4	-66.1	168.9	0	0	0	111.3	P306 R307 G312	P306-I310 HydrophobicContact CB-CD1 4.3Å; P306-I310 PolarHBondContact O-N 3.42Å; P306-I310 VanDerWaalsContact O-N 3.09Å; R307-I310 PolarHBondContact O-N 3.03Å; I310-G312 PolarHBondContact O-N 3.22Å
311	C	96.7	Very high	97.1	Very high	59 Å²	59	64.7 Å²	64.7	40%	0.399	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.6	-179.8	-65.6	0	0	0	0	114.7	E286 A287 R307 L309	E286-C311 HydrophobicContact CG-CB 3.49Å; E286-C311 VanDerWaalsContact CG-CB 3.49Å; E286-C311 CarbonylContact O-C 3.46Å; E286-C311 VanDerWaalsContact O-C 3.32Å; E286-C311 VanDerWaalsContact O-O 3.11Å; E286-C311 WeakPolarHBondContact OE1-CB 3.45Å; E286-C311 PolarHBondContact OE1-SG 3.49Å; A287-C311 WeakPolarHBondContact CA-O 3.28Å; R307-C311 WeakPolarHBondContact O-CB 3.47Å; R307-C311 PolarHBondContact O-N 3.42Å; R307-C311 PolarHBondContact O-SG 2.88Å; L309-C311 PolarHBondContact O-N 3.34Å
312	G	97.9	Very high	97.2	Very high	31 Å²	31	58.5 Å²	58.5	32%	0.32	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	127.6	-10	169.8	0	0	0	0	0	116.3	E286 A287 L309 I310	E286-G312 CarbonylContact O-C 2.99Å; E286-G312 PolarHBondContact O-N 3.41Å; A287-G312 CarbonylContact O-C 3.53Å; A287-G312 WeakPolarHBondContact O-CA 3.28Å; L309-G312 PolarHBondContact O-N 3.25Å; I310-G312 PolarHBondContact O-N 3.22Å
313	R	98.6	Very high	97.4	Very high	23 Å²	23	56.6 Å²	56.6	9%	0.087	32%	0.316	C	S	.	.			trans	-61.6	145.6	175.1	-63.9	-178.5	176.8	84.1	-1.4	111.7	L281 S284 M285 E286 G289 H308	L281-R313 HydrophobicContact CD1-CB 4.13Å; L281-R313 WeakPolarHBondContact O-CD 3.4Å; L281-R313 PolarHBondContact O-NE 2.84Å; S284-R313 VanDerWaalsContact O-CZ 3.27Å; S284-R313 PolarHBondContact O-NE 2.75Å; S284-R313 PolarHBondContact O-NH2 2.91Å; S284-R313 WeakPolarHBondContact OG-CD 3.41Å; S284-R313 PolarHBondContact OG-NE 2.77Å; M285-R313 WeakPolarHBondContact O-CG 3.48Å; E286-R313 VanDerWaalsContact CA-CZ 3.4Å; E286-R313 PolarHBondContact O-N 2.74Å; G289-R313 CarbonylContact O-C 3.56Å; G289-R313 VanDerWaalsContact O-CA 3.28Å; G289-R313 WeakPolarHBondContact O-CA 3.18Å; H308-R313 VanDerWaalsContact O-CB 3.22Å; H308-R313 WeakPolarHBondContact O-CB 3.28Å; H308-R313 WeakPolarHBondContact O-CD 3.49Å; H308-R313 VanDerWaalsContact O-CG 3.31Å; H308-R313 WeakPolarHBondContact O-CG 3.31Å
314	T	98.8	Very high	97.6	Very high	64 Å²	64	55.7 Å²	55.7	39%	0.393	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.7	167.7	-59.6	0	0	0	0	110	G289 V290 S291	G289-T314 PolarHBondContact O-N 2.88Å; V290-T314 WeakPolarHBondContact CA-O 3.36Å; S291-T314 PolarHBondContact N-O 2.68Å
315	W	98.5	Very high	97.6	Very high	69 Å²	69	54 Å²	54	26%	0.261	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128	174	-159.3	29.6	0	0	0	110.3	M277 L281 S291 V293 I302 I304 L309	M277-W315 HydrophobicContact CB-CZ2 4.35Å; L281-W315 HydrophobicContact CD1-CB 3.92Å; L281-W315 HydrophobicContact CD1-CD2 4.46Å; L281-W315 HydrophobicContact CD1-CG 3.88Å; L281-W315 HydrophobicContact CD2-CD2 3.99Å; L281-W315 HydrophobicContact CD2-CE3 4.13Å; L281-W315 HydrophobicContact CD2-CG 4.27Å; S291-W315 WeakPolarHBondContact O-CA 3.43Å; V293-W315 HydrophobicContact CG2-CZ2 4.1Å; I302-W315 HydrophobicContact CB-CH2 3.99Å; I302-W315 HydrophobicContact CD1-CH2 4.04Å; I302-W315 HydrophobicContact CD1-CZ2 4.21Å; I302-W315 HydrophobicContact CG2-CH2 3.54Å; I302-W315 HydrophobicContact CG2-CZ2 4.09Å; I304-W315 HydrophobicContact CD1-CE3 3.74Å; I304-W315 HydrophobicContact CD1-CZ3 3.68Å; I304-W315 HydrophobicContact CG1-CZ3 4.1Å; I304-W315 HydrophobicContact CG2-CH2 4Å; I304-W315 HydrophobicContact CG2-CZ3 4.05Å; L309-W315 HydrophobicContact CD2-CB 3.8Å
316	K	98.3	Very high	97.7	Very high	76 Å²	76	47.6 Å²	47.6	33%	0.33	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	158.6	-175	65.4	-174.1	74.2	163.2	0	111.3	T188 V290 S291 V292 V293	T188-K316 HydrophobicContact CG2-CD 3.86Å; T188-K316 HydrophobicContact CG2-CG 4.16Å; V290-K316 HydrophobicContact CG1-CD 4.28Å; S291-K316 PolarHBondContact O-N 2.89Å; V292-K316 CarbonylContact C-O 3.32Å; V292-K316 VanDerWaalsContact CA-O 3.28Å; V292-K316 WeakPolarHBondContact CA-O 3.47Å; V292-K316 HydrophobicContact CG2-CD 4.37Å; V292-K316 HydrophobicContact CG2-CG 4.02Å; V293-K316 PolarHBondContact N-O 2.92Å
317	G	98.1	Very high	97.7	Very high	58 Å²	58	47 Å²	47	60%	0.598	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	158.4	172.7	0	0	0	0	0	112.5	V293	V293-G317 CarbonylContact O-C 3.52Å; V293-G317 WeakPolarHBondContact O-CA 3.5Å
318	S	98.1	Very high	97.7	Very high	9 Å²	9	41.6 Å²	41.6	6%	0.063	24%	0.243	C	C	.	.			trans	-128.7	109.2	172.1	-163.7	0	0	0	0	111.7	T188 V293 G321 G322	T188-S318 WeakPolarHBondContact CB-OG 3.33Å; T188-S318 PolarHBondContact OG1-OG 3.06Å; V293-S318 PolarHBondContact O-N 3.04Å; S318-G321 VanDerWaalsContact OG-CA 3.27Å; S318-G321 WeakPolarHBondContact OG-CA 3.31Å; S318-G322 PolarHBondContact OG-N 2.89Å
319	M	96.6	Very high	97.8	Very high	57 Å²	57	40.9 Å²	40.9	28%	0.281	24%	0.239	S	C	.	.	S	Bend	trans	-89.8	127.5	169.2	-170.8	54	44.9	0	0	109.9	F95 L96 N111 Q112 W296 G321 G322	F95-M319 HydrophobicContact CE2-SD 3.92Å; F95-M319 HydrophobicContact CZ-SD 4.38Å; L96-M319 HydrophobicContact CD1-CG 4.31Å; N111-M319 PolarHBondContact ND2-O 3.24Å; Q112-M319 VanDerWaalsContact NE2-CB 3.34Å; W296-M319 HydrophobicContact CE3-CE 3.79Å; W296-M319 HydrophobicContact CZ3-CE 3.56Å; M319-G321 PolarHBondContact O-N 2.83Å; M319-G322 PolarHBondContact O-N 2.76Å
