A0A077ZH65_TRITR Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A077ZH65, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 441 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	34.6	Very low	247 Å²	247	163.7 Å²	163.7	100%	1.217	84%	0.838	S	S	*	*				0	99.4	0	-93.6	179.4	-174.9	0	0	108.3
2	M	32.4	Very low	34.3	Very low	188 Å²	188	160.9 Å²	160.9	93%	0.926	82%	0.824	S	S	*	*			trans	-158.6	113.4	159.3	-111.6	170.3	165.3	0	0	106.6
3	S	36.3	Very low	34.1	Very low	108 Å²	108	165.6 Å²	165.6	76%	0.755	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-67.9	127.1	-175	46.7	0	0	0	0	111.5
4	Y	37.5	Very low	34	Very low	235 Å²	235	164 Å²	164	92%	0.922	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-83.7	125	162	-98.8	-99.2	0	0	0	108.5
5	V	42.6	Very low	34.1	Very low	108 Å²	108	160.9 Å²	160.9	66%	0.655	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-89.4	117.5	-179.7	176.4	0	0	0	0	107.9	W7	V5-W7 PolarHBondContact O-N 3.46Å
6	D	35.9	Very low	34.1	Very low	161 Å²	161	163.4 Å²	163.4	86%	0.861	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-68.7	120.9	173	-90.2	-34.5	0	0	0	110.4
7	W	26.4	Very low	34.1	Very low	231 Å²	231	167 Å²	167	88%	0.875	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-86.5	130.7	172.4	-75.9	84.7	0	0	0	110.3	V5	V5-W7 PolarHBondContact O-N 3.46Å
8	P	32.5	Very low	34.1	Very low	106 Å²	106	166.8 Å²	166.8	69%	0.688	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.3	158.2	-179	30.1	-33.1	0	0	0	112.6
9	P	38	Very low	34.3	Very low	117 Å²	117	161.9 Å²	161.9	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.1	135.1	-162.3	5.1	8.5	0	0	0	113.5	I11	P9-I11 PolarHBondContact O-N 3.33Å; P9-I11 VanDerWaalsContact O-N 3.12Å
10	L	31.2	Very low	34.8	Very low	155 Å²	155	162.2 Å²	162.2	81%	0.812	80%	0.799	S	S	*	*			trans	-63.4	105.5	172.2	-82.1	100.4	0	0	0	111.4	L12	L10-L12 PolarHBondContact O-N 3.31Å
11	I	32.8	Very low	35.2	Very low	145 Å²	145	163.8 Å²	163.8	74%	0.744	80%	0.802	S	S	*	*			trans	-85.3	93.2	167.1	-59.3	174.9	0	0	0	108	P9 R13	P9-I11 PolarHBondContact O-N 3.33Å; P9-I11 VanDerWaalsContact O-N 3.12Å; I11-R13 HydrophobicContact CG2-CG 4.13Å; I11-R13 PolarHBondContact O-N 3.33Å
12	L	31	Very low	36.7	Very low	130 Å²	130	157.7 Å²	157.7	68%	0.681	77%	0.77	S	S	*	*			trans	-72.6	90.2	171.2	-75.9	162.4	0	0	0	110	L10 H14	L10-L12 PolarHBondContact O-N 3.31Å; L12-H14 PolarHBondContact O-N 3.11Å; L12-H14 VanDerWaalsContact O-N 3.17Å
13	R	32.4	Very low	38.9	Very low	222 Å²	222	152 Å²	152	84%	0.838	75%	0.747	S	S	*	*			trans	-77.7	89.1	166.7	-74.6	-171.7	177.9	-161.3	-0.1	110	I11 T15	I11-R13 HydrophobicContact CG2-CG 4.13Å; I11-R13 PolarHBondContact O-N 3.33Å; R13-T15 PolarHBondContact O-N 2.69Å
14	H	32.8	Very low	41.4	Very low	143 Å²	143	149.6 Å²	149.6	66%	0.662	73%	0.727	S	S	*	*			trans	-91.7	83	164.1	-79	88.2	0	0	0	109.6	L12 Y16	L12-H14 PolarHBondContact O-N 3.11Å; L12-H14 VanDerWaalsContact O-N 3.17Å; H14-Y16 PolarHBondContact O-N 3Å
15	T	34.3	Very low	43.8	Very low	118 Å²	118	138.8 Å²	138.8	72%	0.724	69%	0.685	S	S	*	*			trans	-79.8	100.6	163.6	24.1	0	0	0	0	108.5	R13 Y17	R13-T15 PolarHBondContact O-N 2.69Å; T15-Y17 PolarHBondContact O-N 3.49Å
16	Y	34.8	Very low	45.9	Very low	201 Å²	201	136.6 Å²	136.6	79%	0.788	68%	0.678	S	S	*	*			trans	-64.4	106.8	167.3	-84.4	-96.6	0	0	0	109	H14 M18	H14-Y16 PolarHBondContact O-N 3Å; Y16-M18 VanDerWaalsContact C-N 3.33Å; Y16-M18 PolarHBondContact O-N 3.23Å; Y16-M18 VanDerWaalsContact O-N 3.11Å
17	Y	34.6	Very low	48.4	Very low	224 Å²	224	134.2 Å²	134.2	88%	0.878	67%	0.665	S	S	*	*			trans	-70.1	94.8	157	-89.3	-92.1	0	0	0	107	T15 A19	T15-Y17 PolarHBondContact O-N 3.49Å; Y17-A19 VanDerWaalsContact C-N 3.33Å; Y17-A19 PolarHBondContact O-N 3.01Å; Y17-A19 VanDerWaalsContact O-N 3.13Å
18	M	34.2	Very low	51.3	Low	164 Å²	164	124.2 Å²	124.2	81%	0.808	63%	0.629	S	S	*	*			trans	-73.6	97.3	160.3	-63.3	-142.2	81.1	0	0	106.2	Y16 E20	Y16-M18 VanDerWaalsContact C-N 3.33Å; Y16-M18 PolarHBondContact O-N 3.23Å; Y16-M18 VanDerWaalsContact O-N 3.11Å; M18-E20 PolarHBondContact O-N 3.29Å
19	A	36.7	Very low	53.9	Low	74 Å²	74	121.6 Å²	121.6	61%	0.612	62%	0.621	S	S	*	*			trans	-60.1	109.4	161.6	0	0	0	0	0	106.3	Y17 F21	Y17-A19 VanDerWaalsContact C-N 3.33Å; Y17-A19 PolarHBondContact O-N 3.01Å; Y17-A19 VanDerWaalsContact O-N 3.13Å; A19-F21 PolarHBondContact O-N 3.36Å
20	E	44.6	Very low	56.5	Low	167 Å²	167	116.5 Å²	116.5	78%	0.78	59%	0.588	S	S	*	*			trans	-58.5	105.1	165.1	-77.9	179.1	160.1	0	0	106.1	M18 E22	M18-E20 PolarHBondContact O-N 3.29Å; E20-E22 PolarHBondContact O-N 3.46Å
21	F	42.9	Very low	59.4	Low	196 Å²	196	113.3 Å²	113.3	86%	0.86	57%	0.567	S	S	*	*			trans	-65.9	91.9	170.3	-82.8	-89.8	0	0	0	107.2	A19 T23	A19-F21 PolarHBondContact O-N 3.36Å; F21-T23 PolarHBondContact O-N 3.13Å
22	E	66.3	Low	62.3	Low	118 Å²	118	110 Å²	110	55%	0.551	56%	0.561	S	S	*	*			trans	-75.4	115	178.2	-70	-174.7	134.3	0	0	109.7	E20 T24 K45	E20-E22 PolarHBondContact O-N 3.46Å; E22-T24 PolarHBondContact O-N 3.46Å; E22-K45 IonicContact OE1-NZ 3.39Å; E22-K45 PolarHBondContact OE1-NZ 3.28Å; E22-K45 IonicContact OE2-NZ 3.2Å; E22-K45 PolarHBondContact OE2-NZ 2.93Å
23	T	80.2	Confident	65.4	Low	70 Å²	70	105.8 Å²	105.8	43%	0.429	54%	0.542	S	S	.	.			trans	-67	127.4	-179.7	-54.6	0	0	0	0	111.2	F21 D27 L28 P46	F21-T23 PolarHBondContact O-N 3.13Å; T23-D27 HydrophobicContact CG2-CB 4.14Å; T23-L28 HydrophobicContact CG2-CD2 3.82Å; T23-L28 HydrophobicContact CG2-CG 4.4Å; T23-P46 VanDerWaalsContact O-CD 3.24Å; T23-P46 WeakPolarHBondContact O-CD 3.43Å; T23-P46 WeakPolarHBondContact O-CG 3.31Å
24	T	87.6	Confident	68.4	Low	56 Å²	56	95.2 Å²	95.2	34%	0.344	50%	0.502	S	S	.	.			trans	-96.7	168	172.4	71.6	0	0	0	0	111.5	E22 A26 D27	E22-T24 PolarHBondContact O-N 3.46Å; T24-A26 PolarHBondContact O-N 3.01Å; T24-A26 PolarHBondContact OG1-N 3.01Å; T24-D27 WeakPolarHBondContact CB-OD2 3.24Å; T24-D27 PolarHBondContact N-OD2 3.39Å; T24-D27 PolarHBondContact O-N 3.41Å; T24-D27 PolarHBondContact OG1-N 2.89Å; T24-D27 PolarHBondContact OG1-OD2 3.33Å
25	F	88.2	Confident	71.4	Confident	9 Å²	9	90.2 Å²	90.2	4%	0.039	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-30.6	172.6	-77.7	-76.2	0	0	0	113.2	D27 L28 L30 L35 L38 Y43 P46 I54 L79	F25-D27 VanDerWaalsContact C-N 3.3Å; F25-D27 PolarHBondContact O-N 3.49Å; F25-L28 HydrophobicContact CD1-CD1 3.99Å; F25-L28 WeakPolarHBondContact O-CB 3.24Å; F25-L28 PolarHBondContact O-N 2.84Å; F25-L30 HydrophobicContact CB-CD1 4.49Å; F25-L30 HydrophobicContact CD1-CD1 4.15Å; F25-L35 HydrophobicContact CB-CD2 4.03Å; F25-L38 HydrophobicContact CB-CD1 4.02Å; F25-L38 HydrophobicContact CD1-CD1 3.82Å; F25-L38 HydrophobicContact CD2-CD1 4.4Å; F25-L38 HydrophobicContact CE1-CD1 4.37Å; F25-L38 HydrophobicContact CG-CD1 3.84Å; F25-Y43 AromaticContact CE2-CD1 3.88Å; F25-Y43 HydrophobicContact CE2-CD1 3.88Å; F25-Y43 HydrophobicContact CE2-CG 4.37Å; F25-Y43 AromaticContact CZ-CD1 3.81Å; F25-Y43 HydrophobicContact CZ-CD1 3.81Å; F25-P46 HydrophobicContact CD1-CB 4.41Å; F25-P46 HydrophobicContact CE1-CB 3.95Å; F25-P46 HydrophobicContact CE2-CB 4.29Å; F25-P46 HydrophobicContact CZ-CB 3.89Å; F25-I54 HydrophobicContact CE1-CD1 4.11Å; F25-L79 HydrophobicContact CD1-CD1 4.03Å; F25-L79 HydrophobicContact CE1-CD1 3.64Å
26	A	86.6	Confident	74.3	Confident	62 Å²	62	89.3 Å²	89.3	51%	0.512	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-65.8	-35.8	176.3	0	0	0	0	0	111.5	T24 L28 G29 L35	T24-A26 PolarHBondContact O-N 3.01Å; T24-A26 PolarHBondContact OG1-N 3.01Å; A26-L28 PolarHBondContact O-N 3.42Å; A26-G29 PolarHBondContact O-N 3.37Å; A26-L35 HydrophobicContact CB-CD1 4.42Å
27	D	87.6	Confident	77.2	Confident	110 Å²	110	79.7 Å²	79.7	59%	0.588	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-68.1	-15.9	177.7	-56.8	-45.2	0	0	0	113	T23 T24 F25 G29	T23-D27 HydrophobicContact CG2-CB 4.14Å; T24-D27 WeakPolarHBondContact CB-OD2 3.24Å; T24-D27 PolarHBondContact N-OD2 3.39Å; T24-D27 PolarHBondContact O-N 3.41Å; T24-D27 PolarHBondContact OG1-N 2.89Å; T24-D27 PolarHBondContact OG1-OD2 3.33Å; F25-D27 VanDerWaalsContact C-N 3.3Å; F25-D27 PolarHBondContact O-N 3.49Å; D27-G29 VanDerWaalsContact C-N 3.29Å; D27-G29 PolarHBondContact O-N 3.3Å
28	L	88.1	Confident	79.9	Confident	22 Å²	22	69.1 Å²	69.1	12%	0.115	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-80.4	-6.6	176.9	-57.4	176.6	0	0	0	113.2	T23 F25 A26 L30 P46 I54 P55 L58	T23-L28 HydrophobicContact CG2-CD2 3.82Å; T23-L28 HydrophobicContact CG2-CG 4.4Å; F25-L28 HydrophobicContact CD1-CD1 3.99Å; F25-L28 WeakPolarHBondContact O-CB 3.24Å; F25-L28 PolarHBondContact O-N 2.84Å; A26-L28 PolarHBondContact O-N 3.42Å; L28-L30 HydrophobicContact CB-CG 4.42Å; L28-P46 HydrophobicContact CD1-CB 4.43Å; L28-I54 HydrophobicContact CB-CG2 4.19Å; L28-I54 HydrophobicContact CD1-CB 4.15Å; L28-I54 HydrophobicContact CD1-CD1 3.75Å; L28-I54 HydrophobicContact CD1-CG2 3.89Å; L28-P55 HydrophobicContact CD2-CG 4.18Å; L28-L58 WeakPolarHBondContact O-CD1 3.45Å
29	G	87.1	Confident	82.6	Confident	50 Å²	50	67 Å²	67	52%	0.515	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	27.7	176.8	0	0	0	0	0	115	A26 D27 Q83	A26-G29 PolarHBondContact O-N 3.37Å; D27-G29 VanDerWaalsContact C-N 3.29Å; D27-G29 PolarHBondContact O-N 3.3Å; G29-Q83 PolarHBondContact O-NE2 2.81Å
30	L	92.4	Very high	85.1	Confident	11 Å²	11	67.9 Å²	67.9	6%	0.058	38%	0.375	C	S	.	.			trans	-72.5	147.2	176.9	-61.6	173.3	0	0	0	112	F25 L28 I34 L35 L38 I54 L58 L79	F25-L30 HydrophobicContact CB-CD1 4.49Å; F25-L30 HydrophobicContact CD1-CD1 4.15Å; L28-L30 HydrophobicContact CB-CG 4.42Å; L30-I34 HydrophobicContact CB-CG2 4.46Å; L30-I34 HydrophobicContact CD1-CG2 4.27Å; L30-L35 HydrophobicContact CB-CD2 3.99Å; L30-L35 HydrophobicContact CB-CG 4.11Å; L30-L35 HydrophobicContact CD1-CD2 4.33Å; L30-L38 HydrophobicContact CD1-CD1 4.02Å; L30-I54 HydrophobicContact CD2-CG2 4.5Å; L30-L58 HydrophobicContact CD2-CD1 4.39Å; L30-L58 HydrophobicContact CD2-CD2 4.15Å; L30-L79 HydrophobicContact CD1-CB 4.26Å; L30-L79 HydrophobicContact CD1-CD1 4.21Å; L30-L79 HydrophobicContact CD2-CB 4.23Å
31	K	92.5	Very high	87	Confident	88 Å²	88	63 Å²	63	38%	0.383	35%	0.354	S	S	.	.			trans	-60.4	144.5	176.1	-79.5	169.5	176.2	175	0	110.2	P33 I34 L35 Q83	K31-P33 VanDerWaalsContact C-CD 3.5Å; K31-I34 HydrophobicContact CB-CD1 4.36Å; K31-I34 WeakPolarHBondContact O-CB 2.97Å; K31-I34 PolarHBondContact O-N 3.2Å; K31-L35 PolarHBondContact O-N 2.94Å; K31-Q83 WeakPolarHBondContact CE-O 3.09Å; K31-Q83 PolarHBondContact NZ-O 3.42Å
32	A	94.5	Very high	88.9	Confident	74 Å²	74	56.3 Å²	56.3	61%	0.612	34%	0.34	S	S	*	.	H	α-helix	trans	-51.8	-42.7	-177.1	0	0	0	0	0	114.9	I34 L35 E36	A32-I34 VanDerWaalsContact C-N 3.26Å; A32-I34 PolarHBondContact O-N 3.11Å; A32-L35 PolarHBondContact O-N 3.15Å; A32-E36 PolarHBondContact O-N 2.69Å
33	P	95.4	Very high	89.7	Confident	43 Å²	43	54.4 Å²	54.4	28%	0.279	33%	0.328	S	S	.	.	H	α-helix	trans	-60.8	-31.9	176.5	-25.9	36.4	0	0	0	114.3	K31 A37 H117 M118	K31-P33 VanDerWaalsContact C-CD 3.5Å; P33-A37 PolarHBondContact O-N 3.2Å; P33-A37 VanDerWaalsContact O-N 3.15Å; P33-H117 HydrophobicContact CB-CB 3.86Å; P33-M118 HydrophobicContact CB-CG 3.92Å
34	I	96	Very high	89.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-73.1	-42.8	177.6	-60.8	174.9	0	0	0	109.6	L30 K31 A32 E36 A37 L38 L79 L82 Q83 M118	L30-I34 HydrophobicContact CB-CG2 4.46Å; L30-I34 HydrophobicContact CD1-CG2 4.27Å; K31-I34 HydrophobicContact CB-CD1 4.36Å; K31-I34 WeakPolarHBondContact O-CB 2.97Å; K31-I34 PolarHBondContact O-N 3.2Å; A32-I34 VanDerWaalsContact C-N 3.26Å; A32-I34 PolarHBondContact O-N 3.11Å; I34-E36 VanDerWaalsContact C-N 3.34Å; I34-E36 PolarHBondContact O-N 3.48Å; I34-A37 PolarHBondContact O-N 2.85Å; I34-L38 HydrophobicContact CG2-CD1 4.3Å; I34-L38 WeakPolarHBondContact O-CG 3.19Å; I34-L38 PolarHBondContact O-N 2.88Å; I34-L79 HydrophobicContact CG2-CB 4.47Å; I34-L79 HydrophobicContact CG2-CD2 3.53Å; I34-L82 HydrophobicContact CD1-CB 3.84Å; I34-Q83 HydrophobicContact CD1-CB 4.46Å; I34-M118 HydrophobicContact CD1-SD 4.29Å; I34-M118 HydrophobicContact CG1-SD 3.95Å
35	L	95	Very high	89.4	Confident	38 Å²	38	61.5 Å²	61.5	20%	0.199	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-40.1	176.1	-66.7	174.6	0	0	0	112.1	F25 A26 L30 K31 A32 A37 L38 N39	F25-L35 HydrophobicContact CB-CD2 4.03Å; A26-L35 HydrophobicContact CB-CD1 4.42Å; L30-L35 HydrophobicContact CB-CD2 3.99Å; L30-L35 HydrophobicContact CB-CG 4.11Å; L30-L35 HydrophobicContact CD1-CD2 4.33Å; K31-L35 PolarHBondContact O-N 2.94Å; A32-L35 PolarHBondContact O-N 3.15Å; L35-A37 VanDerWaalsContact C-N 3.32Å; L35-A37 PolarHBondContact O-N 2.94Å; L35-L38 HydrophobicContact CD2-CD1 4.44Å; L35-L38 PolarHBondContact O-N 3.36Å; L35-N39 PolarHBondContact O-N 3.29Å; L35-N39 PolarHBondContact O-ND2 2.95Å
36	E	96	Very high	89.3	Confident	98 Å²	98	62 Å²	62	46%	0.458	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-42.2	174.6	-166.3	179.1	174.2	0	0	111.3	A32 I34 L38 N39 D40 H117	A32-E36 PolarHBondContact O-N 2.69Å; I34-E36 VanDerWaalsContact C-N 3.34Å; I34-E36 PolarHBondContact O-N 3.48Å; E36-L38 PolarHBondContact O-N 3.25Å; E36-N39 PolarHBondContact O-N 3.19Å; E36-D40 PolarHBondContact O-N 3.47Å; E36-D40 VanDerWaalsContact O-N 3.08Å; E36-H117 IonicContact OE1-CE1 3.31Å; E36-H117 IonicContact OE1-ND1 2.83Å; E36-H117 IonicContact OE1-NE2 2.69Å; E36-H117 IonicContact OE2-CG 2.93Å
37	A	94.9	Very high	89.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.3	-41.1	177.7	0	0	0	0	0	111.9	P33 I34 L35 D40 L41 D113 K116 H117	P33-A37 PolarHBondContact O-N 3.2Å; P33-A37 VanDerWaalsContact O-N 3.15Å; I34-A37 PolarHBondContact O-N 2.85Å; L35-A37 VanDerWaalsContact C-N 3.32Å; L35-A37 PolarHBondContact O-N 2.94Å; A37-D40 PolarHBondContact O-N 3.33Å; A37-L41 WeakPolarHBondContact O-CB 3.32Å; A37-L41 WeakPolarHBondContact O-CD1 3.47Å; A37-L41 VanDerWaalsContact O-CG 3.26Å; A37-L41 WeakPolarHBondContact O-CG 3.5Å; A37-L41 PolarHBondContact O-N 2.91Å; A37-L41 VanDerWaalsContact O-N 3.11Å; A37-D113 WeakPolarHBondContact CB-O 3.28Å; A37-K116 HydrophobicContact CB-CG 4.18Å; A37-H117 PolarHBondContact N-CD2 3.11Å
38	L	90.4	Very high	89	Confident	2 Å²	2	59 Å²	59	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-43.5	175.4	-73.1	172.1	0	0	0	112.1	F25 L30 I34 L35 E36 L41 G42 Y43 L79 F114	F25-L38 HydrophobicContact CB-CD1 4.02Å; F25-L38 HydrophobicContact CD1-CD1 3.82Å; F25-L38 HydrophobicContact CD2-CD1 4.4Å; F25-L38 HydrophobicContact CE1-CD1 4.37Å; F25-L38 HydrophobicContact CG-CD1 3.84Å; L30-L38 HydrophobicContact CD1-CD1 4.02Å; I34-L38 HydrophobicContact CG2-CD1 4.3Å; I34-L38 WeakPolarHBondContact O-CG 3.19Å; I34-L38 PolarHBondContact O-N 2.88Å; L35-L38 HydrophobicContact CD2-CD1 4.44Å; L35-L38 PolarHBondContact O-N 3.36Å; E36-L38 PolarHBondContact O-N 3.25Å; L38-L41 CarbonylContact O-C 3.53Å; L38-L41 PolarHBondContact O-N 3.05Å; L38-G42 PolarHBondContact O-N 3.24Å; L38-G42 VanDerWaalsContact O-N 3.13Å; L38-Y43 HydrophobicContact CD2-CD1 3.96Å; L38-Y43 HydrophobicContact CD2-CD2 3.84Å; L38-Y43 HydrophobicContact CD2-CE1 4.48Å; L38-Y43 HydrophobicContact CD2-CE2 4.37Å; L38-Y43 HydrophobicContact CD2-CG 3.6Å; L38-Y43 PolarHBondContact O-N 2.64Å; L38-L79 HydrophobicContact CD1-CD1 4Å; L38-L79 HydrophobicContact CD1-CD2 4.16Å; L38-L79 HydrophobicContact CD2-CD1 4.05Å; L38-L79 HydrophobicContact CD2-CD2 3.9Å; L38-L79 HydrophobicContact CG-CD2 4.18Å; L38-F114 HydrophobicContact CD2-CD1 4.27Å; L38-F114 HydrophobicContact CD2-CE1 4.26Å
39	N	90.9	Very high	88.9	Confident	118 Å²	118	58 Å²	58	63%	0.631	33%	0.332	S	S	*	.	H	α-helix	trans	-61.5	-45.3	177	-74.1	-24.5	0	0	0	111.9	L35 E36 L41 G42	L35-N39 PolarHBondContact O-N 3.29Å; L35-N39 PolarHBondContact O-ND2 2.95Å; E36-N39 PolarHBondContact O-N 3.19Å; N39-L41 PolarHBondContact O-N 3.35Å; N39-G42 PolarHBondContact O-N 3.29Å
40	D	90.3	Very high	89	Confident	94 Å²	94	56 Å²	56	50%	0.503	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-31.4	178.2	-69.3	-19	0	0	0	113.1	E36 A37 G42 K116 H117	E36-D40 PolarHBondContact O-N 3.47Å; E36-D40 VanDerWaalsContact O-N 3.08Å; A37-D40 PolarHBondContact O-N 3.33Å; D40-G42 VanDerWaalsContact C-N 3.28Å; D40-K116 VanDerWaalsContact CG-NZ 3.32Å; D40-K116 WeakPolarHBondContact OD2-CE 3.4Å; D40-K116 IonicContact OD2-NZ 3.96Å; D40-K116 PolarHBondContact OD2-NZ 3.11Å; D40-H117 IonicContact OD2-CD2 3.83Å; D40-H117 IonicContact OD2-CE1 3.11Å; D40-H117 IonicContact OD2-NE2 3.99Å; D40-H117 PolarHBondContact OD2-NE2 3.3Å
41	L	84.1	Confident	89	Confident	65 Å²	65	57.1 Å²	57.1	34%	0.34	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-4.4	176.8	-69.5	169.1	0	0	0	112.9	A37 L38 N39 Y43 D113 F114	A37-L41 WeakPolarHBondContact O-CB 3.32Å; A37-L41 WeakPolarHBondContact O-CD1 3.47Å; A37-L41 VanDerWaalsContact O-CG 3.26Å; A37-L41 WeakPolarHBondContact O-CG 3.5Å; A37-L41 PolarHBondContact O-N 2.91Å; A37-L41 VanDerWaalsContact O-N 3.11Å; L38-L41 CarbonylContact O-C 3.53Å; L38-L41 PolarHBondContact O-N 3.05Å; N39-L41 PolarHBondContact O-N 3.35Å; L41-Y43 HydrophobicContact CB-CD2 3.67Å; L41-Y43 HydrophobicContact CB-CE2 3.92Å; L41-Y43 HydrophobicContact CD1-CD2 4.48Å; L41-Y43 HydrophobicContact CD1-CE2 4.22Å; L41-D113 HydrophobicContact CD1-CB 3.94Å; L41-D113 HydrophobicContact CD2-CB 4.06Å; L41-F114 HydrophobicContact CD1-CD1 3.65Å; L41-F114 HydrophobicContact CD1-CE1 3.75Å
42	G	83.8	Confident	88.9	Confident	55 Å²	55	57.9 Å²	57.9	57%	0.567	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	25	-179.7	0	0	0	0	0	114.5	L38 N39 D40 E44	L38-G42 PolarHBondContact O-N 3.24Å; L38-G42 VanDerWaalsContact O-N 3.13Å; N39-G42 PolarHBondContact O-N 3.29Å; D40-G42 VanDerWaalsContact C-N 3.28Å; G42-E44 PolarHBondContact O-N 2.91Å
43	Y	81.9	Confident	88.9	Confident	77 Å²	77	54.4 Å²	54.4	30%	0.302	30%	0.295	S	S	.	.			trans	-74.9	108	172.9	-82.4	-102.7	0	0	0	110.6	F25 L38 L41 A75 F114	F25-Y43 AromaticContact CE2-CD1 3.88Å; F25-Y43 HydrophobicContact CE2-CD1 3.88Å; F25-Y43 HydrophobicContact CE2-CG 4.37Å; F25-Y43 AromaticContact CZ-CD1 3.81Å; F25-Y43 HydrophobicContact CZ-CD1 3.81Å; L38-Y43 HydrophobicContact CD2-CD1 3.96Å; L38-Y43 HydrophobicContact CD2-CD2 3.84Å; L38-Y43 HydrophobicContact CD2-CE1 4.48Å; L38-Y43 HydrophobicContact CD2-CE2 4.37Å; L38-Y43 HydrophobicContact CD2-CG 3.6Å; L38-Y43 PolarHBondContact O-N 2.64Å; L41-Y43 HydrophobicContact CB-CD2 3.67Å; L41-Y43 HydrophobicContact CB-CE2 3.92Å; L41-Y43 HydrophobicContact CD1-CD2 4.48Å; L41-Y43 HydrophobicContact CD1-CE2 4.22Å; Y43-A75 HydrophobicContact CE1-CB 4.16Å; Y43-F114 AromaticContact CE2-CE1 3.81Å; Y43-F114 HydrophobicContact CE2-CE1 3.81Å; Y43-F114 HydrophobicContact CE2-CZ 4.44Å; Y43-F114 AromaticContact CZ-CE1 3.85Å
44	E	78.5	Confident	88.9	Confident	165 Å²	165	52.3 Å²	52.3	77%	0.771	28%	0.282	S	S	*	.			trans	-88.3	-50.7	178.8	-62.2	-175.9	173.1	0	0	112.6	G42	G42-E44 PolarHBondContact O-N 2.91Å
45	K	82.8	Confident	88.8	Confident	111 Å²	111	54.5 Å²	54.5	48%	0.483	30%	0.296	S	S	.	.	S	Bend	trans	-136.8	144.5	-173.4	-64	-175.2	-175.2	179.7	0	111.9	E22 S47	E22-K45 IonicContact OE1-NZ 3.39Å; E22-K45 PolarHBondContact OE1-NZ 3.28Å; E22-K45 IonicContact OE2-NZ 3.2Å; E22-K45 PolarHBondContact OE2-NZ 2.93Å; K45-S47 PolarHBondContact O-N 3.46Å
46	P	86.4	Confident	88.8	Confident	18 Å²	18	54.7 Å²	54.7	12%	0.117	30%	0.296	C	S	.	.			trans	-67.1	133	173.5	28.4	-33.1	0	0	0	110.5	T23 F25 L28 Q50 A51	T23-P46 VanDerWaalsContact O-CD 3.24Å; T23-P46 WeakPolarHBondContact O-CD 3.43Å; T23-P46 WeakPolarHBondContact O-CG 3.31Å; F25-P46 HydrophobicContact CD1-CB 4.41Å; F25-P46 HydrophobicContact CE1-CB 3.95Å; F25-P46 HydrophobicContact CE2-CB 4.29Å; F25-P46 HydrophobicContact CZ-CB 3.89Å; L28-P46 HydrophobicContact CD1-CB 4.43Å; P46-Q50 HydrophobicContact CB-CB 3.91Å; P46-A51 HydrophobicContact CB-CB 4.27Å; P46-A51 HydrophobicContact CG-CB 4.34Å
47	S	83.4	Confident	88.9	Confident	29 Å²	29	50 Å²	50	20%	0.203	27%	0.274	C	S	.	.			trans	-63.3	162.8	166.4	63.6	0	0	0	0	111.2	K45 I49 Q50 A51 S71	K45-S47 PolarHBondContact O-N 3.46Å; S47-I49 VanDerWaalsContact C-N 3.29Å; S47-I49 PolarHBondContact O-N 3.46Å; S47-Q50 WeakPolarHBondContact O-CA 3.41Å; S47-Q50 WeakPolarHBondContact O-CB 3.43Å; S47-Q50 PolarHBondContact O-N 2.94Å; S47-Q50 VanDerWaalsContact OG-CG 3.24Å; S47-Q50 WeakPolarHBondContact OG-CG 3.46Å; S47-Q50 PolarHBondContact OG-NE2 3.35Å; S47-Q50 PolarHBondContact OG-OE1 3.38Å; S47-Q50 VanDerWaalsContact OG-OE1 3.07Å; S47-A51 PolarHBondContact O-N 3.45Å; S47-S71 WeakPolarHBondContact CB-O 3.48Å; S47-S71 PolarHBondContact OG-O 2.76Å
48	P	85.1	Confident	88.9	Confident	82 Å²	82	51.8 Å²	51.8	53%	0.532	28%	0.283	S	S	.	.	H	α-helix	trans	-53.7	-40.3	179.6	-29.4	36.1	0	0	0	114.4	Q50 E52 I227	P48-Q50 VanDerWaalsContact C-N 3.34Å; P48-Q50 PolarHBondContact O-N 3.44Å; P48-E52 WeakPolarHBondContact O-CB 3.43Å; P48-E52 VanDerWaalsContact O-CG 3.28Å; P48-E52 WeakPolarHBondContact O-CG 3.28Å; P48-E52 PolarHBondContact O-N 2.94Å; P48-E52 VanDerWaalsContact O-N 3.1Å; P48-I227 HydrophobicContact CB-CD1 3.99Å; P48-I227 HydrophobicContact CB-CG2 4.16Å
49	I	86.2	Confident	89	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-34.7	177.2	-168.9	64.8	0	0	0	111.9	S47 C53 A67 S71 K73 A76 F203 V225 I227	S47-I49 VanDerWaalsContact C-N 3.29Å; S47-I49 PolarHBondContact O-N 3.46Å; I49-C53 VanDerWaalsContact CD1-SG 3.51Å; I49-C53 WeakPolarHBondContact O-CB 3.33Å; I49-C53 PolarHBondContact O-N 3.48Å; I49-C53 PolarHBondContact O-SG 3.47Å; I49-A67 HydrophobicContact CD1-CB 4.03Å; I49-A67 HydrophobicContact CG1-CB 4.19Å; I49-S71 WeakPolarHBondContact CG2-O 3.39Å; I49-K73 HydrophobicContact CG1-CG 4.5Å; I49-A76 HydrophobicContact CG1-CB 4.45Å; I49-A76 HydrophobicContact CG2-CB 4.42Å; I49-F203 HydrophobicContact CG1-CE1 4.34Å; I49-V225 HydrophobicContact CD1-CB 4.48Å; I49-V225 HydrophobicContact CD1-CG1 3.8Å; I49-I227 HydrophobicContact CB-CG1 3.82Å; I49-I227 HydrophobicContact CD1-CG1 3.62Å; I49-I227 HydrophobicContact CG1-CG1 4.3Å
50	Q	89.2	Confident	89.1	Confident	7 Å²	7	54.2 Å²	54.2	3%	0.033	31%	0.307	C	S	.	.	H	α-helix	trans	-70.5	-47.7	177.3	-71	158.8	-1.5	0	0	110.6	P46 S47 P48 E52 C53 I54 G72 A75 A76	P46-Q50 HydrophobicContact CB-CB 3.91Å; S47-Q50 WeakPolarHBondContact O-CA 3.41Å; S47-Q50 WeakPolarHBondContact O-CB 3.43Å; S47-Q50 PolarHBondContact O-N 2.94Å; S47-Q50 VanDerWaalsContact OG-CG 3.24Å; S47-Q50 WeakPolarHBondContact OG-CG 3.46Å; S47-Q50 PolarHBondContact OG-NE2 3.35Å; S47-Q50 PolarHBondContact OG-OE1 3.38Å; S47-Q50 VanDerWaalsContact OG-OE1 3.07Å; P48-Q50 VanDerWaalsContact C-N 3.34Å; P48-Q50 PolarHBondContact O-N 3.44Å; Q50-E52 VanDerWaalsContact C-N 3.28Å; Q50-E52 PolarHBondContact O-N 3.21Å; Q50-C53 PolarHBondContact O-N 3.01Å; Q50-I54 HydrophobicContact CB-CD1 3.79Å; Q50-I54 HydrophobicContact CB-CG1 4.49Å; Q50-I54 HydrophobicContact CG-CD1 4.42Å; Q50-I54 WeakPolarHBondContact O-CB 3.44Å; Q50-I54 WeakPolarHBondContact O-CD1 3.49Å; Q50-I54 WeakPolarHBondContact O-CG1 3.41Å; Q50-I54 PolarHBondContact O-N 2.93Å; Q50-G72 WeakPolarHBondContact CG-O 3.48Å; Q50-G72 PolarHBondContact NE2-O 2.84Å; Q50-A75 HydrophobicContact CG-CB 4.41Å; Q50-A76 HydrophobicContact CB-CB 4.39Å; Q50-A76 HydrophobicContact CG-CB 3.79Å
51	A	90.6	Very high	89.4	Confident	34 Å²	34	56.5 Å²	56.5	28%	0.281	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-38.7	179.6	0	0	0	0	0	112.3	P46 S47 P55	P46-A51 HydrophobicContact CB-CB 4.27Å; P46-A51 HydrophobicContact CG-CB 4.34Å; S47-A51 PolarHBondContact O-N 3.45Å; A51-P55 WeakPolarHBondContact O-CD 3.42Å; A51-P55 WeakPolarHBondContact O-CG 3.41Å
52	E	91.8	Very high	90.1	Very high	105 Å²	105	53.8 Å²	53.8	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-78.8	-47.1	178.2	-68.8	-71.8	161	0	0	112.3	P48 Q50 H56 V225 I227	P48-E52 WeakPolarHBondContact O-CB 3.43Å; P48-E52 VanDerWaalsContact O-CG 3.28Å; P48-E52 WeakPolarHBondContact O-CG 3.28Å; P48-E52 PolarHBondContact O-N 2.94Å; P48-E52 VanDerWaalsContact O-N 3.1Å; Q50-E52 VanDerWaalsContact C-N 3.28Å; Q50-E52 PolarHBondContact O-N 3.21Å; E52-H56 PolarHBondContact O-CD2 2.95Å; E52-V225 HydrophobicContact CB-CG1 3.48Å; E52-V225 VanDerWaalsContact CB-CG1 3.48Å; E52-V225 HydrophobicContact CB-CG2 4.26Å; E52-V225 HydrophobicContact CG-CG1 4.21Å; E52-I227 HydrophobicContact CG-CD1 4.1Å
53	C	94.2	Very high	90.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-76	-38	-174.1	-68.5	0	0	0	0	113.9	I49 Q50 H56 L57 V63 A76	I49-C53 VanDerWaalsContact CD1-SG 3.51Å; I49-C53 WeakPolarHBondContact O-CB 3.33Å; I49-C53 PolarHBondContact O-N 3.48Å; I49-C53 PolarHBondContact O-SG 3.47Å; Q50-C53 PolarHBondContact O-N 3.01Å; C53-H56 PolarHBondContact O-N 3.26Å; C53-L57 HydrophobicContact CB-CD1 4.46Å; C53-L57 PolarHBondContact O-N 3.45Å; C53-V63 HydrophobicContact CB-CG1 4.3Å; C53-A76 HydrophobicContact CB-CB 4.22Å
54	I	95.2	Very high	91.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-48.7	-171	-68.9	169.4	0	0	0	111.7	F25 L28 L30 Q50 H56 L57 L58 L79 P80	F25-I54 HydrophobicContact CE1-CD1 4.11Å; L28-I54 HydrophobicContact CB-CG2 4.19Å; L28-I54 HydrophobicContact CD1-CB 4.15Å; L28-I54 HydrophobicContact CD1-CD1 3.75Å; L28-I54 HydrophobicContact CD1-CG2 3.89Å; L30-I54 HydrophobicContact CD2-CG2 4.5Å; Q50-I54 HydrophobicContact CB-CD1 3.79Å; Q50-I54 HydrophobicContact CB-CG1 4.49Å; Q50-I54 HydrophobicContact CG-CD1 4.42Å; Q50-I54 WeakPolarHBondContact O-CB 3.44Å; Q50-I54 WeakPolarHBondContact O-CD1 3.49Å; Q50-I54 WeakPolarHBondContact O-CG1 3.41Å; Q50-I54 PolarHBondContact O-N 2.93Å; I54-H56 VanDerWaalsContact C-N 3.3Å; I54-H56 PolarHBondContact O-N 3.18Å; I54-L57 PolarHBondContact O-N 3.39Å; I54-L58 HydrophobicContact CG2-CD1 3.67Å; I54-L58 HydrophobicContact CG2-CG 4.01Å; I54-L58 WeakPolarHBondContact O-CB 3.47Å; I54-L58 VanDerWaalsContact O-CG 3.31Å; I54-L58 WeakPolarHBondContact O-CG 3.34Å; I54-L58 PolarHBondContact O-N 2.88Å; I54-L79 HydrophobicContact CD1-CD1 4.07Å; I54-P80 HydrophobicContact CG1-CG 4.46Å; I54-P80 HydrophobicContact CG2-CB 4.46Å
55	P	94.3	Very high	92.2	Very high	45 Å²	45	39.7 Å²	39.7	29%	0.292	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-39.1	179	-25.8	35.5	0	0	0	113.4	L28 A51 N59	L28-P55 HydrophobicContact CD2-CG 4.18Å; A51-P55 WeakPolarHBondContact O-CD 3.42Å; A51-P55 WeakPolarHBondContact O-CG 3.41Å; P55-N59 PolarHBondContact O-N 3.07Å; P55-N59 PolarHBondContact O-ND2 3.22Å
56	H	95.6	Very high	92.5	Very high	43 Å²	43	35.6 Å²	35.6	20%	0.199	20%	0.2	C	C	.	.	H	α-helix	trans	-68.9	-41.5	179.1	-65	-61	0	0	0	112.1	E52 C53 I54 N59 R61 V63 Q223	E52-H56 PolarHBondContact O-CD2 2.95Å; C53-H56 PolarHBondContact O-N 3.26Å; I54-H56 VanDerWaalsContact C-N 3.3Å; I54-H56 PolarHBondContact O-N 3.18Å; H56-N59 PolarHBondContact O-N 3.28Å; H56-R61 PolarHBondContact O-N 3.25Å; H56-R61 VanDerWaalsContact O-N 3.15Å; H56-V63 HydrophobicContact CB-CG2 3.77Å; H56-Q223 HydrophobicContact CB-CB 4.38Å; H56-Q223 HydrophobicContact CB-CG 4.37Å; H56-Q223 VanDerWaalsContact CD2-CG 3.49Å; H56-Q223 WeakPolarHBondContact CD2-CG 3.42Å
57	L	96.5	Very high	92.1	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68.6	-39.3	177.4	-72.4	171.3	0	0	0	112.2	C53 I54 N59 G60 V63 A76 F77 P80 Q199 A201	C53-L57 HydrophobicContact CB-CD1 4.46Å; C53-L57 PolarHBondContact O-N 3.45Å; I54-L57 PolarHBondContact O-N 3.39Å; L57-N59 PolarHBondContact O-N 3.13Å; L57-G60 PolarHBondContact O-N 2.93Å; L57-V63 HydrophobicContact CD2-CB 3.93Å; L57-V63 HydrophobicContact CD2-CG2 3.71Å; L57-V63 HydrophobicContact CG-CB 4.19Å; L57-V63 HydrophobicContact CG-CG2 3.69Å; L57-A76 WeakPolarHBondContact CD1-O 3.24Å; L57-F77 HydrophobicContact CD1-CB 4.3Å; L57-P80 HydrophobicContact CB-CB 3.51Å; L57-P80 HydrophobicContact CB-CG 3.42Å; L57-P80 VanDerWaalsContact CB-CG 3.42Å; L57-P80 HydrophobicContact CD1-CG 3.6Å; L57-P80 HydrophobicContact CG-CG 4.15Å; L57-Q199 VanDerWaalsContact CA-NE2 3.34Å; L57-Q199 HydrophobicContact CD2-CG 4.47Å; L57-Q199 PolarHBondContact O-NE2 3.21Å; L57-A201 HydrophobicContact CD1-CB 4.48Å; L57-A201 HydrophobicContact CD2-CB 3.91Å