320	F	97.9	Very high	97.8	Very high	1 Å²	1	39 Å²	39	0%	0.004	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	48.2	36	-179.5	-161.3	-129.9	0	0	0	113.5	L94 F95 L96 G175 C179 G322 F323 A325 V329	L94-F320 HydrophobicContact CD2-CZ 4.44Å; F95-F320 HydrophobicContact CD1-CD2 4.48Å; F95-F320 HydrophobicContact CE1-CB 4.42Å; F95-F320 AromaticContact CE1-CD2 3.38Å; F95-F320 HydrophobicContact CE1-CD2 3.38Å; F95-F320 AromaticContact CE1-CE2 3.82Å; F95-F320 HydrophobicContact CE1-CE2 3.82Å; F95-F320 HydrophobicContact CE1-CG 4.06Å; F95-F320 HydrophobicContact CZ-CB 3.81Å; F95-F320 AromaticContact CZ-CD2 3.62Å; F95-F320 HydrophobicContact CZ-CD2 3.62Å; F95-F320 HydrophobicContact CZ-CE2 4.48Å; F95-F320 AromaticContact CZ-CG 3.95Å; F95-F320 HydrophobicContact CZ-CG 3.95Å; L96-F320 HydrophobicContact CB-CB 4.45Å; L96-F320 HydrophobicContact CB-CD1 4.43Å; L96-F320 HydrophobicContact CD2-CB 3.86Å; L96-F320 HydrophobicContact CD2-CD1 4.33Å; G175-F320 VanDerWaalsContact O-CE2 3.23Å; G175-F320 WeakPolarHBondContact O-CE2 3.22Å; C179-F320 HydrophobicContact CB-CD2 4.25Å; C179-F320 HydrophobicContact CB-CE1 4.43Å; C179-F320 HydrophobicContact CB-CE2 3.62Å; C179-F320 HydrophobicContact CB-CZ 3.75Å; F320-G322 PolarHBondContact O-N 3.02Å; F320-G322 VanDerWaalsContact O-N 3.16Å; F320-F323 HydrophobicContact CD1-CB 4.25Å; F320-F323 PolarHBondContact O-N 3.45Å; F320-A325 HydrophobicContact CD1-CB 3.89Å; F320-A325 HydrophobicContact CE1-CB 3.77Å; F320-V329 HydrophobicContact CE1-CG2 3.63Å; F320-V329 HydrophobicContact CZ-CG2 3.44Å; F320-V329 VanDerWaalsContact CZ-CG2 3.44Å
321	G	98.1	Very high	97.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	64.6	21.1	178.4	0	0	0	0	0	114.1	T180 G183 A184 N187 S318 M319 F323	T180-G321 WeakPolarHBondContact O-CA 3.47Å; G183-G321 VanDerWaalsContact C-CA 3.44Å; G183-G321 CarbonylContact C-O 3.54Å; G183-G321 WeakPolarHBondContact CA-O 3.36Å; A184-G321 VanDerWaalsContact N-CA 3.34Å; N187-G321 WeakPolarHBondContact CB-O 3.06Å; N187-G321 PolarHBondContact ND2-O 2.82Å; S318-G321 VanDerWaalsContact OG-CA 3.27Å; S318-G321 WeakPolarHBondContact OG-CA 3.31Å; M319-G321 PolarHBondContact O-N 2.83Å; G321-F323 PolarHBondContact O-N 2.85Å; G321-F323 VanDerWaalsContact O-N 3.16Å
322	G	98	Very high	97.9	Very high	29 Å²	29	31.4 Å²	31.4	30%	0.299	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	69.6	6.5	-176.6	0	0	0	0	0	114.6	S318 M319 F320	S318-G322 PolarHBondContact OG-N 2.89Å; M319-G322 PolarHBondContact O-N 2.76Å; F320-G322 PolarHBondContact O-N 3.02Å; F320-G322 VanDerWaalsContact O-N 3.16Å
323	F	98.2	Very high	97.9	Very high	26 Å²	26	30 Å²	30	11%	0.114	18%	0.184	C	C	.	.			trans	-70.1	133.4	177.1	-77.1	-70	0	0	0	111.3	N111 C179 Y182 G183 N187 F320 G321 A325 M332	N111-F323 WeakPolarHBondContact CB-O 3.28Å; N111-F323 PolarHBondContact ND2-O 2.92Å; C179-F323 HydrophobicContact CB-CD2 4.06Å; C179-F323 HydrophobicContact CB-CE2 4.28Å; C179-F323 WeakPolarHBondContact O-CD2 3.34Å; C179-F323 WeakPolarHBondContact O-CE2 3.31Å; Y182-F323 HydrophobicContact CD1-CZ 4.25Å; G183-F323 VanDerWaalsContact CA-CE2 3.45Å; N187-F323 WeakPolarHBondContact ND2-CD1 3.11Å; N187-F323 VanDerWaalsContact ND2-CE1 3.29Å; N187-F323 WeakPolarHBondContact ND2-CE1 3.49Å; N187-F323 WeakPolarHBondContact ND2-CE2 3.34Å; N187-F323 VanDerWaalsContact ND2-CZ 3.31Å; N187-F323 WeakPolarHBondContact ND2-CZ 3.28Å; F320-F323 HydrophobicContact CD1-CB 4.25Å; F320-F323 PolarHBondContact O-N 3.45Å; G321-F323 PolarHBondContact O-N 2.85Å; G321-F323 VanDerWaalsContact O-N 3.16Å; F323-A325 PolarHBondContact O-N 3.04Å; F323-A325 VanDerWaalsContact O-N 3.07Å; F323-M332 HydrophobicContact CE1-CG 4.43Å; F323-M332 HydrophobicContact CE2-CG 4.43Å; F323-M332 HydrophobicContact CZ-CG 4.03Å; F323-M332 HydrophobicContact CZ-SD 3.94Å
324	K	97.8	Very high	97.9	Very high	44 Å²	44	36.6 Å²	36.6	19%	0.191	21%	0.209	C	C	.	.			trans	-63.2	104.9	157.7	-67.9	-75	-178.4	174.3	0	107.1	Q98 F104 C105 S107 T110 K326 D327 G328	Q98-K324 PolarHBondContact OE1-O 3.36Å; F104-K324 PolarHBondContact O-NZ 2.83Å; C105-K324 PolarHBondContact O-NZ 3Å; S107-K324 WeakPolarHBondContact O-CE 3.36Å; S107-K324 PolarHBondContact O-NZ 3.37Å; T110-K324 WeakPolarHBondContact O-CE 3.46Å; T110-K324 PolarHBondContact O-NZ 3.39Å; K324-K326 PolarHBondContact O-N 3.14Å; K324-D327 PolarHBondContact O-N 3.32Å; K324-G328 PolarHBondContact O-N 3.08Å
325	A	96.4	Very high	97.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-55.2	-47.3	-153.7	0	0	0	0	0	115.3	L94 L96 F320 F323 V329	L94-A325 HydrophobicContact CD1-CB 3.87Å; L96-A325 HydrophobicContact CB-CB 4.18Å; L96-A325 WeakPolarHBondContact O-CB 3.37Å; F320-A325 HydrophobicContact CD1-CB 3.89Å; F320-A325 HydrophobicContact CE1-CB 3.77Å; F323-A325 PolarHBondContact O-N 3.04Å; F323-A325 VanDerWaalsContact O-N 3.07Å; A325-V329 WeakPolarHBondContact O-CB 3.46Å; A325-V329 VanDerWaalsContact O-CG2 3.27Å; A325-V329 WeakPolarHBondContact O-CG2 3.31Å; A325-V329 PolarHBondContact O-N 2.84Å; A325-V329 VanDerWaalsContact O-N 3.07Å
326	K	97.3	Very high	97.9	Very high	7 Å²	7	32.2 Å²	32.2	3%	0.03	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-52.2	179.6	-69.2	-178.5	121.5	-177.7	0	111.7	E84 L94 Q98 Q156 V159 T160 K324 A330	E84-K326 WeakPolarHBondContact OE1-CE 3.37Å; E84-K326 IonicContact OE1-NZ 2.98Å; E84-K326 PolarHBondContact OE1-NZ 3.02Å; E84-K326 IonicContact OE2-NZ 3.03Å; E84-K326 PolarHBondContact OE2-NZ 3.06Å; L94-K326 HydrophobicContact CD1-CB 4.39Å; L94-K326 HydrophobicContact CD1-CG 3.78Å; Q98-K326 HydrophobicContact CB-CB 4.39Å; Q98-K326 HydrophobicContact CB-CD 4.32Å; Q98-K326 HydrophobicContact CB-CG 4.06Å; Q156-K326 WeakPolarHBondContact O-CE 3.41Å; Q156-K326 PolarHBondContact O-NZ 2.95Å; V159-K326 WeakPolarHBondContact O-CE 3.46Å; T160-K326 PolarHBondContact OG1-O 2.93Å; K324-K326 PolarHBondContact O-N 3.14Å; K326-A330 WeakPolarHBondContact O-CB 3.48Å; K326-A330 PolarHBondContact O-N 3.33Å
327	D	97	Very high	97.9	Very high	79 Å²	79	31.6 Å²	31.6	42%	0.422	19%	0.19	S	C	.	.	H	α-helix	trans	-70.9	-40.5	-173.8	-57.1	-32.4	0	0	0	111.1	Q98 K100 K324 G331	Q98-D327 PolarHBondContact NE2-OD2 2.9Å; K100-D327 WeakPolarHBondContact CE-OD1 3.43Å; K100-D327 IonicContact NZ-OD1 2.74Å; K100-D327 PolarHBondContact NZ-OD1 2.9Å; K324-D327 PolarHBondContact O-N 3.32Å; D327-G331 PolarHBondContact O-N 3.01Å