58	L	94.8	Very high	91.4	Very high	36 Å²	36	38.1 Å²	38.1	19%	0.188	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-34.7	173.7	-73.7	174.6	0	0	0	112.2	L28 L30 I54 G60 P80 Q83	L28-L58 WeakPolarHBondContact O-CD1 3.45Å; L30-L58 HydrophobicContact CD2-CD1 4.39Å; L30-L58 HydrophobicContact CD2-CD2 4.15Å; I54-L58 HydrophobicContact CG2-CD1 3.67Å; I54-L58 HydrophobicContact CG2-CG 4.01Å; I54-L58 WeakPolarHBondContact O-CB 3.47Å; I54-L58 VanDerWaalsContact O-CG 3.31Å; I54-L58 WeakPolarHBondContact O-CG 3.34Å; I54-L58 PolarHBondContact O-N 2.88Å; L58-G60 PolarHBondContact O-N 2.77Å; L58-P80 HydrophobicContact CD2-CB 3.79Å; L58-P80 HydrophobicContact CG-CB 3.84Å; L58-Q83 HydrophobicContact CD2-CB 3.65Å; L58-Q83 HydrophobicContact CD2-CG 3.57Å
59	N	93.5	Very high	90.5	Very high	126 Å²	126	36.1 Å²	36.1	67%	0.674	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	10.8	177	-73.1	-55	0	0	0	113.9	P55 H56 L57 R61	P55-N59 PolarHBondContact O-N 3.07Å; P55-N59 PolarHBondContact O-ND2 3.22Å; H56-N59 PolarHBondContact O-N 3.28Å; L57-N59 PolarHBondContact O-N 3.13Å; N59-R61 VanDerWaalsContact C-N 3.28Å; N59-R61 PolarHBondContact O-N 3.06Å
60	G	94	Very high	89.6	Confident	45 Å²	45	40.1 Å²	40.1	46%	0.464	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	12.9	175.8	0	0	0	0	0	114.9	L57 L58 Q199	L57-G60 PolarHBondContact O-N 2.93Å; L58-G60 PolarHBondContact O-N 2.77Å; G60-Q199 VanDerWaalsContact CA-NE2 3.33Å
61	R	96.6	Very high	88.7	Confident	142 Å²	142	41.2 Å²	41.2	54%	0.536	24%	0.243	S	C	.	.			trans	-82.4	146.4	176.4	-62.5	-168.7	-174.5	-164.2	0.4	111.3	H56 N59 Q199	H56-R61 PolarHBondContact O-N 3.25Å; H56-R61 VanDerWaalsContact O-N 3.15Å; N59-R61 VanDerWaalsContact C-N 3.28Å; N59-R61 PolarHBondContact O-N 3.06Å; R61-Q199 PolarHBondContact O-NE2 2.94Å
62	D	97.8	Very high	88.2	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.043	24%	0.242	C	C	.	.			trans	-64.8	147	165.7	-76.5	4.2	0	0	0	110.3	Q199 T200 M219 K220 P222 Q223	D62-Q199 WeakPolarHBondContact OD1-CA 3.34Å; D62-T200 CarbonylContact C-O 3.58Å; D62-T200 WeakPolarHBondContact CA-O 3.42Å; D62-T200 WeakPolarHBondContact CB-O 3.43Å; D62-T200 PolarHBondContact OD1-N 2.97Å; D62-M219 HydrophobicContact CB-CB 4.38Å; D62-M219 HydrophobicContact CB-CE 4.09Å; D62-M219 WeakPolarHBondContact OD2-CA 3.23Å; D62-M219 WeakPolarHBondContact OD2-CB 3.38Å; D62-K220 PolarHBondContact OD2-N 2.99Å; D62-P222 HydrophobicContact CB-CB 3.95Å; D62-P222 CarbonylContact O-C 3.57Å; D62-P222 WeakPolarHBondContact O-CA 3.2Å; D62-Q223 PolarHBondContact O-N 3.11Å
63	V	97.9	Very high	88	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134	-179.2	170.8	0	0	0	0	111.2	C53 H56 L57 T200 A201 L202 M219 Q223 V225	C53-V63 HydrophobicContact CB-CG1 4.3Å; H56-V63 HydrophobicContact CB-CG2 3.77Å; L57-V63 HydrophobicContact CD2-CB 3.93Å; L57-V63 HydrophobicContact CD2-CG2 3.71Å; L57-V63 HydrophobicContact CG-CB 4.19Å; L57-V63 HydrophobicContact CG-CG2 3.69Å; V63-T200 PolarHBondContact N-O 3.12Å; V63-A201 CarbonylContact O-C 3.58Å; V63-A201 WeakPolarHBondContact O-CA 3.43Å; V63-L202 PolarHBondContact O-N 2.81Å; V63-M219 WeakPolarHBondContact O-CE 3.42Å; V63-Q223 WeakPolarHBondContact CA-O 3.46Å; V63-Q223 HydrophobicContact CG2-CB 4.39Å; V63-V225 HydrophobicContact CG1-CG2 4.45Å
64	L	96.4	Very high	87.8	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	98.4	167.5	176.8	60.2	0	0	0	109.2	M66 L202 M207 T215 P222 Q223 E224 V225	L64-M66 HydrophobicContact CD2-CE 3.92Å; L64-M66 HydrophobicContact CG-CE 3.89Å; L64-L202 CarbonylContact C-O 3.57Å; L64-L202 WeakPolarHBondContact CA-O 3.22Å; L64-L202 HydrophobicContact CD1-CB 4.09Å; L64-L202 HydrophobicContact CD1-CD2 3.42Å; L64-L202 VanDerWaalsContact CD1-CD2 3.42Å; L64-L202 HydrophobicContact CD1-CG 4.29Å; L64-M207 HydrophobicContact CD1-CE 4.11Å; L64-M207 HydrophobicContact CD1-SD 3.86Å; L64-M207 HydrophobicContact CD2-CE 3.77Å; L64-M207 HydrophobicContact CD2-SD 4.25Å; L64-T215 HydrophobicContact CD1-CG2 4.07Å; L64-T215 HydrophobicContact CD2-CG2 4.24Å; L64-P222 HydrophobicContact CB-CB 4.32Å; L64-Q223 PolarHBondContact N-O 3.35Å; L64-E224 HydrophobicContact CB-CG 4.37Å; L64-E224 HydrophobicContact CD2-CG 4.05Å; L64-E224 WeakPolarHBondContact O-CA 3.38Å; L64-V225 PolarHBondContact O-N 2.9Å
65	G	93.8	Very high	87.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	109.8	-178.7	0	0	0	0	0	112.6	L202 F203 S204	G65-L202 PolarHBondContact N-O 3.49Å; G65-F203 VanDerWaalsContact O-CA 3.32Å; G65-F203 WeakPolarHBondContact O-CA 3.49Å; G65-S204 PolarHBondContact O-N 3.05Å
66	M	88.3	Confident	87.6	Confident	25 Å²	25	35.8 Å²	35.8	12%	0.123	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	103.8	174.1	-73.9	161.4	-85.4	0	0	110.3	L64 S204 M207 E224 V225 R226 I227	L64-M66 HydrophobicContact CD2-CE 3.92Å; L64-M66 HydrophobicContact CG-CE 3.89Å; M66-S204 WeakPolarHBondContact CA-O 3.34Å; M66-M207 HydrophobicContact CG-CG 4.05Å; M66-M207 HydrophobicContact SD-CG 3.73Å; M66-E224 HydrophobicContact CE-CB 4.14Å; M66-E224 HydrophobicContact CE-CG 4.38Å; M66-V225 PolarHBondContact N-O 3.13Å; M66-R226 HydrophobicContact CB-CG 4.16Å; M66-R226 HydrophobicContact CE-CG 3.36Å; M66-R226 VanDerWaalsContact CE-NE 3.35Å; M66-R226 HydrophobicContact SD-CG 3.82Å; M66-I227 PolarHBondContact O-N 2.87Å
67	A	79	Confident	87.7	Confident	5 Å²	5	33.7 Å²	33.7	4%	0.041	21%	0.207	C	C	.	.			trans	-153.4	154.9	178	0	0	0	0	0	111.4	I49 S71 K73 I227	I49-A67 HydrophobicContact CD1-CB 4.03Å; I49-A67 HydrophobicContact CG1-CB 4.19Å; A67-S71 WeakPolarHBondContact CB-OG 3.24Å; A67-K73 HydrophobicContact CB-CG 4.5Å; A67-I227 HydrophobicContact CB-CB 4.2Å
68	Q	69.3	Low	87.7	Confident	95 Å²	95	33.7 Å²	33.7	44%	0.444	21%	0.207	S	C	.	.			trans	-71.5	163.9	177.1	-68.6	-178.5	-21.7	0	0	112.4	S71	Q68-S71 VanDerWaalsContact O-CB 3.3Å; Q68-S71 WeakPolarHBondContact O-CB 3.32Å; Q68-S71 PolarHBondContact O-N 3.28Å; Q68-S71 PolarHBondContact O-OG 3.32Å
69	T	66.5	Low	87.8	Confident	40 Å²	40	32 Å²	32	25%	0.245	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	143.4	172.9	54.9	0	0	0	0	111.7	S71 H348	T69-S71 VanDerWaalsContact C-N 3.26Å; T69-S71 PolarHBondContact O-N 3.08Å; T69-H348 WeakPolarHBondContact CG2-NE2 3.42Å; T69-H348 PolarHBondContact OG1-CD2 3.26Å
70	G	66.7	Low	88	Confident	85 Å²	85	26 Å²	26	88%	0.876	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	80	0.6	-179.6	0	0	0	0	0	114.9	G72	G70-G72 PolarHBondContact O-N 2.96Å
71	S	69.6	Low	88.1	Confident	29 Å²	29	24.2 Å²	24.2	20%	0.203	15%	0.146	C	C	.	.	S	Bend	trans	-71.2	-9.2	176.6	53.3	0	0	0	0	114.6	S47 I49 A67 Q68 T69 K73	S47-S71 WeakPolarHBondContact CB-O 3.48Å; S47-S71 PolarHBondContact OG-O 2.76Å; I49-S71 WeakPolarHBondContact CG2-O 3.39Å; A67-S71 WeakPolarHBondContact CB-OG 3.24Å; Q68-S71 VanDerWaalsContact O-CB 3.3Å; Q68-S71 WeakPolarHBondContact O-CB 3.32Å; Q68-S71 PolarHBondContact O-N 3.28Å; Q68-S71 PolarHBondContact O-OG 3.32Å; T69-S71 VanDerWaalsContact C-N 3.26Å; T69-S71 PolarHBondContact O-N 3.08Å; S71-K73 WeakPolarHBondContact OG-CG 3.26Å
72	G	79.8	Confident	88.2	Confident	24 Å²	24	17.5 Å²	17.5	25%	0.247	12%	0.121	C	C	.	.	S	Bend	trans	96.5	17.9	-178.4	0	0	0	0	0	115.3	Q50 G70 T74 A75 A76	Q50-G72 WeakPolarHBondContact CG-O 3.48Å; Q50-G72 PolarHBondContact NE2-O 2.84Å; G70-G72 PolarHBondContact O-N 2.96Å; G72-T74 VanDerWaalsContact C-N 3.28Å; G72-T74 PolarHBondContact O-N 3.41Å; G72-A75 PolarHBondContact O-N 3.07Å; G72-A76 PolarHBondContact O-N 3.31Å
73	K	87.4	Confident	88	Confident	13 Å²	13	18.6 Å²	18.6	6%	0.057	13%	0.126	C	C	.	.	H	α-helix	trans	-51.5	-40.6	-179.4	-60.6	-173.6	-73.9	150.9	0	114	I49 A67 S71 A75 A76 F77 D173 F203	I49-K73 HydrophobicContact CG1-CG 4.5Å; A67-K73 HydrophobicContact CB-CG 4.5Å; S71-K73 WeakPolarHBondContact OG-CG 3.26Å; K73-A75 PolarHBondContact O-N 3.09Å; K73-A76 WeakPolarHBondContact O-CA 3.39Å; K73-A76 VanDerWaalsContact O-CB 3.24Å; K73-A76 WeakPolarHBondContact O-CB 3.4Å; K73-A76 PolarHBondContact O-N 2.92Å; K73-F77 WeakPolarHBondContact O-CD1 3.18Å; K73-F77 PolarHBondContact O-N 3.27Å; K73-F77 VanDerWaalsContact O-N 3.07Å; K73-D173 IonicContact NZ-OD1 3.29Å; K73-D173 PolarHBondContact NZ-OD1 2.73Å; K73-F203 HydrophobicContact CB-CD1 4.02Å; K73-F203 HydrophobicContact CB-CE1 4.35Å; K73-F203 HydrophobicContact CB-CG 4.48Å; K73-F203 HydrophobicContact CD-CB 3.93Å; K73-F203 HydrophobicContact CD-CD1 3.75Å; K73-F203 HydrophobicContact CD-CG 4.16Å; K73-F203 HydrophobicContact CG-CD1 3.9Å; K73-F203 HydrophobicContact CG-CE1 4.43Å
74	T	90.9	Very high	87.8	Confident	32 Å²	32	22.5 Å²	22.5	20%	0.196	15%	0.147	C	C	.	.	H	α-helix	trans	-56.6	-50	-177.2	-47	0	0	0	0	111.9	G72 A76 F77 S78 V107 A110 F114	G72-T74 VanDerWaalsContact C-N 3.28Å; G72-T74 PolarHBondContact O-N 3.41Å; T74-A76 VanDerWaalsContact C-N 3.33Å; T74-F77 VanDerWaalsContact CA-CE1 3.48Å; T74-F77 HydrophobicContact CG2-CZ 3.99Å; T74-S78 WeakPolarHBondContact O-CB 3.28Å; T74-S78 PolarHBondContact O-N 3.02Å; T74-S78 PolarHBondContact O-OG 3.06Å; T74-V107 HydrophobicContact CG2-CG1 4.36Å; T74-V107 HydrophobicContact CG2-CG2 4.17Å; T74-A110 HydrophobicContact CG2-CB 3.83Å; T74-F114 HydrophobicContact CG2-CE2 4.38Å
75	A	91.5	Very high	87.7	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-33.7	174.2	0	0	0	0	0	112	Y43 Q50 G72 K73 F77 S78 L79 F114	Y43-A75 HydrophobicContact CE1-CB 4.16Å; Q50-A75 HydrophobicContact CG-CB 4.41Å; G72-A75 PolarHBondContact O-N 3.07Å; K73-A75 PolarHBondContact O-N 3.09Å; A75-F77 VanDerWaalsContact C-N 3.28Å; A75-F77 PolarHBondContact O-N 3.36Å; A75-S78 PolarHBondContact O-N 2.88Å; A75-L79 HydrophobicContact CB-CD1 4.01Å; A75-L79 HydrophobicContact CB-CG 4.25Å; A75-L79 WeakPolarHBondContact O-CB 3.37Å; A75-L79 WeakPolarHBondContact O-CG 3.46Å; A75-L79 PolarHBondContact O-N 2.87Å; A75-L79 VanDerWaalsContact O-N 3.16Å; A75-F114 HydrophobicContact CB-CE1 4.48Å; A75-F114 HydrophobicContact CB-CE2 4.07Å; A75-F114 HydrophobicContact CB-CZ 3.76Å
76	A	93.9	Very high	87.8	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-38.1	180	0	0	0	0	0	112.7	I49 Q50 C53 L57 G72 K73 T74 P80	I49-A76 HydrophobicContact CG1-CB 4.45Å; I49-A76 HydrophobicContact CG2-CB 4.42Å; Q50-A76 HydrophobicContact CB-CB 4.39Å; Q50-A76 HydrophobicContact CG-CB 3.79Å; C53-A76 HydrophobicContact CB-CB 4.22Å; L57-A76 WeakPolarHBondContact CD1-O 3.24Å; G72-A76 PolarHBondContact O-N 3.31Å; K73-A76 WeakPolarHBondContact O-CA 3.39Å; K73-A76 VanDerWaalsContact O-CB 3.24Å; K73-A76 WeakPolarHBondContact O-CB 3.4Å; K73-A76 PolarHBondContact O-N 2.92Å; T74-A76 VanDerWaalsContact C-N 3.33Å; A76-P80 WeakPolarHBondContact O-CD 3.19Å; A76-P80 VanDerWaalsContact O-CG 3.26Å; A76-P80 WeakPolarHBondContact O-CG 3.16Å
77	F	96.8	Very high	88.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-92.7	-33.8	173.7	67.1	-109.9	0	0	0	114.2	L57 K73 T74 A75 P80 L81 V96 V107 M111 V171 D173 A201 F203	L57-F77 HydrophobicContact CD1-CB 4.3Å; K73-F77 WeakPolarHBondContact O-CD1 3.18Å; K73-F77 PolarHBondContact O-N 3.27Å; K73-F77 VanDerWaalsContact O-N 3.07Å; T74-F77 VanDerWaalsContact CA-CE1 3.48Å; T74-F77 HydrophobicContact CG2-CZ 3.99Å; A75-F77 VanDerWaalsContact C-N 3.28Å; A75-F77 PolarHBondContact O-N 3.36Å; F77-P80 WeakPolarHBondContact O-CD 3.39Å; F77-P80 WeakPolarHBondContact O-CG 3.48Å; F77-L81 WeakPolarHBondContact O-CB 3.24Å; F77-L81 WeakPolarHBondContact O-CD1 3.5Å; F77-L81 WeakPolarHBondContact O-CG 3.47Å; F77-L81 PolarHBondContact O-N 3.12Å; F77-V96 HydrophobicContact CE2-CG1 4.37Å; F77-V96 HydrophobicContact CE2-CG2 4.17Å; F77-V96 HydrophobicContact CZ-CG1 4.3Å; F77-V107 HydrophobicContact CE2-CG1 4.15Å; F77-V107 HydrophobicContact CZ-CG1 3.93Å; F77-V107 HydrophobicContact CZ-CG2 4.45Å; F77-M111 HydrophobicContact CE2-SD 4.41Å; F77-V171 HydrophobicContact CB-CG1 4.42Å; F77-V171 HydrophobicContact CB-CG2 4.22Å; F77-V171 HydrophobicContact CD1-CG1 3.84Å; F77-V171 HydrophobicContact CD2-CB 4.39Å; F77-V171 HydrophobicContact CD2-CG1 3.97Å; F77-V171 HydrophobicContact CD2-CG2 3.79Å; F77-V171 HydrophobicContact CE1-CG1 3.98Å; F77-V171 HydrophobicContact CE2-CG1 4.16Å; F77-V171 HydrophobicContact CE2-CG2 4.39Å; F77-V171 HydrophobicContact CG-CG1 3.84Å; F77-V171 HydrophobicContact CG-CG2 4.09Å; F77-V171 HydrophobicContact CZ-CG1 4.16Å; F77-D173 HydrophobicContact CE1-CB 4.49Å; F77-A201 HydrophobicContact CB-CB 4.47Å; F77-F203 HydrophobicContact CB-CE2 3.59Å; F77-F203 HydrophobicContact CB-CZ 3.99Å; F77-F203 AromaticContact CD1-CD2 3.9Å; F77-F203 HydrophobicContact CD1-CD2 3.9Å; F77-F203 AromaticContact CD1-CE2 3.69Å; F77-F203 HydrophobicContact CD1-CE2 3.69Å; F77-F203 HydrophobicContact CD1-CZ 4.26Å; F77-F203 HydrophobicContact CG-CE2 4.08Å
78	S	97.2	Very high	88.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-70	-46.4	-171.6	-61.5	0	0	0	0	112	T74 A75 L81 L82 M111	T74-S78 WeakPolarHBondContact O-CB 3.28Å; T74-S78 PolarHBondContact O-N 3.02Å; T74-S78 PolarHBondContact O-OG 3.06Å; A75-S78 PolarHBondContact O-N 2.88Å; S78-L81 PolarHBondContact O-N 3.16Å; S78-L82 VanDerWaalsContact O-CB 3.31Å; S78-L82 WeakPolarHBondContact O-CB 3.48Å; S78-L82 WeakPolarHBondContact O-CG 3.45Å; S78-L82 PolarHBondContact O-N 3.05Å; S78-M111 VanDerWaalsContact OG-CG 3.31Å; S78-M111 WeakPolarHBondContact OG-CG 3.45Å
79	L	97.1	Very high	90.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.2	-49.9	-175.8	-56.7	173	0	0	0	113.1	F25 L30 I34 L38 I54 A75 L81 L82 Q83 F114	F25-L79 HydrophobicContact CD1-CD1 4.03Å; F25-L79 HydrophobicContact CE1-CD1 3.64Å; L30-L79 HydrophobicContact CD1-CB 4.26Å; L30-L79 HydrophobicContact CD1-CD1 4.21Å; L30-L79 HydrophobicContact CD2-CB 4.23Å; I34-L79 HydrophobicContact CG2-CB 4.47Å; I34-L79 HydrophobicContact CG2-CD2 3.53Å; L38-L79 HydrophobicContact CD1-CD1 4Å; L38-L79 HydrophobicContact CD1-CD2 4.16Å; L38-L79 HydrophobicContact CD2-CD1 4.05Å; L38-L79 HydrophobicContact CD2-CD2 3.9Å; L38-L79 HydrophobicContact CG-CD2 4.18Å; I54-L79 HydrophobicContact CD1-CD1 4.07Å; A75-L79 HydrophobicContact CB-CD1 4.01Å; A75-L79 HydrophobicContact CB-CG 4.25Å; A75-L79 WeakPolarHBondContact O-CB 3.37Å; A75-L79 WeakPolarHBondContact O-CG 3.46Å; A75-L79 PolarHBondContact O-N 2.87Å; A75-L79 VanDerWaalsContact O-N 3.16Å; L79-L81 PolarHBondContact O-N 2.99Å; L79-L82 PolarHBondContact O-N 3.44Å; L79-Q83 PolarHBondContact O-N 3.43Å; L79-F114 HydrophobicContact CD2-CB 4.18Å; L79-F114 HydrophobicContact CD2-CD1 4.12Å; L79-F114 HydrophobicContact CD2-CD2 4.38Å; L79-F114 HydrophobicContact CD2-CG 3.98Å
80	P	97	Very high	91.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-70.8	-29.2	178.8	28.1	-36.9	0	0	0	113.4	I54 L57 L58 A76 F77 Q83	I54-P80 HydrophobicContact CG1-CG 4.46Å; I54-P80 HydrophobicContact CG2-CB 4.46Å; L57-P80 HydrophobicContact CB-CB 3.51Å; L57-P80 HydrophobicContact CB-CG 3.42Å; L57-P80 VanDerWaalsContact CB-CG 3.42Å; L57-P80 HydrophobicContact CD1-CG 3.6Å; L57-P80 HydrophobicContact CG-CG 4.15Å; L58-P80 HydrophobicContact CD2-CB 3.79Å; L58-P80 HydrophobicContact CG-CB 3.84Å; A76-P80 WeakPolarHBondContact O-CD 3.19Å; A76-P80 VanDerWaalsContact O-CG 3.26Å; A76-P80 WeakPolarHBondContact O-CG 3.16Å; F77-P80 WeakPolarHBondContact O-CD 3.39Å; F77-P80 WeakPolarHBondContact O-CG 3.48Å; P80-Q83 VanDerWaalsContact O-CB 3.29Å; P80-Q83 WeakPolarHBondContact O-CB 3.33Å; P80-Q83 PolarHBondContact O-N 3.1Å
81	L	97.3	Very high	93	Very high	8 Å²	8	31.7 Å²	31.7	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-72.9	-39.5	174.7	-66.4	176	0	0	0	111.4	F77 S78 L79 Q83 N84 L85 I94 V171	F77-L81 WeakPolarHBondContact O-CB 3.24Å; F77-L81 WeakPolarHBondContact O-CD1 3.5Å; F77-L81 WeakPolarHBondContact O-CG 3.47Å; F77-L81 PolarHBondContact O-N 3.12Å; S78-L81 PolarHBondContact O-N 3.16Å; L79-L81 PolarHBondContact O-N 2.99Å; L81-Q83 VanDerWaalsContact C-N 3.28Å; L81-Q83 PolarHBondContact O-N 3.21Å; L81-N84 PolarHBondContact O-N 3.15Å; L81-L85 PolarHBondContact O-N 3.22Å; L81-I94 HydrophobicContact CB-CD1 3.66Å; L81-I94 HydrophobicContact CB-CG1 4.19Å; L81-I94 HydrophobicContact CD1-CG2 4.08Å; L81-V171 HydrophobicContact CD1-CG2 3.35Å
82	L	97.3	Very high	94.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-36.2	171.4	-74.8	171.9	0	0	0	111.9	I34 S78 L79 N84 L85 F114 M118 I145	I34-L82 HydrophobicContact CD1-CB 3.84Å; S78-L82 VanDerWaalsContact O-CB 3.31Å; S78-L82 WeakPolarHBondContact O-CB 3.48Å; S78-L82 WeakPolarHBondContact O-CG 3.45Å; S78-L82 PolarHBondContact O-N 3.05Å; L79-L82 PolarHBondContact O-N 3.44Å; L82-N84 PolarHBondContact O-N 3.36Å; L82-L85 HydrophobicContact CD2-CD1 4.49Å; L82-L85 PolarHBondContact O-N 2.98Å; L82-F114 HydrophobicContact CD1-CB 3.54Å; L82-M118 HydrophobicContact CB-SD 4.22Å; L82-M118 HydrophobicContact CD2-SD 4.25Å; L82-M118 WeakPolarHBondContact O-CE 3.36Å; L82-I145 HydrophobicContact CD2-CD1 3.38Å
83	Q	95.4	Very high	95.3	Very high	31 Å²	31	30.1 Å²	30.1	15%	0.145	16%	0.156	C	C	.	.	H	α-helix	trans	-53.6	-42.5	174	-176.4	82.9	-10.5	0	0	111.7	G29 K31 I34 L58 L79 P80 L81	G29-Q83 PolarHBondContact O-NE2 2.81Å; K31-Q83 WeakPolarHBondContact CE-O 3.09Å; K31-Q83 PolarHBondContact NZ-O 3.42Å; I34-Q83 HydrophobicContact CD1-CB 4.46Å; L58-Q83 HydrophobicContact CD2-CB 3.65Å; L58-Q83 HydrophobicContact CD2-CG 3.57Å; L79-Q83 PolarHBondContact O-N 3.43Å; P80-Q83 VanDerWaalsContact O-CB 3.29Å; P80-Q83 WeakPolarHBondContact O-CB 3.33Å; P80-Q83 PolarHBondContact O-N 3.1Å; L81-Q83 VanDerWaalsContact C-N 3.28Å; L81-Q83 PolarHBondContact O-N 3.21Å
84	N	92.5	Very high	95.8	Very high	83 Å²	83	29.6 Å²	29.6	44%	0.444	15%	0.153	S	C	.	.	H	α-helix	trans	-91.6	-3.8	-173	-67.4	-23.7	0	0	0	113.6	L81 L82	L81-N84 PolarHBondContact O-N 3.15Å; L82-N84 PolarHBondContact O-N 3.36Å
85	L	95.5	Very high	96.2	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.016	14%	0.144	C	C	.	.			trans	-73.4	138.9	179.4	-174.8	149.3	0	0	0	111.6	L81 L82 P87 I94 M118 V121 Q144 I145	L81-L85 PolarHBondContact O-N 3.22Å; L82-L85 HydrophobicContact CD2-CD1 4.49Å; L82-L85 PolarHBondContact O-N 2.98Å; L85-P87 HydrophobicContact CD2-CG 4.37Å; L85-P87 WeakPolarHBondContact O-CD 3.24Å; L85-I94 HydrophobicContact CB-CD1 4.39Å; L85-I94 HydrophobicContact CD1-CD1 3.63Å; L85-I94 HydrophobicContact CD1-CG1 4.21Å; L85-M118 HydrophobicContact CD2-CE 4.4Å; L85-V121 HydrophobicContact CD1-CG1 4.37Å; L85-V121 HydrophobicContact CD2-CG1 4.23Å; L85-V121 HydrophobicContact CD2-CG2 3.56Å; L85-Q144 HydrophobicContact CD1-CB 3.74Å; L85-Q144 HydrophobicContact CD2-CB 4.23Å; L85-Q144 HydrophobicContact CD2-CG 4.39Å; L85-Q144 HydrophobicContact CG-CB 4.23Å; L85-I145 HydrophobicContact CD1-CD1 3.91Å; L85-I145 HydrophobicContact CD1-CG1 3.68Å
86	D	95.8	Very high	96.5	Very high	77 Å²	77	28 Å²	28	41%	0.412	14%	0.144	S	C	.	.			trans	-96.1	109.3	172.1	179	3.7	0	0	0	110.6	E88 L89 Q93	D86-E88 PolarHBondContact O-N 3.15Å; D86-E88 PolarHBondContact OD1-N 2.87Å; D86-L89 HydrophobicContact CB-CB 4.24Å; D86-L89 PolarHBondContact O-N 3.25Å; D86-Q93 PolarHBondContact O-NE2 3.12Å
87	P	94.8	Very high	96.7	Very high	31 Å²	31	28 Å²	28	20%	0.201	14%	0.144	C	C	.	.	S	Bend	trans	-64.9	-22.8	-179.4	-21.8	34.6	0	0	0	114.6	L85 K90 M118 R119 V121 Q144	L85-P87 HydrophobicContact CD2-CG 4.37Å; L85-P87 WeakPolarHBondContact O-CD 3.24Å; P87-K90 PolarHBondContact O-NZ 3.43Å; P87-M118 HydrophobicContact CG-CE 4.34Å; P87-R119 WeakPolarHBondContact CB-O 3.38Å; P87-V121 HydrophobicContact CB-CG2 3.99Å; P87-V121 HydrophobicContact CG-CG2 4.09Å; P87-Q144 PolarHBondContact O-NE2 3.15Å
88	E	95.2	Very high	96.6	Very high	155 Å²	155	28 Å²	28	72%	0.724	14%	0.144	S	C	*	.	S	Bend	trans	-80.7	-28.1	-177.2	-62.6	-57.3	121.8	0	0	112	D86 K90	D86-E88 PolarHBondContact O-N 3.15Å; D86-E88 PolarHBondContact OD1-N 2.87Å; E88-K90 PolarHBondContact O-N 3.05Å; E88-K90 VanDerWaalsContact O-N 3.14Å
89	L	96.1	Very high	96.2	Very high	67 Å²	67	28.1 Å²	28.1	35%	0.351	14%	0.144	S	C	.	.			trans	-78.8	96.7	176	-179.2	61.9	0	0	0	111.3	D86 A91 Q93 Q144 K166	D86-L89 HydrophobicContact CB-CB 4.24Å; D86-L89 PolarHBondContact O-N 3.25Å; L89-A91 HydrophobicContact CG-CB 4.42Å; L89-A91 PolarHBondContact O-N 3.4Å; L89-Q93 HydrophobicContact CD2-CG 4.29Å; L89-Q93 PolarHBondContact O-NE2 2.93Å; L89-Q144 VanDerWaalsContact O-CG 3.3Å; L89-Q144 WeakPolarHBondContact O-CG 3.42Å; L89-K166 HydrophobicContact CD2-CB 4.29Å; L89-K166 HydrophobicContact CD2-CG 4.45Å
90	K	96	Very high	95.6	Very high	94 Å²	94	28.5 Å²	28.5	41%	0.409	15%	0.146	S	C	.	.			trans	-75.5	62.5	177.7	-58.1	-52.5	-175.4	-153	0	113.6	P87 E88 G120 G142	P87-K90 PolarHBondContact O-NZ 3.43Å; E88-K90 PolarHBondContact O-N 3.05Å; E88-K90 VanDerWaalsContact O-N 3.14Å; K90-G120 PolarHBondContact NZ-O 2.88Å; K90-G142 CarbonylContact C-O 3.5Å
91	A	96.6	Very high	95	Very high	17 Å²	17	30.7 Å²	30.7	14%	0.14	16%	0.155	C	C	.	.	S	Bend	trans	-144.8	154.3	173.4	0	0	0	0	0	109.7	L89 Q93 P143 Q144 K166	L89-A91 HydrophobicContact CG-CB 4.42Å; L89-A91 PolarHBondContact O-N 3.4Å; A91-Q93 WeakPolarHBondContact O-CG 3.39Å; A91-Q93 PolarHBondContact O-N 3.16Å; A91-Q93 VanDerWaalsContact O-N 3.12Å; A91-P143 CarbonylContact C-O 3.58Å; A91-Q144 WeakPolarHBondContact O-CA 3.44Å; A91-K166 HydrophobicContact CB-CB 3.94Å; A91-K166 HydrophobicContact CB-CG 3.93Å
92	P	98	Very high	94.3	Very high	13 Å²	13	31.5 Å²	31.5	8%	0.084	16%	0.158	C	C	.	.			trans	-54.2	118	173	-27	36.1	0	0	0	111.6	P143 V146 L162 D163 L164 K166 L167	P92-P143 WeakPolarHBondContact CA-O 3.11Å; P92-V146 HydrophobicContact CB-CG2 3.98Å; P92-V146 HydrophobicContact CG-CG2 3.99Å; P92-L162 HydrophobicContact CB-CD1 4.45Å; P92-L162 HydrophobicContact CG-CD1 3.9Å; P92-D163 WeakPolarHBondContact CG-O 3.27Å; P92-L164 HydrophobicContact CB-CD2 4.29Å; P92-K166 CarbonylContact O-C 3.59Å; P92-L167 PolarHBondContact O-N 3.07Å
93	Q	98.2	Very high	93.7	Very high	8 Å²	8	31.9 Å²	31.9	4%	0.037	16%	0.16	C	C	.	.			trans	-112.1	-32.3	177.9	-73.2	172.7	62	0	0	111.2	D86 L89 A91 Q144 L167 S168 G169	D86-Q93 PolarHBondContact O-NE2 3.12Å; L89-Q93 HydrophobicContact CD2-CG 4.29Å; L89-Q93 PolarHBondContact O-NE2 2.93Å; A91-Q93 WeakPolarHBondContact O-CG 3.39Å; A91-Q93 PolarHBondContact O-N 3.16Å; A91-Q93 VanDerWaalsContact O-N 3.12Å; Q93-Q144 PolarHBondContact N-O 3.45Å; Q93-L167 WeakPolarHBondContact O-CD1 3.37Å; Q93-S168 PolarHBondContact O-N 2.85Å; Q93-S168 PolarHBondContact O-OG 3.45Å; Q93-G169 PolarHBondContact O-N 2.98Å
94	I	98.6	Very high	93.5	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.6	176	-56.7	166.9	0	0	0	109.6	L81 L85 V96 M111 Q144 I145 V146 G169	L81-I94 HydrophobicContact CB-CD1 3.66Å; L81-I94 HydrophobicContact CB-CG1 4.19Å; L81-I94 HydrophobicContact CD1-CG2 4.08Å; L85-I94 HydrophobicContact CB-CD1 4.39Å; L85-I94 HydrophobicContact CD1-CD1 3.63Å; L85-I94 HydrophobicContact CD1-CG1 4.21Å; I94-V96 HydrophobicContact CG2-CG2 4.18Å; I94-M111 HydrophobicContact CD1-CE 4.27Å; I94-M111 HydrophobicContact CG2-CE 4.1Å; I94-Q144 PolarHBondContact N-O 3.05Å; I94-I145 HydrophobicContact CB-CG1 4.38Å; I94-I145 HydrophobicContact CB-CG2 4.26Å; I94-I145 HydrophobicContact CD1-CD1 4.21Å; I94-I145 HydrophobicContact CD1-CG1 4.24Å; I94-I145 HydrophobicContact CG2-CG2 4.37Å; I94-I145 WeakPolarHBondContact O-CA 3.3Å; I94-V146 PolarHBondContact O-N 3.1Å; I94-G169 CarbonylContact C-O 3.57Å; I94-G169 WeakPolarHBondContact CA-O 3.1Å
95	L	98.7	Very high	93.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.3	175.6	178.9	65.1	0	0	0	108.9	L97 V146 L153 L164 L167 G169 L170 V171 I190 I194	L95-L97 HydrophobicContact CD2-CD1 3.84Å; L95-L97 HydrophobicContact CG-CD1 3.78Å; L95-V146 CarbonylContact C-O 3.43Å; L95-V146 VanDerWaalsContact CA-O 3.27Å; L95-V146 WeakPolarHBondContact CA-O 3.3Å; L95-V146 HydrophobicContact CD1-CB 3.9Å; L95-V146 HydrophobicContact CD1-CG1 3.78Å; L95-L153 HydrophobicContact CD1-CD1 3.97Å; L95-L153 HydrophobicContact CD1-CD2 3.86Å; L95-L164 HydrophobicContact CD2-CD1 3.77Å; L95-L164 HydrophobicContact CD2-CD2 4.17Å; L95-L167 HydrophobicContact CB-CD1 3.53Å; L95-L167 HydrophobicContact CB-CD2 3.86Å; L95-L167 HydrophobicContact CB-CG 4.34Å; L95-L167 HydrophobicContact CD2-CD2 4.36Å; L95-G169 PolarHBondContact N-O 3.43Å; L95-L170 HydrophobicContact CB-CD1 4.22Å; L95-L170 HydrophobicContact CD2-CD1 4.03Å; L95-L170 HydrophobicContact CG-CD1 4.19Å; L95-L170 CarbonylContact O-C 3.56Å; L95-L170 WeakPolarHBondContact O-CA 3.36Å; L95-V171 PolarHBondContact O-N 3.35Å; L95-I190 HydrophobicContact CD2-CG2 3.99Å; L95-I194 HydrophobicContact CD2-CD1 4.39Å
96	V	98.7	Very high	92.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.3	175.3	-174.5	0	0	0	0	109.8	F77 I94 V107 M111 V146 V147 G148 V171	F77-V96 HydrophobicContact CE2-CG1 4.37Å; F77-V96 HydrophobicContact CE2-CG2 4.17Å; F77-V96 HydrophobicContact CZ-CG1 4.3Å; I94-V96 HydrophobicContact CG2-CG2 4.18Å; V96-V107 HydrophobicContact CB-CG1 4.41Å; V96-V107 HydrophobicContact CG1-CG1 3.98Å; V96-V107 HydrophobicContact CG2-CG1 4.47Å; V96-M111 HydrophobicContact CG2-SD 3.88Å; V96-V146 PolarHBondContact N-O 2.56Å; V96-V147 HydrophobicContact CB-CB 4.39Å; V96-V147 HydrophobicContact CB-CG1 4.05Å; V96-V147 HydrophobicContact CB-CG2 4.13Å; V96-V147 HydrophobicContact CG1-CG1 4.32Å; V96-V147 HydrophobicContact CG2-CG2 4.27Å; V96-V147 CarbonylContact O-C 3.56Å; V96-V147 WeakPolarHBondContact O-CA 3.46Å; V96-G148 PolarHBondContact O-N 3.08Å; V96-V171 WeakPolarHBondContact CA-O 3.4Å; V96-V171 HydrophobicContact CB-CB 4.2Å; V96-V171 HydrophobicContact CG1-CB 3.9Å; V96-V171 HydrophobicContact CG1-CG1 4.01Å; V96-V171 HydrophobicContact CG2-CB 3.95Å; V96-V171 HydrophobicContact CG2-CG2 4.13Å
97	L	98.5	Very high	92.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.3	172.7	-74.1	73.4	0	0	0	108.4	L95 G148 P150 L153 L170 V171 D173 M178 V187 I190	L95-L97 HydrophobicContact CD2-CD1 3.84Å; L95-L97 HydrophobicContact CG-CD1 3.78Å; L97-G148 WeakPolarHBondContact CA-O 3.37Å; L97-P150 HydrophobicContact CD2-CG 4.32Å; L97-L153 HydrophobicContact CD1-CD1 4.26Å; L97-L153 HydrophobicContact CG-CD1 3.86Å; L97-L170 HydrophobicContact CD1-CD1 3.54Å; L97-V171 PolarHBondContact N-O 2.7Å; L97-D173 PolarHBondContact O-N 3.1Å; L97-M178 HydrophobicContact CB-CE 4.22Å; L97-M178 HydrophobicContact CB-SD 3.98Å; L97-V187 HydrophobicContact CD2-CB 4.38Å; L97-V187 HydrophobicContact CD2-CG1 4.28Å; L97-V187 HydrophobicContact CD2-CG2 3.91Å; L97-I190 HydrophobicContact CD2-CD1 3.88Å; L97-I190 HydrophobicContact CD2-CG2 4.37Å
98	A	95	Very high	92.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.128	C	C	.	.			trans	-123.3	141.4	174.2	0	0	0	0	0	110.1	T100 L103 A104 G148 T149 P150	A98-T100 PolarHBondContact O-N 3.18Å; A98-L103 HydrophobicContact CB-CB 4.14Å; A98-L103 HydrophobicContact CB-CD2 4.05Å; A98-L103 HydrophobicContact CB-CG 3.89Å; A98-A104 HydrophobicContact CB-CB 4.17Å; A98-G148 PolarHBondContact N-O 2.84Å; A98-T149 WeakPolarHBondContact O-CA 3.39Å; A98-P150 WeakPolarHBondContact O-CD 3.44Å
99	P	87.4	Confident	92.6	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.013	12%	0.117	C	C	.	.	S	Bend	trans	-61.8	-28.1	-178.3	23.8	-38.4	0	0	0	114.2	L103 D173 E174 E177 M178 M181	P99-L103 HydrophobicContact CG-CD2 4.05Å; P99-D173 WeakPolarHBondContact CD-O 3.23Å; P99-E174 HydrophobicContact CG-CB 3.77Å; P99-E177 HydrophobicContact CB-CB 3.98Å; P99-E177 HydrophobicContact CG-CB 3.91Å; P99-M178 HydrophobicContact CB-CG 3.73Å; P99-M178 HydrophobicContact CG-CG 4.39Å; P99-M181 HydrophobicContact CB-SD 3.86Å
100	T	85.1	Confident	92.5	Very high	7 Å²	7	21.3 Å²	21.3	4%	0.043	11%	0.109	C	C	.	.	S	Bend	trans	-128.1	155.1	-173	66.8	0	0	0	0	111.8	A98 E102 L103 A104 T149 M181 R324	A98-T100 PolarHBondContact O-N 3.18Å; T100-E102 VanDerWaalsContact C-N 3.28Å; T100-E102 PolarHBondContact O-N 2.72Å; T100-L103 WeakPolarHBondContact OG1-CB 3.47Å; T100-L103 PolarHBondContact OG1-N 2.64Å; T100-A104 WeakPolarHBondContact O-CB 3.27Å; T100-A104 PolarHBondContact O-N 3.22Å; T100-T149 VanDerWaalsContact C-CG2 3.46Å; T100-M181 HydrophobicContact CG2-CE 4.38Å; T100-M181 HydrophobicContact CG2-SD 4.1Å; T100-R324 HydrophobicContact CG2-CB 3.72Å; T100-R324 HydrophobicContact CG2-CG 4.47Å
101	R	84.5	Confident	92.6	Very high	46 Å²	46	16.9 Å²	16.9	17%	0.174	9%	0.089	C	C	.	.	H	α-helix	trans	-58.6	-44.3	175.5	171.4	-179.3	-51.2	117.2	-9.9	111.1	A104 V105 Y127 G128 Q298	R101-A104 WeakPolarHBondContact O-CB 3.49Å; R101-A104 PolarHBondContact O-N 2.86Å; R101-A104 VanDerWaalsContact O-N 3.17Å; R101-V105 HydrophobicContact CG-CG2 4.49Å; R101-V105 WeakPolarHBondContact O-CG2 3.4Å; R101-V105 PolarHBondContact O-N 3.04Å; R101-Y127 HydrophobicContact CB-CD2 4.42Å; R101-Y127 HydrophobicContact CB-CG 4.14Å; R101-Y127 VanDerWaalsContact CD-CE2 3.47Å; R101-Y127 HydrophobicContact CG-CD1 3.79Å; R101-Y127 HydrophobicContact CG-CD2 3.48Å; R101-Y127 VanDerWaalsContact CG-CD2 3.48Å; R101-Y127 HydrophobicContact CG-CE1 4.1Å; R101-Y127 HydrophobicContact CG-CE2 3.78Å; R101-Y127 HydrophobicContact CG-CG 3.45Å; R101-Y127 VanDerWaalsContact CG-CG 3.45Å; R101-G128 VanDerWaalsContact CZ-O 3.25Å; R101-G128 PolarHBondContact NE-O 3.07Å; R101-G128 PolarHBondContact NH2-O 2.96Å; R101-Q298 VanDerWaalsContact NH1-CD 3.34Å
102	E	82.1	Confident	92.6	Very high	25 Å²	25	19.1 Å²	19.1	12%	0.117	10%	0.101	C	C	.	.	H	α-helix	trans	-66.8	-42.8	-173.9	-66	64.9	-141.8	0	0	110.3	T100 A104 V105 Q106 R301 R324	T100-E102 VanDerWaalsContact C-N 3.28Å; T100-E102 PolarHBondContact O-N 2.72Å; E102-A104 VanDerWaalsContact C-N 3.33Å; E102-A104 PolarHBondContact O-N 2.87Å; E102-V105 PolarHBondContact O-N 3.44Å; E102-Q106 WeakPolarHBondContact O-CB 3.41Å; E102-Q106 PolarHBondContact O-N 3.11Å; E102-R301 IonicContact OE1-CZ 3.96Å; E102-R301 VanDerWaalsContact OE1-CZ 3.31Å; E102-R301 IonicContact OE1-NE 3.34Å; E102-R301 PolarHBondContact OE1-NE 2.92Å; E102-R301 IonicContact OE1-NH2 2.78Å; E102-R301 PolarHBondContact OE1-NH2 2.97Å; E102-R301 VanDerWaalsContact OE1-NH2 3.11Å; E102-R301 IonicContact OE2-CZ 2.84Å; E102-R301 IonicContact OE2-NE 3.37Å; E102-R301 IonicContact OE2-NH2 3.63Å; E102-R301 PolarHBondContact OE2-NH2 3.4Å; E102-R301 VanDerWaalsContact OE2-NH2 3.1Å; E102-R324 WeakPolarHBondContact CB-O 3.48Å
103	L	85.3	Confident	92.5	Very high	9 Å²	9	22 Å²	22	5%	0.047	12%	0.116	C	C	.	.	H	α-helix	trans	-64.8	-38.5	173.2	-176.5	58.7	0	0	0	111.6	A98 P99 T100 V105 Q106 V107 E174	A98-L103 HydrophobicContact CB-CB 4.14Å; A98-L103 HydrophobicContact CB-CD2 4.05Å; A98-L103 HydrophobicContact CB-CG 3.89Å; P99-L103 HydrophobicContact CG-CD2 4.05Å; T100-L103 WeakPolarHBondContact OG1-CB 3.47Å; T100-L103 PolarHBondContact OG1-N 2.64Å; L103-V105 PolarHBondContact O-N 2.57Å; L103-Q106 PolarHBondContact O-N 2.76Å; L103-V107 HydrophobicContact CD1-CG2 3.95Å; L103-V107 HydrophobicContact CG-CG2 4.3Å; L103-V107 WeakPolarHBondContact O-CB 3.37Å; L103-V107 VanDerWaalsContact O-CG2 3.27Å; L103-V107 WeakPolarHBondContact O-CG2 3.49Å; L103-V107 PolarHBondContact O-N 3.05Å; L103-E174 HydrophobicContact CD2-CB 4.34Å; L103-E174 HydrophobicContact CD2-CG 3.93Å
104	A	90	Very high	92.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.3	-41.3	175.2	0	0	0	0	0	112.4	A98 T100 R101 E102 A108 V147	A98-A104 HydrophobicContact CB-CB 4.17Å; T100-A104 WeakPolarHBondContact O-CB 3.27Å; T100-A104 PolarHBondContact O-N 3.22Å; R101-A104 WeakPolarHBondContact O-CB 3.49Å; R101-A104 PolarHBondContact O-N 2.86Å; R101-A104 VanDerWaalsContact O-N 3.17Å; E102-A104 VanDerWaalsContact C-N 3.33Å; E102-A104 PolarHBondContact O-N 2.87Å; A104-A108 VanDerWaalsContact O-CB 3.27Å; A104-A108 WeakPolarHBondContact O-CB 3.31Å; A104-A108 PolarHBondContact O-N 3.06Å; A104-V147 HydrophobicContact CB-CG1 3.98Å; A104-V147 WeakPolarHBondContact O-CG1 3.37Å
105	V	88.2	Confident	92.4	Very high	36 Å²	36	21.9 Å²	21.9	22%	0.218	12%	0.116	C	C	.	.	H	α-helix	trans	-64.8	-49.5	174.5	172.1	0	0	0	0	110.4	R101 E102 L103 V107 A108 E109 Y127	R101-V105 HydrophobicContact CG-CG2 4.49Å; R101-V105 WeakPolarHBondContact O-CG2 3.4Å; R101-V105 PolarHBondContact O-N 3.04Å; E102-V105 PolarHBondContact O-N 3.44Å; L103-V105 PolarHBondContact O-N 2.57Å; V105-V107 VanDerWaalsContact C-N 3.32Å; V105-V107 PolarHBondContact O-N 3.09Å; V105-A108 WeakPolarHBondContact O-CB 3.34Å; V105-A108 PolarHBondContact O-N 2.97Å; V105-A108 VanDerWaalsContact O-N 3.1Å; V105-E109 HydrophobicContact CG1-CG 4.26Å; V105-E109 WeakPolarHBondContact CG1-OE1 3.35Å; V105-E109 WeakPolarHBondContact O-CG 3.23Å; V105-E109 PolarHBondContact O-N 3.36Å; V105-Y127 HydrophobicContact CG2-CD1 4.12Å; V105-Y127 HydrophobicContact CG2-CE1 3.33Å
106	Q	84.8	Confident	92.3	Very high	53 Å²	53	26.4 Å²	26.4	25%	0.248	14%	0.136	C	C	.	.	H	α-helix	trans	-58.6	-43.5	-179.6	-174.2	-177	-3	0	0	112	E102 L103 A110 D327	E102-Q106 WeakPolarHBondContact O-CB 3.41Å; E102-Q106 PolarHBondContact O-N 3.11Å; L103-Q106 PolarHBondContact O-N 2.76Å; Q106-A110 WeakPolarHBondContact O-CB 3.41Å; Q106-A110 PolarHBondContact O-N 3.18Å; Q106-D327 PolarHBondContact NE2-OD2 2.8Å
107	V	93	Very high	92.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.9	-39.8	176.6	171.2	0	0	0	0	110.9	T74 F77 V96 L103 V105 A110 M111 V147	T74-V107 HydrophobicContact CG2-CG1 4.36Å; T74-V107 HydrophobicContact CG2-CG2 4.17Å; F77-V107 HydrophobicContact CE2-CG1 4.15Å; F77-V107 HydrophobicContact CZ-CG1 3.93Å; F77-V107 HydrophobicContact CZ-CG2 4.45Å; V96-V107 HydrophobicContact CB-CG1 4.41Å; V96-V107 HydrophobicContact CG1-CG1 3.98Å; V96-V107 HydrophobicContact CG2-CG1 4.47Å; L103-V107 HydrophobicContact CD1-CG2 3.95Å; L103-V107 HydrophobicContact CG-CG2 4.3Å; L103-V107 WeakPolarHBondContact O-CB 3.37Å; L103-V107 VanDerWaalsContact O-CG2 3.27Å; L103-V107 WeakPolarHBondContact O-CG2 3.49Å; L103-V107 PolarHBondContact O-N 3.05Å; V105-V107 VanDerWaalsContact C-N 3.32Å; V105-V107 PolarHBondContact O-N 3.09Å; V107-A110 PolarHBondContact O-N 3.3Å; V107-M111 HydrophobicContact CG1-CG 4.32Å; V107-M111 HydrophobicContact CG1-SD 4.13Å; V107-M111 WeakPolarHBondContact O-CB 3.35Å; V107-M111 VanDerWaalsContact O-CG 3.29Å; V107-M111 WeakPolarHBondContact O-CG 3.4Å; V107-M111 PolarHBondContact O-N 3.45Å; V107-V147 HydrophobicContact CB-CG1 3.94Å; V107-V147 HydrophobicContact CG1-CG1 3.89Å; V107-V147 HydrophobicContact CG1-CG2 4.09Å
108	A	96.4	Very high	92.1	Very high	9 Å²	9	30.1 Å²	30.1	7%	0.074	15%	0.153	C	C	.	.	H	α-helix	trans	-64.5	-41.1	176.2	0	0	0	0	0	112.6	A104 V105 T112 V123 A125 V147	A104-A108 VanDerWaalsContact O-CB 3.27Å; A104-A108 WeakPolarHBondContact O-CB 3.31Å; A104-A108 PolarHBondContact O-N 3.06Å; V105-A108 WeakPolarHBondContact O-CB 3.34Å; V105-A108 PolarHBondContact O-N 2.97Å; V105-A108 VanDerWaalsContact O-N 3.1Å; A108-T112 WeakPolarHBondContact O-CB 3.46Å; A108-T112 PolarHBondContact O-N 3.23Å; A108-T112 PolarHBondContact O-OG1 3.01Å; A108-V123 HydrophobicContact CB-CG1 3.93Å; A108-A125 HydrophobicContact CB-CB 3.86Å; A108-V147 HydrophobicContact CB-CB 4.11Å; A108-V147 HydrophobicContact CB-CG2 4.03Å
109	E	94	Very high	92	Very high	105 Å²	105	41 Å²	41	49%	0.491	19%	0.194	S	C	.	.	H	α-helix	trans	-61.3	-51.4	173.7	-73.4	172.1	172.3	0	0	110.1	V105 M111 T112 D113	V105-E109 HydrophobicContact CG1-CG 4.26Å; V105-E109 WeakPolarHBondContact CG1-OE1 3.35Å; V105-E109 WeakPolarHBondContact O-CG 3.23Å; V105-E109 PolarHBondContact O-N 3.36Å; E109-M111 PolarHBondContact O-N 2.88Å; E109-T112 WeakPolarHBondContact O-CA 3.31Å; E109-T112 VanDerWaalsContact O-CB 3.3Å; E109-T112 WeakPolarHBondContact O-CB 3.4Å; E109-T112 PolarHBondContact O-N 2.75Å; E109-D113 PolarHBondContact O-N 3.2Å
110	A	92.6	Very high	92.3	Very high	22 Å²	22	42.5 Å²	42.5	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-58.8	-43.7	178	0	0	0	0	0	112.6	T74 Q106 V107 T112 D113 F114	T74-A110 HydrophobicContact CG2-CB 3.83Å; Q106-A110 WeakPolarHBondContact O-CB 3.41Å; Q106-A110 PolarHBondContact O-N 3.18Å; V107-A110 PolarHBondContact O-N 3.3Å; A110-T112 VanDerWaalsContact C-N 3.32Å; A110-T112 PolarHBondContact O-N 2.94Å; A110-D113 PolarHBondContact O-N 3.31Å; A110-F114 HydrophobicContact CB-CE2 3.96Å; A110-F114 HydrophobicContact CB-CZ 4.34Å; A110-F114 WeakPolarHBondContact O-CB 3.25Å; A110-F114 WeakPolarHBondContact O-CD2 3.48Å; A110-F114 WeakPolarHBondContact O-CG 3.44Å; A110-F114 PolarHBondContact O-N 3.44Å
111	M	98.2	Very high	92.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-31.2	176.3	-70	-171.3	84	0	0	112.6	F77 S78 I94 V96 V107 E109 S115 V123 I145 V147	F77-M111 HydrophobicContact CE2-SD 4.41Å; S78-M111 VanDerWaalsContact OG-CG 3.31Å; S78-M111 WeakPolarHBondContact OG-CG 3.45Å; I94-M111 HydrophobicContact CD1-CE 4.27Å; I94-M111 HydrophobicContact CG2-CE 4.1Å; V96-M111 HydrophobicContact CG2-SD 3.88Å; V107-M111 HydrophobicContact CG1-CG 4.32Å; V107-M111 HydrophobicContact CG1-SD 4.13Å; V107-M111 WeakPolarHBondContact O-CB 3.35Å; V107-M111 VanDerWaalsContact O-CG 3.29Å; V107-M111 WeakPolarHBondContact O-CG 3.4Å; V107-M111 PolarHBondContact O-N 3.45Å; E109-M111 PolarHBondContact O-N 2.88Å; M111-S115 WeakPolarHBondContact O-CB 3.44Å; M111-S115 PolarHBondContact O-N 2.97Å; M111-S115 VanDerWaalsContact O-N 3.09Å; M111-S115 PolarHBondContact O-OG 2.78Å; M111-V123 HydrophobicContact CB-CG1 4.35Å; M111-V123 HydrophobicContact CB-CG2 4.36Å; M111-I145 HydrophobicContact CE-CD1 3.8Å; M111-I145 HydrophobicContact CE-CG2 3.53Å; M111-I145 HydrophobicContact SD-CG2 3.61Å; M111-V147 HydrophobicContact SD-CG2 4.2Å
112	T	97.8	Very high	93.5	Very high	64 Å²	64	44.2 Å²	44.2	39%	0.393	22%	0.223	S	C	.	.	H	α-helix	trans	-63.8	-46.1	171.3	-58.9	0	0	0	0	110	A108 E109 A110 S115 K116 V123	A108-T112 WeakPolarHBondContact O-CB 3.46Å; A108-T112 PolarHBondContact O-N 3.23Å; A108-T112 PolarHBondContact O-OG1 3.01Å; E109-T112 WeakPolarHBondContact O-CA 3.31Å; E109-T112 VanDerWaalsContact O-CB 3.3Å; E109-T112 WeakPolarHBondContact O-CB 3.4Å; E109-T112 PolarHBondContact O-N 2.75Å; A110-T112 VanDerWaalsContact C-N 3.32Å; A110-T112 PolarHBondContact O-N 2.94Å; T112-S115 CarbonylContact O-C 3.56Å; T112-S115 PolarHBondContact O-N 3.48Å; T112-S115 PolarHBondContact O-OG 2.83Å; T112-K116 PolarHBondContact O-N 2.99Å; T112-V123 WeakPolarHBondContact OG1-CB 3.09Å
113	D	95.4	Very high	94.3	Very high	73 Å²	73	44.5 Å²	44.5	39%	0.39	23%	0.226	S	C	.	.	H	α-helix	trans	-65.7	-44.3	178.9	-69.3	-27	0	0	0	112.2	A37 L41 E109 A110 S115 K116	A37-D113 WeakPolarHBondContact CB-O 3.28Å; L41-D113 HydrophobicContact CD1-CB 3.94Å; L41-D113 HydrophobicContact CD2-CB 4.06Å; E109-D113 PolarHBondContact O-N 3.2Å; A110-D113 PolarHBondContact O-N 3.31Å; D113-S115 PolarHBondContact O-N 2.71Å; D113-K116 WeakPolarHBondContact O-CD 3.43Å; D113-K116 VanDerWaalsContact O-CG 3.24Å; D113-K116 WeakPolarHBondContact O-CG 3.18Å; D113-K116 PolarHBondContact O-N 3.25Å
114	F	96.8	Very high	94.9	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-23.4	175.6	-61.6	-35.4	0	0	0	113.5	L38 L41 Y43 T74 A75 L79 L82 A110	L38-F114 HydrophobicContact CD2-CD1 4.27Å; L38-F114 HydrophobicContact CD2-CE1 4.26Å; L41-F114 HydrophobicContact CD1-CD1 3.65Å; L41-F114 HydrophobicContact CD1-CE1 3.75Å; Y43-F114 AromaticContact CE2-CE1 3.81Å; Y43-F114 HydrophobicContact CE2-CE1 3.81Å; Y43-F114 HydrophobicContact CE2-CZ 4.44Å; Y43-F114 AromaticContact CZ-CE1 3.85Å; T74-F114 HydrophobicContact CG2-CE2 4.38Å; A75-F114 HydrophobicContact CB-CE1 4.48Å; A75-F114 HydrophobicContact CB-CE2 4.07Å; A75-F114 HydrophobicContact CB-CZ 3.76Å; L79-F114 HydrophobicContact CD2-CB 4.18Å; L79-F114 HydrophobicContact CD2-CD1 4.12Å; L79-F114 HydrophobicContact CD2-CD2 4.38Å; L79-F114 HydrophobicContact CD2-CG 3.98Å; L82-F114 HydrophobicContact CD1-CB 3.54Å; A110-F114 HydrophobicContact CB-CE2 3.96Å; A110-F114 HydrophobicContact CB-CZ 4.34Å; A110-F114 WeakPolarHBondContact O-CB 3.25Å; A110-F114 WeakPolarHBondContact O-CD2 3.48Å; A110-F114 WeakPolarHBondContact O-CG 3.44Å; A110-F114 PolarHBondContact O-N 3.44Å
115	S	97.3	Very high	95.2	Very high	5 Å²	5	45.8 Å²	45.8	4%	0.035	24%	0.236	C	C	.	.	H	α-helix	trans	-105.2	3.6	-178.1	65.9	0	0	0	0	113.4	M111 T112 D113 H117 M118	M111-S115 WeakPolarHBondContact O-CB 3.44Å; M111-S115 PolarHBondContact O-N 2.97Å; M111-S115 VanDerWaalsContact O-N 3.09Å; M111-S115 PolarHBondContact O-OG 2.78Å; T112-S115 CarbonylContact O-C 3.56Å; T112-S115 PolarHBondContact O-N 3.48Å; T112-S115 PolarHBondContact O-OG 2.83Å; D113-S115 PolarHBondContact O-N 2.71Å; S115-H117 PolarHBondContact O-N 2.88Å; S115-M118 WeakPolarHBondContact O-CA 3.43Å; S115-M118 VanDerWaalsContact O-CB 3.3Å; S115-M118 WeakPolarHBondContact O-CB 3.48Å; S115-M118 PolarHBondContact O-N 2.91Å
116	K	96.6	Very high	95.6	Very high	95 Å²	95	44 Å²	44	41%	0.413	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.3	-170	73	-173.5	-178.4	165.1	0	115.1	A37 D40 T112 D113	A37-K116 HydrophobicContact CB-CG 4.18Å; D40-K116 VanDerWaalsContact CG-NZ 3.32Å; D40-K116 WeakPolarHBondContact OD2-CE 3.4Å; D40-K116 IonicContact OD2-NZ 3.96Å; D40-K116 PolarHBondContact OD2-NZ 3.11Å; T112-K116 PolarHBondContact O-N 2.99Å; D113-K116 WeakPolarHBondContact O-CD 3.43Å; D113-K116 VanDerWaalsContact O-CG 3.24Å; D113-K116 WeakPolarHBondContact O-CG 3.18Å; D113-K116 PolarHBondContact O-N 3.25Å
117	H	97.2	Very high	96.1	Very high	60 Å²	60	42.4 Å²	42.4	28%	0.278	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-3.7	176.1	-63.7	-60.8	0	0	0	113.2	P33 E36 A37 D40 S115 R119	P33-H117 HydrophobicContact CB-CB 3.86Å; E36-H117 IonicContact OE1-CE1 3.31Å; E36-H117 IonicContact OE1-ND1 2.83Å; E36-H117 IonicContact OE1-NE2 2.69Å; E36-H117 IonicContact OE2-CG 2.93Å; A37-H117 PolarHBondContact N-CD2 3.11Å; D40-H117 IonicContact OD2-CD2 3.83Å; D40-H117 IonicContact OD2-CE1 3.11Å; D40-H117 IonicContact OD2-NE2 3.99Å; D40-H117 PolarHBondContact OD2-NE2 3.3Å; S115-H117 PolarHBondContact O-N 2.88Å; H117-R119 PolarHBondContact O-N 3.44Å
118	M	96.4	Very high	95.7	Very high	17 Å²	17	43.5 Å²	43.5	8%	0.084	23%	0.229	C	C	.	.	S	Bend	trans	-88.3	93.4	173.3	-60.4	180	67.3	0	0	110.1	P33 I34 L82 L85 P87 S115 G120 V121	P33-M118 HydrophobicContact CB-CG 3.92Å; I34-M118 HydrophobicContact CD1-SD 4.29Å; I34-M118 HydrophobicContact CG1-SD 3.95Å; L82-M118 HydrophobicContact CB-SD 4.22Å; L82-M118 HydrophobicContact CD2-SD 4.25Å; L82-M118 WeakPolarHBondContact O-CE 3.36Å; L85-M118 HydrophobicContact CD2-CE 4.4Å; P87-M118 HydrophobicContact CG-CE 4.34Å; S115-M118 WeakPolarHBondContact O-CA 3.43Å; S115-M118 VanDerWaalsContact O-CB 3.3Å; S115-M118 WeakPolarHBondContact O-CB 3.48Å; S115-M118 PolarHBondContact O-N 2.91Å; M118-G120 PolarHBondContact O-N 2.91Å; M118-V121 HydrophobicContact CB-CB 4.23Å; M118-V121 HydrophobicContact CB-CG2 3.61Å; M118-V121 HydrophobicContact CE-CG2 4.1Å; M118-V121 PolarHBondContact O-N 3.07Å
119	R	93.8	Very high	94.9	Very high	230 Å²	230	45.8 Å²	45.8	87%	0.868	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	132	-178.6	-68.2	-176.5	-179.5	175.7	1	111.8	P87 H117 V121	P87-R119 WeakPolarHBondContact CB-O 3.38Å; H117-R119 PolarHBondContact O-N 3.44Å; R119-V121 VanDerWaalsContact C-N 3.32Å; R119-V121 PolarHBondContact O-N 2.71Å
120	G	93.8	Very high	94.4	Very high	33 Å²	33	43.4 Å²	43.4	34%	0.34	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-2.3	175.9	0	0	0	0	0	114.9	K90 M118 Q144	K90-G120 PolarHBondContact NZ-O 2.88Å; M118-G120 PolarHBondContact O-N 2.91Å; G120-Q144 PolarHBondContact O-NE2 2.61Å; G120-Q144 PolarHBondContact O-OE1 2.9Å
121	V	97.3	Very high	94	Very high	15 Å²	15	50.7 Å²	50.7	9%	0.091	27%	0.265	C	S	.	.			trans	-80.8	126.5	172.1	-178.2	0	0	0	0	109.4	L85 P87 M118 R119 I145	L85-V121 HydrophobicContact CD1-CG1 4.37Å; L85-V121 HydrophobicContact CD2-CG1 4.23Å; L85-V121 HydrophobicContact CD2-CG2 3.56Å; P87-V121 HydrophobicContact CB-CG2 3.99Å; P87-V121 HydrophobicContact CG-CG2 4.09Å; M118-V121 HydrophobicContact CB-CB 4.23Å; M118-V121 HydrophobicContact CB-CG2 3.61Å; M118-V121 HydrophobicContact CE-CG2 4.1Å; M118-V121 PolarHBondContact O-N 3.07Å; R119-V121 VanDerWaalsContact C-N 3.32Å; R119-V121 PolarHBondContact O-N 2.71Å; V121-I145 HydrophobicContact CG1-CD1 3.91Å; V121-I145 HydrophobicContact CG1-CG1 4.3Å
122	N	97.1	Very high	93.5	Very high	73 Å²	73	53.1 Å²	53.1	39%	0.39	28%	0.275	S	S	.	.			trans	-122.7	139.8	177.6	-65.7	-49.3	0	0	0	110.4	P143 Q144 I145	N122-P143 HydrophobicContact CB-CB 4.23Å; N122-Q144 PolarHBondContact O-N 3.14Å; N122-Q144 VanDerWaalsContact O-N 3.17Å; N122-I145 PolarHBondContact O-N 2.95Å
123	V	98.2	Very high	93.1	Very high	32 Å²	32	53 Å²	53	19%	0.194	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.8	178.4	-168.2	0	0	0	0	109.5	A108 M111 T112 I145 V147	A108-V123 HydrophobicContact CB-CG1 3.93Å; M111-V123 HydrophobicContact CB-CG1 4.35Å; M111-V123 HydrophobicContact CB-CG2 4.36Å; T112-V123 WeakPolarHBondContact OG1-CB 3.09Å; V123-I145 CarbonylContact C-O 3.56Å; V123-I145 WeakPolarHBondContact CA-O 3.46Å; V123-I145 HydrophobicContact CB-CB 4.29Å; V123-I145 HydrophobicContact CG1-CB 4.01Å; V123-I145 HydrophobicContact CG1-CG2 3.91Å; V123-I145 HydrophobicContact CG2-CB 4.03Å; V123-I145 HydrophobicContact CG2-CD1 4.01Å; V123-I145 HydrophobicContact CG2-CG1 4.37Å; V123-I145 HydrophobicContact CG2-CG2 4.49Å; V123-V147 HydrophobicContact CG1-CG2 4.28Å
124	V	97.6	Very high	92.8	Very high	14 Å²	14	52.8 Å²	52.8	9%	0.085	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.8	173.5	68.3	0	0	0	0	111.1	L126 A138 L139 P143 I145 V146 V147	V124-L126 HydrophobicContact CG1-CD2 4.5Å; V124-L126 HydrophobicContact CG1-CG 4.43Å; V124-L126 HydrophobicContact CG2-CD2 3.93Å; V124-A138 HydrophobicContact CB-CB 4.47Å; V124-A138 HydrophobicContact CG2-CB 3.54Å; V124-L139 HydrophobicContact CG1-CD2 4.42Å; V124-P143 HydrophobicContact CB-CB 4.25Å; V124-P143 HydrophobicContact CB-CG 4.18Å; V124-P143 HydrophobicContact CG1-CB 3.91Å; V124-P143 HydrophobicContact CG1-CG 3.53Å; V124-I145 PolarHBondContact N-O 2.94Å; V124-V146 HydrophobicContact CG1-CB 4.29Å; V124-V146 HydrophobicContact CG1-CG1 4.28Å; V124-V146 HydrophobicContact CG1-CG2 3.82Å; V124-V147 PolarHBondContact O-N 2.77Å
125	A	96.8	Very high	92.6	Very high	21 Å²	21	52.7 Å²	52.7	17%	0.174	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.2	170.1	0	0	0	0	0	111	A108 Y127 V147	A108-A125 HydrophobicContact CB-CB 3.86Å; A125-Y127 HydrophobicContact CB-CD1 4.01Å; A125-Y127 HydrophobicContact CB-CE1 3.69Å; A125-V147 CarbonylContact C-O 3.59Å; A125-V147 WeakPolarHBondContact CA-O 3.31Å
126	L	97.1	Very high	92.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	112.9	-179.5	-58.5	-176.9	0	0	0	111	V124 Q135 L139 V146 V147 G148 T149 R152 L153	V124-L126 HydrophobicContact CG1-CD2 4.5Å; V124-L126 HydrophobicContact CG1-CG 4.43Å; V124-L126 HydrophobicContact CG2-CD2 3.93Å; L126-Q135 HydrophobicContact CD2-CB 3.74Å; L126-Q135 HydrophobicContact CD2-CG 3.78Å; L126-L139 HydrophobicContact CD1-CD1 4.12Å; L126-L139 HydrophobicContact CD1-CD2 4.12Å; L126-L139 HydrophobicContact CD1-CG 4.39Å; L126-L139 HydrophobicContact CD2-CD1 4.32Å; L126-L139 HydrophobicContact CD2-CG 4.36Å; L126-V146 HydrophobicContact CD1-CG1 3.56Å; L126-V146 HydrophobicContact CG-CG1 4.02Å; L126-V147 PolarHBondContact N-O 2.84Å; L126-G148 CarbonylContact O-C 3.57Å; L126-G148 WeakPolarHBondContact O-CA 3.28Å; L126-T149 PolarHBondContact O-N 2.93Å; L126-R152 HydrophobicContact CB-CG 4.28Å; L126-L153 HydrophobicContact CB-CD2 4.09Å; L126-L153 HydrophobicContact CD1-CD2 3.88Å
127	Y	93.9	Very high	92.2	Very high	18 Å²	18	57.8 Å²	57.8	7%	0.071	29%	0.291	C	S	.	.			trans	-147.4	165.9	-177.9	46.2	-106.5	0	0	0	113.5	R101 V105 A125 Q130 Q135 T149 R152	R101-Y127 HydrophobicContact CB-CD2 4.42Å; R101-Y127 HydrophobicContact CB-CG 4.14Å; R101-Y127 VanDerWaalsContact CD-CE2 3.47Å; R101-Y127 HydrophobicContact CG-CD1 3.79Å; R101-Y127 HydrophobicContact CG-CD2 3.48Å; R101-Y127 VanDerWaalsContact CG-CD2 3.48Å; R101-Y127 HydrophobicContact CG-CE1 4.1Å; R101-Y127 HydrophobicContact CG-CE2 3.78Å; R101-Y127 HydrophobicContact CG-CG 3.45Å; R101-Y127 VanDerWaalsContact CG-CG 3.45Å; V105-Y127 HydrophobicContact CG2-CD1 4.12Å; V105-Y127 HydrophobicContact CG2-CE1 3.33Å; A125-Y127 HydrophobicContact CB-CD1 4.01Å; A125-Y127 HydrophobicContact CB-CE1 3.69Å; Y127-Q130 HydrophobicContact CD2-CB 4.25Å; Y127-Q130 HydrophobicContact CE2-CB 3.89Å; Y127-Q135 PolarHBondContact O-NE2 3.37Å; Y127-T149 WeakPolarHBondContact CA-OG1 3.48Å; Y127-R152 PolarHBondContact O-NE 2.78Å
128	G	85.8	Confident	92.1	Very high	24 Å²	24	56.8 Å²	56.8	25%	0.247	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	165.8	176.3	0	0	0	0	0	113	R101 Q130	R101-G128 VanDerWaalsContact CZ-O 3.25Å; R101-G128 PolarHBondContact NE-O 3.07Å; R101-G128 PolarHBondContact NH2-O 2.96Å; G128-Q130 PolarHBondContact O-N 2.99Å
129	G	79.2	Confident	92.1	Very high	57 Å²	57	56.9 Å²	56.9	59%	0.588	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	-17.7	169.6	0	0	0	0	0	117.5
130	Q	82.9	Confident	92.1	Very high	55 Å²	55	55.2 Å²	55.2	26%	0.257	29%	0.288	S	S	.	.	S	Bend	trans	-87	149.2	165	-170	-175.8	50.4	0	0	109.9	Y127 G128 V134	Y127-Q130 HydrophobicContact CD2-CB 4.25Å; Y127-Q130 HydrophobicContact CE2-CB 3.89Å; G128-Q130 PolarHBondContact O-N 2.99Å; Q130-V134 HydrophobicContact CG-CB 4.5Å
131	R	83.9	Confident	92	Very high	175 Å²	175	59.8 Å²	59.8	66%	0.66	30%	0.3	S	S	*	.			trans	-66.5	138.5	179.2	-62.2	176	45.2	172.8	-1.3	111.4	D133 V134	R131-D133 VanDerWaalsContact C-N 3.3Å; R131-D133 WeakPolarHBondContact CB-OD1 3.48Å; R131-D133 IonicContact CZ-OD1 2.69Å; R131-D133 IonicContact CZ-OD2 3.06Å; R131-D133 IonicContact NE-OD1 3.14Å; R131-D133 PolarHBondContact NE-OD1 3.3Å; R131-D133 IonicContact NE-OD2 2.76Å; R131-D133 IonicContact NH2-OD1 2.57Å; R131-D133 PolarHBondContact NH2-OD1 2.99Å; R131-D133 VanDerWaalsContact NH2-OD1 3.08Å; R131-D133 IonicContact NH2-OD2 2.91Å; R131-D133 PolarHBondContact NH2-OD2 2.91Å; R131-D133 PolarHBondContact O-N 3.06Å; R131-V134 PolarHBondContact O-N 3.14Å
132	Y	88.3	Confident	91.9	Very high	51 Å²	51	59.7 Å²	59.7	20%	0.2	30%	0.302	C	S	.	.	H	α-helix	trans	-57.2	-38.9	-179.6	-92.1	-82.4	0	0	0	113.6	V134 Q135 L136 R152 D155 H156 R159	Y132-V134 PolarHBondContact O-N 2.76Å; Y132-Q135 PolarHBondContact O-N 2.76Å; Y132-Q135 VanDerWaalsContact O-N 3.14Å; Y132-L136 WeakPolarHBondContact O-CB 3.1Å; Y132-L136 VanDerWaalsContact O-CG 3.22Å; Y132-L136 WeakPolarHBondContact O-CG 3.41Å; Y132-L136 PolarHBondContact O-N 3.2Å; Y132-R152 VanDerWaalsContact CZ-NH1 3.29Å; Y132-R152 PolarHBondContact OH-NH1 2.81Å; Y132-D155 WeakPolarHBondContact OH-CB 3.42Å; Y132-D155 PolarHBondContact OH-OD2 2.57Å; Y132-D155 VanDerWaalsContact OH-OD2 3.04Å; Y132-H156 AromaticContact CD1-CE1 3.81Å; Y132-H156 AromaticContact CD1-NE2 4Å; Y132-H156 AromaticContact CE1-CE1 3.99Å; Y132-H156 AromaticContact CE1-NE2 3.95Å; Y132-R159 PolarHBondContact OH-NE 2.69Å; Y132-R159 PolarHBondContact OH-NH2 2.83Å
133	D	89	Confident	91.9	Very high	61 Å²	61	56.4 Å²	56.4	33%	0.326	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-30.3	-175.8	58.1	-59.2	0	0	0	113.3	R131 R137	R131-D133 VanDerWaalsContact C-N 3.3Å; R131-D133 WeakPolarHBondContact CB-OD1 3.48Å; R131-D133 IonicContact CZ-OD1 2.69Å; R131-D133 IonicContact CZ-OD2 3.06Å; R131-D133 IonicContact NE-OD1 3.14Å; R131-D133 PolarHBondContact NE-OD1 3.3Å; R131-D133 IonicContact NE-OD2 2.76Å; R131-D133 IonicContact NH2-OD1 2.57Å; R131-D133 PolarHBondContact NH2-OD1 2.99Å; R131-D133 VanDerWaalsContact NH2-OD1 3.08Å; R131-D133 IonicContact NH2-OD2 2.91Å; R131-D133 PolarHBondContact NH2-OD2 2.91Å; R131-D133 PolarHBondContact O-N 3.06Å; D133-R137 WeakPolarHBondContact O-CB 3.25Å; D133-R137 PolarHBondContact O-N 3.41Å; D133-R137 VanDerWaalsContact O-N 3.1Å
134	V	89.7	Confident	92	Very high	68 Å²	68	54.9 Å²	54.9	41%	0.412	28%	0.276	S	S	.	.	H	α-helix	trans	-67.9	-49.3	173.9	-179.8	0	0	0	0	109.9	Q130 R131 Y132 L136 R137 A138	Q130-V134 HydrophobicContact CG-CB 4.5Å; R131-V134 PolarHBondContact O-N 3.14Å; Y132-V134 PolarHBondContact O-N 2.76Å; V134-L136 PolarHBondContact O-N 3.3Å; V134-R137 PolarHBondContact O-N 2.85Å; V134-A138 PolarHBondContact O-N 2.82Å; V134-A138 VanDerWaalsContact O-N 3.12Å
135	Q	92.9	Very high	92	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-39.9	179	-70.2	-175.8	20.5	0	0	112.3	L126 Y127 Y132 R137 A138 L139 H156	L126-Q135 HydrophobicContact CD2-CB 3.74Å; L126-Q135 HydrophobicContact CD2-CG 3.78Å; Y127-Q135 PolarHBondContact O-NE2 3.37Å; Y132-Q135 PolarHBondContact O-N 2.76Å; Y132-Q135 VanDerWaalsContact O-N 3.14Å; Q135-R137 VanDerWaalsContact C-N 3.33Å; Q135-R137 PolarHBondContact O-N 2.86Å; Q135-A138 PolarHBondContact O-N 3.38Å; Q135-L139 WeakPolarHBondContact O-CB 3.5Å; Q135-L139 WeakPolarHBondContact O-CG 3.41Å; Q135-L139 PolarHBondContact O-N 3.43Å; Q135-H156 PolarHBondContact OE1-NE2 3.44Å
136	L	93.2	Very high	92.1	Very high	42 Å²	42	53.2 Å²	53.2	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-38.3	175.4	-69.8	173.4	0	0	0	112.1	Y132 V134 R140 T161	Y132-L136 WeakPolarHBondContact O-CB 3.1Å; Y132-L136 VanDerWaalsContact O-CG 3.22Å; Y132-L136 WeakPolarHBondContact O-CG 3.41Å; Y132-L136 PolarHBondContact O-N 3.2Å; V134-L136 PolarHBondContact O-N 3.3Å; L136-R140 VanDerWaalsContact O-CG 3.23Å; L136-R140 WeakPolarHBondContact O-CG 3.29Å; L136-R140 PolarHBondContact O-N 2.8Å; L136-T161 HydrophobicContact CD2-CG2 3.49Å; L136-T161 VanDerWaalsContact CD2-CG2 3.49Å
137	R	93.2	Very high	92.2	Very high	166 Å²	166	53.2 Å²	53.2	63%	0.626	26%	0.263	S	S	*	.	H	α-helix	trans	-65.5	-41.9	176.3	-170.7	-176.2	-56.5	-176.8	2.7	111.4	D133 V134 Q135 R140	D133-R137 WeakPolarHBondContact O-CB 3.25Å; D133-R137 PolarHBondContact O-N 3.41Å; D133-R137 VanDerWaalsContact O-N 3.1Å; V134-R137 PolarHBondContact O-N 2.85Å; Q135-R137 VanDerWaalsContact C-N 3.33Å; Q135-R137 PolarHBondContact O-N 2.86Å; R137-R140 PolarHBondContact O-N 2.92Å
138	A	93.8	Very high	92.3	Very high	38 Å²	38	52.3 Å²	52.3	31%	0.314	26%	0.26	S	S	.	.	H	α-helix	trans	-65.3	-44.9	176.5	0	0	0	0	0	111.6	V124 V134 Q135 R140 Q141	V124-A138 HydrophobicContact CB-CB 4.47Å; V124-A138 HydrophobicContact CG2-CB 3.54Å; V134-A138 PolarHBondContact O-N 2.82Å; V134-A138 VanDerWaalsContact O-N 3.12Å; Q135-A138 PolarHBondContact O-N 3.38Å; A138-R140 VanDerWaalsContact C-N 3.3Å; A138-R140 PolarHBondContact O-N 3.33Å; A138-Q141 WeakPolarHBondContact O-CB 3.34Å; A138-Q141 PolarHBondContact O-N 2.81Å
139	L	96	Very high	92.8	Very high	19 Å²	19	52 Å²	52	10%	0.099	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-36.6	176.1	-78.3	169.2	0	0	0	113.2	V124 L126 Q135 Q141 G142 P143 L162	V124-L139 HydrophobicContact CG1-CD2 4.42Å; L126-L139 HydrophobicContact CD1-CD1 4.12Å; L126-L139 HydrophobicContact CD1-CD2 4.12Å; L126-L139 HydrophobicContact CD1-CG 4.39Å; L126-L139 HydrophobicContact CD2-CD1 4.32Å; L126-L139 HydrophobicContact CD2-CG 4.36Å; Q135-L139 WeakPolarHBondContact O-CB 3.5Å; Q135-L139 WeakPolarHBondContact O-CG 3.41Å; Q135-L139 PolarHBondContact O-N 3.43Å; L139-Q141 PolarHBondContact O-N 3.07Å; L139-G142 PolarHBondContact O-N 3.4Å; L139-P143 HydrophobicContact CD2-CG 4.3Å; L139-P143 VanDerWaalsContact O-CD 3.3Å; L139-P143 WeakPolarHBondContact O-CD 3.41Å; L139-L162 HydrophobicContact CD2-CD1 3.91Å
140	R	93.8	Very high	93.6	Very high	195 Å²	195	49.2 Å²	49.2	74%	0.736	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.8	175.5	-75.3	169.6	-174.2	163.5	1.8	114.1	L136 R137 A138 G142	L136-R140 VanDerWaalsContact O-CG 3.23Å; L136-R140 WeakPolarHBondContact O-CG 3.29Å; L136-R140 PolarHBondContact O-N 2.8Å; R137-R140 PolarHBondContact O-N 2.92Å; A138-R140 VanDerWaalsContact C-N 3.3Å; A138-R140 PolarHBondContact O-N 3.33Å; R140-G142 PolarHBondContact O-N 3.47Å
141	Q	93.2	Very high	94.2	Very high	130 Å²	130	47.6 Å²	47.6	61%	0.607	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.8	173	-56.5	-55.3	-52.9	0	0	112.8	A138 L139	A138-Q141 WeakPolarHBondContact O-CB 3.34Å; A138-Q141 PolarHBondContact O-N 2.81Å; L139-Q141 PolarHBondContact O-N 3.07Å
142	G	94.8	Very high	94.8	Very high	13 Å²	13	40.7 Å²	40.7	13%	0.134	20%	0.196	C	C	.	.			trans	64.1	52.2	-178.8	0	0	0	0	0	113.2	K90 L139 R140 Q144	K90-G142 CarbonylContact C-O 3.5Å; L139-G142 PolarHBondContact O-N 3.4Å; R140-G142 PolarHBondContact O-N 3.47Å; G142-Q144 PolarHBondContact O-N 2.95Å
143	P	97.8	Very high	95.2	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.019	19%	0.187	C	C	.	.			trans	-63.9	135.8	179.7	29	-33.6	0	0	0	110.6	A91 P92 N122 V124 L139 I145 V146	A91-P143 CarbonylContact C-O 3.58Å; P92-P143 WeakPolarHBondContact CA-O 3.11Å; N122-P143 HydrophobicContact CB-CB 4.23Å; V124-P143 HydrophobicContact CB-CB 4.25Å; V124-P143 HydrophobicContact CB-CG 4.18Å; V124-P143 HydrophobicContact CG1-CB 3.91Å; V124-P143 HydrophobicContact CG1-CG 3.53Å; L139-P143 HydrophobicContact CD2-CG 4.3Å; L139-P143 VanDerWaalsContact O-CD 3.3Å; L139-P143 WeakPolarHBondContact O-CD 3.41Å; P143-I145 VanDerWaalsContact C-N 3.33Å; P143-V146 HydrophobicContact CG-CG2 4.42Å