328	G	97.6	Very high	97.9	Very high	12 Å²	12	33.4 Å²	33.4	12%	0.124	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-48.1	179.4	0	0	0	0	0	112.6	K324 G331 M332	K324-G328 PolarHBondContact O-N 3.08Å; G328-G331 PolarHBondContact O-N 2.84Å; G328-M332 WeakPolarHBondContact O-CG 3.37Å; G328-M332 PolarHBondContact O-N 3.48Å
329	V	98.4	Very high	97.8	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.2	-41.5	179.4	173.7	0	0	0	0	111.3	I92 L94 T160 L174 F320 A325 G331 M332 V333	I92-V329 HydrophobicContact CB-CG1 4.33Å; I92-V329 HydrophobicContact CD1-CG1 3.75Å; I92-V329 HydrophobicContact CG2-CG1 4.15Å; L94-V329 HydrophobicContact CD2-CB 4.21Å; L94-V329 HydrophobicContact CD2-CG1 4.43Å; L94-V329 HydrophobicContact CD2-CG2 3.68Å; T160-V329 HydrophobicContact CG2-CB 3.85Å; T160-V329 HydrophobicContact CG2-CG1 3.54Å; L174-V329 HydrophobicContact CB-CG1 4.18Å; L174-V329 WeakPolarHBondContact O-CG2 3.25Å; F320-V329 HydrophobicContact CE1-CG2 3.63Å; F320-V329 HydrophobicContact CZ-CG2 3.44Å; F320-V329 VanDerWaalsContact CZ-CG2 3.44Å; A325-V329 WeakPolarHBondContact O-CB 3.46Å; A325-V329 VanDerWaalsContact O-CG2 3.27Å; A325-V329 WeakPolarHBondContact O-CG2 3.31Å; A325-V329 PolarHBondContact O-N 2.84Å; A325-V329 VanDerWaalsContact O-N 3.07Å; V329-G331 VanDerWaalsContact C-N 3.27Å; V329-G331 PolarHBondContact O-N 2.9Å; V329-M332 PolarHBondContact O-N 3.41Å; V329-M332 VanDerWaalsContact O-N 3.14Å; V329-V333 WeakPolarHBondContact O-CG2 3.39Å; V329-V333 PolarHBondContact O-N 3.16Å
330	A	97.9	Very high	97.8	Very high	32 Å²	32	46.4 Å²	46.4	26%	0.264	24%	0.237	S	C	.	.	H	α-helix	trans	-59.3	-40.3	174	0	0	0	0	0	111.8	K326 R334	K326-A330 WeakPolarHBondContact O-CB 3.48Å; K326-A330 PolarHBondContact O-N 3.33Å; A330-R334 PolarHBondContact O-N 3.42Å
331	G	98.3	Very high	97.8	Very high	34 Å²	34	46.6 Å²	46.6	35%	0.351	24%	0.237	S	C	.	.	H	α-helix	trans	-63.3	-41.5	173.3	0	0	0	0	0	113.4	D327 G328 V329 R334 A335	D327-G331 PolarHBondContact O-N 3.01Å; G328-G331 PolarHBondContact O-N 2.84Å; V329-G331 VanDerWaalsContact C-N 3.27Å; V329-G331 PolarHBondContact O-N 2.9Å; G331-R334 WeakPolarHBondContact O-CB 3.19Å; G331-R334 PolarHBondContact O-N 3.39Å; G331-A335 PolarHBondContact O-N 2.89Å
332	M	98.6	Very high	97.7	Very high	9 Å²	9	50.5 Å²	50.5	4%	0.044	26%	0.255	C	S	.	.	H	α-helix	trans	-68.8	-35.7	178.2	-71.6	-64.7	-69.6	0	0	112.7	L174 I178 Y182 F323 G328 V329 R334 A335 F336 V341	L174-M332 HydrophobicContact CD1-CB 4.04Å; L174-M332 HydrophobicContact CD2-CB 3.94Å; L174-M332 HydrophobicContact CD2-CE 4.26Å; I178-M332 HydrophobicContact CG2-CE 4.43Å; Y182-M332 HydrophobicContact CD1-CE 3.84Å; Y182-M332 HydrophobicContact CD1-SD 3.98Å; Y182-M332 HydrophobicContact CE1-CE 4.31Å; Y182-M332 HydrophobicContact CE1-SD 4.1Å; Y182-M332 HydrophobicContact CG-CE 3.98Å; F323-M332 HydrophobicContact CE1-CG 4.43Å; F323-M332 HydrophobicContact CE2-CG 4.43Å; F323-M332 HydrophobicContact CZ-CG 4.03Å; F323-M332 HydrophobicContact CZ-SD 3.94Å; G328-M332 WeakPolarHBondContact O-CG 3.37Å; G328-M332 PolarHBondContact O-N 3.48Å; V329-M332 PolarHBondContact O-N 3.41Å; V329-M332 VanDerWaalsContact O-N 3.14Å; M332-R334 VanDerWaalsContact C-N 3.34Å; M332-A335 PolarHBondContact O-N 2.8Å; M332-F336 WeakPolarHBondContact O-CB 3.34Å; M332-F336 PolarHBondContact O-N 3.39Å; M332-V341 HydrophobicContact CE-CB 4.45Å; M332-V341 HydrophobicContact CE-CG1 3.93Å; M332-V341 HydrophobicContact CE-CG2 3.78Å; M332-V341 HydrophobicContact SD-CG2 4.32Å
333	V	98.7	Very high	97.7	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-45.8	171.8	171.3	0	0	0	0	110.2	I92 I162 D163 A166 V171 L174 V329 A335 F336 L337	I92-V333 HydrophobicContact CD1-CG2 4.02Å; I162-V333 HydrophobicContact CB-CG1 4.29Å; I162-V333 HydrophobicContact CB-CG2 4.21Å; I162-V333 HydrophobicContact CG2-CG2 3.86Å; D163-V333 HydrophobicContact CB-CG1 4.36Å; A166-V333 HydrophobicContact CB-CG1 3.85Å; V171-V333 HydrophobicContact CB-CG2 4.27Å; V171-V333 HydrophobicContact CG1-CG1 4.44Å; V171-V333 HydrophobicContact CG1-CG2 4.41Å; L174-V333 HydrophobicContact CD1-CB 4.26Å; L174-V333 HydrophobicContact CD1-CG2 3.55Å; V329-V333 WeakPolarHBondContact O-CG2 3.39Å; V329-V333 PolarHBondContact O-N 3.16Å; V333-A335 PolarHBondContact O-N 3.33Å; V333-F336 WeakPolarHBondContact O-CB 3.46Å; V333-F336 PolarHBondContact O-N 2.73Å; V333-L337 HydrophobicContact CG1-CD1 4.24Å; V333-L337 WeakPolarHBondContact O-CG 3.36Å; V333-L337 PolarHBondContact O-N 3.22Å
334	R	98.3	Very high	97.7	Very high	160 Å²	160	51.5 Å²	51.5	60%	0.604	25%	0.254	S	S	*	.	H	α-helix	trans	-60.5	-46.1	175.5	-174.4	-175.8	-61.2	144.9	3.1	111.4	A330 G331 M332 F336 L337 E338	A330-R334 PolarHBondContact O-N 3.42Å; G331-R334 WeakPolarHBondContact O-CB 3.19Å; G331-R334 PolarHBondContact O-N 3.39Å; M332-R334 VanDerWaalsContact C-N 3.34Å; R334-F336 VanDerWaalsContact C-N 3.26Å; R334-F336 PolarHBondContact O-N 3.33Å; R334-L337 PolarHBondContact O-N 3.27Å; R334-E338 WeakPolarHBondContact CD-OE1 3.46Å; R334-E338 HydrophobicContact CG-CG 4.41Å; R334-E338 WeakPolarHBondContact CG-OE1 3.45Å; R334-E338 WeakPolarHBondContact O-CB 3.42Å; R334-E338 WeakPolarHBondContact O-CG 3.43Å; R334-E338 PolarHBondContact O-N 3.1Å
335	A	98.1	Very high	97.6	Very high	18 Å²	18	51.5 Å²	51.5	15%	0.149	26%	0.255	C	S	.	.	H	α-helix	trans	-60.3	-36.5	178.1	0	0	0	0	0	112.3	G331 M332 V333 E338 K339 K340 V341	G331-A335 PolarHBondContact O-N 2.89Å; M332-A335 PolarHBondContact O-N 2.8Å; V333-A335 PolarHBondContact O-N 3.33Å; A335-E338 CarbonylContact O-C 3.51Å; A335-E338 PolarHBondContact O-N 3.17Å; A335-K339 PolarHBondContact O-N 3.42Å; A335-K340 HydrophobicContact CB-CB 4.31Å; A335-K340 WeakPolarHBondContact O-CB 3.46Å; A335-K340 PolarHBondContact O-N 3.03Å; A335-V341 HydrophobicContact CB-CB 4.47Å; A335-V341 HydrophobicContact CB-CG2 3.8Å; A335-V341 PolarHBondContact O-N 3.49Å
336	F	98.5	Very high	97.6	Very high	24 Å²	24	51.5 Å²	51.5	11%	0.105	26%	0.255	C	S	.	.	H	α-helix	trans	-65.4	-47.5	173.1	170.2	-109.4	0	0	0	112.2	P167 K170 V171 M332 V333 R334 E338 K339 V341 L343	P167-F336 HydrophobicContact CG-CE1 3.71Å; P167-F336 HydrophobicContact CG-CZ 4.3Å; K170-F336 HydrophobicContact CB-CE1 4.33Å; K170-F336 HydrophobicContact CB-CZ 4.1Å; K170-F336 HydrophobicContact CD-CE1 4.37Å; K170-F336 HydrophobicContact CD-CZ 3.68Å; V171-F336 HydrophobicContact CG1-CD1 3.73Å; V171-F336 HydrophobicContact CG1-CE1 4.04Å; M332-F336 WeakPolarHBondContact O-CB 3.34Å; M332-F336 PolarHBondContact O-N 3.39Å; V333-F336 WeakPolarHBondContact O-CB 3.46Å; V333-F336 PolarHBondContact O-N 2.73Å; R334-F336 VanDerWaalsContact C-N 3.26Å; R334-F336 PolarHBondContact O-N 3.33Å; F336-E338 PolarHBondContact O-N 2.92Å; F336-K339 WeakPolarHBondContact O-CA 3.11Å; F336-K339 PolarHBondContact O-N 2.87Å; F336-V341 WeakPolarHBondContact CD2-O 3.37Å; F336-L343 HydrophobicContact CB-CD1 4.04Å; F336-L343 HydrophobicContact CD1-CD1 3.9Å; F336-L343 HydrophobicContact CD2-CB 3.92Å; F336-L343 HydrophobicContact CD2-CD1 3.47Å; F336-L343 VanDerWaalsContact CD2-CD1 3.47Å; F336-L343 HydrophobicContact CD2-CG 3.49Å; F336-L343 VanDerWaalsContact CD2-CG 3.49Å; F336-L343 HydrophobicContact CE1-CD1 4.24Å; F336-L343 HydrophobicContact CE2-CB 3.72Å; F336-L343 HydrophobicContact CE2-CD1 3.85Å; F336-L343 HydrophobicContact CE2-CG 3.85Å; F336-L343 HydrophobicContact CG-CD1 3.5Å; F336-L343 VanDerWaalsContact CG-CD1 3.5Å; F336-L343 HydrophobicContact CG-CG 4.02Å; F336-L343 HydrophobicContact CZ-CB 4.43Å; F336-L343 HydrophobicContact CZ-CD1 4.22Å
337	L	98.2	Very high	97.7	Very high	63 Å²	63	52.6 Å²	52.6	33%	0.33	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-32.4	176.8	-68.2	175.9	0	0	0	112.4	D163 V333 R334 K339	D163-L337 HydrophobicContact CB-CD1 3.67Å; V333-L337 HydrophobicContact CG1-CD1 4.24Å; V333-L337 WeakPolarHBondContact O-CG 3.36Å; V333-L337 PolarHBondContact O-N 3.22Å; R334-L337 PolarHBondContact O-N 3.27Å; L337-K339 PolarHBondContact O-N 2.91Å
338	E	98	Very high	97.6	Very high	95 Å²	95	51.3 Å²	51.3	44%	0.444	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	4.1	172.9	-68.4	174.7	-172.6	0	0	113.7	R334 A335 F336 K340	R334-E338 WeakPolarHBondContact CD-OE1 3.46Å; R334-E338 HydrophobicContact CG-CG 4.41Å; R334-E338 WeakPolarHBondContact CG-OE1 3.45Å; R334-E338 WeakPolarHBondContact O-CB 3.42Å; R334-E338 WeakPolarHBondContact O-CG 3.43Å; R334-E338 PolarHBondContact O-N 3.1Å; A335-E338 CarbonylContact O-C 3.51Å; A335-E338 PolarHBondContact O-N 3.17Å; F336-E338 PolarHBondContact O-N 2.92Å; E338-K340 HydrophobicContact CB-CD 4.27Å; E338-K340 HydrophobicContact CB-CG 4.24Å; E338-K340 PolarHBondContact O-N 3.04Å; E338-K340 VanDerWaalsContact OE2-CE 3.27Å; E338-K340 WeakPolarHBondContact OE2-CE 3.29Å; E338-K340 IonicContact OE2-NZ 2.68Å; E338-K340 PolarHBondContact OE2-NZ 3.24Å
339	K	97.1	Very high	97.6	Very high	191 Å²	191	53.9 Å²	53.9	83%	0.83	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	22.8	-178.7	-51.9	180	-179.8	179.6	0	114.6	A335 F336 L337	A335-K339 PolarHBondContact O-N 3.42Å; F336-K339 WeakPolarHBondContact O-CA 3.11Å; F336-K339 PolarHBondContact O-N 2.87Å; L337-K339 PolarHBondContact O-N 2.91Å
340	K	96.4	Very high	97.6	Very high	149 Å²	149	59.3 Å²	59.3	65%	0.648	30%	0.296	S	S	*	.	S	Bend	trans	-84.2	-23.6	175	-66.2	175.2	178.2	163.3	0	112.6	A335 E338	A335-K340 HydrophobicContact CB-CB 4.31Å; A335-K340 WeakPolarHBondContact O-CB 3.46Å; A335-K340 PolarHBondContact O-N 3.03Å; E338-K340 HydrophobicContact CB-CD 4.27Å; E338-K340 HydrophobicContact CB-CG 4.24Å; E338-K340 PolarHBondContact O-N 3.04Å; E338-K340 VanDerWaalsContact OE2-CE 3.27Å; E338-K340 WeakPolarHBondContact OE2-CE 3.29Å; E338-K340 IonicContact OE2-NZ 2.68Å; E338-K340 PolarHBondContact OE2-NZ 3.24Å
341	V	96.7	Very high	97.7	Very high	4 Å²	4	59 Å²	59	2%	0.024	29%	0.289	C	S	.	.	S	Bend	trans	-121	139.7	176.8	173.3	0	0	0	0	108.7	I178 M211 M332 A335 F336 L343	I178-V341 HydrophobicContact CG2-CG1 4.42Å; M211-V341 HydrophobicContact CE-CG1 3.79Å; M211-V341 HydrophobicContact SD-CG1 4.29Å; M332-V341 HydrophobicContact CE-CB 4.45Å; M332-V341 HydrophobicContact CE-CG1 3.93Å; M332-V341 HydrophobicContact CE-CG2 3.78Å; M332-V341 HydrophobicContact SD-CG2 4.32Å; A335-V341 HydrophobicContact CB-CB 4.47Å; A335-V341 HydrophobicContact CB-CG2 3.8Å; A335-V341 PolarHBondContact O-N 3.49Å; F336-V341 WeakPolarHBondContact CD2-O 3.37Å; V341-L343 HydrophobicContact CG1-CD2 4.3Å
342	K	97.1	Very high	97.7	Very high	83 Å²	83	58.9 Å²	58.9	36%	0.361	29%	0.285	S	S	.	.			trans	-96.9	133.4	178	-78.6	172.5	167.6	-115.8	0	109.8	M211 L237 E345 F346	M211-K342 HydrophobicContact SD-CB 3.88Å; L237-K342 HydrophobicContact CD2-CB 4.36Å; L237-K342 HydrophobicContact CD2-CD 4.04Å; K342-E345 VanDerWaalsContact CB-OE2 3.24Å; K342-E345 WeakPolarHBondContact CB-OE2 3.46Å; K342-E345 VanDerWaalsContact CD-OE1 3.25Å; K342-E345 WeakPolarHBondContact CD-OE1 3.45Å; K342-E345 WeakPolarHBondContact CE-OE1 3.5Å; K342-E345 WeakPolarHBondContact CG-OE1 3.45Å; K342-E345 IonicContact NZ-OE1 3.78Å; K342-E345 PolarHBondContact NZ-OE1 2.97Å; K342-F346 VanDerWaalsContact O-CE2 3.29Å; K342-F346 WeakPolarHBondContact O-CE2 3.47Å
343	L	98.1	Very high	97.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.283	C	S	.	.			trans	-127.4	-37.2	176.7	-64.5	-177.9	0	0	0	112	K170 V171 L173 L174 I178 F336 V341 E345 F346	K170-L343 HydrophobicContact CB-CB 4.48Å; K170-L343 HydrophobicContact CB-CD1 4.43Å; V171-L343 HydrophobicContact CG1-CD1 4.25Å; L173-L343 HydrophobicContact CB-CD2 4.48Å; L174-L343 HydrophobicContact CD1-CD1 4.17Å; L174-L343 HydrophobicContact CD2-CD1 4.35Å; L174-L343 HydrophobicContact CD2-CD2 3.81Å; L174-L343 HydrophobicContact CG-CD1 4.08Å; L174-L343 HydrophobicContact CG-CD2 4.3Å; I178-L343 HydrophobicContact CB-CD2 4.25Å; I178-L343 HydrophobicContact CG1-CD2 3.87Å; I178-L343 HydrophobicContact CG2-CD2 3.87Å; F336-L343 HydrophobicContact CB-CD1 4.04Å; F336-L343 HydrophobicContact CD1-CD1 3.9Å; F336-L343 HydrophobicContact CD2-CB 3.92Å; F336-L343 HydrophobicContact CD2-CD1 3.47Å; F336-L343 VanDerWaalsContact CD2-CD1 3.47Å; F336-L343 HydrophobicContact CD2-CG 3.49Å; F336-L343 VanDerWaalsContact CD2-CG 3.49Å; F336-L343 HydrophobicContact CE1-CD1 4.24Å; F336-L343 HydrophobicContact CE2-CB 3.72Å; F336-L343 HydrophobicContact CE2-CD1 3.85Å; F336-L343 HydrophobicContact CE2-CG 3.85Å; F336-L343 HydrophobicContact CG-CD1 3.5Å; F336-L343 VanDerWaalsContact CG-CD1 3.5Å; F336-L343 HydrophobicContact CG-CG 4.02Å; F336-L343 HydrophobicContact CZ-CB 4.43Å; F336-L343 HydrophobicContact CZ-CD1 4.22Å; V341-L343 HydrophobicContact CG1-CD2 4.3Å; L343-E345 PolarHBondContact O-N 3.25Å; L343-F346 WeakPolarHBondContact O-CB 3.46Å; L343-F346 PolarHBondContact O-N 3.24Å