144	Q	98.4	Very high	95.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-80.1	-21.4	177.7	-61.4	91.8	-29.6	0	0	112.3	L85 P87 L89 A91 Q93 I94 G120 N122 G142	L85-Q144 HydrophobicContact CD1-CB 3.74Å; L85-Q144 HydrophobicContact CD2-CB 4.23Å; L85-Q144 HydrophobicContact CD2-CG 4.39Å; L85-Q144 HydrophobicContact CG-CB 4.23Å; P87-Q144 PolarHBondContact O-NE2 3.15Å; L89-Q144 VanDerWaalsContact O-CG 3.3Å; L89-Q144 WeakPolarHBondContact O-CG 3.42Å; A91-Q144 WeakPolarHBondContact O-CA 3.44Å; Q93-Q144 PolarHBondContact N-O 3.45Å; I94-Q144 PolarHBondContact N-O 3.05Å; G120-Q144 PolarHBondContact O-NE2 2.61Å; G120-Q144 PolarHBondContact O-OE1 2.9Å; N122-Q144 PolarHBondContact O-N 3.14Å; N122-Q144 VanDerWaalsContact O-N 3.17Å; G142-Q144 PolarHBondContact O-N 2.95Å
145	I	98.7	Very high	95.9	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.2	-178.5	-47.8	-175.5	0	0	0	108.7	L82 L85 I94 M111 V121 N122 V123 V124 P143 V147	L82-I145 HydrophobicContact CD2-CD1 3.38Å; L85-I145 HydrophobicContact CD1-CD1 3.91Å; L85-I145 HydrophobicContact CD1-CG1 3.68Å; I94-I145 HydrophobicContact CB-CG1 4.38Å; I94-I145 HydrophobicContact CB-CG2 4.26Å; I94-I145 HydrophobicContact CD1-CD1 4.21Å; I94-I145 HydrophobicContact CD1-CG1 4.24Å; I94-I145 HydrophobicContact CG2-CG2 4.37Å; I94-I145 WeakPolarHBondContact O-CA 3.3Å; M111-I145 HydrophobicContact CE-CD1 3.8Å; M111-I145 HydrophobicContact CE-CG2 3.53Å; M111-I145 HydrophobicContact SD-CG2 3.61Å; V121-I145 HydrophobicContact CG1-CD1 3.91Å; V121-I145 HydrophobicContact CG1-CG1 4.3Å; N122-I145 PolarHBondContact O-N 2.95Å; V123-I145 CarbonylContact C-O 3.56Å; V123-I145 WeakPolarHBondContact CA-O 3.46Å; V123-I145 HydrophobicContact CB-CB 4.29Å; V123-I145 HydrophobicContact CG1-CB 4.01Å; V123-I145 HydrophobicContact CG1-CG2 3.91Å; V123-I145 HydrophobicContact CG2-CB 4.03Å; V123-I145 HydrophobicContact CG2-CD1 4.01Å; V123-I145 HydrophobicContact CG2-CG1 4.37Å; V123-I145 HydrophobicContact CG2-CG2 4.49Å; V124-I145 PolarHBondContact N-O 2.94Å; P143-I145 VanDerWaalsContact C-N 3.33Å; I145-V147 HydrophobicContact CG2-CG2 4.31Å
146	V	98.7	Very high	96.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.6	175.8	179	0	0	0	0	107.9	P92 I94 L95 V96 V124 L126 P143 L153 L162	P92-V146 HydrophobicContact CB-CG2 3.98Å; P92-V146 HydrophobicContact CG-CG2 3.99Å; I94-V146 PolarHBondContact O-N 3.1Å; L95-V146 CarbonylContact C-O 3.43Å; L95-V146 VanDerWaalsContact CA-O 3.27Å; L95-V146 WeakPolarHBondContact CA-O 3.3Å; L95-V146 HydrophobicContact CD1-CB 3.9Å; L95-V146 HydrophobicContact CD1-CG1 3.78Å; V96-V146 PolarHBondContact N-O 2.56Å; V124-V146 HydrophobicContact CG1-CB 4.29Å; V124-V146 HydrophobicContact CG1-CG1 4.28Å; V124-V146 HydrophobicContact CG1-CG2 3.82Å; L126-V146 HydrophobicContact CD1-CG1 3.56Å; L126-V146 HydrophobicContact CG-CG1 4.02Å; P143-V146 HydrophobicContact CG-CG2 4.42Å; V146-L153 HydrophobicContact CG1-CD2 3.76Å; V146-L162 HydrophobicContact CG1-CD1 4.48Å; V146-L162 HydrophobicContact CG2-CD1 4.07Å
147	V	98.6	Very high	96.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.2	173.7	-174.5	0	0	0	0	107.5	V96 A104 V107 A108 M111 V123 V124 A125 L126 I145	V96-V147 HydrophobicContact CB-CB 4.39Å; V96-V147 HydrophobicContact CB-CG1 4.05Å; V96-V147 HydrophobicContact CB-CG2 4.13Å; V96-V147 HydrophobicContact CG1-CG1 4.32Å; V96-V147 HydrophobicContact CG2-CG2 4.27Å; V96-V147 CarbonylContact O-C 3.56Å; V96-V147 WeakPolarHBondContact O-CA 3.46Å; A104-V147 HydrophobicContact CB-CG1 3.98Å; A104-V147 WeakPolarHBondContact O-CG1 3.37Å; V107-V147 HydrophobicContact CB-CG1 3.94Å; V107-V147 HydrophobicContact CG1-CG1 3.89Å; V107-V147 HydrophobicContact CG1-CG2 4.09Å; A108-V147 HydrophobicContact CB-CB 4.11Å; A108-V147 HydrophobicContact CB-CG2 4.03Å; M111-V147 HydrophobicContact SD-CG2 4.2Å; V123-V147 HydrophobicContact CG1-CG2 4.28Å; V124-V147 PolarHBondContact O-N 2.77Å; A125-V147 CarbonylContact C-O 3.59Å; A125-V147 WeakPolarHBondContact CA-O 3.31Å; L126-V147 PolarHBondContact N-O 2.84Å; I145-V147 HydrophobicContact CG2-CG2 4.31Å
148	G	97.5	Very high	96.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	168.4	-178.9	0	0	0	0	0	116.8	V96 L97 A98 L126 L153	V96-G148 PolarHBondContact O-N 3.08Å; L97-G148 WeakPolarHBondContact CA-O 3.37Å; A98-G148 PolarHBondContact N-O 2.84Å; L126-G148 CarbonylContact O-C 3.57Å; L126-G148 WeakPolarHBondContact O-CA 3.28Å; G148-L153 WeakPolarHBondContact O-CD1 3.33Å
149	T	95.3	Very high	96.4	Very high	16 Å²	16	38.6 Å²	38.6	10%	0.098	18%	0.175	C	C	.	.			trans	-81.5	138.6	173.2	57.6	0	0	0	0	110.4	A98 T100 L126 Y127 G151 R152 L153	A98-T149 WeakPolarHBondContact O-CA 3.39Å; T100-T149 VanDerWaalsContact C-CG2 3.46Å; L126-T149 PolarHBondContact O-N 2.93Å; Y127-T149 WeakPolarHBondContact CA-OG1 3.48Å; T149-G151 PolarHBondContact O-N 3.25Å; T149-R152 PolarHBondContact O-N 2.98Å; T149-R152 VanDerWaalsContact O-N 3.07Å; T149-L153 PolarHBondContact O-N 2.82Å
150	P	96.9	Very high	96.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-49.2	-52.4	-173.8	-30	34.4	0	0	0	114	L97 A98 R152 L153 L154 M178 F183 D186 V187 I190	L97-P150 HydrophobicContact CD2-CG 4.32Å; A98-P150 WeakPolarHBondContact O-CD 3.44Å; P150-R152 VanDerWaalsContact C-N 3.32Å; P150-R152 PolarHBondContact O-N 2.79Å; P150-L153 PolarHBondContact O-N 2.91Å; P150-L154 WeakPolarHBondContact O-CB 3.07Å; P150-L154 PolarHBondContact O-N 2.96Å; P150-M178 HydrophobicContact CG-CG 4.39Å; P150-M178 HydrophobicContact CG-SD 3.61Å; P150-F183 HydrophobicContact CB-CB 3.99Å; P150-F183 HydrophobicContact CB-CG 4.32Å; P150-F183 HydrophobicContact CG-CB 3.92Å; P150-F183 HydrophobicContact CG-CD2 4.44Å; P150-F183 HydrophobicContact CG-CG 4.26Å; P150-D186 HydrophobicContact CB-CB 3.87Å; P150-V187 HydrophobicContact CB-CG2 4.09Å; P150-V187 HydrophobicContact CG-CG2 3.82Å; P150-I190 HydrophobicContact CB-CD1 4.22Å; P150-I190 WeakPolarHBondContact O-CD1 3.47Å
151	G	94.9	Very high	96.4	Very high	20 Å²	20	34 Å²	34	21%	0.206	18%	0.182	C	C	.	.	H	α-helix	trans	-57.1	-41.9	-178.7	0	0	0	0	0	113.6	T149 D155	T149-G151 PolarHBondContact O-N 3.25Å; G151-D155 VanDerWaalsContact O-CG 3.29Å; G151-D155 PolarHBondContact O-N 2.82Å
152	R	95.8	Very high	96.6	Very high	31 Å²	31	28.1 Å²	28.1	12%	0.117	16%	0.155	C	C	.	.	H	α-helix	trans	-71.7	-39.7	178.4	-179.8	61	77.2	-147	16.1	112.6	L126 Y127 Y132 T149 P150 L154 D155 H156	L126-R152 HydrophobicContact CB-CG 4.28Å; Y127-R152 PolarHBondContact O-NE 2.78Å; Y132-R152 VanDerWaalsContact CZ-NH1 3.29Å; Y132-R152 PolarHBondContact OH-NH1 2.81Å; T149-R152 PolarHBondContact O-N 2.98Å; T149-R152 VanDerWaalsContact O-N 3.07Å; P150-R152 VanDerWaalsContact C-N 3.32Å; P150-R152 PolarHBondContact O-N 2.79Å; R152-L154 VanDerWaalsContact C-N 3.32Å; R152-D155 IonicContact CZ-OD2 3.52Å; R152-D155 IonicContact NH1-OD2 3.51Å; R152-D155 PolarHBondContact NH1-OD2 2.88Å; R152-D155 WeakPolarHBondContact O-CB 3.34Å; R152-D155 PolarHBondContact O-N 2.89Å; R152-H156 PolarHBondContact O-CD2 2.85Å; R152-H156 PolarHBondContact O-N 3.21Å; R152-H156 VanDerWaalsContact O-N 3.13Å
153	L	98	Very high	96.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-45.8	175.6	-70.2	170.3	0	0	0	110.4	L95 L97 L126 V146 G148 T149 P150 D155 H156 L157 L162 I190	L95-L153 HydrophobicContact CD1-CD1 3.97Å; L95-L153 HydrophobicContact CD1-CD2 3.86Å; L97-L153 HydrophobicContact CD1-CD1 4.26Å; L97-L153 HydrophobicContact CG-CD1 3.86Å; L126-L153 HydrophobicContact CB-CD2 4.09Å; L126-L153 HydrophobicContact CD1-CD2 3.88Å; V146-L153 HydrophobicContact CG1-CD2 3.76Å; G148-L153 WeakPolarHBondContact O-CD1 3.33Å; T149-L153 PolarHBondContact O-N 2.82Å; P150-L153 PolarHBondContact O-N 2.91Å; L153-D155 VanDerWaalsContact C-N 3.32Å; L153-D155 PolarHBondContact O-N 2.93Å; L153-H156 PolarHBondContact O-N 3.04Å; L153-H156 VanDerWaalsContact O-N 3.11Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 2.8Å; L153-L162 HydrophobicContact CD2-CD2 3.98Å; L153-I190 HydrophobicContact CB-CD1 3.88Å
154	L	96.9	Very high	96.6	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-39.5	177.3	-175.8	58.6	0	0	0	112.3	P150 R152 H156 L157 K158 D186 T189 I190	P150-L154 WeakPolarHBondContact O-CB 3.07Å; P150-L154 PolarHBondContact O-N 2.96Å; R152-L154 VanDerWaalsContact C-N 3.32Å; L154-H156 VanDerWaalsContact C-N 3.32Å; L154-H156 PolarHBondContact O-N 3.28Å; L154-L157 PolarHBondContact O-N 3.16Å; L154-K158 HydrophobicContact CD1-CD 4.45Å; L154-K158 HydrophobicContact CD1-CG 4.32Å; L154-K158 HydrophobicContact CG-CD 4.16Å; L154-K158 HydrophobicContact CG-CG 4.48Å; L154-K158 WeakPolarHBondContact O-CB 3.37Å; L154-K158 WeakPolarHBondContact O-CG 3.45Å; L154-K158 PolarHBondContact O-N 2.85Å; L154-D186 HydrophobicContact CD2-CB 4.12Å; L154-D186 VanDerWaalsContact CD2-OD1 3.3Å; L154-D186 WeakPolarHBondContact CD2-OD1 3.4Å; L154-T189 HydrophobicContact CD1-CG2 3.6Å; L154-T189 HydrophobicContact CD2-CG2 4.34Å; L154-I190 HydrophobicContact CB-CD1 4.31Å; L154-I190 HydrophobicContact CB-CG1 4.21Å; L154-I190 HydrophobicContact CD1-CG1 4.36Å
155	D	95.9	Very high	96.4	Very high	55 Å²	55	35.2 Å²	35.2	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-58.9	-43.8	173	-71.1	-25.5	0	0	0	112.3	Y132 G151 R152 L153 K158 R159	Y132-D155 WeakPolarHBondContact OH-CB 3.42Å; Y132-D155 PolarHBondContact OH-OD2 2.57Å; Y132-D155 VanDerWaalsContact OH-OD2 3.04Å; G151-D155 VanDerWaalsContact O-CG 3.29Å; G151-D155 PolarHBondContact O-N 2.82Å; R152-D155 IonicContact CZ-OD2 3.52Å; R152-D155 IonicContact NH1-OD2 3.51Å; R152-D155 PolarHBondContact NH1-OD2 2.88Å; R152-D155 WeakPolarHBondContact O-CB 3.34Å; R152-D155 PolarHBondContact O-N 2.89Å; L153-D155 VanDerWaalsContact C-N 3.32Å; L153-D155 PolarHBondContact O-N 2.93Å; D155-K158 PolarHBondContact O-N 2.85Å; D155-R159 WeakPolarHBondContact O-CB 3.48Å; D155-R159 WeakPolarHBondContact O-CD 3.39Å; D155-R159 WeakPolarHBondContact O-CG 3.3Å; D155-R159 PolarHBondContact O-N 3.26Å; D155-R159 VanDerWaalsContact O-N 3.1Å
156	H	97.5	Very high	96.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.9	-37.4	180	-87.1	-71.7	0	0	0	112.5	Y132 Q135 R152 L153 L154 R159 G160 T161 L162	Y132-H156 AromaticContact CD1-CE1 3.81Å; Y132-H156 AromaticContact CD1-NE2 4Å; Y132-H156 AromaticContact CE1-CE1 3.99Å; Y132-H156 AromaticContact CE1-NE2 3.95Å; Q135-H156 PolarHBondContact OE1-NE2 3.44Å; R152-H156 PolarHBondContact O-CD2 2.85Å; R152-H156 PolarHBondContact O-N 3.21Å; R152-H156 VanDerWaalsContact O-N 3.13Å; L153-H156 PolarHBondContact O-N 3.04Å; L153-H156 VanDerWaalsContact O-N 3.11Å; L154-H156 VanDerWaalsContact C-N 3.32Å; L154-H156 PolarHBondContact O-N 3.28Å; H156-R159 PolarHBondContact O-N 3.2Å; H156-G160 PolarHBondContact O-N 3.3Å; H156-T161 WeakPolarHBondContact CA-OG1 3.36Å; H156-T161 PolarHBondContact ND1-OG1 2.67Å; H156-T161 PolarHBondContact O-N 3Å; H156-T161 PolarHBondContact O-OG1 3.22Å; H156-L162 HydrophobicContact CB-CB 3.75Å; H156-L162 PolarHBondContact O-N 2.91Å
157	L	96.5	Very high	96.3	Very high	17 Å²	17	41.2 Å²	41.2	9%	0.089	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-50.9	173.1	-69	171.3	0	0	0	111.5	L153 L154 R159 G160 L162 L164 I190	L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 2.8Å; L154-L157 PolarHBondContact O-N 3.16Å; L157-R159 PolarHBondContact O-N 3.44Å; L157-R159 VanDerWaalsContact O-N 3.16Å; L157-G160 PolarHBondContact O-N 3.19Å; L157-L162 HydrophobicContact CD2-CB 4.27Å; L157-L162 HydrophobicContact CD2-CD2 4.11Å; L157-L162 HydrophobicContact CD2-CG 4.07Å; L157-L162 HydrophobicContact CG-CD2 4.24Å; L157-L164 HydrophobicContact CD1-CD1 4.14Å; L157-L164 HydrophobicContact CD2-CD1 3.64Å; L157-L164 HydrophobicContact CD2-CG 3.78Å; L157-L164 HydrophobicContact CG-CD1 4.46Å; L157-I190 HydrophobicContact CD1-CB 4.34Å; L157-I190 HydrophobicContact CD1-CG1 3.88Å; L157-I190 HydrophobicContact CD1-CG2 4.18Å
158	K	95.5	Very high	96.1	Very high	151 Å²	151	43.8 Å²	43.8	66%	0.657	24%	0.239	S	C	*	.	H	α-helix	trans	-58	-31.2	178	-75.6	174.6	177.9	170	0	112.7	L154 D155	L154-K158 HydrophobicContact CD1-CD 4.45Å; L154-K158 HydrophobicContact CD1-CG 4.32Å; L154-K158 HydrophobicContact CG-CD 4.16Å; L154-K158 HydrophobicContact CG-CG 4.48Å; L154-K158 WeakPolarHBondContact O-CB 3.37Å; L154-K158 WeakPolarHBondContact O-CG 3.45Å; L154-K158 PolarHBondContact O-N 2.85Å; D155-K158 PolarHBondContact O-N 2.85Å
159	R	94.6	Very high	96.1	Very high	156 Å²	156	43.9 Å²	43.9	59%	0.589	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.1	176.3	-69.2	170.2	-174.3	-111.5	3.7	113.9	Y132 D155 H156 L157 T161	Y132-R159 PolarHBondContact OH-NE 2.69Å; Y132-R159 PolarHBondContact OH-NH2 2.83Å; D155-R159 WeakPolarHBondContact O-CB 3.48Å; D155-R159 WeakPolarHBondContact O-CD 3.39Å; D155-R159 WeakPolarHBondContact O-CG 3.3Å; D155-R159 PolarHBondContact O-N 3.26Å; D155-R159 VanDerWaalsContact O-N 3.1Å; H156-R159 PolarHBondContact O-N 3.2Å; L157-R159 PolarHBondContact O-N 3.44Å; L157-R159 VanDerWaalsContact O-N 3.16Å; R159-T161 VanDerWaalsContact C-N 3.26Å; R159-T161 HydrophobicContact CB-CG2 4Å; R159-T161 PolarHBondContact O-N 3.45Å
160	G	94.1	Very high	96.3	Very high	66 Å²	66	43.1 Å²	43.1	68%	0.68	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.6	22.5	-174.4	0	0	0	0	0	113.9	H156 L157	H156-G160 PolarHBondContact O-N 3.3Å; L157-G160 PolarHBondContact O-N 3.19Å
161	T	95.1	Very high	96.3	Very high	51 Å²	51	43.1 Å²	43.1	31%	0.313	24%	0.235	S	C	.	.			trans	-99.1	-16.1	-176.4	55.7	0	0	0	0	113.4	L136 H156 R159	L136-T161 HydrophobicContact CD2-CG2 3.49Å; L136-T161 VanDerWaalsContact CD2-CG2 3.49Å; H156-T161 WeakPolarHBondContact CA-OG1 3.36Å; H156-T161 PolarHBondContact ND1-OG1 2.67Å; H156-T161 PolarHBondContact O-N 3Å; H156-T161 PolarHBondContact O-OG1 3.22Å; R159-T161 VanDerWaalsContact C-N 3.26Å; R159-T161 HydrophobicContact CB-CG2 4Å; R159-T161 PolarHBondContact O-N 3.45Å
162	L	97	Very high	96.5	Very high	7 Å²	7	42.2 Å²	42.2	4%	0.037	23%	0.225	C	C	.	.	S	Bend	trans	-113.3	123.7	167	173.9	63.3	0	0	0	107.1	P92 L139 V146 L153 H156 L157 L164	P92-L162 HydrophobicContact CB-CD1 4.45Å; P92-L162 HydrophobicContact CG-CD1 3.9Å; L139-L162 HydrophobicContact CD2-CD1 3.91Å; V146-L162 HydrophobicContact CG1-CD1 4.48Å; V146-L162 HydrophobicContact CG2-CD1 4.07Å; L153-L162 HydrophobicContact CD2-CD2 3.98Å; H156-L162 HydrophobicContact CB-CB 3.75Å; H156-L162 PolarHBondContact O-N 2.91Å; L157-L162 HydrophobicContact CD2-CB 4.27Å; L157-L162 HydrophobicContact CD2-CD2 4.11Å; L157-L162 HydrophobicContact CD2-CG 4.07Å; L157-L162 HydrophobicContact CG-CD2 4.24Å; L162-L164 HydrophobicContact CD1-CD2 3.95Å; L162-L164 HydrophobicContact CD2-CD2 4.06Å; L162-L164 HydrophobicContact CD2-CG 4.46Å; L162-L164 HydrophobicContact CG-CD2 3.86Å; L162-L164 HydrophobicContact CG-CG 4.22Å
163	D	95.5	Very high	96.4	Very high	99 Å²	99	40.9 Å²	40.9	53%	0.529	22%	0.221	S	C	.	.			trans	-108.5	123.1	173.9	178.9	17.4	0	0	0	109.1	P92 S165	P92-D163 WeakPolarHBondContact CG-O 3.27Å; D163-S165 VanDerWaalsContact CG-OG 3.28Å; D163-S165 WeakPolarHBondContact OD1-CB 3.41Å; D163-S165 PolarHBondContact OD1-N 3.06Å; D163-S165 PolarHBondContact OD1-OG 2.97Å; D163-S165 VanDerWaalsContact OD1-OG 3.08Å; D163-S165 PolarHBondContact OD2-OG 3.31Å
164	L	96.7	Very high	96.1	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.031	23%	0.227	C	C	.	.			trans	-106.1	12.1	179.3	-58.7	-179.5	0	0	0	112.2	P92 L95 L157 L162 K166 L167 I194 P195	P92-L164 HydrophobicContact CB-CD2 4.29Å; L95-L164 HydrophobicContact CD2-CD1 3.77Å; L95-L164 HydrophobicContact CD2-CD2 4.17Å; L157-L164 HydrophobicContact CD1-CD1 4.14Å; L157-L164 HydrophobicContact CD2-CD1 3.64Å; L157-L164 HydrophobicContact CD2-CG 3.78Å; L157-L164 HydrophobicContact CG-CD1 4.46Å; L162-L164 HydrophobicContact CD1-CD2 3.95Å; L162-L164 HydrophobicContact CD2-CD2 4.06Å; L162-L164 HydrophobicContact CD2-CG 4.46Å; L162-L164 HydrophobicContact CG-CD2 3.86Å; L162-L164 HydrophobicContact CG-CG 4.22Å; L164-K166 PolarHBondContact O-N 3.41Å; L164-L167 HydrophobicContact CB-CB 4.24Å; L164-L167 HydrophobicContact CD2-CD1 4.25Å; L164-L167 VanDerWaalsContact O-CB 3.23Å; L164-L167 WeakPolarHBondContact O-CB 3.47Å; L164-L167 PolarHBondContact O-N 3.3Å; L164-I194 HydrophobicContact CD1-CG1 4.07Å; L164-P195 WeakPolarHBondContact O-CD 3.24Å; L164-P195 WeakPolarHBondContact O-CG 3.22Å
165	S	95.3	Very high	96	Very high	61 Å²	61	42.1 Å²	42.1	43%	0.427	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.2	-178.5	67.6	0	0	0	0	114.5	D163	D163-S165 VanDerWaalsContact CG-OG 3.28Å; D163-S165 WeakPolarHBondContact OD1-CB 3.41Å; D163-S165 PolarHBondContact OD1-N 3.06Å; D163-S165 PolarHBondContact OD1-OG 2.97Å; D163-S165 VanDerWaalsContact OD1-OG 3.08Å; D163-S165 PolarHBondContact OD2-OG 3.31Å
166	K	96.5	Very high	95.6	Very high	116 Å²	116	40 Å²	40	50%	0.504	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	10.1	177.6	-57.9	-56.7	179.1	-173.7	0	113.7	L89 A91 P92 L164 S168	L89-K166 HydrophobicContact CD2-CB 4.29Å; L89-K166 HydrophobicContact CD2-CG 4.45Å; A91-K166 HydrophobicContact CB-CB 3.94Å; A91-K166 HydrophobicContact CB-CG 3.93Å; P92-K166 CarbonylContact O-C 3.59Å; L164-K166 PolarHBondContact O-N 3.41Å; K166-S168 PolarHBondContact O-N 3.17Å
167	L	97.5	Very high	95	Very high	9 Å²	9	40.4 Å²	40.4	5%	0.047	22%	0.217	C	C	.	.			trans	-66.9	126.9	-179.6	-162.4	79.7	0	0	0	110.7	P92 Q93 L95 L164 L170 I194	P92-L167 PolarHBondContact O-N 3.07Å; Q93-L167 WeakPolarHBondContact O-CD1 3.37Å; L95-L167 HydrophobicContact CB-CD1 3.53Å; L95-L167 HydrophobicContact CB-CD2 3.86Å; L95-L167 HydrophobicContact CB-CG 4.34Å; L95-L167 HydrophobicContact CD2-CD2 4.36Å; L164-L167 HydrophobicContact CB-CB 4.24Å; L164-L167 HydrophobicContact CD2-CD1 4.25Å; L164-L167 VanDerWaalsContact O-CB 3.23Å; L164-L167 WeakPolarHBondContact O-CB 3.47Å; L164-L167 PolarHBondContact O-N 3.3Å; L167-L170 HydrophobicContact CD2-CB 4.43Å; L167-I194 HydrophobicContact CB-CG2 4.35Å; L167-I194 HydrophobicContact CD2-CB 4.4Å; L167-I194 HydrophobicContact CD2-CD1 3.68Å; L167-I194 HydrophobicContact CD2-CG1 3.88Å; L167-I194 HydrophobicContact CD2-CG2 3.59Å; L167-I194 HydrophobicContact CG-CG2 4.47Å
168	S	96	Very high	94.7	Very high	55 Å²	55	39.6 Å²	39.6	39%	0.385	21%	0.213	S	C	.	.			trans	-115.9	-23.9	175.5	58.7	0	0	0	0	112.7	Q93 K166 H198 Q199	Q93-S168 PolarHBondContact O-N 2.85Å; Q93-S168 PolarHBondContact O-OG 3.45Å; K166-S168 PolarHBondContact O-N 3.17Å; S168-H198 CarbonylContact O-C 3.6Å; S168-H198 WeakPolarHBondContact O-CA 3.39Å; S168-Q199 PolarHBondContact O-N 3.05Å
169	G	97.7	Very high	94.4	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.5	179.1	0	0	0	0	0	112.6	Q93 I94 L95 Q199	Q93-G169 PolarHBondContact O-N 2.98Å; I94-G169 CarbonylContact C-O 3.57Å; I94-G169 WeakPolarHBondContact CA-O 3.1Å; L95-G169 PolarHBondContact N-O 3.43Å; G169-Q199 WeakPolarHBondContact CA-O 3.4Å
170	L	98.2	Very high	93.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134	174	176.9	66.5	0	0	0	110	L95 L97 L167 L172 M191 I194 Q199 T200 A201	L95-L170 HydrophobicContact CB-CD1 4.22Å; L95-L170 HydrophobicContact CD2-CD1 4.03Å; L95-L170 HydrophobicContact CG-CD1 4.19Å; L95-L170 CarbonylContact O-C 3.56Å; L95-L170 WeakPolarHBondContact O-CA 3.36Å; L97-L170 HydrophobicContact CD1-CD1 3.54Å; L167-L170 HydrophobicContact CD2-CB 4.43Å; L170-L172 HydrophobicContact CD1-CD1 4.31Å; L170-L172 HydrophobicContact CD2-CD1 3.78Å; L170-L172 HydrophobicContact CG-CD1 3.78Å; L170-M191 HydrophobicContact CD2-CE 3.63Å; L170-M191 HydrophobicContact CD2-CG 3.97Å; L170-I194 HydrophobicContact CB-CD1 4.48Å; L170-I194 HydrophobicContact CD1-CD1 3.7Å; L170-I194 HydrophobicContact CD2-CD1 3.64Å; L170-I194 HydrophobicContact CG-CD1 4.13Å; L170-Q199 PolarHBondContact N-O 3.18Å; L170-T200 HydrophobicContact CD2-CG2 4.16Å; L170-T200 HydrophobicContact CG-CG2 4.45Å; L170-T200 CarbonylContact O-C 3.59Å; L170-T200 WeakPolarHBondContact O-CA 3.43Å; L170-A201 PolarHBondContact O-N 2.98Å
171	V	98.4	Very high	93.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.2	173.3	-176	0	0	0	0	110.3	F77 L81 L95 V96 L97 A201 F203	F77-V171 HydrophobicContact CB-CG1 4.42Å; F77-V171 HydrophobicContact CB-CG2 4.22Å; F77-V171 HydrophobicContact CD1-CG1 3.84Å; F77-V171 HydrophobicContact CD2-CB 4.39Å; F77-V171 HydrophobicContact CD2-CG1 3.97Å; F77-V171 HydrophobicContact CD2-CG2 3.79Å; F77-V171 HydrophobicContact CE1-CG1 3.98Å; F77-V171 HydrophobicContact CE2-CG1 4.16Å; F77-V171 HydrophobicContact CE2-CG2 4.39Å; F77-V171 HydrophobicContact CG-CG1 3.84Å; F77-V171 HydrophobicContact CG-CG2 4.09Å; F77-V171 HydrophobicContact CZ-CG1 4.16Å; L81-V171 HydrophobicContact CD1-CG2 3.35Å; L95-V171 PolarHBondContact O-N 3.35Å; V96-V171 WeakPolarHBondContact CA-O 3.4Å; V96-V171 HydrophobicContact CB-CB 4.2Å; V96-V171 HydrophobicContact CG1-CB 3.9Å; V96-V171 HydrophobicContact CG1-CG1 4.01Å; V96-V171 HydrophobicContact CG2-CB 3.95Å; V96-V171 HydrophobicContact CG2-CG2 4.13Å; L97-V171 PolarHBondContact N-O 2.7Å; V171-A201 CarbonylContact C-O 3.34Å; V171-A201 VanDerWaalsContact CA-O 3.24Å; V171-A201 WeakPolarHBondContact CA-O 3.42Å; V171-A201 HydrophobicContact CG2-CB 4.34Å; V171-F203 HydrophobicContact CG1-CD2 4.29Å
172	L	97.8	Very high	92.8	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	101	167.6	-74	77.5	0	0	0	107.4	L170 A175 M178 V187 M191 T200 A201 L202 F203 I214	L170-L172 HydrophobicContact CD1-CD1 4.31Å; L170-L172 HydrophobicContact CD2-CD1 3.78Å; L170-L172 HydrophobicContact CG-CD1 3.78Å; L172-A175 HydrophobicContact CB-CB 4.38Å; L172-M178 HydrophobicContact CB-CE 3.77Å; L172-M178 HydrophobicContact CD2-CE 4.27Å; L172-M178 HydrophobicContact CG-CE 4.1Å; L172-V187 HydrophobicContact CD2-CG1 3.51Å; L172-V187 HydrophobicContact CG-CG1 4.42Å; L172-M191 HydrophobicContact CD1-CE 4.06Å; L172-M191 HydrophobicContact CD1-SD 4.31Å; L172-M191 HydrophobicContact CD2-SD 4.04Å; L172-T200 HydrophobicContact CD1-CG2 4.19Å; L172-A201 PolarHBondContact N-O 2.72Å; L172-L202 HydrophobicContact CB-CD1 4.35Å; L172-L202 HydrophobicContact CB-CG 4.06Å; L172-L202 HydrophobicContact CD2-CD1 4.04Å; L172-F203 PolarHBondContact O-N 3.14Å; L172-I214 HydrophobicContact CD2-CG2 4.26Å
173	D	95	Very high	92.6	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.016	19%	0.19	C	C	.	.	S	Bend	trans	-94.8	139.5	176.6	-164	14.7	0	0	0	110.8	K73 F77 L97 P99 A175	K73-D173 IonicContact NZ-OD1 3.29Å; K73-D173 PolarHBondContact NZ-OD1 2.73Å; F77-D173 HydrophobicContact CE1-CB 4.49Å; L97-D173 PolarHBondContact O-N 3.1Å; P99-D173 WeakPolarHBondContact CD-O 3.23Å; D173-A175 PolarHBondContact O-N 3.26Å
174	E	91.7	Very high	92.5	Very high	29 Å²	29	31.2 Å²	31.2	14%	0.136	17%	0.17	C	C	.	.	S	Bend	trans	50	54.9	-173.7	-60.7	-172.2	-178.4	0	0	112.2	P99 L103 D176 E177 M178 F203	P99-E174 HydrophobicContact CG-CB 3.77Å; L103-E174 HydrophobicContact CD2-CB 4.34Å; L103-E174 HydrophobicContact CD2-CG 3.93Å; E174-D176 PolarHBondContact O-N 3.28Å; E174-E177 HydrophobicContact CB-CB 3.99Å; E174-E177 HydrophobicContact CB-CG 4.1Å; E174-E177 WeakPolarHBondContact O-CA 3.43Å; E174-E177 VanDerWaalsContact O-CB 3.32Å; E174-E177 WeakPolarHBondContact O-CB 3.18Å; E174-E177 PolarHBondContact O-N 3.01Å; E174-M178 PolarHBondContact O-N 3.1Å; E174-M178 VanDerWaalsContact O-N 3.07Å; E174-F203 PolarHBondContact N-O 3.11Å
175	A	92.9	Very high	92.4	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-36.2	-173.2	0	0	0	0	0	113.8	L172 D173 E177 M178 L179 L202 F203 I211	L172-A175 HydrophobicContact CB-CB 4.38Å; D173-A175 PolarHBondContact O-N 3.26Å; A175-E177 VanDerWaalsContact C-N 3.27Å; A175-E177 PolarHBondContact O-N 3.29Å; A175-M178 HydrophobicContact CB-CE 4.13Å; A175-M178 WeakPolarHBondContact O-CB 3.15Å; A175-M178 PolarHBondContact O-N 3.29Å; A175-L179 PolarHBondContact O-N 2.87Å; A175-L202 HydrophobicContact CB-CD1 4.21Å; A175-L202 HydrophobicContact CB-CD2 3.86Å; A175-L202 HydrophobicContact CB-CG 4Å; A175-F203 PolarHBondContact N-O 3.1Å; A175-F203 VanDerWaalsContact N-O 3.11Å; A175-I211 HydrophobicContact CB-CD1 3.88Å; A175-I211 HydrophobicContact CB-CG2 4.31Å; A175-I211 VanDerWaalsContact O-CD1 3.28Å; A175-I211 WeakPolarHBondContact O-CD1 3.15Å
176	D	87.5	Confident	92.4	Very high	12 Å²	12	36.9 Å²	36.9	6%	0.064	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-35.9	170.4	49.8	-2.6	0	0	0	113.1	E174 L179 R180 S204 A205 T206	E174-D176 PolarHBondContact O-N 3.28Å; D176-L179 WeakPolarHBondContact O-CB 3.4Å; D176-L179 PolarHBondContact O-N 3.21Å; D176-R180 PolarHBondContact O-N 2.83Å; D176-S204 VanDerWaalsContact CB-OG 3.29Å; D176-S204 WeakPolarHBondContact CB-OG 3.15Å; D176-S204 PolarHBondContact N-OG 2.69Å; D176-S204 PolarHBondContact OD1-OG 2.69Å; D176-S204 PolarHBondContact OD2-OG 3.11Å; D176-A205 PolarHBondContact OD2-N 3.45Å; D176-A205 VanDerWaalsContact OD2-N 3.14Å; D176-T206 WeakPolarHBondContact CB-OG1 2.88Å; D176-T206 PolarHBondContact OD2-N 3Å; D176-T206 PolarHBondContact OD2-OG1 3.28Å
177	E	85.6	Confident	92.5	Very high	7 Å²	7	31.4 Å²	31.4	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-68	-39.8	172.5	-69.1	-62.2	159.7	0	0	112.5	P99 E174 A175 L179 R180 M181 R324	P99-E177 HydrophobicContact CB-CB 3.98Å; P99-E177 HydrophobicContact CG-CB 3.91Å; E174-E177 HydrophobicContact CB-CB 3.99Å; E174-E177 HydrophobicContact CB-CG 4.1Å; E174-E177 WeakPolarHBondContact O-CA 3.43Å; E174-E177 VanDerWaalsContact O-CB 3.32Å; E174-E177 WeakPolarHBondContact O-CB 3.18Å; E174-E177 PolarHBondContact O-N 3.01Å; A175-E177 VanDerWaalsContact C-N 3.27Å; A175-E177 PolarHBondContact O-N 3.29Å; E177-L179 VanDerWaalsContact C-N 3.27Å; E177-L179 PolarHBondContact O-N 2.7Å; E177-R180 PolarHBondContact O-N 2.8Å; E177-R180 IonicContact OE1-CZ 3.61Å; E177-R180 IonicContact OE1-NE 3.93Å; E177-R180 PolarHBondContact OE1-NE 3.07Å; E177-R180 IonicContact OE1-NH1 2.72Å; E177-R180 IonicContact OE1-NH2 3.59Å; E177-R180 PolarHBondContact OE1-NH2 3.02Å; E177-R180 IonicContact OE2-CZ 3.9Å; E177-R180 IonicContact OE2-NE 2.7Å; E177-R180 PolarHBondContact OE2-NE 3.13Å; E177-R180 IonicContact OE2-NH2 3.81Å; E177-R180 PolarHBondContact OE2-NH2 3.37Å; E177-M181 VanDerWaalsContact O-CG 3.32Å; E177-M181 WeakPolarHBondContact O-CG 3.28Å; E177-M181 PolarHBondContact O-N 2.94Å; E177-R324 IonicContact OE2-CZ 2.72Å; E177-R324 IonicContact OE2-NE 3.53Å; E177-R324 PolarHBondContact OE2-NE 3.48Å; E177-R324 IonicContact OE2-NH1 3.1Å; E177-R324 PolarHBondContact OE2-NH1 2.88Å; E177-R324 IonicContact OE2-NH2 3.5Å; E177-R324 PolarHBondContact OE2-NH2 2.9Å
178	M	91.1	Very high	92.4	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-59	-40.7	172.6	-69.9	-167.7	-81.7	0	0	111.3	L97 P99 P150 L172 E174 A175 M181 G182 F183 V187	L97-M178 HydrophobicContact CB-CE 4.22Å; L97-M178 HydrophobicContact CB-SD 3.98Å; P99-M178 HydrophobicContact CB-CG 3.73Å; P99-M178 HydrophobicContact CG-CG 4.39Å; P150-M178 HydrophobicContact CG-CG 4.39Å; P150-M178 HydrophobicContact CG-SD 3.61Å; L172-M178 HydrophobicContact CB-CE 3.77Å; L172-M178 HydrophobicContact CD2-CE 4.27Å; L172-M178 HydrophobicContact CG-CE 4.1Å; E174-M178 PolarHBondContact O-N 3.1Å; E174-M178 VanDerWaalsContact O-N 3.07Å; A175-M178 HydrophobicContact CB-CE 4.13Å; A175-M178 WeakPolarHBondContact O-CB 3.15Å; A175-M178 PolarHBondContact O-N 3.29Å; M178-M181 PolarHBondContact O-N 3.06Å; M178-G182 PolarHBondContact O-N 3.37Å; M178-F183 HydrophobicContact CB-CB 4.38Å; M178-F183 PolarHBondContact O-N 2.95Å; M178-V187 HydrophobicContact CB-CG2 4.47Å; M178-V187 HydrophobicContact CE-CG2 4.43Å; M178-V187 HydrophobicContact SD-CG2 3.74Å