344	D	97.2	Very high	97.6	Very high	75 Å²	75	62.5 Å²	62.5	40%	0.401	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-54.4	-40.8	179.5	-74.4	-68.7	0	0	0	112.3	K170 F346 I347	K170-D344 WeakPolarHBondContact CD-OD1 3.27Å; K170-D344 WeakPolarHBondContact CE-OD1 3.25Å; K170-D344 IonicContact NZ-OD1 2.74Å; K170-D344 PolarHBondContact NZ-OD1 3.28Å; K170-D344 IonicContact NZ-OD2 2.86Å; K170-D344 PolarHBondContact NZ-OD2 2.93Å; D344-F346 PolarHBondContact O-N 2.99Å; D344-F346 VanDerWaalsContact O-N 3.11Å; D344-I347 PolarHBondContact O-N 3.15Å
345	E	95.6	Very high	97.6	Very high	44 Å²	44	58.7 Å²	58.7	21%	0.206	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-64.9	-16.8	-177.9	-65.4	87.8	154.5	0	0	113.9	K233 E236 L237 K342 L343	K233-E345 PolarHBondContact NZ-O 3.11Å; E236-E345 WeakPolarHBondContact OE1-CG 3.42Å; L237-E345 HydrophobicContact CD2-CB 4.26Å; K342-E345 VanDerWaalsContact CB-OE2 3.24Å; K342-E345 WeakPolarHBondContact CB-OE2 3.46Å; K342-E345 VanDerWaalsContact CD-OE1 3.25Å; K342-E345 WeakPolarHBondContact CD-OE1 3.45Å; K342-E345 WeakPolarHBondContact CE-OE1 3.5Å; K342-E345 WeakPolarHBondContact CG-OE1 3.45Å; K342-E345 IonicContact NZ-OE1 3.78Å; K342-E345 PolarHBondContact NZ-OE1 2.97Å; L343-E345 PolarHBondContact O-N 3.25Å
346	F	97.4	Very high	97.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-89.1	-21.6	177.4	-66.9	-96.5	0	0	0	112.5	L173 I178 A204 L207 A208 M211 L237 K342 L343 D344 S348 V369 R370	L173-F346 HydrophobicContact CD1-CB 3.94Å; I178-F346 HydrophobicContact CD1-CB 4.19Å; I178-F346 HydrophobicContact CD1-CD1 3.3Å; I178-F346 HydrophobicContact CD1-CD2 3.77Å; I178-F346 HydrophobicContact CD1-CE1 3.42Å; I178-F346 VanDerWaalsContact CD1-CE1 3.42Å; I178-F346 HydrophobicContact CD1-CE2 3.9Å; I178-F346 HydrophobicContact CD1-CG 3.48Å; I178-F346 VanDerWaalsContact CD1-CG 3.48Å; I178-F346 HydrophobicContact CD1-CZ 3.73Å; A204-F346 HydrophobicContact CB-CD1 4.13Å; A204-F346 WeakPolarHBondContact O-CE1 3.46Å; L207-F346 HydrophobicContact CB-CD1 4.31Å; L207-F346 HydrophobicContact CB-CE1 3.56Å; L207-F346 HydrophobicContact CB-CZ 4.28Å; A208-F346 HydrophobicContact CB-CE1 4.08Å; A208-F346 HydrophobicContact CB-CZ 4.14Å; M211-F346 HydrophobicContact CE-CE2 4.05Å; M211-F346 HydrophobicContact CE-CZ 4.05Å; M211-F346 HydrophobicContact SD-CE2 4.3Å; L237-F346 HydrophobicContact CD1-CE1 4Å; L237-F346 HydrophobicContact CD1-CE2 4.06Å; L237-F346 HydrophobicContact CD1-CZ 3.63Å; L237-F346 HydrophobicContact CD2-CE2 4Å; L237-F346 HydrophobicContact CD2-CZ 4.23Å; K342-F346 VanDerWaalsContact O-CE2 3.29Å; K342-F346 WeakPolarHBondContact O-CE2 3.47Å; L343-F346 WeakPolarHBondContact O-CB 3.46Å; L343-F346 PolarHBondContact O-N 3.24Å; D344-F346 PolarHBondContact O-N 2.99Å; D344-F346 VanDerWaalsContact O-N 3.11Å; F346-S348 PolarHBondContact O-N 3.36Å; F346-V369 HydrophobicContact CB-CG1 4.29Å; F346-V369 HydrophobicContact CD1-CG1 4.09Å; F346-V369 WeakPolarHBondContact O-CB 3.48Å; F346-V369 WeakPolarHBondContact O-CG1 3.34Å; F346-R370 WeakPolarHBondContact O-CB 3.39Å; F346-R370 PolarHBondContact O-N 3.33Å
347	I	97.8	Very high	97.6	Very high	30 Å²	30	59 Å²	59	15%	0.154	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	100.7	-177.8	-54.5	171.4	0	0	0	108.3	K170 L173 D344 V372	K170-I347 HydrophobicContact CB-CD1 4.48Å; K170-I347 HydrophobicContact CG-CD1 4.18Å; L173-I347 HydrophobicContact CD1-CD1 4.41Å; L173-I347 HydrophobicContact CD1-CG1 3.8Å; D344-I347 PolarHBondContact O-N 3.15Å; I347-V372 HydrophobicContact CD1-CG2 4.09Å; I347-V372 HydrophobicContact CG1-CG2 3.89Å; I347-V372 HydrophobicContact CG2-CB 4.28Å; I347-V372 HydrophobicContact CG2-CG2 3.95Å
348	S	96.4	Very high	97.6	Very high	53 Å²	53	60.5 Å²	60.5	37%	0.371	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-24.8	177.7	63.3	0	0	0	0	112.5	F346 C368 V369 R370	F346-S348 PolarHBondContact O-N 3.36Å; S348-C368 WeakPolarHBondContact OG-CA 3.37Å; S348-C368 VanDerWaalsContact OG-CB 3.27Å; S348-C368 WeakPolarHBondContact OG-CB 3.49Å; S348-V369 PolarHBondContact OG-N 3.11Å; S348-V369 VanDerWaalsContact OG-N 3.09Å; S348-R370 PolarHBondContact N-O 3.12Å; S348-R370 PolarHBondContact OG-O 2.88Å; S348-R370 VanDerWaalsContact OG-O 3.12Å
349	H	97.9	Very high	97.6	Very high	66 Å²	66	56 Å²	56	31%	0.306	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	144.1	179.2	-57.5	96.5	0	0	0	111.1	M351 R370 V371 V372	H349-M351 HydrophobicContact CB-CG 4.49Å; H349-R370 PolarHBondContact N-O 3.36Å; H349-V371 HydrophobicContact CB-CB 4.47Å; H349-V371 HydrophobicContact CB-CG1 4.13Å; H349-V371 HydrophobicContact CB-CG2 4.14Å; H349-V371 WeakPolarHBondContact O-CA 3.36Å; H349-V372 PolarHBondContact O-N 3.03Å
350	N	98.3	Very high	97.7	Very high	113 Å²	113	47.3 Å²	47.3	60%	0.604	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.3	167.7	-70.6	-77.1	0	0	0	108.3	V372	N350-V372 CarbonylContact C-O 3.53Å; N350-V372 WeakPolarHBondContact CA-O 3.34Å
351	M	98.3	Very high	97.7	Very high	27 Å²	27	44 Å²	44	13%	0.133	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	172.3	-175	-61.7	-179.2	71.6	0	0	110.1	H349 Q355 D358 A359 L362 V371 V372 M373 K374	H349-M351 HydrophobicContact CB-CG 4.49Å; M351-Q355 HydrophobicContact CB-CB 4.38Å; M351-Q355 HydrophobicContact CE-CB 3.49Å; M351-Q355 VanDerWaalsContact CE-CB 3.49Å; M351-Q355 HydrophobicContact CE-CG 4.33Å; M351-D358 HydrophobicContact CE-CB 3.52Å; M351-A359 HydrophobicContact SD-CB 4.19Å; M351-L362 HydrophobicContact SD-CD1 3.88Å; M351-V371 HydrophobicContact CB-CG1 4.14Å; M351-V371 HydrophobicContact CG-CG1 3.81Å; M351-V371 HydrophobicContact SD-CG1 3.47Å; M351-V371 WeakPolarHBondContact SD-CG1 3.16Å; M351-V372 PolarHBondContact N-O 3.4Å; M351-M373 HydrophobicContact CB-CG 4.45Å; M351-M373 CarbonylContact O-C 3.47Å; M351-M373 VanDerWaalsContact O-CA 3.27Å; M351-M373 WeakPolarHBondContact O-CA 3.37Å; M351-K374 PolarHBondContact O-N 3.26Å
352	A	98.2	Very high	97.7	Very high	31 Å²	31	45.5 Å²	45.5	26%	0.256	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	157.4	169.7	0	0	0	0	0	110.6	E354 Q355	A352-E354 WeakPolarHBondContact CB-OE2 3.25Å; A352-E354 PolarHBondContact O-N 2.73Å; A352-E354 VanDerWaalsContact O-N 3.13Å; A352-Q355 VanDerWaalsContact N-OE1 3.1Å; A352-Q355 WeakPolarHBondContact O-CB 3.3Å; A352-Q355 PolarHBondContact O-N 2.86Å
353	L	98.4	Very high	97.6	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-54.4	-32.2	178.8	177.4	63.3	0	0	0	112.6	A13 I24 F148 Q355 V356 M373 K374 V375	A13-L353 HydrophobicContact CB-CD1 4.25Å; I24-L353 HydrophobicContact CD1-CG 4.34Å; F148-L353 HydrophobicContact CB-CD1 4.15Å; L353-Q355 PolarHBondContact O-N 3.01Å; L353-Q355 VanDerWaalsContact O-N 3.13Å; L353-V356 WeakPolarHBondContact O-CB 3.44Å; L353-V356 PolarHBondContact O-N 2.8Å; L353-V356 VanDerWaalsContact O-N 3.09Å; L353-M373 HydrophobicContact CD1-CE 4.32Å; L353-K374 PolarHBondContact N-O 3.45Å; L353-K374 VanDerWaalsContact N-O 3.09Å; L353-V375 HydrophobicContact CB-CG2 4.38Å; L353-V375 HydrophobicContact CD1-CG2 4.46Å; L353-V375 HydrophobicContact CD2-CG1 4.09Å
354	E	98.1	Very high	97.4	Very high	85 Å²	85	48.4 Å²	48.4	40%	0.397	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-61.1	-22.1	178.4	-60.7	78.4	-175.5	0	0	112.8	R11 A352	R11-E354 IonicContact CZ-OE1 2.72Å; R11-E354 IonicContact NH1-OE1 3.6Å; R11-E354 PolarHBondContact NH1-OE1 3.41Å; R11-E354 IonicContact NH2-OE1 3.56Å; R11-E354 PolarHBondContact NH2-OE1 3.25Å; A352-E354 WeakPolarHBondContact CB-OE2 3.25Å; A352-E354 PolarHBondContact O-N 2.73Å; A352-E354 VanDerWaalsContact O-N 3.13Å
355	Q	98.3	Very high	97.2	Very high	79 Å²	79	49 Å²	49	37%	0.369	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-97.8	20.8	179.9	-48.8	177	-93.4	0	0	112.3	M351 A352 L353 N357 D358 A359	M351-Q355 HydrophobicContact CB-CB 4.38Å; M351-Q355 HydrophobicContact CE-CB 3.49Å; M351-Q355 VanDerWaalsContact CE-CB 3.49Å; M351-Q355 HydrophobicContact CE-CG 4.33Å; A352-Q355 VanDerWaalsContact N-OE1 3.1Å; A352-Q355 WeakPolarHBondContact O-CB 3.3Å; A352-Q355 PolarHBondContact O-N 2.86Å; L353-Q355 PolarHBondContact O-N 3.01Å; L353-Q355 VanDerWaalsContact O-N 3.13Å; Q355-N357 PolarHBondContact O-N 3.21Å; Q355-D358 HydrophobicContact CB-CB 4.47Å; Q355-D358 WeakPolarHBondContact O-CB 3.3Å; Q355-D358 PolarHBondContact O-N 3.39Å; Q355-A359 PolarHBondContact O-N 3Å
356	V	98.4	Very high	96.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-53.6	-37.7	-178.3	62	0	0	0	0	113.6	A13 A22 I24 F148 L353 A359 I360 M373	A13-V356 HydrophobicContact CB-CB 4.36Å; A13-V356 HydrophobicContact CB-CG1 3.81Å; A13-V356 HydrophobicContact CB-CG2 4.29Å; A22-V356 HydrophobicContact CB-CG1 4.21Å; I24-V356 HydrophobicContact CD1-CG1 4.24Å; F148-V356 HydrophobicContact CD2-CG2 3.92Å; F148-V356 HydrophobicContact CE2-CG2 3.98Å; L353-V356 WeakPolarHBondContact O-CB 3.44Å; L353-V356 PolarHBondContact O-N 2.8Å; L353-V356 VanDerWaalsContact O-N 3.09Å; V356-A359 WeakPolarHBondContact O-CB 3.3Å; V356-A359 PolarHBondContact O-N 3.21Å; V356-I360 HydrophobicContact CG2-CD1 4Å; V356-I360 VanDerWaalsContact O-CG1 3.29Å; V356-I360 WeakPolarHBondContact O-CG1 3.33Å; V356-I360 PolarHBondContact O-N 2.71Å; V356-M373 HydrophobicContact CB-CE 4.42Å; V356-M373 HydrophobicContact CB-SD 3.92Å; V356-M373 HydrophobicContact CG2-CE 4.04Å; V356-M373 HydrophobicContact CG2-SD 4.1Å
357	N	98.4	Very high	96.7	Very high	50 Å²	50	56.4 Å²	56.4	27%	0.267	29%	0.29	S	S	.	.	H	α-helix	trans	-69.3	-38.2	179.3	-65.9	-51.8	0	0	0	111.8	P21 A22 Q355 A359 I360 E361	P21-N357 WeakPolarHBondContact CA-OD1 3.49Å; A22-N357 PolarHBondContact N-OD1 2.9Å; A22-N357 PolarHBondContact O-ND2 2.74Å; Q355-N357 PolarHBondContact O-N 3.21Å; N357-A359 VanDerWaalsContact C-N 3.32Å; N357-I360 PolarHBondContact O-N 2.65Å; N357-E361 PolarHBondContact O-N 2.84Å
358	D	98.4	Very high	96.5	Very high	94 Å²	94	55.5 Å²	55.5	50%	0.503	29%	0.286	S	S	.	.	H	α-helix	trans	-64.7	-40	173.6	-59.5	-23.9	0	0	0	110.5	M351 Q355 E361 L362	M351-D358 HydrophobicContact CE-CB 3.52Å; Q355-D358 HydrophobicContact CB-CB 4.47Å; Q355-D358 WeakPolarHBondContact O-CB 3.3Å; Q355-D358 PolarHBondContact O-N 3.39Å; D358-E361 PolarHBondContact O-N 2.93Å; D358-L362 WeakPolarHBondContact O-CG 3.19Å; D358-L362 PolarHBondContact O-N 3.42Å
359	A	97.9	Very high	96.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-41	175.8	0	0	0	0	0	112.3	V46 M351 Q355 V356 N357 M363 V371 M373	V46-A359 HydrophobicContact CG2-CB 3.72Å; M351-A359 HydrophobicContact SD-CB 4.19Å; Q355-A359 PolarHBondContact O-N 3Å; V356-A359 WeakPolarHBondContact O-CB 3.3Å; V356-A359 PolarHBondContact O-N 3.21Å; N357-A359 VanDerWaalsContact C-N 3.32Å; A359-M363 PolarHBondContact O-N 3.48Å; A359-V371 HydrophobicContact CB-CB 4.07Å; A359-V371 HydrophobicContact CB-CG1 3.62Å; A359-V371 HydrophobicContact CB-CG2 4.38Å; A359-M373 HydrophobicContact CB-CG 4.47Å; A359-M373 HydrophobicContact CB-SD 3.99Å