179	L	88.1	Confident	92.4	Very high	50 Å²	50	33 Å²	33	26%	0.262	17%	0.172	S	C	.	.	H	α-helix	trans	-62.3	-48.7	172.7	175.9	66.1	0	0	0	111.7	A175 D176 E177 M181 G182 I184 P208 A210 I211	A175-L179 PolarHBondContact O-N 2.87Å; D176-L179 WeakPolarHBondContact O-CB 3.4Å; D176-L179 PolarHBondContact O-N 3.21Å; E177-L179 VanDerWaalsContact C-N 3.27Å; E177-L179 PolarHBondContact O-N 2.7Å; L179-M181 PolarHBondContact O-N 3.5Å; L179-G182 PolarHBondContact O-N 2.7Å; L179-I184 HydrophobicContact CB-CD1 4.26Å; L179-I184 HydrophobicContact CD1-CB 3.86Å; L179-I184 HydrophobicContact CD1-CD1 4.13Å; L179-I184 HydrophobicContact CD1-CG1 3.98Å; L179-I184 HydrophobicContact CD1-CG2 4.04Å; L179-P208 HydrophobicContact CD2-CB 4Å; L179-P208 HydrophobicContact CD2-CG 3.51Å; L179-A210 HydrophobicContact CD1-CB 3.67Å; L179-A210 HydrophobicContact CD2-CB 3.83Å; L179-A210 HydrophobicContact CG-CB 4.39Å; L179-I211 HydrophobicContact CB-CD1 4.21Å; L179-I211 HydrophobicContact CD2-CG1 4.44Å
180	R	81.5	Confident	92.4	Very high	115 Å²	115	33 Å²	33	43%	0.434	17%	0.172	S	C	.	.	H	α-helix	trans	-58.5	-32.9	179.8	-176.9	167.3	72.7	164.8	-4.1	112.3	D176 E177 G182 R324	D176-R180 PolarHBondContact O-N 2.83Å; E177-R180 PolarHBondContact O-N 2.8Å; E177-R180 IonicContact OE1-CZ 3.61Å; E177-R180 IonicContact OE1-NE 3.93Å; E177-R180 PolarHBondContact OE1-NE 3.07Å; E177-R180 IonicContact OE1-NH1 2.72Å; E177-R180 IonicContact OE1-NH2 3.59Å; E177-R180 PolarHBondContact OE1-NH2 3.02Å; E177-R180 IonicContact OE2-CZ 3.9Å; E177-R180 IonicContact OE2-NE 2.7Å; E177-R180 PolarHBondContact OE2-NE 3.13Å; E177-R180 IonicContact OE2-NH2 3.81Å; E177-R180 PolarHBondContact OE2-NH2 3.37Å; R180-G182 VanDerWaalsContact C-N 3.32Å; R180-R324 VanDerWaalsContact NE-NH2 3.12Å
181	M	83.3	Confident	92.2	Very high	59 Å²	59	33.2 Å²	33.2	29%	0.291	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.9	177.5	-65.7	-177.3	77.7	0	0	114	P99 T100 E177 M178 L179 F183 V321 R324	P99-M181 HydrophobicContact CB-SD 3.86Å; T100-M181 HydrophobicContact CG2-CE 4.38Å; T100-M181 HydrophobicContact CG2-SD 4.1Å; E177-M181 VanDerWaalsContact O-CG 3.32Å; E177-M181 WeakPolarHBondContact O-CG 3.28Å; E177-M181 PolarHBondContact O-N 2.94Å; M178-M181 PolarHBondContact O-N 3.06Å; L179-M181 PolarHBondContact O-N 3.5Å; M181-F183 HydrophobicContact CB-CD2 3.62Å; M181-F183 HydrophobicContact CB-CE2 3.65Å; M181-F183 HydrophobicContact CB-CG 4.41Å; M181-F183 HydrophobicContact CB-CZ 4.45Å; M181-F183 HydrophobicContact CE-CE2 3.71Å; M181-F183 HydrophobicContact CE-CZ 4.28Å; M181-F183 HydrophobicContact CG-CE2 4.41Å; M181-F183 HydrophobicContact SD-CD2 4.42Å; M181-F183 HydrophobicContact SD-CE2 3.95Å; M181-V321 HydrophobicContact CE-CG1 4.37Å; M181-R324 VanDerWaalsContact CG-NH1 3.33Å; M181-R324 PolarHBondContact SD-NH1 3.3Å
182	G	86.1	Confident	92	Very high	54 Å²	54	36.5 Å²	36.5	56%	0.557	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	15.1	179.6	0	0	0	0	0	114.5	M178 L179 R180 I184	M178-G182 PolarHBondContact O-N 3.37Å; L179-G182 PolarHBondContact O-N 2.7Å; R180-G182 VanDerWaalsContact C-N 3.32Å; G182-I184 VanDerWaalsContact C-N 3.29Å; G182-I184 PolarHBondContact O-N 3.28Å
183	F	93.2	Very high	91.7	Very high	54 Å²	54	40.8 Å²	40.8	24%	0.237	22%	0.22	C	C	.	.			trans	-86	5.5	-179.6	-63.7	-46.9	0	0	0	114.2	P150 M178 M181 E185 D186 V187	P150-F183 HydrophobicContact CB-CB 3.99Å; P150-F183 HydrophobicContact CB-CG 4.32Å; P150-F183 HydrophobicContact CG-CB 3.92Å; P150-F183 HydrophobicContact CG-CD2 4.44Å; P150-F183 HydrophobicContact CG-CG 4.26Å; M178-F183 HydrophobicContact CB-CB 4.38Å; M178-F183 PolarHBondContact O-N 2.95Å; M181-F183 HydrophobicContact CB-CD2 3.62Å; M181-F183 HydrophobicContact CB-CE2 3.65Å; M181-F183 HydrophobicContact CB-CG 4.41Å; M181-F183 HydrophobicContact CB-CZ 4.45Å; M181-F183 HydrophobicContact CE-CE2 3.71Å; M181-F183 HydrophobicContact CE-CZ 4.28Å; M181-F183 HydrophobicContact CG-CE2 4.41Å; M181-F183 HydrophobicContact SD-CD2 4.42Å; M181-F183 HydrophobicContact SD-CE2 3.95Å; F183-E185 VanDerWaalsContact C-N 3.31Å; F183-E185 PolarHBondContact O-N 3.3Å; F183-D186 WeakPolarHBondContact O-CB 3.2Å; F183-D186 PolarHBondContact O-N 2.81Å; F183-V187 VanDerWaalsContact O-CG2 3.28Å; F183-V187 WeakPolarHBondContact O-CG2 3.19Å; F183-V187 PolarHBondContact O-N 2.7Å
184	I	93.4	Very high	91.7	Very high	22 Å²	22	41.3 Å²	41.3	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-38.8	-173.3	-159.1	72.5	0	0	0	112.7	L179 G182 V187 E188 A210 I211 I214	L179-I184 HydrophobicContact CB-CD1 4.26Å; L179-I184 HydrophobicContact CD1-CB 3.86Å; L179-I184 HydrophobicContact CD1-CD1 4.13Å; L179-I184 HydrophobicContact CD1-CG1 3.98Å; L179-I184 HydrophobicContact CD1-CG2 4.04Å; G182-I184 VanDerWaalsContact C-N 3.29Å; G182-I184 PolarHBondContact O-N 3.28Å; I184-V187 PolarHBondContact O-N 3.15Å; I184-E188 WeakPolarHBondContact O-CG 3.36Å; I184-E188 PolarHBondContact O-N 3Å; I184-A210 HydrophobicContact CG1-CB 4.43Å; I184-I211 HydrophobicContact CD1-CD1 3.73Å; I184-I214 HydrophobicContact CD1-CD1 3.24Å; I184-I214 HydrophobicContact CD1-CG1 4.31Å; I184-I214 HydrophobicContact CG1-CD1 3.97Å
185	E	93.3	Very high	91.6	Very high	142 Å²	142	42.1 Å²	42.1	66%	0.664	23%	0.231	S	C	*	.	H	α-helix	trans	-68.7	-38.8	178.1	-64.8	-180	-174.8	0	0	111.3	F183 E188 T189	F183-E185 VanDerWaalsContact C-N 3.31Å; F183-E185 PolarHBondContact O-N 3.3Å; E185-E188 PolarHBondContact O-N 3.43Å; E185-T189 WeakPolarHBondContact O-CB 3.21Å; E185-T189 PolarHBondContact O-N 3.31Å; E185-T189 PolarHBondContact O-OG1 2.97Å
186	D	96.4	Very high	91.4	Very high	44 Å²	44	51.3 Å²	51.3	24%	0.235	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-44	174.7	-70.6	-15.6	0	0	0	110.8	P150 L154 F183 T189 I190	P150-D186 HydrophobicContact CB-CB 3.87Å; L154-D186 HydrophobicContact CD2-CB 4.12Å; L154-D186 VanDerWaalsContact CD2-OD1 3.3Å; L154-D186 WeakPolarHBondContact CD2-OD1 3.4Å; F183-D186 WeakPolarHBondContact O-CB 3.2Å; F183-D186 PolarHBondContact O-N 2.81Å; D186-T189 PolarHBondContact O-N 3.44Å; D186-I190 VanDerWaalsContact O-CG1 3.27Å; D186-I190 WeakPolarHBondContact O-CG1 3.35Å; D186-I190 PolarHBondContact O-N 3.15Å
187	V	97.1	Very high	91.3	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-51.9	175.6	171.1	0	0	0	0	110.6	L97 P150 L172 M178 F183 I184 T189 I190 M191 I214	L97-V187 HydrophobicContact CD2-CB 4.38Å; L97-V187 HydrophobicContact CD2-CG1 4.28Å; L97-V187 HydrophobicContact CD2-CG2 3.91Å; P150-V187 HydrophobicContact CB-CG2 4.09Å; P150-V187 HydrophobicContact CG-CG2 3.82Å; L172-V187 HydrophobicContact CD2-CG1 3.51Å; L172-V187 HydrophobicContact CG-CG1 4.42Å; M178-V187 HydrophobicContact CB-CG2 4.47Å; M178-V187 HydrophobicContact CE-CG2 4.43Å; M178-V187 HydrophobicContact SD-CG2 3.74Å; F183-V187 VanDerWaalsContact O-CG2 3.28Å; F183-V187 WeakPolarHBondContact O-CG2 3.19Å; F183-V187 PolarHBondContact O-N 2.7Å; I184-V187 PolarHBondContact O-N 3.15Å; V187-T189 PolarHBondContact O-N 3.09Å; V187-I190 PolarHBondContact O-N 3.29Å; V187-M191 HydrophobicContact CG1-CG 4.36Å; V187-M191 HydrophobicContact CG1-SD 3.94Å; V187-M191 VanDerWaalsContact O-CG 3.29Å; V187-M191 WeakPolarHBondContact O-CG 3.22Å; V187-M191 PolarHBondContact O-N 2.97Å; V187-I214 HydrophobicContact CG1-CD1 4Å
188	E	95.3	Very high	91.7	Very high	37 Å²	37	54.4 Å²	54.4	17%	0.173	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-36.9	178.5	-71	-173.5	165.7	0	0	111.8	I184 E185 M191 A192 R213 I214 R217 F218	I184-E188 WeakPolarHBondContact O-CG 3.36Å; I184-E188 PolarHBondContact O-N 3Å; E185-E188 PolarHBondContact O-N 3.43Å; E188-M191 PolarHBondContact O-N 2.83Å; E188-A192 WeakPolarHBondContact O-CB 3.44Å; E188-A192 PolarHBondContact O-N 3.01Å; E188-R213 IonicContact OE1-NE 2.79Å; E188-R213 IonicContact OE1-NH2 3.83Å; E188-I214 HydrophobicContact CG-CD1 4.21Å; E188-I214 HydrophobicContact CG-CG1 4.16Å; E188-R217 IonicContact OE2-NH1 3.49Å; E188-F218 HydrophobicContact CB-CE2 4.4Å; E188-F218 HydrophobicContact CB-CZ 4.41Å; E188-F218 HydrophobicContact CG-CE2 4.1Å
189	T	96.3	Very high	92	Very high	61 Å²	61	55.2 Å²	55.2	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-69.9	-36.9	177.8	-55.9	0	0	0	0	112.6	L154 E185 D186 V187 Q193	L154-T189 HydrophobicContact CD1-CG2 3.6Å; L154-T189 HydrophobicContact CD2-CG2 4.34Å; E185-T189 WeakPolarHBondContact O-CB 3.21Å; E185-T189 PolarHBondContact O-N 3.31Å; E185-T189 PolarHBondContact O-OG1 2.97Å; D186-T189 PolarHBondContact O-N 3.44Å; V187-T189 PolarHBondContact O-N 3.09Å; T189-Q193 PolarHBondContact O-NE2 3.49Å; T189-Q193 VanDerWaalsContact O-NE2 3.16Å
190	I	97.3	Very high	92.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.1	-49.7	173	-69.3	162.5	0	0	0	109.4	L95 L97 P150 L153 L154 L157 D186 V187 A192 Q193 I194	L95-I190 HydrophobicContact CD2-CG2 3.99Å; L97-I190 HydrophobicContact CD2-CD1 3.88Å; L97-I190 HydrophobicContact CD2-CG2 4.37Å; P150-I190 HydrophobicContact CB-CD1 4.22Å; P150-I190 WeakPolarHBondContact O-CD1 3.47Å; L153-I190 HydrophobicContact CB-CD1 3.88Å; L154-I190 HydrophobicContact CB-CD1 4.31Å; L154-I190 HydrophobicContact CB-CG1 4.21Å; L154-I190 HydrophobicContact CD1-CG1 4.36Å; L157-I190 HydrophobicContact CD1-CB 4.34Å; L157-I190 HydrophobicContact CD1-CG1 3.88Å; L157-I190 HydrophobicContact CD1-CG2 4.18Å; D186-I190 VanDerWaalsContact O-CG1 3.27Å; D186-I190 WeakPolarHBondContact O-CG1 3.35Å; D186-I190 PolarHBondContact O-N 3.15Å; V187-I190 PolarHBondContact O-N 3.29Å; I190-A192 VanDerWaalsContact C-N 3.26Å; I190-A192 PolarHBondContact O-N 3.04Å; I190-Q193 PolarHBondContact O-N 3.34Å; I190-I194 HydrophobicContact CG2-CD1 4.38Å
191	M	95.5	Very high	93.2	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.02	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-35.6	-178.3	-67.3	-177.2	88.4	0	0	112.7	L170 L172 V187 E188 Q193 I194 T200 I214 F218	L170-M191 HydrophobicContact CD2-CE 3.63Å; L170-M191 HydrophobicContact CD2-CG 3.97Å; L172-M191 HydrophobicContact CD1-CE 4.06Å; L172-M191 HydrophobicContact CD1-SD 4.31Å; L172-M191 HydrophobicContact CD2-SD 4.04Å; V187-M191 HydrophobicContact CG1-CG 4.36Å; V187-M191 HydrophobicContact CG1-SD 3.94Å; V187-M191 VanDerWaalsContact O-CG 3.29Å; V187-M191 WeakPolarHBondContact O-CG 3.22Å; V187-M191 PolarHBondContact O-N 2.97Å; E188-M191 PolarHBondContact O-N 2.83Å; M191-Q193 PolarHBondContact O-N 3.2Å; M191-I194 PolarHBondContact O-N 3.11Å; M191-T200 HydrophobicContact CE-CG2 4.33Å; M191-I214 HydrophobicContact CE-CG2 4.18Å; M191-I214 HydrophobicContact SD-CG2 3.82Å; M191-F218 HydrophobicContact CB-CD1 3.72Å; M191-F218 HydrophobicContact CB-CD2 4.46Å; M191-F218 HydrophobicContact CB-CE1 3.68Å; M191-F218 HydrophobicContact CB-CE2 4.43Å; M191-F218 HydrophobicContact CB-CG 4.12Å; M191-F218 HydrophobicContact CB-CZ 4.05Å; M191-F218 HydrophobicContact CE-CB 3.29Å; M191-F218 HydrophobicContact CE-CD1 4.38Å; M191-F218 HydrophobicContact CE-CD2 4.15Å; M191-F218 HydrophobicContact CE-CG 3.73Å; M191-F218 HydrophobicContact SD-CB 4.2Å; M191-F218 HydrophobicContact SD-CD2 3.91Å; M191-F218 HydrophobicContact SD-CE2 4.39Å; M191-F218 HydrophobicContact SD-CG 3.99Å
192	A	93.3	Very high	93.9	Very high	69 Å²	69	44.7 Å²	44.7	57%	0.57	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.7	176.3	0	0	0	0	0	114.5	E188 I190	E188-A192 WeakPolarHBondContact O-CB 3.44Å; E188-A192 PolarHBondContact O-N 3.01Å; I190-A192 VanDerWaalsContact C-N 3.26Å; I190-A192 PolarHBondContact O-N 3.04Å
193	Q	92.3	Very high	94.3	Very high	91 Å²	91	42.1 Å²	42.1	43%	0.425	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-6	178	-70.8	176.4	69.2	0	0	113.3	T189 I190 M191	T189-Q193 PolarHBondContact O-NE2 3.49Å; T189-Q193 VanDerWaalsContact O-NE2 3.16Å; I190-Q193 PolarHBondContact O-N 3.34Å; M191-Q193 PolarHBondContact O-N 3.2Å
194	I	94	Very high	94.2	Very high	15 Å²	15	39.5 Å²	39.5	8%	0.077	22%	0.223	C	C	.	.	S	Bend	trans	-82.1	137.7	-177.9	-64	173	0	0	0	109.4	L95 L164 L167 L170 I190 M191 H198	L95-I194 HydrophobicContact CD2-CD1 4.39Å; L164-I194 HydrophobicContact CD1-CG1 4.07Å; L167-I194 HydrophobicContact CB-CG2 4.35Å; L167-I194 HydrophobicContact CD2-CB 4.4Å; L167-I194 HydrophobicContact CD2-CD1 3.68Å; L167-I194 HydrophobicContact CD2-CG1 3.88Å; L167-I194 HydrophobicContact CD2-CG2 3.59Å; L167-I194 HydrophobicContact CG-CG2 4.47Å; L170-I194 HydrophobicContact CB-CD1 4.48Å; L170-I194 HydrophobicContact CD1-CD1 3.7Å; L170-I194 HydrophobicContact CD2-CD1 3.64Å; L170-I194 HydrophobicContact CG-CD1 4.13Å; I190-I194 HydrophobicContact CG2-CD1 4.38Å; M191-I194 PolarHBondContact O-N 3.11Å; I194-H198 HydrophobicContact CG2-CB 4.01Å; I194-H198 VanDerWaalsContact CG2-ND1 3.3Å; I194-H198 WeakPolarHBondContact CG2-ND1 3.48Å
195	P	90	Very high	93.8	Very high	46 Å²	46	40.4 Å²	40.4	30%	0.299	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-54.5	147.6	177.8	-25.7	33.9	0	0	0	113.4	L164 H198	L164-P195 WeakPolarHBondContact O-CD 3.24Å; L164-P195 WeakPolarHBondContact O-CG 3.22Å; P195-H198 PolarHBondContact O-ND1 3.43Å
196	E	88.2	Confident	93.2	Very high	194 Å²	194	36.3 Å²	36.3	91%	0.907	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	142.7	169.9	-65.4	-172.7	177.4	0	0	110.9
197	G	86.9	Confident	92.9	Very high	59 Å²	59	35.4 Å²	35.4	61%	0.608	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.5	1.2	176.2	0	0	0	0	0	115.5
198	H	94.2	Very high	92.3	Very high	25 Å²	25	37.5 Å²	37.5	12%	0.116	23%	0.227	C	C	.	.			trans	-65.5	151.5	166.2	68	-82	0	0	0	111.6	S168 I194 P195 T200	S168-H198 CarbonylContact O-C 3.6Å; S168-H198 WeakPolarHBondContact O-CA 3.39Å; I194-H198 HydrophobicContact CG2-CB 4.01Å; I194-H198 VanDerWaalsContact CG2-ND1 3.3Å; I194-H198 WeakPolarHBondContact CG2-ND1 3.48Å; P195-H198 PolarHBondContact O-ND1 3.43Å; H198-T200 PolarHBondContact CD2-OG1 2.76Å; H198-T200 PolarHBondContact NE2-OG1 3.46Å
199	Q	96.5	Very high	92.1	Very high	18 Å²	18	40.9 Å²	40.9	8%	0.084	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	135.7	169.4	-177.7	-179.1	30.8	0	0	109.5	L57 G60 R61 D62 S168 G169 L170	L57-Q199 VanDerWaalsContact CA-NE2 3.34Å; L57-Q199 HydrophobicContact CD2-CG 4.47Å; L57-Q199 PolarHBondContact O-NE2 3.21Å; G60-Q199 VanDerWaalsContact CA-NE2 3.33Å; R61-Q199 PolarHBondContact O-NE2 2.94Å; D62-Q199 WeakPolarHBondContact OD1-CA 3.34Å; S168-Q199 PolarHBondContact O-N 3.05Å; G169-Q199 WeakPolarHBondContact CA-O 3.4Å; L170-Q199 PolarHBondContact N-O 3.18Å
200	T	97.5	Very high	91.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.5	178.8	-60.3	0	0	0	0	111.8	D62 V63 L170 L172 M191 H198 M219	D62-T200 CarbonylContact C-O 3.58Å; D62-T200 WeakPolarHBondContact CA-O 3.42Å; D62-T200 WeakPolarHBondContact CB-O 3.43Å; D62-T200 PolarHBondContact OD1-N 2.97Å; V63-T200 PolarHBondContact N-O 3.12Å; L170-T200 HydrophobicContact CD2-CG2 4.16Å; L170-T200 HydrophobicContact CG-CG2 4.45Å; L170-T200 CarbonylContact O-C 3.59Å; L170-T200 WeakPolarHBondContact O-CA 3.43Å; L172-T200 HydrophobicContact CD1-CG2 4.19Å; M191-T200 HydrophobicContact CE-CG2 4.33Å; H198-T200 PolarHBondContact CD2-OG1 2.76Å; H198-T200 PolarHBondContact NE2-OG1 3.46Å; T200-M219 HydrophobicContact CG2-CE 4.01Å; T200-M219 HydrophobicContact CG2-CG 3.89Å; T200-M219 HydrophobicContact CG2-SD 4.3Å; T200-M219 WeakPolarHBondContact O-CE 3.46Å
201	A	97.8	Very high	91.7	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.1	168.7	0	0	0	0	0	110.1	L57 V63 F77 L170 V171 L172 F203	L57-A201 HydrophobicContact CD1-CB 4.48Å; L57-A201 HydrophobicContact CD2-CB 3.91Å; V63-A201 CarbonylContact O-C 3.58Å; V63-A201 WeakPolarHBondContact O-CA 3.43Å; F77-A201 HydrophobicContact CB-CB 4.47Å; L170-A201 PolarHBondContact O-N 2.98Å; V171-A201 CarbonylContact C-O 3.34Å; V171-A201 VanDerWaalsContact CA-O 3.24Å; V171-A201 WeakPolarHBondContact CA-O 3.42Å; V171-A201 HydrophobicContact CG2-CB 4.34Å; L172-A201 PolarHBondContact N-O 2.72Å; A201-F203 HydrophobicContact CB-CD2 4.44Å; A201-F203 HydrophobicContact CB-CE2 3.73Å
202	L	97.7	Very high	91.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.5	176.9	-169.6	151.7	0	0	0	109.5	V63 L64 G65 L172 A175 I211 I214 T215 M219	V63-L202 PolarHBondContact O-N 2.81Å; L64-L202 CarbonylContact C-O 3.57Å; L64-L202 WeakPolarHBondContact CA-O 3.22Å; L64-L202 HydrophobicContact CD1-CB 4.09Å; L64-L202 HydrophobicContact CD1-CD2 3.42Å; L64-L202 VanDerWaalsContact CD1-CD2 3.42Å; L64-L202 HydrophobicContact CD1-CG 4.29Å; G65-L202 PolarHBondContact N-O 3.49Å; L172-L202 HydrophobicContact CB-CD1 4.35Å; L172-L202 HydrophobicContact CB-CG 4.06Å; L172-L202 HydrophobicContact CD2-CD1 4.04Å; A175-L202 HydrophobicContact CB-CD1 4.21Å; A175-L202 HydrophobicContact CB-CD2 3.86Å; A175-L202 HydrophobicContact CB-CG 4Å; L202-I211 HydrophobicContact CD1-CG2 4.04Å; L202-I211 HydrophobicContact CD2-CG2 3.82Å; L202-I214 HydrophobicContact CD1-CG2 4.08Å; L202-T215 HydrophobicContact CD1-CG2 3.98Å; L202-M219 HydrophobicContact CB-CE 4.02Å; L202-M219 HydrophobicContact CB-SD 3.96Å
203	F	95.2	Very high	91.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.3	176.2	-68.7	-91.9	0	0	0	111.2	I49 G65 K73 F77 V171 L172 E174 A175 A201	I49-F203 HydrophobicContact CG1-CE1 4.34Å; G65-F203 VanDerWaalsContact O-CA 3.32Å; G65-F203 WeakPolarHBondContact O-CA 3.49Å; K73-F203 HydrophobicContact CB-CD1 4.02Å; K73-F203 HydrophobicContact CB-CE1 4.35Å; K73-F203 HydrophobicContact CB-CG 4.48Å; K73-F203 HydrophobicContact CD-CB 3.93Å; K73-F203 HydrophobicContact CD-CD1 3.75Å; K73-F203 HydrophobicContact CD-CG 4.16Å; K73-F203 HydrophobicContact CG-CD1 3.9Å; K73-F203 HydrophobicContact CG-CE1 4.43Å; F77-F203 HydrophobicContact CB-CE2 3.59Å; F77-F203 HydrophobicContact CB-CZ 3.99Å; F77-F203 AromaticContact CD1-CD2 3.9Å; F77-F203 HydrophobicContact CD1-CD2 3.9Å; F77-F203 AromaticContact CD1-CE2 3.69Å; F77-F203 HydrophobicContact CD1-CE2 3.69Å; F77-F203 HydrophobicContact CD1-CZ 4.26Å; F77-F203 HydrophobicContact CG-CE2 4.08Å; V171-F203 HydrophobicContact CG1-CD2 4.29Å; L172-F203 PolarHBondContact O-N 3.14Å; E174-F203 PolarHBondContact N-O 3.11Å; A175-F203 PolarHBondContact N-O 3.1Å; A175-F203 VanDerWaalsContact N-O 3.11Å; A201-F203 HydrophobicContact CB-CD2 4.44Å; A201-F203 HydrophobicContact CB-CE2 3.73Å
204	S	90.9	Very high	91.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	144	-175.3	-163.6	0	0	0	0	110.3	G65 M66 D176 T206	G65-S204 PolarHBondContact O-N 3.05Å; M66-S204 WeakPolarHBondContact CA-O 3.34Å; D176-S204 VanDerWaalsContact CB-OG 3.29Å; D176-S204 WeakPolarHBondContact CB-OG 3.15Å; D176-S204 PolarHBondContact N-OG 2.69Å; D176-S204 PolarHBondContact OD1-OG 2.69Å; D176-S204 PolarHBondContact OD2-OG 3.11Å; S204-T206 VanDerWaalsContact CB-O 3.29Å; S204-T206 WeakPolarHBondContact CB-O 3.46Å; S204-T206 PolarHBondContact OG-O 2.87Å
205	A	83.7	Confident	91.7	Very high	41 Å²	41	40.4 Å²	40.4	34%	0.339	22%	0.219	S	C	.	.	S	Bend	trans	-77.7	-33.5	174.9	0	0	0	0	0	110.8	D176 E344	D176-A205 PolarHBondContact OD2-N 3.45Å; D176-A205 VanDerWaalsContact OD2-N 3.14Å; A205-E344 VanDerWaalsContact CB-OE1 3.25Å; A205-E344 WeakPolarHBondContact CB-OE1 3.12Å
206	T	81.8	Confident	91.9	Very high	56 Å²	56	45.4 Å²	45.4	34%	0.344	23%	0.232	S	C	.	.			trans	-123.5	162.4	-180	68.2	0	0	0	0	111.7	D176 S204 P208	D176-T206 WeakPolarHBondContact CB-OG1 2.88Å; D176-T206 PolarHBondContact OD2-N 3Å; D176-T206 PolarHBondContact OD2-OG1 3.28Å; S204-T206 VanDerWaalsContact CB-O 3.29Å; S204-T206 WeakPolarHBondContact CB-O 3.46Å; S204-T206 PolarHBondContact OG-O 2.87Å; T206-P208 VanDerWaalsContact C-CD 3.44Å; T206-P208 WeakPolarHBondContact O-CD 3.47Å
207	M	89.3	Confident	92.1	Very high	25 Å²	25	43.6 Å²	43.6	12%	0.123	22%	0.217	C	C	.	.			trans	-127.5	68.4	179.9	-73.4	-61.6	-62.7	0	0	111.5	L64 M66 I211 R212 T215	L64-M207 HydrophobicContact CD1-CE 4.11Å; L64-M207 HydrophobicContact CD1-SD 3.86Å; L64-M207 HydrophobicContact CD2-CE 3.77Å; L64-M207 HydrophobicContact CD2-SD 4.25Å; M66-M207 HydrophobicContact CG-CG 4.05Å; M66-M207 HydrophobicContact SD-CG 3.73Å; M207-I211 HydrophobicContact CE-CB 4.43Å; M207-I211 HydrophobicContact CE-CG2 3.79Å; M207-I211 HydrophobicContact SD-CB 4.49Å; M207-I211 HydrophobicContact SD-CG2 3.68Å; M207-R212 HydrophobicContact CB-CG 4.37Å; M207-R212 HydrophobicContact CE-CG 3.84Å; M207-R212 PolarHBondContact O-NE 2.85Å; M207-T215 HydrophobicContact CE-CG2 3.97Å
208	P	85	Confident	92.4	Very high	45 Å²	45	42.6 Å²	42.6	29%	0.292	20%	0.196	S	C	.	.			trans	-66.5	161.6	172.5	29.5	-33.7	0	0	0	110.8	L179 T206 A210 I211 R212	L179-P208 HydrophobicContact CD2-CB 4Å; L179-P208 HydrophobicContact CD2-CG 3.51Å; T206-P208 VanDerWaalsContact C-CD 3.44Å; T206-P208 WeakPolarHBondContact O-CD 3.47Å; P208-A210 PolarHBondContact O-N 2.95Å; P208-A210 VanDerWaalsContact O-N 3.14Å; P208-I211 HydrophobicContact CG-CB 4.37Å; P208-I211 HydrophobicContact CG-CG1 3.83Å; P208-I211 PolarHBondContact O-N 3.34Å; P208-R212 PolarHBondContact O-N 3.1Å; P208-R212 VanDerWaalsContact O-N 3.08Å
209	E	90.6	Very high	92.4	Very high	108 Å²	108	42.1 Å²	42.1	51%	0.505	19%	0.194	S	C	.	.	H	α-helix	trans	-59.7	-32.3	-169.8	-173.4	54.1	-151.3	0	0	113.7	I211 R212 R213 R216	E209-I211 PolarHBondContact O-N 2.9Å; E209-R212 PolarHBondContact O-N 3Å; E209-R213 WeakPolarHBondContact O-CB 3.35Å; E209-R213 PolarHBondContact O-N 3.46Å; E209-R216 IonicContact OE1-CZ 3.48Å; E209-R216 IonicContact OE1-NH1 3.31Å; E209-R216 PolarHBondContact OE1-NH1 3.43Å; E209-R216 IonicContact OE1-NH2 2.7Å; E209-R216 PolarHBondContact OE1-NH2 3.24Å
210	A	91.6	Very high	92.3	Very high	14 Å²	14	47.8 Å²	47.8	12%	0.116	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-39.3	175.6	0	0	0	0	0	112.6	L179 I184 P208 R213 I214	L179-A210 HydrophobicContact CD1-CB 3.67Å; L179-A210 HydrophobicContact CD2-CB 3.83Å; L179-A210 HydrophobicContact CG-CB 4.39Å; I184-A210 HydrophobicContact CG1-CB 4.43Å; P208-A210 PolarHBondContact O-N 2.95Å; P208-A210 VanDerWaalsContact O-N 3.14Å; A210-R213 PolarHBondContact O-N 3.43Å; A210-I214 PolarHBondContact O-N 3.12Å; A210-I214 VanDerWaalsContact O-N 3.11Å
211	I	93.2	Very high	92.1	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-71.1	-39.6	175.7	-57.8	-55.9	0	0	0	110.5	A175 L179 I184 L202 M207 P208 E209 R213 I214 T215	A175-I211 HydrophobicContact CB-CD1 3.88Å; A175-I211 HydrophobicContact CB-CG2 4.31Å; A175-I211 VanDerWaalsContact O-CD1 3.28Å; A175-I211 WeakPolarHBondContact O-CD1 3.15Å; L179-I211 HydrophobicContact CB-CD1 4.21Å; L179-I211 HydrophobicContact CD2-CG1 4.44Å; I184-I211 HydrophobicContact CD1-CD1 3.73Å; L202-I211 HydrophobicContact CD1-CG2 4.04Å; L202-I211 HydrophobicContact CD2-CG2 3.82Å; M207-I211 HydrophobicContact CE-CB 4.43Å; M207-I211 HydrophobicContact CE-CG2 3.79Å; M207-I211 HydrophobicContact SD-CB 4.49Å; M207-I211 HydrophobicContact SD-CG2 3.68Å; P208-I211 HydrophobicContact CG-CB 4.37Å; P208-I211 HydrophobicContact CG-CG1 3.83Å; P208-I211 PolarHBondContact O-N 3.34Å; E209-I211 PolarHBondContact O-N 2.9Å; I211-R213 PolarHBondContact O-N 3.04Å; I211-I214 WeakPolarHBondContact O-CB 3.42Å; I211-I214 PolarHBondContact O-N 3.44Å; I211-I214 VanDerWaalsContact O-N 3.11Å; I211-T215 WeakPolarHBondContact O-CG2 3.36Å; I211-T215 PolarHBondContact O-N 3.1Å
212	R	94.2	Very high	92	Very high	92 Å²	92	58.3 Å²	58.3	35%	0.347	27%	0.27	S	S	.	.	H	α-helix	trans	-60.4	-34.4	172.7	-64.7	-178.4	-177.6	-82.2	-1.9	112.7	M207 P208 E209 T215 R216	M207-R212 HydrophobicContact CB-CG 4.37Å; M207-R212 HydrophobicContact CE-CG 3.84Å; M207-R212 PolarHBondContact O-NE 2.85Å; P208-R212 PolarHBondContact O-N 3.1Å; P208-R212 VanDerWaalsContact O-N 3.08Å; E209-R212 PolarHBondContact O-N 3Å; R212-T215 PolarHBondContact O-OG1 3.32Å; R212-R216 WeakPolarHBondContact O-CG 3.22Å; R212-R216 PolarHBondContact O-N 3.38Å; R212-R216 VanDerWaalsContact O-N 3.09Å
213	R	93.8	Very high	92	Very high	106 Å²	106	61.4 Å²	61.4	40%	0.4	28%	0.284	S	S	.	.	H	α-helix	trans	-68.2	-41	174.5	-178.3	178.9	57.9	-111.4	-0.7	111.3	E188 E209 A210 I211 R216 R217	E188-R213 IonicContact OE1-NE 2.79Å; E188-R213 IonicContact OE1-NH2 3.83Å; E209-R213 WeakPolarHBondContact O-CB 3.35Å; E209-R213 PolarHBondContact O-N 3.46Å; A210-R213 PolarHBondContact O-N 3.43Å; I211-R213 PolarHBondContact O-N 3.04Å; R213-R216 PolarHBondContact O-N 3.28Å; R213-R217 VanDerWaalsContact O-CB 3.27Å; R213-R217 WeakPolarHBondContact O-CB 3.42Å; R213-R217 PolarHBondContact O-N 2.75Å
214	I	93.1	Very high	92	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-49.1	174	-73.1	-176	0	0	0	110.5	L172 I184 V187 E188 M191 L202 A210 I211 R216 R217 F218	L172-I214 HydrophobicContact CD2-CG2 4.26Å; I184-I214 HydrophobicContact CD1-CD1 3.24Å; I184-I214 HydrophobicContact CD1-CG1 4.31Å; I184-I214 HydrophobicContact CG1-CD1 3.97Å; V187-I214 HydrophobicContact CG1-CD1 4Å; E188-I214 HydrophobicContact CG-CD1 4.21Å; E188-I214 HydrophobicContact CG-CG1 4.16Å; M191-I214 HydrophobicContact CE-CG2 4.18Å; M191-I214 HydrophobicContact SD-CG2 3.82Å; L202-I214 HydrophobicContact CD1-CG2 4.08Å; A210-I214 PolarHBondContact O-N 3.12Å; A210-I214 VanDerWaalsContact O-N 3.11Å; I211-I214 WeakPolarHBondContact O-CB 3.42Å; I211-I214 PolarHBondContact O-N 3.44Å; I211-I214 VanDerWaalsContact O-N 3.11Å; I214-R216 PolarHBondContact O-N 3.25Å; I214-R217 PolarHBondContact O-N 3.48Å; I214-F218 HydrophobicContact CG2-CD2 4.21Å; I214-F218 PolarHBondContact O-N 2.89Å
215	T	93.8	Very high	92.1	Very high	15 Å²	15	65.8 Å²	65.8	9%	0.092	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-45.8	-179.8	62.6	0	0	0	0	111.6	L64 L202 M207 I211 R212 R217 M219	L64-T215 HydrophobicContact CD1-CG2 4.07Å; L64-T215 HydrophobicContact CD2-CG2 4.24Å; L202-T215 HydrophobicContact CD1-CG2 3.98Å; M207-T215 HydrophobicContact CE-CG2 3.97Å; I211-T215 WeakPolarHBondContact O-CG2 3.36Å; I211-T215 PolarHBondContact O-N 3.1Å; R212-T215 PolarHBondContact O-OG1 3.32Å; T215-R217 VanDerWaalsContact C-N 3.3Å; T215-R217 PolarHBondContact O-N 3.3Å; T215-M219 HydrophobicContact CG2-SD 3.68Å; T215-M219 VanDerWaalsContact O-CB 3.3Å; T215-M219 WeakPolarHBondContact O-CB 3.2Å; T215-M219 PolarHBondContact O-N 2.88Å; T215-M219 VanDerWaalsContact O-N 3.07Å
216	R	93.9	Very high	92.4	Very high	152 Å²	152	71.1 Å²	71.1	57%	0.574	32%	0.316	S	S	*	.	H	α-helix	trans	-64.7	-30.7	178.4	-71.5	-173.8	-55.2	-106.4	1.8	114	E209 R212 R213 I214	E209-R216 IonicContact OE1-CZ 3.48Å; E209-R216 IonicContact OE1-NH1 3.31Å; E209-R216 PolarHBondContact OE1-NH1 3.43Å; E209-R216 IonicContact OE1-NH2 2.7Å; E209-R216 PolarHBondContact OE1-NH2 3.24Å; R212-R216 WeakPolarHBondContact O-CG 3.22Å; R212-R216 PolarHBondContact O-N 3.38Å; R212-R216 VanDerWaalsContact O-N 3.09Å; R213-R216 PolarHBondContact O-N 3.28Å; I214-R216 PolarHBondContact O-N 3.25Å
217	R	92.8	Very high	92.3	Very high	156 Å²	156	70.5 Å²	70.5	59%	0.589	31%	0.311	S	S	*	.	H	α-helix	trans	-88.5	-36.3	-174.3	-178.2	174.9	174.9	-166.2	-0.8	112.8	E188 R213 I214 T215	E188-R217 IonicContact OE2-NH1 3.49Å; R213-R217 VanDerWaalsContact O-CB 3.27Å; R213-R217 WeakPolarHBondContact O-CB 3.42Å; R213-R217 PolarHBondContact O-N 2.75Å; I214-R217 PolarHBondContact O-N 3.48Å; T215-R217 VanDerWaalsContact C-N 3.3Å; T215-R217 PolarHBondContact O-N 3.3Å
218	F	93.2	Very high	91.2	Very high	37 Å²	37	77.6 Å²	77.6	16%	0.162	34%	0.343	C	S	.	.	H	α-helix	trans	-118.1	-9.4	-167.8	-63.8	-78.5	0	0	0	114.6	E188 M191 I214	E188-F218 HydrophobicContact CB-CE2 4.4Å; E188-F218 HydrophobicContact CB-CZ 4.41Å; E188-F218 HydrophobicContact CG-CE2 4.1Å; M191-F218 HydrophobicContact CB-CD1 3.72Å; M191-F218 HydrophobicContact CB-CD2 4.46Å; M191-F218 HydrophobicContact CB-CE1 3.68Å; M191-F218 HydrophobicContact CB-CE2 4.43Å; M191-F218 HydrophobicContact CB-CG 4.12Å; M191-F218 HydrophobicContact CB-CZ 4.05Å; M191-F218 HydrophobicContact CE-CB 3.29Å; M191-F218 HydrophobicContact CE-CD1 4.38Å; M191-F218 HydrophobicContact CE-CD2 4.15Å; M191-F218 HydrophobicContact CE-CG 3.73Å; M191-F218 HydrophobicContact SD-CB 4.2Å; M191-F218 HydrophobicContact SD-CD2 3.91Å; M191-F218 HydrophobicContact SD-CE2 4.39Å; M191-F218 HydrophobicContact SD-CG 3.99Å; I214-F218 HydrophobicContact CG2-CD2 4.21Å; I214-F218 PolarHBondContact O-N 2.89Å
219	M	94.9	Very high	89.6	Confident	15 Å²	15	78.6 Å²	78.6	7%	0.074	35%	0.351	C	S	.	.			trans	-110.6	148.1	179.2	-54.2	175.9	79.8	0	0	111.7	D62 V63 T200 L202 T215 P222	D62-M219 HydrophobicContact CB-CB 4.38Å; D62-M219 HydrophobicContact CB-CE 4.09Å; D62-M219 WeakPolarHBondContact OD2-CA 3.23Å; D62-M219 WeakPolarHBondContact OD2-CB 3.38Å; V63-M219 WeakPolarHBondContact O-CE 3.42Å; T200-M219 HydrophobicContact CG2-CE 4.01Å; T200-M219 HydrophobicContact CG2-CG 3.89Å; T200-M219 HydrophobicContact CG2-SD 4.3Å; T200-M219 WeakPolarHBondContact O-CE 3.46Å; L202-M219 HydrophobicContact CB-CE 4.02Å; L202-M219 HydrophobicContact CB-SD 3.96Å; T215-M219 HydrophobicContact CG2-SD 3.68Å; T215-M219 VanDerWaalsContact O-CB 3.3Å; T215-M219 WeakPolarHBondContact O-CB 3.2Å; T215-M219 PolarHBondContact O-N 2.88Å; T215-M219 VanDerWaalsContact O-N 3.07Å; M219-P222 HydrophobicContact CB-CB 4.21Å; M219-P222 HydrophobicContact CB-CG 4.03Å; M219-P222 HydrophobicContact CE-CB 3.66Å; M219-P222 HydrophobicContact CE-CG 4.37Å; M219-P222 HydrophobicContact SD-CB 4.28Å; M219-P222 HydrophobicContact SD-CG 4.36Å