360	I	97.5	Very high	96.3	Very high	9 Å²	9	51 Å²	51	5%	0.046	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-46.1	174.1	-72.1	165.6	0	0	0	110.5	V46 L51 L54 V356 N357 M363 R364	V46-I360 HydrophobicContact CG1-CG1 4.14Å; L51-I360 HydrophobicContact CD1-CB 4.49Å; L51-I360 HydrophobicContact CD1-CG1 4.29Å; L51-I360 HydrophobicContact CD1-CG2 4.09Å; L51-I360 HydrophobicContact CG-CG2 4.13Å; L54-I360 HydrophobicContact CD2-CD1 4.01Å; V356-I360 HydrophobicContact CG2-CD1 4Å; V356-I360 VanDerWaalsContact O-CG1 3.29Å; V356-I360 WeakPolarHBondContact O-CG1 3.33Å; V356-I360 PolarHBondContact O-N 2.71Å; N357-I360 PolarHBondContact O-N 2.65Å; I360-M363 PolarHBondContact O-N 3.18Å; I360-R364 WeakPolarHBondContact O-CB 3.48Å; I360-R364 PolarHBondContact O-N 2.98Å
361	E	97.3	Very high	96.3	Very high	79 Å²	79	45.7 Å²	45.7	37%	0.369	23%	0.232	S	C	.	.	H	α-helix	trans	-65.6	-39.9	179.3	-80.8	-63.9	139.1	0	0	112.6	N357 D358 M363 R364 N365	N357-E361 PolarHBondContact O-N 2.84Å; D358-E361 PolarHBondContact O-N 2.93Å; E361-M363 VanDerWaalsContact C-N 3.27Å; E361-M363 PolarHBondContact O-N 2.93Å; E361-R364 PolarHBondContact O-N 3.29Å; E361-R364 WeakPolarHBondContact OE1-CD 3.37Å; E361-R364 IonicContact OE1-NH1 3.92Å; E361-R364 PolarHBondContact OE1-NH1 3.42Å; E361-N365 WeakPolarHBondContact O-CB 3.35Å; E361-N365 PolarHBondContact O-N 3.04Å; E361-N365 PolarHBondContact O-ND2 2.89Å; E361-N365 PolarHBondContact OE2-ND2 3.24Å
362	L	96.6	Very high	96.3	Very high	36 Å²	36	44.5 Å²	44.5	19%	0.188	23%	0.226	C	C	.	.	H	α-helix	trans	-57.7	-41.6	172.6	-76.3	171.2	0	0	0	111.8	M351 D358 S366 Q367 C368 V371	M351-L362 HydrophobicContact SD-CD1 3.88Å; D358-L362 WeakPolarHBondContact O-CG 3.19Å; D358-L362 PolarHBondContact O-N 3.42Å; L362-S366 PolarHBondContact O-N 3.26Å; L362-Q367 HydrophobicContact CD2-CB 3.97Å; L362-Q367 PolarHBondContact O-N 3.48Å; L362-C368 HydrophobicContact CB-CB 4.33Å; L362-V371 HydrophobicContact CB-CG2 4.35Å; L362-V371 HydrophobicContact CD1-CG2 4.22Å
363	M	94.4	Very high	96.3	Very high	17 Å²	17	43 Å²	43	8%	0.084	21%	0.214	C	C	.	.	H	α-helix	trans	-70.4	-45.2	177.8	-175.7	161.3	-66	0	0	112.1	V46 H48 L51 A359 I360 E361 N365 S366 C368	V46-M363 HydrophobicContact CB-CE 4.19Å; V46-M363 HydrophobicContact CG1-CE 4.24Å; V46-M363 HydrophobicContact CG1-SD 3.92Å; V46-M363 WeakPolarHBondContact O-CE 3.18Å; H48-M363 HydrophobicContact CB-SD 4.46Å; H48-M363 PolarHBondContact N-SD 3Å; H48-M363 VanDerWaalsContact N-SD 3.39Å; L51-M363 HydrophobicContact CD1-CB 4.42Å; L51-M363 HydrophobicContact CD1-CG 4.35Å; L51-M363 HydrophobicContact CD1-SD 4.12Å; L51-M363 HydrophobicContact CD2-CB 4.03Å; L51-M363 HydrophobicContact CD2-CG 3.83Å; L51-M363 HydrophobicContact CD2-SD 4.49Å; A359-M363 PolarHBondContact O-N 3.48Å; I360-M363 PolarHBondContact O-N 3.18Å; E361-M363 VanDerWaalsContact C-N 3.27Å; E361-M363 PolarHBondContact O-N 2.93Å; M363-N365 VanDerWaalsContact C-N 3.26Å; M363-N365 PolarHBondContact O-N 3.43Å; M363-S366 PolarHBondContact O-N 3.44Å; M363-C368 WeakPolarHBondContact CA-SG 3.4Å
364	R	93.6	Very high	96.3	Very high	127 Å²	127	49.4 Å²	49.4	48%	0.479	24%	0.242	S	C	.	.	H	α-helix	trans	-56.5	-41.9	178	-174.1	-174.5	-172.6	174	6.2	111.6	L51 L55 I360 E361 S366	L51-R364 HydrophobicContact CD2-CB 4Å; L55-R364 HydrophobicContact CD1-CG 4.47Å; I360-R364 WeakPolarHBondContact O-CB 3.48Å; I360-R364 PolarHBondContact O-N 2.98Å; E361-R364 PolarHBondContact O-N 3.29Å; E361-R364 WeakPolarHBondContact OE1-CD 3.37Å; E361-R364 IonicContact OE1-NH1 3.92Å; E361-R364 PolarHBondContact OE1-NH1 3.42Å; R364-S366 VanDerWaalsContact C-N 3.26Å; R364-S366 PolarHBondContact O-N 2.94Å
365	N	93.4	Very high	96.3	Very high	87 Å²	87	45.7 Å²	45.7	47%	0.465	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	9	-179.1	-62.1	-47.6	0	0	0	113.2	E361 M363 Q367	E361-N365 WeakPolarHBondContact O-CB 3.35Å; E361-N365 PolarHBondContact O-N 3.04Å; E361-N365 PolarHBondContact O-ND2 2.89Å; E361-N365 PolarHBondContact OE2-ND2 3.24Å; M363-N365 VanDerWaalsContact C-N 3.26Å; M363-N365 PolarHBondContact O-N 3.43Å; N365-Q367 HydrophobicContact CB-CG 4.09Å; N365-Q367 PolarHBondContact O-N 2.96Å; N365-Q367 VanDerWaalsContact O-N 3.14Å
366	S	90	Very high	96.1	Very high	69 Å²	69	42.3 Å²	42.3	48%	0.483	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	20.4	-179.8	-61.8	0	0	0	0	115.2	K230 L362 M363 R364 C368	K230-S366 PolarHBondContact NZ-O 2.97Å; L362-S366 PolarHBondContact O-N 3.26Å; M363-S366 PolarHBondContact O-N 3.44Å; R364-S366 VanDerWaalsContact C-N 3.26Å; R364-S366 PolarHBondContact O-N 2.94Å; S366-C368 VanDerWaalsContact C-N 3.3Å; S366-C368 PolarHBondContact O-N 3.32Å
367	Q	92.4	Very high	95.7	Very high	131 Å²	131	46.4 Å²	46.4	61%	0.612	24%	0.236	S	C	*	.			trans	-84.6	0.4	-177.3	-67.9	177	-36.8	0	0	113.4	L362 N365	L362-Q367 HydrophobicContact CD2-CB 3.97Å; L362-Q367 PolarHBondContact O-N 3.48Å; N365-Q367 HydrophobicContact CB-CG 4.09Å; N365-Q367 PolarHBondContact O-N 2.96Å; N365-Q367 VanDerWaalsContact O-N 3.14Å
368	C	93.4	Very high	95.1	Very high	10 Å²	10	49.8 Å²	49.8	7%	0.068	25%	0.251	C	S	.	.			trans	-133.8	170.7	176.2	69.8	0	0	0	0	112.5	K230 S348 L362 M363 S366 V371	K230-C368 PolarHBondContact NZ-O 3.09Å; S348-C368 WeakPolarHBondContact OG-CA 3.37Å; S348-C368 VanDerWaalsContact OG-CB 3.27Å; S348-C368 WeakPolarHBondContact OG-CB 3.49Å; L362-C368 HydrophobicContact CB-CB 4.33Å; M363-C368 WeakPolarHBondContact CA-SG 3.4Å; S366-C368 VanDerWaalsContact C-N 3.3Å; S366-C368 PolarHBondContact O-N 3.32Å; C368-V371 HydrophobicContact CB-CG2 3.9Å
369	V	93.9	Very high	94.9	Very high	17 Å²	17	47.6 Å²	47.6	10%	0.103	24%	0.238	C	C	.	.	S	Bend	trans	-101.3	-61.3	162.5	175.7	0	0	0	0	109	A204 L207 F346 S348	A204-V369 HydrophobicContact CB-CG1 3.9Å; L207-V369 HydrophobicContact CD1-CG1 3.79Å; L207-V369 HydrophobicContact CD1-CG2 3.99Å; F346-V369 HydrophobicContact CB-CG1 4.29Å; F346-V369 HydrophobicContact CD1-CG1 4.09Å; F346-V369 WeakPolarHBondContact O-CB 3.48Å; F346-V369 WeakPolarHBondContact O-CG1 3.34Å; S348-V369 PolarHBondContact OG-N 3.11Å; S348-V369 VanDerWaalsContact OG-N 3.09Å