220	K	93.7	Very high	87.4	Confident	138 Å²	138	76.6 Å²	76.6	60%	0.6	35%	0.35	S	S	*	.	S	Bend	trans	-103.6	102.4	-179.3	-63.7	177.4	-176.6	177.1	0	110.3	D62 P222	D62-K220 PolarHBondContact OD2-N 2.99Å; K220-P222 VanDerWaalsContact C-N 3.35Å
221	E	93.7	Very high	85.1	Confident	189 Å²	189	79.9 Å²	79.9	88%	0.883	37%	0.368	S	S	*	.	S	Bend	trans	42.2	56.3	178.6	-61.2	-172.7	138.4	0	0	112.8	Q223	E221-Q223 PolarHBondContact O-N 3.48Å
222	P	96.4	Very high	82.5	Confident	33 Å²	33	86 Å²	86	21%	0.214	41%	0.405	C	S	.	.			trans	-62.8	135.7	-170.9	27	-35.2	0	0	0	110.8	D62 L64 M219 K220 E224	D62-P222 HydrophobicContact CB-CB 3.95Å; D62-P222 CarbonylContact O-C 3.57Å; D62-P222 WeakPolarHBondContact O-CA 3.2Å; L64-P222 HydrophobicContact CB-CB 4.32Å; M219-P222 HydrophobicContact CB-CB 4.21Å; M219-P222 HydrophobicContact CB-CG 4.03Å; M219-P222 HydrophobicContact CE-CB 3.66Å; M219-P222 HydrophobicContact CE-CG 4.37Å; M219-P222 HydrophobicContact SD-CB 4.28Å; M219-P222 HydrophobicContact SD-CG 4.36Å; K220-P222 VanDerWaalsContact C-N 3.35Å; P222-E224 PolarHBondContact O-N 3.17Å; P222-E224 VanDerWaalsContact O-N 3.16Å
223	Q	97.1	Very high	80	Confident	65 Å²	65	87.3 Å²	87.3	30%	0.304	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	114.8	170.4	177.1	63.4	55.8	0	0	109	H56 D62 V63 L64 E221 V225	H56-Q223 HydrophobicContact CB-CB 4.38Å; H56-Q223 HydrophobicContact CB-CG 4.37Å; H56-Q223 VanDerWaalsContact CD2-CG 3.49Å; H56-Q223 WeakPolarHBondContact CD2-CG 3.42Å; D62-Q223 PolarHBondContact O-N 3.11Å; V63-Q223 WeakPolarHBondContact CA-O 3.46Å; V63-Q223 HydrophobicContact CG2-CB 4.39Å; L64-Q223 PolarHBondContact N-O 3.35Å; E221-Q223 PolarHBondContact O-N 3.48Å; Q223-V225 HydrophobicContact CG-CG2 4.21Å
224	E	95.5	Very high	78.1	Confident	86 Å²	86	86 Å²	86	40%	0.402	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	124.2	172.8	-61.7	-159.4	-175.4	0	0	109.9	L64 M66 P222 R226	L64-E224 HydrophobicContact CB-CG 4.37Å; L64-E224 HydrophobicContact CD2-CG 4.05Å; L64-E224 WeakPolarHBondContact O-CA 3.38Å; M66-E224 HydrophobicContact CE-CB 4.14Å; M66-E224 HydrophobicContact CE-CG 4.38Å; P222-E224 PolarHBondContact O-N 3.17Å; P222-E224 VanDerWaalsContact O-N 3.16Å; E224-R226 IonicContact OE2-CZ 2.72Å; E224-R226 IonicContact OE2-NE 3.58Å; E224-R226 PolarHBondContact OE2-NE 2.88Å; E224-R226 IonicContact OE2-NH2 3.57Å; E224-R226 PolarHBondContact OE2-NH2 3.37Å
225	V	93.1	Very high	76.3	Confident	6 Å²	6	88.7 Å²	88.7	4%	0.036	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.6	171.5	178.1	0	0	0	0	107.6	I49 E52 V63 L64 M66 Q223 I227	I49-V225 HydrophobicContact CD1-CB 4.48Å; I49-V225 HydrophobicContact CD1-CG1 3.8Å; E52-V225 HydrophobicContact CB-CG1 3.48Å; E52-V225 VanDerWaalsContact CB-CG1 3.48Å; E52-V225 HydrophobicContact CB-CG2 4.26Å; E52-V225 HydrophobicContact CG-CG1 4.21Å; V63-V225 HydrophobicContact CG1-CG2 4.45Å; L64-V225 PolarHBondContact O-N 2.9Å; M66-V225 PolarHBondContact N-O 3.13Å; Q223-V225 HydrophobicContact CG-CG2 4.21Å; V225-I227 HydrophobicContact CG1-CD1 4.02Å; V225-I227 HydrophobicContact CG1-CG1 4.23Å
226	R	89.8	Confident	75.3	Confident	153 Å²	153	93.7 Å²	93.7	58%	0.577	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	101.9	179.1	-65.2	-174.5	-172.8	179.7	2.9	109.3	M66 E224 Q228	M66-R226 HydrophobicContact CB-CG 4.16Å; M66-R226 HydrophobicContact CE-CG 3.36Å; M66-R226 VanDerWaalsContact CE-NE 3.35Å; M66-R226 HydrophobicContact SD-CG 3.82Å; E224-R226 IonicContact OE2-CZ 2.72Å; E224-R226 IonicContact OE2-NE 3.58Å; E224-R226 PolarHBondContact OE2-NE 2.88Å; E224-R226 IonicContact OE2-NH2 3.57Å; E224-R226 PolarHBondContact OE2-NH2 3.37Å; R226-Q228 PolarHBondContact O-N 3.45Å
227	I	80.2	Confident	75.1	Confident	44 Å²	44	87.3 Å²	87.3	23%	0.226	44%	0.44	C	S	.	.			trans	-87.2	102	171.2	-55.9	-54.9	0	0	0	106.9	P48 I49 E52 M66 A67 V225 S229	P48-I227 HydrophobicContact CB-CD1 3.99Å; P48-I227 HydrophobicContact CB-CG2 4.16Å; I49-I227 HydrophobicContact CB-CG1 3.82Å; I49-I227 HydrophobicContact CD1-CG1 3.62Å; I49-I227 HydrophobicContact CG1-CG1 4.3Å; E52-I227 HydrophobicContact CG-CD1 4.1Å; M66-I227 PolarHBondContact O-N 2.87Å; A67-I227 HydrophobicContact CB-CB 4.2Å; V225-I227 HydrophobicContact CG1-CD1 4.02Å; V225-I227 HydrophobicContact CG1-CG1 4.23Å; I227-S229 PolarHBondContact O-N 2.72Å
228	Q	65.4	Low	75.1	Confident	173 Å²	173	83.2 Å²	83.2	81%	0.808	44%	0.436	S	S	*	.			trans	-58.2	135.9	167.1	-68.6	-170.4	-5.3	0	0	107.6	R226 S230	R226-Q228 PolarHBondContact O-N 3.45Å; Q228-S230 PolarHBondContact O-N 2.9Å
229	S	52.8	Low	75.1	Confident	66 Å²	66	82.4 Å²	82.4	46%	0.462	43%	0.432	S	S	.	.			trans	-58.3	96	167.7	58	0	0	0	0	107.3	I227 V231	I227-S229 PolarHBondContact O-N 2.72Å; S229-V231 PolarHBondContact O-N 3.35Å; S229-V231 VanDerWaalsContact O-N 3.09Å
230	S	43.6	Very low	75.2	Confident	67 Å²	67	82.6 Å²	82.6	47%	0.469	44%	0.435	S	S	.	.			trans	-60.5	118.1	157.9	56.9	0	0	0	0	103.7	Q228 T232	Q228-S230 PolarHBondContact O-N 2.9Å; S230-T232 PolarHBondContact O-N 2.83Å
231	V	43.9	Very low	75.4	Confident	82 Å²	82	77.1 Å²	77.1	50%	0.497	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-55.2	-13.3	178.2	170.8	0	0	0	0	111.3	S229 R234	S229-V231 PolarHBondContact O-N 3.35Å; S229-V231 VanDerWaalsContact O-N 3.09Å; V231-R234 VanDerWaalsContact CG1-NH2 3.33Å
232	T	38.2	Very low	75.6	Confident	129 Å²	129	68.8 Å²	68.8	79%	0.791	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-72.4	-28.7	-169.7	-27.2	0	0	0	0	115.1	S230 R234	S230-T232 PolarHBondContact O-N 2.83Å; T232-R234 VanDerWaalsContact C-N 3.3Å; T232-R234 PolarHBondContact O-N 2.96Å
233	T	42.3	Very low	75.6	Confident	121 Å²	121	68.1 Å²	68.1	74%	0.742	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-97.5	36.3	176.3	5.3	0	0	0	0	112	P235	T233-P235 WeakPolarHBondContact O-CD 3.27Å
234	R	53	Low	75.4	Confident	77 Å²	77	66.3 Å²	66.3	29%	0.291	36%	0.36	S	S	.	.			trans	-64.9	126.3	173.1	-142.7	179.1	-78.7	-131.8	7.4	107.1	V231 T232 D236 M381	V231-R234 VanDerWaalsContact CG1-NH2 3.33Å; T232-R234 VanDerWaalsContact C-N 3.3Å; T232-R234 PolarHBondContact O-N 2.96Å; R234-D236 PolarHBondContact O-N 3.1Å; R234-M381 PolarHBondContact NH2-O 3.4Å
235	P	55	Low	75	Confident	59 Å²	59	72.8 Å²	72.8	38%	0.383	38%	0.381	S	S	.	.			trans	-53.9	142.6	167.9	-6.7	15.9	0	0	0	107.7	T233 I237 G354	T233-P235 WeakPolarHBondContact O-CD 3.27Å; P235-I237 HydrophobicContact CB-CD1 3.85Å; P235-I237 HydrophobicContact CB-CG1 3.95Å; P235-I237 HydrophobicContact CG-CD1 3.98Å; P235-I237 PolarHBondContact O-N 3.27Å; P235-G354 WeakPolarHBondContact CB-O 3.19Å
236	D	73.8	Confident	74.5	Confident	119 Å²	119	76.3 Å²	76.3	64%	0.636	42%	0.419	S	S	*	.			trans	-66.5	78.9	-178.4	-176.9	20.1	0	0	0	109.8	R234 A359 G360	R234-D236 PolarHBondContact O-N 3.1Å; D236-A359 CarbonylContact O-C 3.47Å; D236-A359 WeakPolarHBondContact O-CA 3.14Å; D236-G360 PolarHBondContact O-N 2.92Å
237	I	88.9	Confident	74.4	Confident	18 Å²	18	71 Å²	71	9%	0.092	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	107.4	-175.8	-56.6	167.3	0	0	0	108.3	P235 Q239 I350 T353 G360 A362	P235-I237 HydrophobicContact CB-CD1 3.85Å; P235-I237 HydrophobicContact CB-CG1 3.95Å; P235-I237 HydrophobicContact CG-CD1 3.98Å; P235-I237 PolarHBondContact O-N 3.27Å; I237-Q239 HydrophobicContact CG2-CG 4.05Å; I237-Q239 PolarHBondContact O-N 2.89Å; I237-I350 HydrophobicContact CD1-CB 4.41Å; I237-I350 HydrophobicContact CD1-CD1 4.49Å; I237-I350 HydrophobicContact CD1-CG1 4.3Å; I237-I350 WeakPolarHBondContact CD1-O 3.34Å; I237-T353 HydrophobicContact CD1-CG2 4.31Å; I237-T353 HydrophobicContact CG1-CG2 4.22Å; I237-T353 HydrophobicContact CG2-CG2 4.09Å; I237-G360 CarbonylContact C-O 3.59Å; I237-G360 VanDerWaalsContact CA-O 3.29Å; I237-G360 WeakPolarHBondContact CA-O 3.38Å; I237-A362 HydrophobicContact CG2-CB 3.81Å
238	S	92.2	Very high	74.9	Confident	71 Å²	71	78 Å²	78	50%	0.497	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	116.7	169	-177.5	0	0	0	0	109.3	G360 R361 A362	S238-G360 PolarHBondContact N-O 2.93Å; S238-R361 CarbonylContact O-C 3.52Å; S238-R361 WeakPolarHBondContact O-CA 3.23Å; S238-A362 PolarHBondContact O-N 2.83Å
239	Q	94.6	Very high	76.3	Confident	20 Å²	20	70.6 Å²	70.6	9%	0.093	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.4	-176.8	-70.6	169.2	74.1	0	0	110.3	I237 Y346 I350 A362 I385 P386	I237-Q239 HydrophobicContact CG2-CG 4.05Å; I237-Q239 PolarHBondContact O-N 2.89Å; Q239-Y346 VanDerWaalsContact OE1-CE1 3.28Å; Q239-Y346 PolarHBondContact OE1-OH 3.48Å; Q239-I350 HydrophobicContact CG-CD1 4.47Å; Q239-A362 CarbonylContact C-O 3.5Å; Q239-A362 WeakPolarHBondContact CA-O 3.24Å; Q239-A362 HydrophobicContact CG-CB 4.09Å; Q239-I385 HydrophobicContact CB-CG2 4.23Å; Q239-P386 WeakPolarHBondContact O-CD 3.18Å; Q239-P386 WeakPolarHBondContact O-CG 3.42Å
240	S	96.8	Very high	78.4	Confident	18 Å²	18	69.9 Å²	69.9	13%	0.126	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	159.3	173.1	54.4	0	0	0	0	110.5	A362 L363 L364 I385 P386	S240-A362 PolarHBondContact N-O 2.82Å; S240-L363 CarbonylContact O-C 3.6Å; S240-L363 WeakPolarHBondContact O-CA 3.35Å; S240-L363 WeakPolarHBondContact OG-CD1 3.37Å; S240-L364 PolarHBondContact O-N 3.12Å; S240-I385 VanDerWaalsContact C-CG2 3.46Å; S240-P386 CarbonylContact C-O 3.51Å; S240-P386 VanDerWaalsContact CA-O 3.3Å; S240-P386 WeakPolarHBondContact CA-O 3.46Å
241	Y	97.7	Very high	80.8	Confident	23 Å²	23	71.4 Å²	71.4	9%	0.09	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	149.2	170.7	83.9	-87.5	0	0	0	111.6	L364 V366 L374 I385 P386 E387 V388	Y241-L364 CarbonylContact C-O 3.58Å; Y241-L364 WeakPolarHBondContact CA-O 3.32Å; Y241-L364 WeakPolarHBondContact CB-O 3.45Å; Y241-V366 HydrophobicContact CD2-CB 4.2Å; Y241-V366 HydrophobicContact CD2-CG2 3.8Å; Y241-V366 HydrophobicContact CG-CG2 4.27Å; Y241-L374 HydrophobicContact CD1-CD1 4.41Å; Y241-L374 HydrophobicContact CD1-CD2 4.07Å; Y241-L374 HydrophobicContact CD2-CD2 3.89Å; Y241-L374 HydrophobicContact CE1-CD2 3.9Å; Y241-L374 HydrophobicContact CE2-CD2 3.7Å; Y241-L374 HydrophobicContact CG-CD1 4.4Å; Y241-L374 HydrophobicContact CG-CD2 4.06Å; Y241-I385 HydrophobicContact CD1-CB 4.23Å; Y241-I385 HydrophobicContact CD1-CG2 4Å; Y241-I385 WeakPolarHBondContact CD1-O 3.27Å; Y241-I385 WeakPolarHBondContact CE1-O 3.46Å; Y241-P386 WeakPolarHBondContact CD1-O 3.48Å; Y241-P386 PolarHBondContact N-O 3.34Å; Y241-E387 HydrophobicContact CD1-CB 4.24Å; Y241-E387 HydrophobicContact CD2-CG 4.34Å; Y241-E387 HydrophobicContact CE1-CB 3.56Å; Y241-E387 HydrophobicContact CE1-CG 4.15Å; Y241-E387 HydrophobicContact CE2-CB 4.11Å; Y241-E387 HydrophobicContact CE2-CG 3.75Å; Y241-E387 VanDerWaalsContact CZ-CB 3.5Å; Y241-E387 CarbonylContact O-C 3.58Å; Y241-E387 VanDerWaalsContact O-CA 3.3Å; Y241-E387 WeakPolarHBondContact O-CA 3.38Å; Y241-E387 PolarHBondContact OH-OE2 3.14Å; Y241-E387 VanDerWaalsContact OH-OE2 3.1Å; Y241-V388 WeakPolarHBondContact O-CG2 3.3Å; Y241-V388 PolarHBondContact O-N 3.04Å
242	W	97.5	Very high	83.2	Confident	14 Å²	14	67.5 Å²	67.5	5%	0.053	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.9	172.8	172.4	67.3	0	0	0	109.4	V244 A252 F256 L363 L364 F365 V366 V388 L390	W242-V244 HydrophobicContact CE3-CB 4.46Å; W242-V244 HydrophobicContact CE3-CG2 3.86Å; W242-V244 HydrophobicContact CH2-CB 4.22Å; W242-V244 HydrophobicContact CH2-CG1 4.01Å; W242-V244 HydrophobicContact CH2-CG2 4.37Å; W242-V244 HydrophobicContact CZ3-CB 3.95Å; W242-V244 HydrophobicContact CZ3-CG1 3.97Å; W242-V244 HydrophobicContact CZ3-CG2 3.61Å; W242-V244 PolarHBondContact O-N 2.79Å; W242-A252 HydrophobicContact CE3-CB 4.14Å; W242-A252 HydrophobicContact CH2-CB 3.4Å; W242-A252 HydrophobicContact CZ2-CB 4.01Å; W242-A252 HydrophobicContact CZ3-CB 3.46Å; W242-A252 VanDerWaalsContact CZ3-CB 3.46Å; W242-F256 HydrophobicContact CB-CE2 3.97Å; W242-F256 HydrophobicContact CB-CZ 3.73Å; W242-F256 AromaticContact CD1-CZ 3.98Å; W242-F256 AromaticContact CD2-CE2 3.93Å; W242-F256 HydrophobicContact CD2-CE2 3.93Å; W242-F256 HydrophobicContact CD2-CZ 4.34Å; W242-F256 HydrophobicContact CE3-CE2 4.23Å; W242-F256 AromaticContact CG-CE2 3.78Å; W242-F256 HydrophobicContact CG-CE2 3.78Å; W242-F256 AromaticContact CG-CZ 3.73Å; W242-F256 HydrophobicContact CG-CZ 3.73Å; W242-L363 HydrophobicContact CB-CD1 4.45Å; W242-L364 PolarHBondContact N-O 3.3Å; W242-F365 HydrophobicContact CB-CD1 4.28Å; W242-F365 AromaticContact CE3-CD1 3.76Å; W242-F365 HydrophobicContact CE3-CD1 3.76Å; W242-F365 HydrophobicContact CE3-CD2 4.38Å; W242-F365 AromaticContact CE3-CE1 3.96Å; W242-F365 HydrophobicContact CE3-CE1 3.96Å; W242-F365 AromaticContact CE3-CG 3.99Å; W242-F365 HydrophobicContact CE3-CG 3.99Å; W242-F365 HydrophobicContact CE3-CZ 4.37Å; W242-F365 HydrophobicContact CZ3-CD2 4.46Å; W242-F365 HydrophobicContact CZ3-CG 4.46Å; W242-V366 PolarHBondContact O-N 2.93Å; W242-V388 HydrophobicContact CB-CG2 4.27Å; W242-L390 HydrophobicContact CZ2-CD1 4.32Å
243	T	96	Very high	86	Confident	20 Å²	20	61.4 Å²	61.4	12%	0.123	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	119.4	171.4	-63.9	0	0	0	0	109.6	W245 V366 E387	T243-W245 PolarHBondContact O-N 2.72Å; T243-V366 CarbonylContact C-O 3.55Å; T243-V366 WeakPolarHBondContact CA-O 3.37Å; T243-E387 VanDerWaalsContact CB-OE1 3.25Å; T243-E387 WeakPolarHBondContact CB-OE1 3.38Å; T243-E387 PolarHBondContact OG1-OE1 3.06Å
244	V	93.2	Very high	88.6	Confident	27 Å²	27	56.6 Å²	56.6	16%	0.164	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	101.9	177.2	-174	0	0	0	0	108.9	W242 K249 F365 V366 E367	W242-V244 HydrophobicContact CE3-CB 4.46Å; W242-V244 HydrophobicContact CE3-CG2 3.86Å; W242-V244 HydrophobicContact CH2-CB 4.22Å; W242-V244 HydrophobicContact CH2-CG1 4.01Å; W242-V244 HydrophobicContact CH2-CG2 4.37Å; W242-V244 HydrophobicContact CZ3-CB 3.95Å; W242-V244 HydrophobicContact CZ3-CG1 3.97Å; W242-V244 HydrophobicContact CZ3-CG2 3.61Å; W242-V244 PolarHBondContact O-N 2.79Å; V244-K249 HydrophobicContact CG1-CG 3.86Å; V244-K249 HydrophobicContact CG2-CG 4.1Å; V244-F365 HydrophobicContact CG2-CB 3.94Å; V244-V366 PolarHBondContact N-O 3.3Å; V244-E367 HydrophobicContact CB-CG 3.93Å; V244-E367 HydrophobicContact CG1-CG 4.26Å; V244-E367 HydrophobicContact CG2-CG 4.1Å
245	W	88	Confident	90.6	Very high	221 Å²	221	56.6 Å²	56.6	84%	0.837	29%	0.289	S	S	*	.			trans	-147.1	138.6	176	-168.6	79.7	0	0	0	111.1	T243 M247	T243-W245 PolarHBondContact O-N 2.72Å; W245-M247 PolarHBondContact O-N 3.06Å
246	G	81	Confident	92.5	Very high	81 Å²	81	54.2 Å²	54.2	84%	0.835	27%	0.273	S	S	*	.	S	Bend	trans	74.5	-49.1	178.1	0	0	0	0	0	115.5
247	M	87.5	Confident	93.6	Very high	40 Å²	40	48.7 Å²	48.7	20%	0.197	24%	0.244	C	C	.	.	S	Bend	trans	-99	145.2	-178	-176.2	160.6	-73.2	0	0	112.2	W245 E251 A252 L390	W245-M247 PolarHBondContact O-N 3.06Å; M247-E251 HydrophobicContact CG-CB 3.66Å; M247-E251 HydrophobicContact SD-CB 3.7Å; M247-A252 HydrophobicContact CG-CB 4.27Å; M247-A252 HydrophobicContact SD-CB 4.32Å; M247-L390 HydrophobicContact CB-CD2 4.38Å; M247-L390 HydrophobicContact CE-CD2 4.04Å; M247-L390 HydrophobicContact SD-CD1 4.4Å; M247-L390 HydrophobicContact SD-CD2 3.51Å; M247-L390 VanDerWaalsContact SD-CD2 3.51Å
248	R	91.7	Very high	93.7	Very high	192 Å²	192	49.6 Å²	49.6	73%	0.725	25%	0.247	S	C	*	.			trans	-67.5	141.3	172.3	-70.4	178.7	168.9	172.3	-3	110.2	N250 E251 A252	R248-N250 VanDerWaalsContact C-N 3.25Å; R248-N250 PolarHBondContact O-N 3.11Å; R248-N250 VanDerWaalsContact O-N 3.16Å; R248-E251 PolarHBondContact O-N 3.13Å; R248-A252 PolarHBondContact O-N 3.33Å
249	K	95.5	Very high	93.7	Very high	17 Å²	17	46.5 Å²	46.5	7%	0.074	23%	0.226	C	C	.	.	H	α-helix	trans	-52.2	-39.8	-178.9	-71.6	-172.7	-178.4	-168.8	0	113.3	V244 A252 L253 Y337 D338 F365 E367	V244-K249 HydrophobicContact CG1-CG 3.86Å; V244-K249 HydrophobicContact CG2-CG 4.1Å; K249-A252 PolarHBondContact O-N 2.95Å; K249-L253 VanDerWaalsContact O-CB 3.24Å; K249-L253 WeakPolarHBondContact O-CB 3.49Å; K249-L253 PolarHBondContact O-N 3.29Å; K249-Y337 HydrophobicContact CB-CD2 4.32Å; K249-Y337 HydrophobicContact CB-CE1 4.18Å; K249-Y337 HydrophobicContact CB-CE2 3.46Å; K249-Y337 VanDerWaalsContact CB-CE2 3.46Å; K249-Y337 VanDerWaalsContact CB-OH 3.23Å; K249-Y337 WeakPolarHBondContact CB-OH 3.37Å; K249-Y337 HydrophobicContact CD-CD1 4.02Å; K249-Y337 HydrophobicContact CD-CE1 3.55Å; K249-Y337 HydrophobicContact CD-CE2 4.21Å; K249-Y337 HydrophobicContact CG-CE2 4.47Å; K249-Y337 PolarHBondContact NZ-O 3.25Å; K249-D338 IonicContact NZ-OD1 3.52Å; K249-D338 PolarHBondContact NZ-OD1 2.86Å; K249-F365 HydrophobicContact CB-CD2 4.28Å; K249-F365 HydrophobicContact CB-CE2 4.44Å; K249-F365 HydrophobicContact CD-CD2 4.32Å; K249-F365 HydrophobicContact CG-CD2 4.21Å; K249-E367 WeakPolarHBondContact CE-OE1 3.33Å; K249-E367 IonicContact NZ-OE1 3.94Å; K249-E367 PolarHBondContact NZ-OE1 3.31Å
250	N	95.6	Very high	93.3	Very high	51 Å²	51	47.1 Å²	47.1	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-42.7	178.2	-73.3	-10.8	0	0	0	113.1	R248 L253 V254 A281 Y337	R248-N250 VanDerWaalsContact C-N 3.25Å; R248-N250 PolarHBondContact O-N 3.11Å; R248-N250 VanDerWaalsContact O-N 3.16Å; N250-L253 PolarHBondContact O-N 3.41Å; N250-V254 WeakPolarHBondContact O-CG2 3.37Å; N250-V254 PolarHBondContact O-N 3.23Å; N250-V254 VanDerWaalsContact O-N 3.15Å; N250-A281 HydrophobicContact CB-CB 4.39Å; N250-Y337 WeakPolarHBondContact OD1-CE2 3.36Å; N250-Y337 PolarHBondContact OD1-OH 3.08Å
251	E	93.8	Very high	92.8	Very high	99 Å²	99	51 Å²	51	46%	0.463	25%	0.248	S	C	.	.	H	α-helix	trans	-67.7	-40.8	177.4	-68	166.6	-149.9	0	0	110.7	M247 R248 V254 R255	M247-E251 HydrophobicContact CG-CB 3.66Å; M247-E251 HydrophobicContact SD-CB 3.7Å; R248-E251 PolarHBondContact O-N 3.13Å; E251-V254 PolarHBondContact O-N 3.42Å; E251-R255 WeakPolarHBondContact O-CG 3.44Å; E251-R255 PolarHBondContact O-N 3.26Å
252	A	95.7	Very high	92.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-42.8	175.5	0	0	0	0	0	111.8	W242 M247 R248 K249 V254 R255 F256 L390	W242-A252 HydrophobicContact CE3-CB 4.14Å; W242-A252 HydrophobicContact CH2-CB 3.4Å; W242-A252 HydrophobicContact CZ2-CB 4.01Å; W242-A252 HydrophobicContact CZ3-CB 3.46Å; W242-A252 VanDerWaalsContact CZ3-CB 3.46Å; M247-A252 HydrophobicContact CG-CB 4.27Å; M247-A252 HydrophobicContact SD-CB 4.32Å; R248-A252 PolarHBondContact O-N 3.33Å; K249-A252 PolarHBondContact O-N 2.95Å; A252-V254 PolarHBondContact O-N 2.95Å; A252-R255 PolarHBondContact O-N 3.13Å; A252-R255 VanDerWaalsContact O-N 3.16Å; A252-F256 WeakPolarHBondContact O-CD2 3.39Å; A252-F256 PolarHBondContact O-N 3.05Å; A252-L390 HydrophobicContact CB-CD1 3.61Å
253	L	97.3	Very high	92.3	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-56.8	-47.8	177	177.3	64	0	0	0	111.6	K249 N250 R255 F256 L257 I267 V278 L282 V335 Y337 F365	K249-L253 VanDerWaalsContact O-CB 3.24Å; K249-L253 WeakPolarHBondContact O-CB 3.49Å; K249-L253 PolarHBondContact O-N 3.29Å; N250-L253 PolarHBondContact O-N 3.41Å; L253-R255 VanDerWaalsContact C-N 3.31Å; L253-R255 PolarHBondContact O-N 3.45Å; L253-F256 PolarHBondContact O-N 3.38Å; L253-L257 HydrophobicContact CD1-CD1 4.05Å; L253-L257 HydrophobicContact CD1-CG 4.12Å; L253-L257 HydrophobicContact CG-CD1 3.9Å; L253-L257 HydrophobicContact CG-CG 4.39Å; L253-L257 WeakPolarHBondContact O-CB 3.46Å; L253-L257 VanDerWaalsContact O-CG 3.28Å; L253-L257 WeakPolarHBondContact O-CG 3.49Å; L253-L257 PolarHBondContact O-N 3.17Å; L253-I267 HydrophobicContact CD1-CD1 3.92Å; L253-I267 HydrophobicContact CD2-CD1 3.9Å; L253-I267 HydrophobicContact CG-CD1 4.38Å; L253-V278 HydrophobicContact CD2-CG1 3.71Å; L253-L282 HydrophobicContact CD2-CD1 4.13Å; L253-L282 HydrophobicContact CD2-CD2 3.87Å; L253-L282 HydrophobicContact CD2-CG 4.18Å; L253-L282 HydrophobicContact CG-CD2 4.12Å; L253-V335 HydrophobicContact CD1-CB 4.46Å; L253-V335 HydrophobicContact CD1-CG1 3.95Å; L253-V335 HydrophobicContact CD1-CG2 4.38Å; L253-Y337 HydrophobicContact CD2-CD2 4.08Å; L253-Y337 HydrophobicContact CD2-CE2 4.3Å; L253-F365 HydrophobicContact CB-CE2 4.12Å; L253-F365 HydrophobicContact CB-CZ 4.24Å; L253-F365 HydrophobicContact CD1-CZ 4.36Å
254	V	95.6	Very high	92.3	Very high	21 Å²	21	53.5 Å²	53.5	13%	0.127	26%	0.261	C	S	.	.	H	α-helix	trans	-58.1	-44	176.6	169.8	0	0	0	0	111.1	N250 E251 A252 L257 E258 L282 N285 Y287	N250-V254 WeakPolarHBondContact O-CG2 3.37Å; N250-V254 PolarHBondContact O-N 3.23Å; N250-V254 VanDerWaalsContact O-N 3.15Å; E251-V254 PolarHBondContact O-N 3.42Å; A252-V254 PolarHBondContact O-N 2.95Å; V254-L257 PolarHBondContact O-N 3.1Å; V254-E258 WeakPolarHBondContact O-CB 3.4Å; V254-E258 PolarHBondContact O-N 3.5Å; V254-L282 HydrophobicContact CG2-CD2 4.08Å; V254-N285 HydrophobicContact CG1-CB 4.21Å; V254-N285 HydrophobicContact CG2-CB 3.88Å; V254-Y287 HydrophobicContact CG1-CE2 4.32Å
255	R	94.6	Very high	92.5	Very high	76 Å²	76	52.2 Å²	52.2	29%	0.287	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-41.5	178	-68	-171.8	177.1	-158.2	2.8	113	E251 A252 L253 E258 A259 L390 P391 L396	E251-R255 WeakPolarHBondContact O-CG 3.44Å; E251-R255 PolarHBondContact O-N 3.26Å; A252-R255 PolarHBondContact O-N 3.13Å; A252-R255 VanDerWaalsContact O-N 3.16Å; L253-R255 VanDerWaalsContact C-N 3.31Å; L253-R255 PolarHBondContact O-N 3.45Å; R255-E258 PolarHBondContact O-N 3.11Å; R255-A259 WeakPolarHBondContact O-CB 3.48Å; R255-A259 PolarHBondContact O-N 3.32Å; R255-L390 HydrophobicContact CB-CD1 4.4Å; R255-P391 HydrophobicContact CB-CB 4.33Å; R255-P391 WeakPolarHBondContact CD-O 3.42Å; R255-P391 PolarHBondContact NH1-O 3.4Å; R255-L396 HydrophobicContact CB-CD1 4.19Å; R255-L396 HydrophobicContact CG-CD1 3.82Å
256	F	96.2	Very high	92.9	Very high	10 Å²	10	41.7 Å²	41.7	4%	0.044	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-49.2	174.1	-78.3	-68	0	0	0	110.8	W242 A252 L253 E258 A259 E260 L363 F365 V388 L390 P391	W242-F256 HydrophobicContact CB-CE2 3.97Å; W242-F256 HydrophobicContact CB-CZ 3.73Å; W242-F256 AromaticContact CD1-CZ 3.98Å; W242-F256 AromaticContact CD2-CE2 3.93Å; W242-F256 HydrophobicContact CD2-CE2 3.93Å; W242-F256 HydrophobicContact CD2-CZ 4.34Å; W242-F256 HydrophobicContact CE3-CE2 4.23Å; W242-F256 AromaticContact CG-CE2 3.78Å; W242-F256 HydrophobicContact CG-CE2 3.78Å; W242-F256 AromaticContact CG-CZ 3.73Å; W242-F256 HydrophobicContact CG-CZ 3.73Å; A252-F256 WeakPolarHBondContact O-CD2 3.39Å; A252-F256 PolarHBondContact O-N 3.05Å; L253-F256 PolarHBondContact O-N 3.38Å; F256-E258 PolarHBondContact O-N 3.05Å; F256-A259 PolarHBondContact O-N 3.07Å; F256-E260 WeakPolarHBondContact O-CB 3.26Å; F256-E260 WeakPolarHBondContact O-CG 3.3Å; F256-E260 PolarHBondContact O-N 3.12Å; F256-E260 VanDerWaalsContact O-N 3.1Å; F256-L363 HydrophobicContact CB-CD2 3.83Å; F256-L363 HydrophobicContact CD1-CD2 3.47Å; F256-L363 VanDerWaalsContact CD1-CD2 3.47Å; F256-L363 HydrophobicContact CD2-CD2 3.72Å; F256-L363 HydrophobicContact CE1-CD1 4.35Å; F256-L363 HydrophobicContact CE1-CD2 3.88Å; F256-L363 HydrophobicContact CE2-CD2 4.11Å; F256-L363 HydrophobicContact CG-CD2 3.4Å; F256-L363 HydrophobicContact CZ-CD1 4.5Å; F256-L363 HydrophobicContact CZ-CD2 4.19Å; F256-F365 AromaticContact CD2-CE1 3.68Å; F256-F365 HydrophobicContact CD2-CE1 3.68Å; F256-F365 AromaticContact CD2-CZ 3.78Å; F256-F365 HydrophobicContact CD2-CZ 3.78Å; F256-F365 AromaticContact CE2-CE1 3.75Å; F256-F365 HydrophobicContact CE2-CE1 3.75Å; F256-F365 HydrophobicContact CE2-CZ 4.19Å; F256-V388 HydrophobicContact CE1-CG2 4.12Å; F256-V388 HydrophobicContact CZ-CG2 4.27Å; F256-L390 HydrophobicContact CD2-CD1 4.33Å; F256-L390 HydrophobicContact CE2-CD1 3.83Å; F256-L390 HydrophobicContact CZ-CD1 4.33Å; F256-P391 HydrophobicContact CD1-CG 3.83Å; F256-P391 VanDerWaalsContact CE1-CD 3.49Å; F256-P391 HydrophobicContact CE1-CG 4.04Å; F256-P391 HydrophobicContact CG-CG 4.37Å
257	L	95.8	Very high	93.8	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-60.7	-31.5	178.1	-67.5	170.8	0	0	0	112.9	L253 V254 F262 L282 Y287 I315 L333	L253-L257 HydrophobicContact CD1-CD1 4.05Å; L253-L257 HydrophobicContact CD1-CG 4.12Å; L253-L257 HydrophobicContact CG-CD1 3.9Å; L253-L257 HydrophobicContact CG-CG 4.39Å; L253-L257 WeakPolarHBondContact O-CB 3.46Å; L253-L257 VanDerWaalsContact O-CG 3.28Å; L253-L257 WeakPolarHBondContact O-CG 3.49Å; L253-L257 PolarHBondContact O-N 3.17Å; V254-L257 PolarHBondContact O-N 3.1Å; L257-F262 HydrophobicContact CB-CE1 4.2Å; L257-F262 HydrophobicContact CD2-CD1 4.49Å; L257-F262 HydrophobicContact CD2-CE1 3.74Å; L257-F262 HydrophobicContact CD2-CZ 3.9Å; L257-F262 WeakPolarHBondContact O-CE1 3.02Å; L257-L282 HydrophobicContact CD1-CD1 4.16Å; L257-L282 HydrophobicContact CD1-CD2 3.47Å; L257-L282 VanDerWaalsContact CD1-CD2 3.47Å; L257-L282 HydrophobicContact CD1-CG 4.48Å; L257-Y287 VanDerWaalsContact C-OH 3.27Å; L257-Y287 HydrophobicContact CB-CE1 3.83Å; L257-Y287 HydrophobicContact CB-CE2 4.3Å; L257-Y287 WeakPolarHBondContact CB-OH 3.25Å; L257-Y287 HydrophobicContact CD1-CE1 4.41Å; L257-Y287 HydrophobicContact CD1-CE2 4.37Å; L257-I315 HydrophobicContact CD1-CD1 3.69Å; L257-I315 HydrophobicContact CD2-CD1 4.05Å; L257-I315 HydrophobicContact CG-CD1 4.45Å; L257-L333 HydrophobicContact CD2-CD2 3.92Å
258	E	92.3	Very high	94.3	Very high	37 Å²	37	36.1 Å²	36.1	17%	0.173	17%	0.165	C	C	.	.	H	α-helix	trans	-75.1	-37.2	177.8	-178.1	170.2	-157.2	0	0	112.7	V254 R255 F256 E260 Y287 L396 R400 K403	V254-E258 WeakPolarHBondContact O-CB 3.4Å; V254-E258 PolarHBondContact O-N 3.5Å; R255-E258 PolarHBondContact O-N 3.11Å; F256-E258 PolarHBondContact O-N 3.05Å; E258-E260 VanDerWaalsContact C-N 3.31Å; E258-Y287 WeakPolarHBondContact CA-OH 3.42Å; E258-Y287 PolarHBondContact N-OH 3.48Å; E258-Y287 VanDerWaalsContact N-OH 3.11Å; E258-L396 HydrophobicContact CB-CD2 3.97Å; E258-L396 HydrophobicContact CG-CD2 3.92Å; E258-R400 VanDerWaalsContact CD-NH2 3.3Å; E258-R400 IonicContact OE1-CZ 3.21Å; E258-R400 IonicContact OE1-NE 2.64Å; E258-R400 PolarHBondContact OE1-NE 3.17Å; E258-R400 IonicContact OE1-NH2 2.94Å; E258-R400 PolarHBondContact OE1-NH2 2.78Å; E258-R400 IonicContact OE2-CZ 3.78Å; E258-R400 IonicContact OE2-NE 3.89Å; E258-R400 IonicContact OE2-NH2 2.85Å; E258-R400 PolarHBondContact OE2-NH2 3.03Å; E258-K403 PolarHBondContact O-NZ 3.25Å
259	A	90.6	Very high	94.6	Very high	7 Å²	7	27 Å²	27	6%	0.058	13%	0.131	C	C	.	.	H	α-helix	trans	-75.8	-19.5	-179.5	0	0	0	0	0	113.7	R255 F256 P391 L396 R399	R255-A259 WeakPolarHBondContact O-CB 3.48Å; R255-A259 PolarHBondContact O-N 3.32Å; F256-A259 PolarHBondContact O-N 3.07Å; A259-P391 HydrophobicContact CB-CB 3.88Å; A259-P391 HydrophobicContact CB-CG 3.75Å; A259-L396 HydrophobicContact CB-CD2 3.99Å; A259-R399 VanDerWaalsContact O-CZ 3.24Å; A259-R399 PolarHBondContact O-NE 3.4Å; A259-R399 VanDerWaalsContact O-NE 3.09Å; A259-R399 PolarHBondContact O-NH2 3.25Å
260	E	86.5	Confident	94.4	Very high	32 Å²	32	30.7 Å²	30.7	15%	0.15	15%	0.145	C	C	.	.	S	Bend	trans	-103.2	139.5	-175.5	-57.8	-68.2	-159.4	0	0	112.1	F256 E258 F262 R361	F256-E260 WeakPolarHBondContact O-CB 3.26Å; F256-E260 WeakPolarHBondContact O-CG 3.3Å; F256-E260 PolarHBondContact O-N 3.12Å; F256-E260 VanDerWaalsContact O-N 3.1Å; E258-E260 VanDerWaalsContact C-N 3.31Å; E260-F262 HydrophobicContact CB-CD1 4.44Å; E260-R361 VanDerWaalsContact CD-CZ 3.42Å; E260-R361 VanDerWaalsContact CD-NH1 3.29Å; E260-R361 IonicContact OE1-CZ 2.66Å; E260-R361 IonicContact OE1-NH1 3.42Å; E260-R361 IonicContact OE1-NH2 2.76Å; E260-R361 PolarHBondContact OE1-NH2 3.4Å; E260-R361 IonicContact OE2-CZ 3.34Å; E260-R361 IonicContact OE2-NH1 3.66Å; E260-R361 PolarHBondContact OE2-NH1 2.85Å; E260-R361 IonicContact OE2-NH2 2.61Å; E260-R361 PolarHBondContact OE2-NH2 3.18Å
261	D	87.1	Confident	94.1	Very high	99 Å²	99	31.6 Å²	31.6	53%	0.529	15%	0.152	S	C	.	.			trans	-92.5	121.3	166.6	-59.3	-54.5	0	0	0	107.8	R399	D261-R399 IonicContact OD2-CZ 2.92Å; D261-R399 IonicContact OD2-NH1 2.76Å; D261-R399 PolarHBondContact OD2-NH1 3.2Å; D261-R399 IonicContact OD2-NH2 2.71Å
262	F	92.7	Very high	93.9	Very high	50 Å²	50	31.3 Å²	31.3	22%	0.219	15%	0.149	C	C	.	.			trans	-142.4	152.6	178.8	63.6	-91.1	0	0	0	110.4	L257 E260 A265 Y287 I315 S332 L333	L257-F262 HydrophobicContact CB-CE1 4.2Å; L257-F262 HydrophobicContact CD2-CD1 4.49Å; L257-F262 HydrophobicContact CD2-CE1 3.74Å; L257-F262 HydrophobicContact CD2-CZ 3.9Å; L257-F262 WeakPolarHBondContact O-CE1 3.02Å; E260-F262 HydrophobicContact CB-CD1 4.44Å; F262-A265 HydrophobicContact CD2-CB 3.87Å; F262-A265 HydrophobicContact CE2-CB 3.91Å; F262-A265 HydrophobicContact CG-CB 4.49Å; F262-Y287 HydrophobicContact CZ-CE1 4.38Å; F262-I315 HydrophobicContact CE2-CD1 4.31Å; F262-I315 HydrophobicContact CE2-CG1 4Å; F262-I315 HydrophobicContact CZ-CD1 3.95Å; F262-I315 HydrophobicContact CZ-CG1 4.16Å; F262-S332 WeakPolarHBondContact CA-OG 3.48Å; F262-S332 WeakPolarHBondContact CB-OG 3.37Å; F262-L333 HydrophobicContact CB-CB 3.88Å; F262-L333 HydrophobicContact CB-CD2 4.3Å; F262-L333 HydrophobicContact CD1-CD2 3.9Å; F262-L333 HydrophobicContact CE1-CD2 4.48Å; F262-L333 HydrophobicContact CG-CB 4.36Å; F262-L333 HydrophobicContact CG-CD2 4.11Å
263	D	92.2	Very high	93.8	Very high	60 Å²	60	35.8 Å²	35.8	32%	0.321	17%	0.173	S	C	.	.	S	Bend	trans	-86.9	-56.7	176.3	-179.2	6.3	0	0	0	110.4	R330 S332	D263-R330 PolarHBondContact O-NH2 3.39Å; D263-R330 IonicContact OD1-CZ 3.97Å; D263-R330 IonicContact OD1-NE 3.73Å; D263-R330 PolarHBondContact OD1-NE 3.4Å; D263-R330 IonicContact OD1-NH2 3.11Å; D263-R330 PolarHBondContact OD1-NH2 2.74Å; D263-R330 IonicContact OD2-NE 3.64Å; D263-S332 PolarHBondContact N-OG 3.18Å
264	A	95.3	Very high	93.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	151.7	165.1	0	0	0	0	0	111.1	L308 D314 R330 I331 S332 L333	A264-L308 HydrophobicContact CB-CD1 4.13Å; A264-D314 CarbonylContact C-O 3.48Å; A264-D314 VanDerWaalsContact CA-O 3.31Å; A264-D314 WeakPolarHBondContact CA-O 3.46Å; A264-R330 HydrophobicContact CB-CB 3.94Å; A264-R330 PolarHBondContact N-O 3.07Å; A264-R330 VanDerWaalsContact N-O 3.07Å; A264-I331 HydrophobicContact CB-CG1 4.35Å; A264-I331 WeakPolarHBondContact O-CA 3.46Å; A264-S332 PolarHBondContact O-N 2.92Å; A264-L333 PolarHBondContact O-N 2.71Å
265	A	97.1	Very high	93.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.2	177.1	0	0	0	0	0	112.4	F262 D314 I315 L316 L333	F262-A265 HydrophobicContact CD2-CB 3.87Å; F262-A265 HydrophobicContact CE2-CB 3.91Å; F262-A265 HydrophobicContact CG-CB 4.49Å; A265-D314 PolarHBondContact N-O 2.92Å; A265-I315 HydrophobicContact CB-CG1 4.31Å; A265-I315 HydrophobicContact CB-CG2 4.42Å; A265-I315 WeakPolarHBondContact O-CA 3.44Å; A265-L316 PolarHBondContact O-N 3.07Å; A265-L333 CarbonylContact C-O 3.42Å; A265-L333 VanDerWaalsContact CA-O 3.23Å; A265-L333 WeakPolarHBondContact CA-O 3.22Å; A265-L333 HydrophobicContact CB-CB 4.01Å; A265-L333 HydrophobicContact CB-CD2 4.12Å; A265-L333 HydrophobicContact CB-CG 4.22Å
266	I	97.6	Very high	93.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.6	166.8	-170.9	169.5	0	0	0	110.3	F268 L316 A318 A323 L326 I331 L333 V334 V335 R352	I266-F268 HydrophobicContact CD1-CE1 4.46Å; I266-F268 HydrophobicContact CD1-CE2 3.94Å; I266-F268 HydrophobicContact CD1-CZ 3.77Å; I266-F268 HydrophobicContact CG1-CD2 4.41Å; I266-F268 HydrophobicContact CG1-CE2 3.99Å; I266-F268 HydrophobicContact CG1-CZ 4.28Å; I266-F268 HydrophobicContact CG2-CD2 4.46Å; I266-F268 HydrophobicContact CG2-CE2 3.84Å; I266-L316 CarbonylContact C-O 3.52Å; I266-L316 WeakPolarHBondContact CA-O 3.28Å; I266-L316 HydrophobicContact CD1-CD2 4.28Å; I266-A318 HydrophobicContact CD1-CB 4.37Å; I266-A318 HydrophobicContact CG1-CB 4.49Å; I266-A323 HydrophobicContact CD1-CB 3.85Å; I266-L326 HydrophobicContact CD1-CD1 4.02Å; I266-I331 HydrophobicContact CB-CD1 4.16Å; I266-I331 HydrophobicContact CB-CG2 4.45Å; I266-I331 HydrophobicContact CG2-CD1 4.22Å; I266-I331 HydrophobicContact CG2-CG2 3.77Å; I266-L333 PolarHBondContact N-O 2.66Å; I266-V334 HydrophobicContact CG2-CB 4.31Å; I266-V334 HydrophobicContact CG2-CG1 4.37Å; I266-V334 HydrophobicContact CG2-CG2 3.68Å; I266-V334 CarbonylContact O-C 3.54Å; I266-V334 WeakPolarHBondContact O-CA 3.44Å; I266-V335 PolarHBondContact O-N 2.76Å; I266-R352 HydrophobicContact CD1-CG 4.48Å; I266-R352 HydrophobicContact CG2-CB 4.04Å; I266-R352 HydrophobicContact CG2-CG 4.49Å
267	I	98.4	Very high	93.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.8	-176.2	-54.2	-178.8	0	0	0	108.5	L253 L282 I315 L316 I317 A318 V335 Y337	L253-I267 HydrophobicContact CD1-CD1 3.92Å; L253-I267 HydrophobicContact CD2-CD1 3.9Å; L253-I267 HydrophobicContact CG-CD1 4.38Å; I267-L282 HydrophobicContact CD1-CD1 3.6Å; I267-I315 HydrophobicContact CD1-CG2 3.45Å; I267-I315 VanDerWaalsContact CD1-CG2 3.45Å; I267-I315 HydrophobicContact CG1-CG2 3.86Å; I267-L316 PolarHBondContact N-O 2.79Å; I267-I317 HydrophobicContact CB-CG1 4.31Å; I267-I317 HydrophobicContact CB-CG2 4.43Å; I267-I317 HydrophobicContact CD1-CG1 4.45Å; I267-I317 HydrophobicContact CG2-CG2 4.5Å; I267-I317 CarbonylContact O-C 3.6Å; I267-I317 WeakPolarHBondContact O-CA 3.44Å; I267-A318 PolarHBondContact O-N 3.49Å; I267-V335 CarbonylContact C-O 3.51Å; I267-V335 VanDerWaalsContact CA-O 3.29Å; I267-V335 WeakPolarHBondContact CA-O 3.42Å; I267-V335 HydrophobicContact CG1-CB 4.16Å; I267-V335 HydrophobicContact CG1-CG2 4.48Å; I267-V335 HydrophobicContact CG2-CB 4.34Å; I267-Y337 HydrophobicContact CG2-CG 4.48Å
268	F	98.3	Very high	93.9	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.2	-179.8	-74.4	-87	0	0	0	112	I266 A318 A323 V334 V335 Y337 D338 R349 R352	I266-F268 HydrophobicContact CD1-CE1 4.46Å; I266-F268 HydrophobicContact CD1-CE2 3.94Å; I266-F268 HydrophobicContact CD1-CZ 3.77Å; I266-F268 HydrophobicContact CG1-CD2 4.41Å; I266-F268 HydrophobicContact CG1-CE2 3.99Å; I266-F268 HydrophobicContact CG1-CZ 4.28Å; I266-F268 HydrophobicContact CG2-CD2 4.46Å; I266-F268 HydrophobicContact CG2-CE2 3.84Å; F268-A318 VanDerWaalsContact CA-O 3.31Å; F268-A318 WeakPolarHBondContact CA-O 3.29Å; F268-A323 HydrophobicContact CD1-CB 4.4Å; F268-A323 HydrophobicContact CE1-CB 3.4Å; F268-A323 HydrophobicContact CZ-CB 3.76Å; F268-V334 HydrophobicContact CD2-CG1 3.94Å; F268-V334 HydrophobicContact CE2-CG1 4Å; F268-V335 PolarHBondContact N-O 3.42Å; F268-Y337 WeakPolarHBondContact O-CB 3.24Å; F268-Y337 PolarHBondContact O-N 3.14Å; F268-D338 PolarHBondContact O-N 2.66Å; F268-D338 VanDerWaalsContact O-N 3.14Å; F268-R349 HydrophobicContact CB-CG 4.44Å; F268-R349 HydrophobicContact CD1-CG 3.68Å; F268-R349 HydrophobicContact CD2-CB 3.82Å; F268-R349 HydrophobicContact CD2-CG 3.77Å; F268-R349 HydrophobicContact CE1-CB 4.42Å; F268-R349 HydrophobicContact CE1-CG 3.66Å; F268-R349 HydrophobicContact CE2-CB 3.67Å; F268-R349 HydrophobicContact CE2-CG 3.79Å; F268-R349 HydrophobicContact CG-CB 4.28Å; F268-R349 HydrophobicContact CG-CG 3.71Å; F268-R349 HydrophobicContact CZ-CB 3.99Å; F268-R349 HydrophobicContact CZ-CG 3.74Å; F268-R352 HydrophobicContact CE2-CG 4.14Å; F268-R352 HydrophobicContact CZ-CG 3.89Å
269	V	97.4	Very high	94.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.			trans	-118.3	159.8	175	-61.4	0	0	0	0	110.6	A274 T275 V278 I317 A318 Y337 D338	V269-A274 HydrophobicContact CB-CB 3.91Å; V269-A274 HydrophobicContact CG1-CB 4.39Å; V269-A274 HydrophobicContact CG2-CB 4Å; V269-T275 HydrophobicContact CG2-CG2 3.37Å; V269-V278 HydrophobicContact CG1-CG2 4.11Å; V269-I317 HydrophobicContact CG1-CG2 3.82Å; V269-I317 HydrophobicContact CG2-CG2 3.92Å; V269-A318 PolarHBondContact N-O 3.11Å; V269-Y337 HydrophobicContact CG1-CD1 3.82Å; V269-Y337 HydrophobicContact CG1-CG 4.03Å; V269-D338 WeakPolarHBondContact CA-OD2 3.3Å
270	R	91.4	Very high	94.4	Very high	96 Å²	96	45.2 Å²	45.2	36%	0.362	22%	0.224	S	C	.	.	S	Bend	trans	-77.5	-39.2	-174.8	-170	179.3	-53.6	-70.3	-2.4	113.4	D338 I339 M341 E370	R270-D338 HydrophobicContact CB-CB 4.07Å; R270-D338 WeakPolarHBondContact CB-OD2 3.3Å; R270-D338 PolarHBondContact N-OD2 2.78Å; R270-I339 PolarHBondContact NH2-O 3.37Å; R270-M341 PolarHBondContact NH1-SD 3.35Å; R270-E370 IonicContact NH2-OE1 3.69Å
271	T	90.2	Very high	94.9	Very high	70 Å²	70	44 Å²	44	43%	0.429	22%	0.219	S	C	.	.	S	Bend	trans	-116.8	152.2	-170.5	72.8	0	0	0	0	111.6	N273 A274 T275	T271-N273 VanDerWaalsContact C-N 3.29Å; T271-N273 PolarHBondContact O-N 3.1Å; T271-A274 WeakPolarHBondContact O-CB 3.45Å; T271-A274 PolarHBondContact O-N 3.06Å; T271-A274 VanDerWaalsContact OG1-CB 3.28Å; T271-A274 WeakPolarHBondContact OG1-CB 3.37Å; T271-A274 PolarHBondContact OG1-N 3.04Å; T271-A274 VanDerWaalsContact OG1-N 3.14Å; T271-T275 PolarHBondContact O-N 3.02Å
272	K	90.3	Very high	95.4	Very high	93 Å²	93	39.3 Å²	39.3	40%	0.404	19%	0.194	S	C	.	.	H	α-helix	trans	-60.7	-37.9	174.9	61.4	177.5	-174.1	168.1	0	112.4	A274 T275 N293 D295	K272-A274 VanDerWaalsContact C-N 3.33Å; K272-A274 PolarHBondContact O-N 2.82Å; K272-T275 WeakPolarHBondContact O-CB 3.32Å; K272-T275 PolarHBondContact O-N 2.98Å; K272-T275 VanDerWaalsContact O-N 3.09Å; K272-T275 PolarHBondContact O-OG1 3.25Å; K272-N293 HydrophobicContact CB-CB 3.97Å; K272-D295 WeakPolarHBondContact CD-OD2 3.36Å; K272-D295 WeakPolarHBondContact CE-OD2 3.35Å; K272-D295 VanDerWaalsContact NZ-CG 3.29Å; K272-D295 IonicContact NZ-OD1 3.21Å; K272-D295 PolarHBondContact NZ-OD1 3.46Å; K272-D295 IonicContact NZ-OD2 3.08Å; K272-D295 PolarHBondContact NZ-OD2 3.33Å
273	N	92.8	Very high	95.5	Very high	94 Å²	94	42.2 Å²	42.2	50%	0.503	21%	0.209	S	C	.	.	H	α-helix	trans	-64.5	-40.4	177.2	-67.6	4.6	0	0	0	111.1	T271 T275 L276 E277	T271-N273 VanDerWaalsContact C-N 3.29Å; T271-N273 PolarHBondContact O-N 3.1Å; N273-T275 PolarHBondContact O-N 3.22Å; N273-L276 PolarHBondContact O-N 2.91Å; N273-E277 PolarHBondContact O-N 3.34Å
274	A	95.6	Very high	95.7	Very high	11 Å²	11	47.9 Å²	47.9	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-27.1	175.4	0	0	0	0	0	112.6	V269 T271 K272 L276 V278	V269-A274 HydrophobicContact CB-CB 3.91Å; V269-A274 HydrophobicContact CG1-CB 4.39Å; V269-A274 HydrophobicContact CG2-CB 4Å; T271-A274 WeakPolarHBondContact O-CB 3.45Å; T271-A274 PolarHBondContact O-N 3.06Å; T271-A274 VanDerWaalsContact OG1-CB 3.28Å; T271-A274 WeakPolarHBondContact OG1-CB 3.37Å; T271-A274 PolarHBondContact OG1-N 3.04Å; T271-A274 VanDerWaalsContact OG1-N 3.14Å; K272-A274 VanDerWaalsContact C-N 3.33Å; K272-A274 PolarHBondContact O-N 2.82Å; A274-L276 VanDerWaalsContact C-N 3.29Å; A274-L276 PolarHBondContact O-N 3.26Å; A274-V278 WeakPolarHBondContact O-CB 3.49Å; A274-V278 VanDerWaalsContact O-CG2 3.27Å; A274-V278 WeakPolarHBondContact O-CG2 3.33Å; A274-V278 PolarHBondContact O-N 3.03Å
275	T	96.8	Very high	95.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-39.6	175.2	66.7	0	0	0	0	111.9	V269 T271 K272 N273 A279 A291 N293 I317 T319	V269-T275 HydrophobicContact CG2-CG2 3.37Å; T271-T275 PolarHBondContact O-N 3.02Å; K272-T275 WeakPolarHBondContact O-CB 3.32Å; K272-T275 PolarHBondContact O-N 2.98Å; K272-T275 VanDerWaalsContact O-N 3.09Å; K272-T275 PolarHBondContact O-OG1 3.25Å; N273-T275 PolarHBondContact O-N 3.22Å; T275-A279 VanDerWaalsContact O-CB 3.26Å; T275-A279 WeakPolarHBondContact O-CB 3.13Å; T275-A279 PolarHBondContact O-N 3.18Å; T275-A291 WeakPolarHBondContact O-CB 3.36Å; T275-N293 HydrophobicContact CG2-CB 4.27Å; T275-N293 PolarHBondContact OG1-ND2 3.45Å; T275-I317 HydrophobicContact CG2-CG2 4.37Å; T275-T319 HydrophobicContact CG2-CG2 3.86Å
276	L	95.5	Very high	95.5	Very high	99 Å²	99	55.7 Å²	55.7	52%	0.518	28%	0.284	S	S	.	.	H	α-helix	trans	-75.3	-46.3	179.5	-61.9	170.9	0	0	0	110.9	N273 A274 V278 A279 E280 A291	N273-L276 PolarHBondContact O-N 2.91Å; A274-L276 VanDerWaalsContact C-N 3.29Å; A274-L276 PolarHBondContact O-N 3.26Å; L276-V278 PolarHBondContact O-N 3.38Å; L276-A279 PolarHBondContact O-N 3.17Å; L276-E280 WeakPolarHBondContact O-CB 3.38Å; L276-E280 PolarHBondContact O-N 2.85Å; L276-A291 HydrophobicContact CD2-CB 3.67Å; L276-A291 HydrophobicContact CG-CB 4.37Å
277	E	96.5	Very high	95.5	Very high	119 Å²	119	57.9 Å²	57.9	56%	0.556	29%	0.293	S	S	*	.	H	α-helix	trans	-60.9	-42.1	-179.2	-69.2	171.6	-163.7	0	0	112.5	N273 A281	N273-E277 PolarHBondContact O-N 3.34Å; E277-A281 WeakPolarHBondContact O-CB 2.98Å; E277-A281 PolarHBondContact O-N 3.38Å
278	V	97.9	Very high	95.3	Very high	3 Å²	3	60.7 Å²	60.7	2%	0.018	31%	0.308	C	S	.	.	H	α-helix	trans	-73.4	-38.1	178.5	176.8	0	0	0	0	110.8	L253 V269 A274 L276 A281 L282 I317 Y337	L253-V278 HydrophobicContact CD2-CG1 3.71Å; V269-V278 HydrophobicContact CG1-CG2 4.11Å; A274-V278 WeakPolarHBondContact O-CB 3.49Å; A274-V278 VanDerWaalsContact O-CG2 3.27Å; A274-V278 WeakPolarHBondContact O-CG2 3.33Å; A274-V278 PolarHBondContact O-N 3.03Å; L276-V278 PolarHBondContact O-N 3.38Å; V278-A281 PolarHBondContact O-N 3.19Å; V278-L282 HydrophobicContact CG1-CD1 4.34Å; V278-L282 HydrophobicContact CG1-CG 4.48Å; V278-L282 WeakPolarHBondContact O-CG 3.41Å; V278-L282 PolarHBondContact O-N 3.04Å; V278-I317 HydrophobicContact CB-CG1 4.34Å; V278-I317 HydrophobicContact CB-CG2 4.1Å; V278-I317 HydrophobicContact CG1-CG1 3.97Å; V278-I317 HydrophobicContact CG1-CG2 4.24Å; V278-Y337 HydrophobicContact CG2-CE1 4.24Å; V278-Y337 HydrophobicContact CG2-CE2 4.12Å
279	A	96.9	Very high	95.3	Very high	6 Å²	6	60.6 Å²	60.6	5%	0.05	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-48.9	174.3	0	0	0	0	0	111.6	T275 L276 A281 L282 E283 S289 A291 I317	T275-A279 VanDerWaalsContact O-CB 3.26Å; T275-A279 WeakPolarHBondContact O-CB 3.13Å; T275-A279 PolarHBondContact O-N 3.18Å; L276-A279 PolarHBondContact O-N 3.17Å; A279-A281 VanDerWaalsContact C-N 3.3Å; A279-A281 PolarHBondContact O-N 3.41Å; A279-L282 PolarHBondContact O-N 2.85Å; A279-L282 VanDerWaalsContact O-N 3.12Å; A279-E283 WeakPolarHBondContact O-CG 3.15Å; A279-E283 PolarHBondContact O-N 2.88Å; A279-S289 PolarHBondContact O-OG 2.85Å; A279-S289 VanDerWaalsContact O-OG 3.1Å; A279-A291 HydrophobicContact CB-CB 4.33Å; A279-I317 HydrophobicContact CB-CD1 3.77Å; A279-I317 HydrophobicContact CB-CG1 4.35Å
280	E	96.3	Very high	95.2	Very high	113 Å²	113	61.3 Å²	61.3	53%	0.528	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-36.5	177.6	-174.2	-175.2	179	0	0	112.1	L276 R284	L276-E280 WeakPolarHBondContact O-CB 3.38Å; L276-E280 PolarHBondContact O-N 2.85Å; E280-R284 WeakPolarHBondContact O-CB 3.32Å; E280-R284 WeakPolarHBondContact O-CG 3.45Å; E280-R284 PolarHBondContact O-N 3.44Å; E280-R284 VanDerWaalsContact O-N 3.13Å; E280-R284 PolarHBondContact O-NE 3.36Å
281	A	96.4	Very high	95.4	Very high	7 Å²	7	57.4 Å²	57.4	6%	0.058	30%	0.302	C	S	.	.	H	α-helix	trans	-64	-40.3	174.4	0	0	0	0	0	112.1	N250 E277 V278 A279 N285	N250-A281 HydrophobicContact CB-CB 4.39Å; E277-A281 WeakPolarHBondContact O-CB 2.98Å; E277-A281 PolarHBondContact O-N 3.38Å; V278-A281 PolarHBondContact O-N 3.19Å; A279-A281 VanDerWaalsContact C-N 3.3Å; A279-A281 PolarHBondContact O-N 3.41Å; A281-N285 PolarHBondContact O-N 2.78Å; A281-N285 PolarHBondContact O-ND2 2.92Å
282	L	97.6	Very high	95.6	Very high	1 Å²	1	54 Å²	54	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-72.4	-42	178.5	-72.5	-177.4	0	0	0	112.7	L253 V254 L257 I267 V278 A279 R284 N285 G286 Y287 S289 I315 I317	L253-L282 HydrophobicContact CD2-CD1 4.13Å; L253-L282 HydrophobicContact CD2-CD2 3.87Å; L253-L282 HydrophobicContact CD2-CG 4.18Å; L253-L282 HydrophobicContact CG-CD2 4.12Å; V254-L282 HydrophobicContact CG2-CD2 4.08Å; L257-L282 HydrophobicContact CD1-CD1 4.16Å; L257-L282 HydrophobicContact CD1-CD2 3.47Å; L257-L282 VanDerWaalsContact CD1-CD2 3.47Å; L257-L282 HydrophobicContact CD1-CG 4.48Å; I267-L282 HydrophobicContact CD1-CD1 3.6Å; V278-L282 HydrophobicContact CG1-CD1 4.34Å; V278-L282 HydrophobicContact CG1-CG 4.48Å; V278-L282 WeakPolarHBondContact O-CG 3.41Å; V278-L282 PolarHBondContact O-N 3.04Å; A279-L282 PolarHBondContact O-N 2.85Å; A279-L282 VanDerWaalsContact O-N 3.12Å; L282-R284 VanDerWaalsContact C-N 3.3Å; L282-R284 PolarHBondContact O-N 3.37Å; L282-N285 CarbonylContact O-C 3.42Å; L282-N285 WeakPolarHBondContact O-CA 3.5Å; L282-N285 PolarHBondContact O-N 2.7Å; L282-G286 PolarHBondContact O-N 3.4Å; L282-Y287 HydrophobicContact CD2-CD2 4.11Å; L282-Y287 PolarHBondContact O-N 2.93Å; L282-S289 WeakPolarHBondContact CB-OG 3.4Å; L282-I315 HydrophobicContact CD1-CD1 4.22Å; L282-I315 HydrophobicContact CD1-CG2 3.89Å; L282-I317 HydrophobicContact CD1-CD1 4.18Å; L282-I317 HydrophobicContact CD1-CG1 4.41Å
283	E	95.9	Very high	95.5	Very high	111 Å²	111	50 Å²	50	52%	0.519	26%	0.264	S	S	.	.	H	α-helix	trans	-57.6	-43	174.5	-75.5	179.1	-178.9	0	0	111.5	A279 N285 G286 Y287 S289	A279-E283 WeakPolarHBondContact O-CG 3.15Å; A279-E283 PolarHBondContact O-N 2.88Å; E283-N285 PolarHBondContact O-N 2.66Å; E283-G286 PolarHBondContact O-N 3.43Å; E283-Y287 WeakPolarHBondContact CA-O 3.49Å; E283-S289 VanDerWaalsContact OE1-O 3.1Å
284	R	95.8	Very high	94.8	Very high	179 Å²	179	48.7 Å²	48.7	68%	0.675	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.7	174.5	-76	-176.1	-68	149.6	-8.3	114	E280 L282	E280-R284 WeakPolarHBondContact O-CB 3.32Å; E280-R284 WeakPolarHBondContact O-CG 3.45Å; E280-R284 PolarHBondContact O-N 3.44Å; E280-R284 VanDerWaalsContact O-N 3.13Å; E280-R284 PolarHBondContact O-NE 3.36Å; L282-R284 VanDerWaalsContact C-N 3.3Å; L282-R284 PolarHBondContact O-N 3.37Å
285	N	94.7	Very high	94.2	Very high	92 Å²	92	53.4 Å²	53.4	49%	0.492	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	12.2	174.6	-73.8	-87.8	0	0	0	112.6	V254 A281 L282 E283 Y287	V254-N285 HydrophobicContact CG1-CB 4.21Å; V254-N285 HydrophobicContact CG2-CB 3.88Å; A281-N285 PolarHBondContact O-N 2.78Å; A281-N285 PolarHBondContact O-ND2 2.92Å; L282-N285 CarbonylContact O-C 3.42Å; L282-N285 WeakPolarHBondContact O-CA 3.5Å; L282-N285 PolarHBondContact O-N 2.7Å; E283-N285 PolarHBondContact O-N 2.66Å; N285-Y287 HydrophobicContact CB-CD2 4.14Å; N285-Y287 HydrophobicContact CB-CE2 4.34Å
286	G	94.1	Very high	93.6	Very high	72 Å²	72	55 Å²	55	74%	0.742	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	9.8	174	0	0	0	0	0	115	L282 E283	L282-G286 PolarHBondContact O-N 3.4Å; E283-G286 PolarHBondContact O-N 3.43Å
287	Y	96.2	Very high	93.1	Very high	45 Å²	45	55.2 Å²	55.2	18%	0.176	31%	0.305	C	S	.	.			trans	-86.4	134.5	175.3	-69.2	-82.3	0	0	0	111.3	V254 L257 E258 F262 L282 E283 N285 S289 I315	V254-Y287 HydrophobicContact CG1-CE2 4.32Å; L257-Y287 VanDerWaalsContact C-OH 3.27Å; L257-Y287 HydrophobicContact CB-CE1 3.83Å; L257-Y287 HydrophobicContact CB-CE2 4.3Å; L257-Y287 WeakPolarHBondContact CB-OH 3.25Å; L257-Y287 HydrophobicContact CD1-CE1 4.41Å; L257-Y287 HydrophobicContact CD1-CE2 4.37Å; E258-Y287 WeakPolarHBondContact CA-OH 3.42Å; E258-Y287 PolarHBondContact N-OH 3.48Å; E258-Y287 VanDerWaalsContact N-OH 3.11Å; F262-Y287 HydrophobicContact CZ-CE1 4.38Å; L282-Y287 HydrophobicContact CD2-CD2 4.11Å; L282-Y287 PolarHBondContact O-N 2.93Å; E283-Y287 WeakPolarHBondContact CA-O 3.49Å; N285-Y287 HydrophobicContact CB-CD2 4.14Å; N285-Y287 HydrophobicContact CB-CE2 4.34Å; Y287-S289 PolarHBondContact O-N 3.23Å; Y287-I315 HydrophobicContact CD1-CD1 3.57Å; Y287-I315 HydrophobicContact CE1-CD1 4.3Å; Y287-I315 HydrophobicContact CG-CD1 3.89Å
288	N	95.6	Very high	92.3	Very high	60 Å²	60	50.2 Å²	50.2	32%	0.321	28%	0.282	S	S	.	.			trans	-77.5	92.1	170.8	-177	16.6	0	0	0	109.3	R312 L313 D314 I315	N288-R312 PolarHBondContact ND2-O 3.27Å; N288-L313 WeakPolarHBondContact O-CD1 3.42Å; N288-D314 WeakPolarHBondContact CB-OD2 3.27Å; N288-D314 PolarHBondContact O-N 3.09Å; N288-D314 VanDerWaalsContact O-N 3.12Å; N288-I315 PolarHBondContact O-N 2.86Å; N288-I315 VanDerWaalsContact O-N 3.15Å
289	S	97	Very high	91.7	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.014	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.9	-172.7	82	0	0	0	0	112.4	A279 L282 E283 Y287 I315	A279-S289 PolarHBondContact O-OG 2.85Å; A279-S289 VanDerWaalsContact O-OG 3.1Å; L282-S289 WeakPolarHBondContact CB-OG 3.4Å; E283-S289 VanDerWaalsContact OE1-O 3.1Å; Y287-S289 PolarHBondContact O-N 3.23Å; S289-I315 CarbonylContact C-O 3.57Å; S289-I315 WeakPolarHBondContact CA-O 3.4Å
290	A	96.3	Very high	91.4	Very high	14 Å²	14	56.5 Å²	56.5	12%	0.116	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.9	177	0	0	0	0	0	111.7	T304 L313 I315 I317	A290-T304 HydrophobicContact CB-CG2 3.91Å; A290-L313 HydrophobicContact CB-CD1 3.77Å; A290-L313 HydrophobicContact CB-CD2 3.77Å; A290-L313 HydrophobicContact CB-CG 4.45Å; A290-I315 PolarHBondContact N-O 3.42Å; A290-I317 WeakPolarHBondContact O-CD1 3.28Å; A290-I317 PolarHBondContact O-N 2.96Å
291	A	95.9	Very high	91	Very high	14 Å²	14	51.8 Å²	51.8	12%	0.116	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	142.5	174.5	0	0	0	0	0	111.8	T275 L276 A279 I317	T275-A291 WeakPolarHBondContact O-CB 3.36Å; L276-A291 HydrophobicContact CD2-CB 3.67Å; L276-A291 HydrophobicContact CG-CB 4.37Å; A279-A291 HydrophobicContact CB-CB 4.33Å; A291-I317 CarbonylContact C-O 3.43Å; A291-I317 WeakPolarHBondContact CA-O 3.34Å
292	L	93	Very high	90.6	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	103.6	171.7	-165.4	71.9	0	0	0	109.5	M296 R301 L305 L316 I317 A318 A322 L326	L292-M296 HydrophobicContact CD1-CE 4.29Å; L292-M296 HydrophobicContact CD1-SD 3.94Å; L292-R301 HydrophobicContact CD1-CG 3.88Å; L292-L305 HydrophobicContact CD1-CD2 4.41Å; L292-L305 HydrophobicContact CD1-CG 4.49Å; L292-L305 HydrophobicContact CD2-CD2 3.88Å; L292-L316 HydrophobicContact CB-CD1 3.85Å; L292-L316 HydrophobicContact CB-CD2 4.11Å; L292-L316 HydrophobicContact CB-CG 3.92Å; L292-L316 HydrophobicContact CD2-CD1 4.5Å; L292-L316 HydrophobicContact CD2-CD2 3.53Å; L292-L316 HydrophobicContact CD2-CG 4.29Å; L292-L316 HydrophobicContact CG-CD2 4.36Å; L292-I317 PolarHBondContact N-O 3.31Å; L292-A318 HydrophobicContact CB-CB 4.03Å; L292-A318 HydrophobicContact CD2-CB 4.4Å; L292-A318 WeakPolarHBondContact O-CA 3.43Å; L292-A322 WeakPolarHBondContact CD2-O 3.3Å; L292-A322 HydrophobicContact CG-CB 4.27Å; L292-A322 WeakPolarHBondContact O-CB 3.37Å; L292-L326 HydrophobicContact CD2-CD1 4.11Å
293	N	88.1	Confident	90.3	Very high	9 Å²	9	60.5 Å²	60.5	5%	0.048	34%	0.341	C	S	.	.			trans	-139.3	169.9	-177.8	63.8	58.5	0	0	0	112.4	K272 T275 D295 M296	K272-N293 HydrophobicContact CB-CB 3.97Å; T275-N293 HydrophobicContact CG2-CB 4.27Å; T275-N293 PolarHBondContact OG1-ND2 3.45Å; N293-D295 VanDerWaalsContact C-N 3.26Å; N293-D295 PolarHBondContact O-N 3.2Å; N293-D295 PolarHBondContact OD1-N 3.5Å; N293-M296 PolarHBondContact N-SD 2.8Å; N293-M296 PolarHBondContact O-N 3.06Å
294	G	78.4	Confident	90.1	Very high	65 Å²	65	55.5 Å²	55.5	67%	0.67	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-13.1	-173.7	0	0	0	0	0	115.7	M296	G294-M296 VanDerWaalsContact C-N 3.34Å
295	D	82.5	Confident	89.9	Confident	111 Å²	111	48.1 Å²	48.1	59%	0.594	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.2	179.3	-66.1	-8.8	0	0	0	112	K272 N293 N297	K272-D295 WeakPolarHBondContact CD-OD2 3.36Å; K272-D295 WeakPolarHBondContact CE-OD2 3.35Å; K272-D295 VanDerWaalsContact NZ-CG 3.29Å; K272-D295 IonicContact NZ-OD1 3.21Å; K272-D295 PolarHBondContact NZ-OD1 3.46Å; K272-D295 IonicContact NZ-OD2 3.08Å; K272-D295 PolarHBondContact NZ-OD2 3.33Å; N293-D295 VanDerWaalsContact C-N 3.26Å; N293-D295 PolarHBondContact O-N 3.2Å; N293-D295 PolarHBondContact OD1-N 3.5Å; D295-N297 PolarHBondContact O-N 2.99Å
296	M	84.5	Confident	89.7	Confident	34 Å²	34	48.3 Å²	48.3	17%	0.167	29%	0.289	C	S	.	.	S	Bend	trans	-65.7	132.5	178.1	-65.6	173.7	75.9	0	0	110.6	L292 N293 G294 L300 R301 T304	L292-M296 HydrophobicContact CD1-CE 4.29Å; L292-M296 HydrophobicContact CD1-SD 3.94Å; N293-M296 PolarHBondContact N-SD 2.8Å; N293-M296 PolarHBondContact O-N 3.06Å; G294-M296 VanDerWaalsContact C-N 3.34Å; M296-L300 HydrophobicContact CE-CB 4.46Å; M296-L300 HydrophobicContact CE-CD2 4.09Å; M296-L300 HydrophobicContact CE-CG 3.78Å; M296-R301 HydrophobicContact CB-CB 4.41Å; M296-T304 WeakPolarHBondContact CE-OG1 3.38Å
297	N	85.1	Confident	89.8	Confident	102 Å²	102	48.3 Å²	48.3	55%	0.545	27%	0.267	S	S	.	.			trans	-63.8	157.7	167	74.6	46.6	0	0	0	110.1	D295 A299 L300 R301	D295-N297 PolarHBondContact O-N 2.99Å; N297-A299 PolarHBondContact O-N 3.22Å; N297-A299 PolarHBondContact OD1-N 3.44Å; N297-L300 PolarHBondContact O-N 3.25Å; N297-L300 VanDerWaalsContact OD1-CB 3.27Å; N297-L300 WeakPolarHBondContact OD1-CB 3.46Å; N297-L300 PolarHBondContact OD1-N 3.15Å; N297-R301 PolarHBondContact O-N 3.36Å; N297-R301 VanDerWaalsContact O-N 3.07Å
298	Q	80.9	Confident	89.7	Confident	15 Å²	15	46.1 Å²	46.1	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-66.8	-38.2	-169.6	178	51.5	11.5	0	0	113.6	R101 L300 R301 E302	R101-Q298 VanDerWaalsContact NH1-CD 3.34Å; Q298-L300 VanDerWaalsContact C-N 3.34Å; Q298-L300 PolarHBondContact O-N 3.23Å; Q298-R301 WeakPolarHBondContact O-CB 3.29Å; Q298-R301 PolarHBondContact O-N 3.49Å; Q298-E302 HydrophobicContact CG-CG 4.42Å; Q298-E302 WeakPolarHBondContact CG-OE1 3.22Å; Q298-E302 VanDerWaalsContact NE2-CD 3.3Å; Q298-E302 PolarHBondContact NE2-OE1 2.97Å; Q298-E302 WeakPolarHBondContact O-CG 3.41Å; Q298-E302 PolarHBondContact O-N 3.33Å
299	A	85.3	Confident	89.5	Confident	67 Å²	67	48 Å²	48	55%	0.554	26%	0.264	S	S	*	.	H	α-helix	trans	-62.2	-42.3	178.7	0	0	0	0	0	111.8	N297 Q303	N297-A299 PolarHBondContact O-N 3.22Å; N297-A299 PolarHBondContact OD1-N 3.44Å; A299-Q303 VanDerWaalsContact O-CB 3.31Å; A299-Q303 WeakPolarHBondContact O-CB 3.06Å; A299-Q303 PolarHBondContact O-N 3.48Å
300	L	89.2	Confident	89.3	Confident	74 Å²	74	51.4 Å²	51.4	39%	0.387	28%	0.281	S	S	.	.	H	α-helix	trans	-67.8	-37.6	177.6	-176.1	63.2	0	0	0	111.6	M296 N297 Q298 T304	M296-L300 HydrophobicContact CE-CB 4.46Å; M296-L300 HydrophobicContact CE-CD2 4.09Å; M296-L300 HydrophobicContact CE-CG 3.78Å; N297-L300 PolarHBondContact O-N 3.25Å; N297-L300 VanDerWaalsContact OD1-CB 3.27Å; N297-L300 WeakPolarHBondContact OD1-CB 3.46Å; N297-L300 PolarHBondContact OD1-N 3.15Å; Q298-L300 VanDerWaalsContact C-N 3.34Å; Q298-L300 PolarHBondContact O-N 3.23Å; L300-T304 WeakPolarHBondContact O-CB 3.31Å; L300-T304 PolarHBondContact O-N 3.44Å; L300-T304 PolarHBondContact O-OG1 3.34Å
301	R	88.5	Confident	89.2	Confident	13 Å²	13	52.3 Å²	52.3	5%	0.049	29%	0.293	C	S	.	.	H	α-helix	trans	-62.8	-50.5	175.7	179.8	172	172.7	81.5	-1.7	111.5	E102 L292 M296 N297 Q298 Q303 T304 L305 A322	E102-R301 IonicContact OE1-CZ 3.96Å; E102-R301 VanDerWaalsContact OE1-CZ 3.31Å; E102-R301 IonicContact OE1-NE 3.34Å; E102-R301 PolarHBondContact OE1-NE 2.92Å; E102-R301 IonicContact OE1-NH2 2.78Å; E102-R301 PolarHBondContact OE1-NH2 2.97Å; E102-R301 VanDerWaalsContact OE1-NH2 3.11Å; E102-R301 IonicContact OE2-CZ 2.84Å; E102-R301 IonicContact OE2-NE 3.37Å; E102-R301 IonicContact OE2-NH2 3.63Å; E102-R301 PolarHBondContact OE2-NH2 3.4Å; E102-R301 VanDerWaalsContact OE2-NH2 3.1Å; L292-R301 HydrophobicContact CD1-CG 3.88Å; M296-R301 HydrophobicContact CB-CB 4.41Å; N297-R301 PolarHBondContact O-N 3.36Å; N297-R301 VanDerWaalsContact O-N 3.07Å; Q298-R301 WeakPolarHBondContact O-CB 3.29Å; Q298-R301 PolarHBondContact O-N 3.49Å; R301-Q303 PolarHBondContact O-N 2.93Å; R301-T304 PolarHBondContact O-N 2.9Å; R301-L305 HydrophobicContact CG-CD1 4.35Å; R301-L305 WeakPolarHBondContact O-CG 3.13Å; R301-L305 PolarHBondContact O-N 3.48Å; R301-A322 PolarHBondContact NH1-O 2.85Å; R301-A322 PolarHBondContact NH2-O 2.8Å
302	E	87.5	Confident	89.1	Confident	86 Å²	86	58.1 Å²	58.1	40%	0.402	31%	0.311	S	S	.	.	H	α-helix	trans	-58	-47.7	175.4	-74.6	169.3	-173.8	0	0	111.2	Q298 T304 L305 E306	Q298-E302 HydrophobicContact CG-CG 4.42Å; Q298-E302 WeakPolarHBondContact CG-OE1 3.22Å; Q298-E302 VanDerWaalsContact NE2-CD 3.3Å; Q298-E302 PolarHBondContact NE2-OE1 2.97Å; Q298-E302 WeakPolarHBondContact O-CG 3.41Å; Q298-E302 PolarHBondContact O-N 3.33Å; E302-T304 VanDerWaalsContact C-N 3.27Å; E302-T304 PolarHBondContact O-N 3.43Å; E302-L305 PolarHBondContact O-N 2.98Å; E302-E306 WeakPolarHBondContact O-CB 3.3Å; E302-E306 PolarHBondContact O-N 3.26Å