370	R	96.6	Very high	94.7	Very high	9 Å²	9	50.1 Å²	50.1	3%	0.034	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141.6	165.4	-73.9	-70.8	-173.8	-101	9.8	110.8	V46 E70 L173 A204 F346 S348 H349	V46-R370 WeakPolarHBondContact O-CD 3.48Å; E70-R370 IonicContact OE1-NE 3.35Å; E70-R370 IonicContact OE1-NH2 3.5Å; E70-R370 IonicContact OE2-CZ 3.47Å; E70-R370 IonicContact OE2-NE 3.46Å; E70-R370 PolarHBondContact OE2-NE 2.74Å; E70-R370 IonicContact OE2-NH2 2.71Å; L173-R370 HydrophobicContact CD2-CB 4.06Å; L173-R370 HydrophobicContact CD2-CG 3.84Å; A204-R370 HydrophobicContact CB-CG 3.81Å; F346-R370 WeakPolarHBondContact O-CB 3.39Å; F346-R370 PolarHBondContact O-N 3.33Å; S348-R370 PolarHBondContact N-O 3.12Å; S348-R370 PolarHBondContact OG-O 2.88Å; S348-R370 VanDerWaalsContact OG-O 3.12Å; H349-R370 PolarHBondContact N-O 3.36Å
371	V	97.7	Very high	94.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.9	165.6	-176.1	0	0	0	0	106.7	S45 V46 H349 M351 A359 L362 C368 M373	S45-V371 VanDerWaalsContact CA-O 3.22Å; S45-V371 WeakPolarHBondContact CA-O 3.45Å; S45-V371 VanDerWaalsContact CB-O 3.25Å; S45-V371 WeakPolarHBondContact CB-O 3.38Å; V46-V371 PolarHBondContact N-O 3.38Å; H349-V371 HydrophobicContact CB-CB 4.47Å; H349-V371 HydrophobicContact CB-CG1 4.13Å; H349-V371 HydrophobicContact CB-CG2 4.14Å; H349-V371 WeakPolarHBondContact O-CA 3.36Å; M351-V371 HydrophobicContact CB-CG1 4.14Å; M351-V371 HydrophobicContact CG-CG1 3.81Å; M351-V371 HydrophobicContact SD-CG1 3.47Å; M351-V371 WeakPolarHBondContact SD-CG1 3.16Å; A359-V371 HydrophobicContact CB-CB 4.07Å; A359-V371 HydrophobicContact CB-CG1 3.62Å; A359-V371 HydrophobicContact CB-CG2 4.38Å; L362-V371 HydrophobicContact CB-CG2 4.35Å; L362-V371 HydrophobicContact CD1-CG2 4.22Å; C368-V371 HydrophobicContact CB-CG2 3.9Å; V371-M373 HydrophobicContact CG1-CG 4.43Å
372	V	98.5	Very high	94.4	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	125.5	171.6	175.3	0	0	0	0	108.1	A43 D169 L173 I347 H349 N350 M351	A43-V372 HydrophobicContact CB-CG1 4.18Å; D169-V372 WeakPolarHBondContact O-CG1 3.39Å; L173-V372 HydrophobicContact CD2-CG2 4.08Å; I347-V372 HydrophobicContact CD1-CG2 4.09Å; I347-V372 HydrophobicContact CG1-CG2 3.89Å; I347-V372 HydrophobicContact CG2-CB 4.28Å; I347-V372 HydrophobicContact CG2-CG2 3.95Å; H349-V372 PolarHBondContact O-N 3.03Å; N350-V372 CarbonylContact C-O 3.53Å; N350-V372 WeakPolarHBondContact CA-O 3.34Å; M351-V372 PolarHBondContact N-O 3.4Å
373	M	98.6	Very high	94.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.7	176	-62	-174.7	-61.1	0	0	109.9	A43 T44 V46 F148 M351 L353 V356 A359 V371	A43-M373 WeakPolarHBondContact CA-O 3.17Å; T44-M373 HydrophobicContact CG2-CB 4.11Å; T44-M373 HydrophobicContact CG2-CE 3.73Å; T44-M373 PolarHBondContact N-O 3.02Å; T44-M373 PolarHBondContact O-N 2.99Å; V46-M373 HydrophobicContact CG2-CE 3.84Å; V46-M373 HydrophobicContact CG2-SD 4.25Å; F148-M373 HydrophobicContact CD1-CE 3.7Å; F148-M373 HydrophobicContact CE1-CE 3.52Å; F148-M373 HydrophobicContact CE2-CE 4.44Å; F148-M373 HydrophobicContact CG-CE 4.27Å; F148-M373 HydrophobicContact CZ-CE 3.94Å; M351-M373 HydrophobicContact CB-CG 4.45Å; M351-M373 CarbonylContact O-C 3.47Å; M351-M373 VanDerWaalsContact O-CA 3.27Å; M351-M373 WeakPolarHBondContact O-CA 3.37Å; L353-M373 HydrophobicContact CD1-CE 4.32Å; V356-M373 HydrophobicContact CB-CE 4.42Å; V356-M373 HydrophobicContact CB-SD 3.92Å; V356-M373 HydrophobicContact CG2-CE 4.04Å; V356-M373 HydrophobicContact CG2-SD 4.1Å; A359-M373 HydrophobicContact CB-CG 4.47Å; A359-M373 HydrophobicContact CB-SD 3.99Å; V371-M373 HydrophobicContact CG1-CG 4.43Å
374	K	98.4	Very high	94.3	Very high	136 Å²	136	54.1 Å²	54.1	59%	0.591	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.3	166.3	-174.4	176.2	-178.6	176.1	0	108.8	M351 L353	M351-K374 PolarHBondContact O-N 3.26Å; L353-K374 PolarHBondContact N-O 3.45Å; L353-K374 VanDerWaalsContact N-O 3.09Å
375	V	97.7	Very high	94.3	Very high	6 Å²	6	48.9 Å²	48.9	4%	0.036	26%	0.257	C	S	.	.			trans	-103.6	-42.1	-175.8	174.3	0	0	0	0	111.1	I41 V42 T44 E150 L353	I41-V375 HydrophobicContact CB-CG1 4.17Å; I41-V375 HydrophobicContact CG2-CB 4.11Å; I41-V375 HydrophobicContact CG2-CG1 4.21Å; I41-V375 HydrophobicContact CG2-CG2 4.07Å; I41-V375 WeakPolarHBondContact O-CB 3.28Å; I41-V375 WeakPolarHBondContact O-CG1 3.47Å; V42-V375 PolarHBondContact O-N 2.93Å; T44-V375 HydrophobicContact CG2-CG2 3.47Å; T44-V375 VanDerWaalsContact CG2-CG2 3.47Å; E150-V375 HydrophobicContact CB-CG1 4.39Å; E150-V375 HydrophobicContact CG-CG1 4.04Å; L353-V375 HydrophobicContact CB-CG2 4.38Å; L353-V375 HydrophobicContact CD1-CG2 4.46Å; L353-V375 HydrophobicContact CD2-CG1 4.09Å
376	S	94.9	Very high	94.4	Very high	8 Å²	8	45.9 Å²	45.9	6%	0.056	24%	0.241	C	C	.	.	S	Bend	trans	-146.9	159.2	178.2	-70.8	0	0	0	0	110.5	I41 V42	I41-S376 VanDerWaalsContact O-CB 3.22Å; I41-S376 WeakPolarHBondContact O-CB 3.48Å; I41-S376 PolarHBondContact O-N 3.46Å; I41-S376 PolarHBondContact O-OG 3.3Å; V42-S376 PolarHBondContact O-N 2.94Å
377	P	90.7	Very high	94.7	Very high	86 Å²	86	44 Å²	44	56%	0.558	22%	0.221	S	C	*	.			trans	-63	149.1	165.3	28.4	-33.9	0	0	0	110.1	K40	K40-P377 VanDerWaalsContact CE-O 3.23Å; K40-P377 WeakPolarHBondContact CE-O 3.5Å; K40-P377 PolarHBondContact NZ-O 2.83Å
378	E	84.1	Confident	95	Very high	122 Å²	122	36.1 Å²	36.1	57%	0.57	19%	0.185	S	C	*	.			trans	-56	0	167.9	-71.1	-163.2	-170.4	0	0	110	K40 V42 I74 K90 L168	K40-E378 PolarHBondContact NZ-OXT 3.46Å; V42-E378 HydrophobicContact CB-CG 4.37Å; V42-E378 HydrophobicContact CG1-CG 3.5Å; V42-E378 HydrophobicContact CG2-CG 4.03Å; I74-E378 HydrophobicContact CD1-CB 4.26Å; I74-E378 WeakPolarHBondContact CD1-OXT 3.39Å; K90-E378 WeakPolarHBondContact CE-OE2 3.44Å; K90-E378 IonicContact NZ-OE1 2.62Å; K90-E378 IonicContact NZ-OE2 3.16Å; K90-E378 PolarHBondContact NZ-OE2 2.9Å; L168-E378 HydrophobicContact CD1-CG 4.13Å

Retrieved 378 of 378 residues in 113 ms (Link to these results)

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