303	Q	91.5	Very high	89.3	Confident	106 Å²	106	58.1 Å²	58.1	50%	0.495	31%	0.311	S	S	.	.	H	α-helix	trans	-59.4	-39.1	177.6	-173.8	-176.1	18.9	0	0	112.3	A299 R301 R307	A299-Q303 VanDerWaalsContact O-CB 3.31Å; A299-Q303 WeakPolarHBondContact O-CB 3.06Å; A299-Q303 PolarHBondContact O-N 3.48Å; R301-Q303 PolarHBondContact O-N 2.93Å; Q303-R307 WeakPolarHBondContact O-CB 3.46Å; Q303-R307 WeakPolarHBondContact O-CG 3.43Å; Q303-R307 PolarHBondContact O-N 3.18Å
304	T	92.7	Very high	89.7	Confident	5 Å²	5	60.3 Å²	60.3	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-69.1	-42.3	179.4	-57.1	0	0	0	0	111.3	A290 M296 L300 R301 E302 R307 L308 L313 L316	A290-T304 HydrophobicContact CB-CG2 3.91Å; M296-T304 WeakPolarHBondContact CE-OG1 3.38Å; L300-T304 WeakPolarHBondContact O-CB 3.31Å; L300-T304 PolarHBondContact O-N 3.44Å; L300-T304 PolarHBondContact O-OG1 3.34Å; R301-T304 PolarHBondContact O-N 2.9Å; E302-T304 VanDerWaalsContact C-N 3.27Å; E302-T304 PolarHBondContact O-N 3.43Å; T304-R307 PolarHBondContact O-N 3.16Å; T304-L308 PolarHBondContact O-N 3.3Å; T304-L308 VanDerWaalsContact O-N 3.11Å; T304-L313 HydrophobicContact CG2-CD2 3.98Å; T304-L316 HydrophobicContact CG2-CD1 3.71Å
305	L	91.2	Very high	90.6	Very high	25 Å²	25	57.2 Å²	57.2	13%	0.131	29%	0.291	C	S	.	.	H	α-helix	trans	-66	-40.5	175.5	-68.1	175.8	0	0	0	111.7	L292 R301 E302 L308 K309 L316 L326	L292-L305 HydrophobicContact CD1-CD2 4.41Å; L292-L305 HydrophobicContact CD1-CG 4.49Å; L292-L305 HydrophobicContact CD2-CD2 3.88Å; R301-L305 HydrophobicContact CG-CD1 4.35Å; R301-L305 WeakPolarHBondContact O-CG 3.13Å; R301-L305 PolarHBondContact O-N 3.48Å; E302-L305 PolarHBondContact O-N 2.98Å; L305-L308 WeakPolarHBondContact O-CB 3.24Å; L305-L308 PolarHBondContact O-N 2.91Å; L305-L308 VanDerWaalsContact O-N 3.11Å; L305-K309 WeakPolarHBondContact O-CG 3.48Å; L305-K309 PolarHBondContact O-N 2.89Å; L305-L316 HydrophobicContact CD2-CD2 4.19Å; L305-L326 HydrophobicContact CD2-CD1 3.57Å; L305-L326 HydrophobicContact CD2-CG 4.12Å
306	E	91.2	Very high	91.3	Very high	95 Å²	95	51.9 Å²	51.9	44%	0.444	26%	0.263	S	S	.	.	H	α-helix	trans	-63.1	-42.8	176.6	-170.3	58.6	-156.7	0	0	111.3	E302 L308 K309 D310	E302-E306 WeakPolarHBondContact O-CB 3.3Å; E302-E306 PolarHBondContact O-N 3.26Å; E306-L308 PolarHBondContact O-N 2.95Å; E306-K309 PolarHBondContact O-N 3.37Å; E306-K309 VanDerWaalsContact O-N 3.07Å; E306-D310 PolarHBondContact O-N 3Å
307	R	95	Very high	92	Very high	72 Å²	72	50.3 Å²	50.3	27%	0.272	26%	0.255	S	S	.	.	H	α-helix	trans	-59.2	-35.4	172.8	-72.7	168.9	63	-167.5	-2.2	112.4	Q303 T304 D310 G311 R312 L313	Q303-R307 WeakPolarHBondContact O-CB 3.46Å; Q303-R307 WeakPolarHBondContact O-CG 3.43Å; Q303-R307 PolarHBondContact O-N 3.18Å; T304-R307 PolarHBondContact O-N 3.16Å; R307-D310 WeakPolarHBondContact CA-OD1 3.43Å; R307-D310 VanDerWaalsContact O-OD1 3.06Å; R307-G311 PolarHBondContact O-N 3.48Å; R307-R312 HydrophobicContact CB-CB 4.1Å; R307-R312 HydrophobicContact CG-CB 4.13Å; R307-R312 CarbonylContact O-C 3.59Å; R307-R312 PolarHBondContact O-N 2.91Å; R307-L313 HydrophobicContact CB-CB 3.85Å; R307-L313 PolarHBondContact O-N 3.2Å
308	L	94.4	Very high	92.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-71.6	-36.9	175.1	-166.8	70.2	0	0	0	111.5	A264 T304 L305 E306 L313 L316 V328 R330 I331	A264-L308 HydrophobicContact CB-CD1 4.13Å; T304-L308 PolarHBondContact O-N 3.3Å; T304-L308 VanDerWaalsContact O-N 3.11Å; L305-L308 WeakPolarHBondContact O-CB 3.24Å; L305-L308 PolarHBondContact O-N 2.91Å; L305-L308 VanDerWaalsContact O-N 3.11Å; E306-L308 PolarHBondContact O-N 2.95Å; L308-L313 HydrophobicContact CB-CB 4.5Å; L308-L313 HydrophobicContact CB-CD2 4.26Å; L308-L313 HydrophobicContact CD1-CB 4.37Å; L308-L313 HydrophobicContact CD1-CD2 4.14Å; L308-L313 HydrophobicContact CD1-CG 4.15Å; L308-L316 HydrophobicContact CD1-CB 4.29Å; L308-L316 HydrophobicContact CD2-CB 3.89Å; L308-L316 HydrophobicContact CD2-CD2 3.84Å; L308-L316 HydrophobicContact CD2-CG 4.36Å; L308-V328 HydrophobicContact CD2-CG1 4.25Å; L308-V328 HydrophobicContact CD2-CG2 4.24Å; L308-V328 HydrophobicContact CG-CG1 4.2Å; L308-R330 PolarHBondContact O-NH1 2.66Å; L308-I331 HydrophobicContact CD2-CD1 4.27Å
309	K	91.7	Very high	93.1	Very high	100 Å²	100	45.5 Å²	45.5	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-67.8	-42	177.4	-72.9	179.8	177.3	-172.2	0	112.1	L305 E306 D327 V328 R330	L305-K309 WeakPolarHBondContact O-CG 3.48Å; L305-K309 PolarHBondContact O-N 2.89Å; E306-K309 PolarHBondContact O-N 3.37Å; E306-K309 VanDerWaalsContact O-N 3.07Å; K309-D327 WeakPolarHBondContact CE-O 3.36Å; K309-V328 HydrophobicContact CG-CG1 4.24Å; K309-V328 HydrophobicContact CG-CG2 3.86Å; K309-R330 VanDerWaalsContact O-CD 3.25Å; K309-R330 WeakPolarHBondContact O-CD 3.45Å
310	D	92.9	Very high	93.1	Very high	72 Å²	72	44.3 Å²	44.3	39%	0.385	22%	0.215	S	C	.	.	H	α-helix	trans	-92.8	1.7	-170.5	72.3	15.5	0	0	0	116.1	E306 R307 R312	E306-D310 PolarHBondContact O-N 3Å; R307-D310 WeakPolarHBondContact CA-OD1 3.43Å; R307-D310 VanDerWaalsContact O-OD1 3.06Å; D310-R312 VanDerWaalsContact CG-NE 3.3Å; D310-R312 VanDerWaalsContact OD1-CB 3.24Å; D310-R312 WeakPolarHBondContact OD1-CB 3.3Å; D310-R312 VanDerWaalsContact OD1-CG 3.24Å; D310-R312 WeakPolarHBondContact OD1-CG 3.49Å; D310-R312 PolarHBondContact OD1-N 2.89Å; D310-R312 IonicContact OD1-NE 2.72Å; D310-R312 PolarHBondContact OD1-NE 2.91Å; D310-R312 VanDerWaalsContact OD1-NE 3.11Å; D310-R312 IonicContact OD2-CZ 3.88Å; D310-R312 IonicContact OD2-NE 2.64Å; D310-R312 PolarHBondContact OD2-NE 3.02Å; D310-R312 IonicContact OD2-NH2 3.05Å; D310-R312 PolarHBondContact OD2-NH2 3.35Å
311	G	92.9	Very high	92.5	Very high	34 Å²	34	44.4 Å²	44.4	35%	0.351	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.8	-4.4	179	0	0	0	0	0	115.4	R307 L313	R307-G311 PolarHBondContact O-N 3.48Å; G311-L313 VanDerWaalsContact C-N 3.27Å; G311-L313 PolarHBondContact O-N 3.07Å
312	R	95	Very high	92.1	Very high	135 Å²	135	43.9 Å²	43.9	51%	0.509	22%	0.217	S	C	.	.	S	Bend	trans	-81	-3.3	177.7	-66.1	-177.9	-66.1	167.3	-5.7	114.2	N288 R307 D310	N288-R312 PolarHBondContact ND2-O 3.27Å; R307-R312 HydrophobicContact CB-CB 4.1Å; R307-R312 HydrophobicContact CG-CB 4.13Å; R307-R312 CarbonylContact O-C 3.59Å; R307-R312 PolarHBondContact O-N 2.91Å; D310-R312 VanDerWaalsContact CG-NE 3.3Å; D310-R312 VanDerWaalsContact OD1-CB 3.24Å; D310-R312 WeakPolarHBondContact OD1-CB 3.3Å; D310-R312 VanDerWaalsContact OD1-CG 3.24Å; D310-R312 WeakPolarHBondContact OD1-CG 3.49Å; D310-R312 PolarHBondContact OD1-N 2.89Å; D310-R312 IonicContact OD1-NE 2.72Å; D310-R312 PolarHBondContact OD1-NE 2.91Å; D310-R312 VanDerWaalsContact OD1-NE 3.11Å; D310-R312 IonicContact OD2-CZ 3.88Å; D310-R312 IonicContact OD2-NE 2.64Å; D310-R312 PolarHBondContact OD2-NE 3.02Å; D310-R312 IonicContact OD2-NH2 3.05Å; D310-R312 PolarHBondContact OD2-NH2 3.35Å
313	L	96.5	Very high	91.8	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.			trans	-139.9	137.4	172.7	-176.2	71.8	0	0	0	108.4	N288 A290 T304 R307 L308 G311 L316 R330	N288-L313 WeakPolarHBondContact O-CD1 3.42Å; A290-L313 HydrophobicContact CB-CD1 3.77Å; A290-L313 HydrophobicContact CB-CD2 3.77Å; A290-L313 HydrophobicContact CB-CG 4.45Å; T304-L313 HydrophobicContact CG2-CD2 3.98Å; R307-L313 HydrophobicContact CB-CB 3.85Å; R307-L313 PolarHBondContact O-N 3.2Å; L308-L313 HydrophobicContact CB-CB 4.5Å; L308-L313 HydrophobicContact CB-CD2 4.26Å; L308-L313 HydrophobicContact CD1-CB 4.37Å; L308-L313 HydrophobicContact CD1-CD2 4.14Å; L308-L313 HydrophobicContact CD1-CG 4.15Å; G311-L313 VanDerWaalsContact C-N 3.27Å; G311-L313 PolarHBondContact O-N 3.07Å; L313-L316 HydrophobicContact CD2-CD1 3.93Å; L313-R330 PolarHBondContact O-NH1 3.44Å
314	D	96.5	Very high	91.1	Very high	55 Å²	55	36.1 Å²	36.1	29%	0.294	18%	0.18	S	C	.	.			trans	-104.8	-34.2	-176.8	-58	-42.7	0	0	0	111.7	A264 A265 N288	A264-D314 CarbonylContact C-O 3.48Å; A264-D314 VanDerWaalsContact CA-O 3.31Å; A264-D314 WeakPolarHBondContact CA-O 3.46Å; A265-D314 PolarHBondContact N-O 2.92Å; N288-D314 WeakPolarHBondContact CB-OD2 3.27Å; N288-D314 PolarHBondContact O-N 3.09Å; N288-D314 VanDerWaalsContact O-N 3.12Å
315	I	98.1	Very high	90	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.9	-173.8	-51.5	-176	0	0	0	111.3	L257 F262 A265 I267 L282 Y287 N288 S289 A290 I317	L257-I315 HydrophobicContact CD1-CD1 3.69Å; L257-I315 HydrophobicContact CD2-CD1 4.05Å; L257-I315 HydrophobicContact CG-CD1 4.45Å; F262-I315 HydrophobicContact CE2-CD1 4.31Å; F262-I315 HydrophobicContact CE2-CG1 4Å; F262-I315 HydrophobicContact CZ-CD1 3.95Å; F262-I315 HydrophobicContact CZ-CG1 4.16Å; A265-I315 HydrophobicContact CB-CG1 4.31Å; A265-I315 HydrophobicContact CB-CG2 4.42Å; A265-I315 WeakPolarHBondContact O-CA 3.44Å; I267-I315 HydrophobicContact CD1-CG2 3.45Å; I267-I315 VanDerWaalsContact CD1-CG2 3.45Å; I267-I315 HydrophobicContact CG1-CG2 3.86Å; L282-I315 HydrophobicContact CD1-CD1 4.22Å; L282-I315 HydrophobicContact CD1-CG2 3.89Å; Y287-I315 HydrophobicContact CD1-CD1 3.57Å; Y287-I315 HydrophobicContact CE1-CD1 4.3Å; Y287-I315 HydrophobicContact CG-CD1 3.89Å; N288-I315 PolarHBondContact O-N 2.86Å; N288-I315 VanDerWaalsContact O-N 3.15Å; S289-I315 CarbonylContact C-O 3.57Å; S289-I315 WeakPolarHBondContact CA-O 3.4Å; A290-I315 PolarHBondContact N-O 3.42Å; I315-I317 HydrophobicContact CG2-CD1 4.16Å
316	L	97.5	Very high	89.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.8	174.9	-166.8	74.3	0	0	0	110.6	A265 I266 I267 L292 T304 L305 L308 L313 L326	A265-L316 PolarHBondContact O-N 3.07Å; I266-L316 CarbonylContact C-O 3.52Å; I266-L316 WeakPolarHBondContact CA-O 3.28Å; I266-L316 HydrophobicContact CD1-CD2 4.28Å; I267-L316 PolarHBondContact N-O 2.79Å; L292-L316 HydrophobicContact CB-CD1 3.85Å; L292-L316 HydrophobicContact CB-CD2 4.11Å; L292-L316 HydrophobicContact CB-CG 3.92Å; L292-L316 HydrophobicContact CD2-CD1 4.5Å; L292-L316 HydrophobicContact CD2-CD2 3.53Å; L292-L316 HydrophobicContact CD2-CG 4.29Å; L292-L316 HydrophobicContact CG-CD2 4.36Å; T304-L316 HydrophobicContact CG2-CD1 3.71Å; L305-L316 HydrophobicContact CD2-CD2 4.19Å; L308-L316 HydrophobicContact CD1-CB 4.29Å; L308-L316 HydrophobicContact CD2-CB 3.89Å; L308-L316 HydrophobicContact CD2-CD2 3.84Å; L308-L316 HydrophobicContact CD2-CG 4.36Å; L313-L316 HydrophobicContact CD2-CD1 3.93Å; L316-L326 HydrophobicContact CD2-CD1 3.44Å; L316-L326 VanDerWaalsContact CD2-CD1 3.44Å
317	I	98.2	Very high	89	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	115.6	176.2	-53.1	73.5	0	0	0	108.5	I267 V269 T275 V278 A279 L282 A290 A291 L292 I315	I267-I317 HydrophobicContact CB-CG1 4.31Å; I267-I317 HydrophobicContact CB-CG2 4.43Å; I267-I317 HydrophobicContact CD1-CG1 4.45Å; I267-I317 HydrophobicContact CG2-CG2 4.5Å; I267-I317 CarbonylContact O-C 3.6Å; I267-I317 WeakPolarHBondContact O-CA 3.44Å; V269-I317 HydrophobicContact CG1-CG2 3.82Å; V269-I317 HydrophobicContact CG2-CG2 3.92Å; T275-I317 HydrophobicContact CG2-CG2 4.37Å; V278-I317 HydrophobicContact CB-CG1 4.34Å; V278-I317 HydrophobicContact CB-CG2 4.1Å; V278-I317 HydrophobicContact CG1-CG1 3.97Å; V278-I317 HydrophobicContact CG1-CG2 4.24Å; A279-I317 HydrophobicContact CB-CD1 3.77Å; A279-I317 HydrophobicContact CB-CG1 4.35Å; L282-I317 HydrophobicContact CD1-CD1 4.18Å; L282-I317 HydrophobicContact CD1-CG1 4.41Å; A290-I317 WeakPolarHBondContact O-CD1 3.28Å; A290-I317 PolarHBondContact O-N 2.96Å; A291-I317 CarbonylContact C-O 3.43Å; A291-I317 WeakPolarHBondContact CA-O 3.34Å; L292-I317 PolarHBondContact N-O 3.31Å; I315-I317 HydrophobicContact CG2-CD1 4.16Å
318	A	96.3	Very high	88.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	154.2	-171.1	0	0	0	0	0	113.7	I266 I267 F268 V269 L292 A323	I266-A318 HydrophobicContact CD1-CB 4.37Å; I266-A318 HydrophobicContact CG1-CB 4.49Å; I267-A318 PolarHBondContact O-N 3.49Å; F268-A318 VanDerWaalsContact CA-O 3.31Å; F268-A318 WeakPolarHBondContact CA-O 3.29Å; V269-A318 PolarHBondContact N-O 3.11Å; L292-A318 HydrophobicContact CB-CB 4.03Å; L292-A318 HydrophobicContact CD2-CB 4.4Å; L292-A318 WeakPolarHBondContact O-CA 3.43Å; A318-A323 HydrophobicContact CB-CB 3.7Å
319	T	92.3	Very high	88.1	Confident	17 Å²	17	36.8 Å²	36.8	10%	0.104	19%	0.191	C	C	.	.			trans	-87.1	161.7	160.5	59.6	0	0	0	0	109.9	T275 V321 A322 A323	T275-T319 HydrophobicContact CG2-CG2 3.86Å; T319-V321 VanDerWaalsContact C-N 3.3Å; T319-V321 PolarHBondContact O-N 2.78Å; T319-A322 PolarHBondContact O-N 3.14Å; T319-A322 VanDerWaalsContact O-N 3.07Å; T319-A322 WeakPolarHBondContact OG1-CB 3.47Å; T319-A322 PolarHBondContact OG1-N 3.29Å; T319-A323 PolarHBondContact O-N 3.41Å
320	D	86	Confident	88	Confident	42 Å²	42	34.1 Å²	34.1	23%	0.225	18%	0.178	C	C	.	.	H	α-helix	trans	-51.3	-49.9	176.3	-69.7	-72.4	0	0	0	112	A322 A323 R324 R349	D320-A322 VanDerWaalsContact C-N 3.27Å; D320-A322 PolarHBondContact O-N 3.33Å; D320-A323 PolarHBondContact O-N 3.27Å; D320-R324 WeakPolarHBondContact O-CG 3.15Å; D320-R324 PolarHBondContact O-N 3.22Å; D320-R324 VanDerWaalsContact O-N 3.17Å; D320-R349 IonicContact OD1-CZ 3.08Å; D320-R349 IonicContact OD1-NE 2.77Å; D320-R349 PolarHBondContact OD1-NE 3.33Å; D320-R349 IonicContact OD1-NH2 3.43Å; D320-R349 IonicContact OD2-CZ 3.92Å; D320-R349 IonicContact OD2-NE 2.85Å; D320-R349 IonicContact OD2-NH2 2.76Å; D320-R349 PolarHBondContact OD2-NH2 3.16Å
321	V	77.1	Confident	88.1	Confident	75 Å²	75	30.9 Å²	30.9	46%	0.455	16%	0.161	S	C	.	.	H	α-helix	trans	-58.2	-42.4	-179.7	179.5	0	0	0	0	111	M181 T319	M181-V321 HydrophobicContact CE-CG1 4.37Å; T319-V321 VanDerWaalsContact C-N 3.3Å; T319-V321 PolarHBondContact O-N 2.78Å
322	A	79	Confident	88.1	Confident	3 Å²	3	30.3 Å²	30.3	3%	0.025	15%	0.151	C	C	.	.	H	α-helix	trans	-78.2	-17	-177.2	0	0	0	0	0	113.8	L292 R301 T319 D320	L292-A322 WeakPolarHBondContact CD2-O 3.3Å; L292-A322 HydrophobicContact CG-CB 4.27Å; L292-A322 WeakPolarHBondContact O-CB 3.37Å; R301-A322 PolarHBondContact NH1-O 2.85Å; R301-A322 PolarHBondContact NH2-O 2.8Å; T319-A322 PolarHBondContact O-N 3.14Å; T319-A322 VanDerWaalsContact O-N 3.07Å; T319-A322 WeakPolarHBondContact OG1-CB 3.47Å; T319-A322 PolarHBondContact OG1-N 3.29Å; D320-A322 VanDerWaalsContact C-N 3.27Å; D320-A322 PolarHBondContact O-N 3.33Å
323	A	82.3	Confident	88.2	Confident	3 Å²	3	24.2 Å²	24.2	3%	0.025	13%	0.129	C	C	.	.	H	α-helix	trans	-103.6	1.5	178.2	0	0	0	0	0	113.8	I266 F268 A318 T319 D320 L326	I266-A323 HydrophobicContact CD1-CB 3.85Å; F268-A323 HydrophobicContact CD1-CB 4.4Å; F268-A323 HydrophobicContact CE1-CB 3.4Å; F268-A323 HydrophobicContact CZ-CB 3.76Å; A318-A323 HydrophobicContact CB-CB 3.7Å; T319-A323 PolarHBondContact O-N 3.41Å; D320-A323 PolarHBondContact O-N 3.27Å; A323-L326 WeakPolarHBondContact O-CB 3.27Å; A323-L326 PolarHBondContact O-N 3.03Å
324	R	75.6	Confident	88.2	Confident	25 Å²	25	24.2 Å²	24.2	9%	0.094	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	146.3	171.6	-78	-176	-152.7	160	9	111.3	T100 E102 E177 R180 M181 D320 L326	T100-R324 HydrophobicContact CG2-CB 3.72Å; T100-R324 HydrophobicContact CG2-CG 4.47Å; E102-R324 WeakPolarHBondContact CB-O 3.48Å; E177-R324 IonicContact OE2-CZ 2.72Å; E177-R324 IonicContact OE2-NE 3.53Å; E177-R324 PolarHBondContact OE2-NE 3.48Å; E177-R324 IonicContact OE2-NH1 3.1Å; E177-R324 PolarHBondContact OE2-NH1 2.88Å; E177-R324 IonicContact OE2-NH2 3.5Å; E177-R324 PolarHBondContact OE2-NH2 2.9Å; R180-R324 VanDerWaalsContact NE-NH2 3.12Å; M181-R324 VanDerWaalsContact CG-NH1 3.33Å; M181-R324 PolarHBondContact SD-NH1 3.3Å; D320-R324 WeakPolarHBondContact O-CG 3.15Å; D320-R324 PolarHBondContact O-N 3.22Å; D320-R324 VanDerWaalsContact O-N 3.17Å; R324-L326 PolarHBondContact O-N 2.78Å
325	G	70.3	Confident	88.3	Confident	12 Å²	12	21.7 Å²	21.7	12%	0.124	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	4.5	-174.5	0	0	0	0	0	115	D327	G325-D327 PolarHBondContact O-N 2.95Å
326	L	80.8	Confident	88.3	Confident	4 Å²	4	21.7 Å²	21.7	2%	0.021	12%	0.115	C	C	.	.			trans	-67.8	119.6	177.2	-172.2	153.1	0	0	0	109.4	I266 L292 L305 L316 A323 R324 V328 I331 R352	I266-L326 HydrophobicContact CD1-CD1 4.02Å; L292-L326 HydrophobicContact CD2-CD1 4.11Å; L305-L326 HydrophobicContact CD2-CD1 3.57Å; L305-L326 HydrophobicContact CD2-CG 4.12Å; L316-L326 HydrophobicContact CD2-CD1 3.44Å; L316-L326 VanDerWaalsContact CD2-CD1 3.44Å; A323-L326 WeakPolarHBondContact O-CB 3.27Å; A323-L326 PolarHBondContact O-N 3.03Å; R324-L326 PolarHBondContact O-N 2.78Å; L326-V328 HydrophobicContact CD2-CB 3.9Å; L326-V328 HydrophobicContact CD2-CG2 3.63Å; L326-V328 HydrophobicContact CG-CG2 4.12Å; L326-I331 HydrophobicContact CD2-CD1 3.41Å; L326-I331 VanDerWaalsContact CD2-CD1 3.41Å; L326-R352 PolarHBondContact O-NH1 3.18Å
327	D	80.8	Confident	88.4	Confident	58 Å²	58	23 Å²	23	31%	0.31	12%	0.12	S	C	.	.			trans	-123.1	100.8	175.9	-160.6	7.5	0	0	0	110	Q106 K309 G325 R355	Q106-D327 PolarHBondContact NE2-OD2 2.8Å; K309-D327 WeakPolarHBondContact CE-O 3.36Å; G325-D327 PolarHBondContact O-N 2.95Å; D327-R355 IonicContact OD1-CZ 3.76Å; D327-R355 IonicContact OD1-NE 2.61Å; D327-R355 IonicContact OD1-NH1 2.7Å; D327-R355 PolarHBondContact OD1-NH1 2.84Å; D327-R355 IonicContact OD2-NH1 3.26Å
328	V	85.4	Confident	88.3	Confident	5 Å²	5	24 Å²	24	3%	0.03	13%	0.126	C	C	.	.			trans	-140.4	105.4	-178.6	-179.8	0	0	0	0	108.2	L308 K309 L326 R330 I331	L308-V328 HydrophobicContact CD2-CG1 4.25Å; L308-V328 HydrophobicContact CD2-CG2 4.24Å; L308-V328 HydrophobicContact CG-CG1 4.2Å; K309-V328 HydrophobicContact CG-CG1 4.24Å; K309-V328 HydrophobicContact CG-CG2 3.86Å; L326-V328 HydrophobicContact CD2-CB 3.9Å; L326-V328 HydrophobicContact CD2-CG2 3.63Å; L326-V328 HydrophobicContact CG-CG2 4.12Å; V328-R330 HydrophobicContact CG1-CB 4.21Å; V328-R330 PolarHBondContact O-N 3.24Å; V328-I331 HydrophobicContact CB-CD1 3.86Å; V328-I331 HydrophobicContact CB-CG1 4.02Å; V328-I331 HydrophobicContact CG1-CD1 4.37Å; V328-I331 HydrophobicContact CG1-CG1 4.04Å; V328-I331 PolarHBondContact O-N 3.17Å
329	E	85.4	Confident	88.2	Confident	132 Å²	132	24 Å²	24	62%	0.617	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.7	-175	-61.9	-177.8	170.2	0	0	113.9	I331	E329-I331 PolarHBondContact O-N 3.09Å
330	R	90	Very high	88.1	Confident	45 Å²	45	23.3 Å²	23.3	17%	0.17	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.6	177.3	-72.3	-175.9	62.2	-133.1	2	113.8	D263 A264 L308 K309 L313 V328 S332	D263-R330 PolarHBondContact O-NH2 3.39Å; D263-R330 IonicContact OD1-CZ 3.97Å; D263-R330 IonicContact OD1-NE 3.73Å; D263-R330 PolarHBondContact OD1-NE 3.4Å; D263-R330 IonicContact OD1-NH2 3.11Å; D263-R330 PolarHBondContact OD1-NH2 2.74Å; D263-R330 IonicContact OD2-NE 3.64Å; A264-R330 HydrophobicContact CB-CB 3.94Å; A264-R330 PolarHBondContact N-O 3.07Å; A264-R330 VanDerWaalsContact N-O 3.07Å; L308-R330 PolarHBondContact O-NH1 2.66Å; K309-R330 VanDerWaalsContact O-CD 3.25Å; K309-R330 WeakPolarHBondContact O-CD 3.45Å; L313-R330 PolarHBondContact O-NH1 3.44Å; V328-R330 HydrophobicContact CG1-CB 4.21Å; V328-R330 PolarHBondContact O-N 3.24Å; R330-S332 PolarHBondContact O-N 2.98Å
331	I	93.7	Very high	87.9	Confident	4 Å²	4	27 Å²	27	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	106.5	-177.8	-64.1	175.3	0	0	0	109.1	A264 I266 L308 L326 V328 E329 V334 R352 T353	A264-I331 HydrophobicContact CB-CG1 4.35Å; A264-I331 WeakPolarHBondContact O-CA 3.46Å; I266-I331 HydrophobicContact CB-CD1 4.16Å; I266-I331 HydrophobicContact CB-CG2 4.45Å; I266-I331 HydrophobicContact CG2-CD1 4.22Å; I266-I331 HydrophobicContact CG2-CG2 3.77Å; L308-I331 HydrophobicContact CD2-CD1 4.27Å; L326-I331 HydrophobicContact CD2-CD1 3.41Å; L326-I331 VanDerWaalsContact CD2-CD1 3.41Å; V328-I331 HydrophobicContact CB-CD1 3.86Å; V328-I331 HydrophobicContact CB-CG1 4.02Å; V328-I331 HydrophobicContact CG1-CD1 4.37Å; V328-I331 HydrophobicContact CG1-CG1 4.04Å; V328-I331 PolarHBondContact O-N 3.17Å; E329-I331 PolarHBondContact O-N 3.09Å; I331-V334 HydrophobicContact CG2-CG2 4.28Å; I331-R352 HydrophobicContact CG2-CB 4.46Å; I331-T353 WeakPolarHBondContact O-CA 3.33Å; I331-T353 WeakPolarHBondContact O-CB 3.45Å; I331-T353 PolarHBondContact O-OG1 2.86Å; I331-T353 VanDerWaalsContact O-OG1 3.04Å
332	S	93.8	Very high	88.1	Confident	21 Å²	21	26.4 Å²	26.4	15%	0.147	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-13.4	176.9	64.7	0	0	0	0	112.6	F262 D263 A264 R330 T353 R361	F262-S332 WeakPolarHBondContact CA-OG 3.48Å; F262-S332 WeakPolarHBondContact CB-OG 3.37Å; D263-S332 PolarHBondContact N-OG 3.18Å; A264-S332 PolarHBondContact O-N 2.92Å; R330-S332 PolarHBondContact O-N 2.98Å; S332-T353 VanDerWaalsContact C-OG1 3.22Å; S332-T353 WeakPolarHBondContact CA-OG1 3.41Å; S332-T353 PolarHBondContact O-OG1 3.08Å; S332-R361 PolarHBondContact O-N 2.84Å
333	L	96.4	Very high	88	Confident	8 Å²	8	27.5 Å²	27.5	4%	0.042	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.5	-179.9	179.2	62	0	0	0	111.2	L257 F262 A264 A265 I266 V335 R361	L257-L333 HydrophobicContact CD2-CD2 3.92Å; F262-L333 HydrophobicContact CB-CB 3.88Å; F262-L333 HydrophobicContact CB-CD2 4.3Å; F262-L333 HydrophobicContact CD1-CD2 3.9Å; F262-L333 HydrophobicContact CE1-CD2 4.48Å; F262-L333 HydrophobicContact CG-CB 4.36Å; F262-L333 HydrophobicContact CG-CD2 4.11Å; A264-L333 PolarHBondContact O-N 2.71Å; A265-L333 CarbonylContact C-O 3.42Å; A265-L333 VanDerWaalsContact CA-O 3.23Å; A265-L333 WeakPolarHBondContact CA-O 3.22Å; A265-L333 HydrophobicContact CB-CB 4.01Å; A265-L333 HydrophobicContact CB-CD2 4.12Å; A265-L333 HydrophobicContact CB-CG 4.22Å; I266-L333 PolarHBondContact N-O 2.66Å; L333-V335 HydrophobicContact CD1-CG2 4.27Å; L333-V335 HydrophobicContact CD2-CG2 4.13Å; L333-V335 HydrophobicContact CG-CG2 4Å; L333-R361 CarbonylContact C-O 3.56Å; L333-R361 WeakPolarHBondContact CA-O 3.4Å; L333-R361 HydrophobicContact CD1-CB 4.12Å
334	V	97.2	Very high	87.7	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.3	168.2	175.1	0	0	0	0	108.4	I266 F268 I331 R352 T353 R361 A362 L363	I266-V334 HydrophobicContact CG2-CB 4.31Å; I266-V334 HydrophobicContact CG2-CG1 4.37Å; I266-V334 HydrophobicContact CG2-CG2 3.68Å; I266-V334 CarbonylContact O-C 3.54Å; I266-V334 WeakPolarHBondContact O-CA 3.44Å; F268-V334 HydrophobicContact CD2-CG1 3.94Å; F268-V334 HydrophobicContact CE2-CG1 4Å; I331-V334 HydrophobicContact CG2-CG2 4.28Å; V334-R352 HydrophobicContact CG2-CB 4.07Å; V334-T353 HydrophobicContact CB-CG2 4.36Å; V334-T353 HydrophobicContact CG2-CG2 3.65Å; V334-R361 PolarHBondContact N-O 2.82Å; V334-A362 HydrophobicContact CB-CB 4.46Å; V334-A362 CarbonylContact O-C 3.53Å; V334-A362 VanDerWaalsContact O-CA 3.28Å; V334-A362 WeakPolarHBondContact O-CA 3.06Å; V334-L363 PolarHBondContact O-N 2.98Å
335	V	98.4	Very high	88	Confident	1 Å²	1	29 Å²	29	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	116.1	171	-173.1	0	0	0	0	109.2	L253 I266 I267 F268 L333 Y337 L363 F365	L253-V335 HydrophobicContact CD1-CB 4.46Å; L253-V335 HydrophobicContact CD1-CG1 3.95Å; L253-V335 HydrophobicContact CD1-CG2 4.38Å; I266-V335 PolarHBondContact O-N 2.76Å; I267-V335 CarbonylContact C-O 3.51Å; I267-V335 VanDerWaalsContact CA-O 3.29Å; I267-V335 WeakPolarHBondContact CA-O 3.42Å; I267-V335 HydrophobicContact CG1-CB 4.16Å; I267-V335 HydrophobicContact CG1-CG2 4.48Å; I267-V335 HydrophobicContact CG2-CB 4.34Å; F268-V335 PolarHBondContact N-O 3.42Å; L333-V335 HydrophobicContact CD1-CG2 4.27Å; L333-V335 HydrophobicContact CD2-CG2 4.13Å; L333-V335 HydrophobicContact CG-CG2 4Å; V335-Y337 VanDerWaalsContact C-N 3.33Å; V335-Y337 PolarHBondContact O-N 3.16Å; V335-Y337 VanDerWaalsContact O-N 3.15Å; V335-L363 CarbonylContact C-O 3.52Å; V335-L363 WeakPolarHBondContact CA-O 3.42Å; V335-F365 HydrophobicContact CG1-CE1 4.33Å; V335-F365 HydrophobicContact CG1-CZ 4.25Å
336	N	98.4	Very high	88.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	82.4	168.4	-68	-88.1	0	0	0	108.3	D338 R349 L363 L364 F365	N336-D338 VanDerWaalsContact C-N 3.27Å; N336-D338 PolarHBondContact O-N 3.34Å; N336-R349 WeakPolarHBondContact OD1-CD 3.41Å; N336-R349 PolarHBondContact OD1-NH1 2.95Å; N336-R349 VanDerWaalsContact OD1-NH1 3.11Å; N336-L363 PolarHBondContact N-O 2.81Å; N336-L364 HydrophobicContact CB-CB 4.37Å; N336-L364 HydrophobicContact CB-CD1 3.37Å; N336-L364 HydrophobicContact CB-CG 4.47Å; N336-F365 PolarHBondContact O-N 2.89Å
337	Y	98.4	Very high	89.1	Confident	29 Å²	29	30 Å²	30	11%	0.114	15%	0.152	C	C	.	.	S	Bend	trans	-61.1	-39.6	178.9	-179.9	-81.5	0	0	0	111.5	K249 N250 L253 I267 F268 V269 V278 V335 F365	K249-Y337 HydrophobicContact CB-CD2 4.32Å; K249-Y337 HydrophobicContact CB-CE1 4.18Å; K249-Y337 HydrophobicContact CB-CE2 3.46Å; K249-Y337 VanDerWaalsContact CB-CE2 3.46Å; K249-Y337 VanDerWaalsContact CB-OH 3.23Å; K249-Y337 WeakPolarHBondContact CB-OH 3.37Å; K249-Y337 HydrophobicContact CD-CD1 4.02Å; K249-Y337 HydrophobicContact CD-CE1 3.55Å; K249-Y337 HydrophobicContact CD-CE2 4.21Å; K249-Y337 HydrophobicContact CG-CE2 4.47Å; K249-Y337 PolarHBondContact NZ-O 3.25Å; N250-Y337 WeakPolarHBondContact OD1-CE2 3.36Å; N250-Y337 PolarHBondContact OD1-OH 3.08Å; L253-Y337 HydrophobicContact CD2-CD2 4.08Å; L253-Y337 HydrophobicContact CD2-CE2 4.3Å; I267-Y337 HydrophobicContact CG2-CG 4.48Å; F268-Y337 WeakPolarHBondContact O-CB 3.24Å; F268-Y337 PolarHBondContact O-N 3.14Å; V269-Y337 HydrophobicContact CG1-CD1 3.82Å; V269-Y337 HydrophobicContact CG1-CG 4.03Å; V278-Y337 HydrophobicContact CG2-CE1 4.24Å; V278-Y337 HydrophobicContact CG2-CE2 4.12Å; V335-Y337 VanDerWaalsContact C-N 3.33Å; V335-Y337 PolarHBondContact O-N 3.16Å; V335-Y337 VanDerWaalsContact O-N 3.15Å; Y337-F365 HydrophobicContact CD2-CD2 4.07Å; Y337-F365 HydrophobicContact CD2-CE2 4Å; Y337-F365 HydrophobicContact CE2-CE2 4.48Å; Y337-F365 HydrophobicContact CG-CD2 4.42Å; Y337-F365 WeakPolarHBondContact O-CB 3.39Å
338	D	96.9	Very high	89.2	Confident	21 Å²	21	28.5 Å²	28.5	11%	0.112	14%	0.143	C	C	.	.	S	Bend	trans	-112	127.6	165.5	-64.8	-43.9	0	0	0	109.8	K249 F268 V269 R270 N336 R349	K249-D338 IonicContact NZ-OD1 3.52Å; K249-D338 PolarHBondContact NZ-OD1 2.86Å; F268-D338 PolarHBondContact O-N 2.66Å; F268-D338 VanDerWaalsContact O-N 3.14Å; V269-D338 WeakPolarHBondContact CA-OD2 3.3Å; R270-D338 HydrophobicContact CB-CB 4.07Å; R270-D338 WeakPolarHBondContact CB-OD2 3.3Å; R270-D338 PolarHBondContact N-OD2 2.78Å; N336-D338 VanDerWaalsContact C-N 3.27Å; N336-D338 PolarHBondContact O-N 3.34Å; D338-R349 PolarHBondContact O-NH1 3.38Å
339	I	94.9	Very high	89.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.142	C	C	.	.			trans	-58.1	133.6	174.7	-172.1	162.9	0	0	0	111.1	R270 L364 V366 E370 L373 L374 I377	R270-I339 PolarHBondContact NH2-O 3.37Å; I339-L364 HydrophobicContact CB-CD1 3.88Å; I339-L364 HydrophobicContact CD1-CD1 4.39Å; I339-L364 HydrophobicContact CD1-CD2 4.15Å; I339-L364 HydrophobicContact CG1-CD1 3.9Å; I339-L364 HydrophobicContact CG1-CD2 4.37Å; I339-V366 HydrophobicContact CD1-CG1 4.43Å; I339-V366 HydrophobicContact CD1-CG2 4.24Å; I339-E370 HydrophobicContact CG2-CB 3.83Å; I339-E370 HydrophobicContact CG2-CG 3.84Å; I339-E370 VanDerWaalsContact CG2-OE1 3.3Å; I339-E370 WeakPolarHBondContact CG2-OE1 3.19Å; I339-E370 WeakPolarHBondContact CG2-OE2 3.44Å; I339-L373 HydrophobicContact CD1-CB 3.63Å; I339-L373 HydrophobicContact CG1-CB 4.09Å; I339-L373 HydrophobicContact CG2-CD1 3.8Å; I339-L374 HydrophobicContact CD1-CB 4.18Å; I339-I377 HydrophobicContact CD1-CD1 4.1Å; I339-I377 HydrophobicContact CG1-CD1 3.95Å
340	P	89.3	Confident	89.7	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.115	C	C	.	.			trans	-64.5	156.6	174.1	25.5	-32.6	0	0	0	111.4	D342 Y346 I377	P340-D342 VanDerWaalsContact C-N 3.28Å; P340-Y346 HydrophobicContact CG-CD2 4.09Å; P340-Y346 HydrophobicContact CG-CG 4.31Å; P340-I377 HydrophobicContact CG-CD1 4.14Å
341	M	82.8	Confident	89.6	Confident	121 Å²	121	21.3 Å²	21.3	60%	0.596	12%	0.117	S	C	*	.	S	Bend	trans	-77.5	-17.8	-178.8	-63.5	-57.3	-68.3	0	0	113.1	R270 L373	R270-M341 PolarHBondContact NH1-SD 3.35Å; M341-L373 HydrophobicContact SD-CD1 4.19Å
342	D	79.8	Confident	89.3	Confident	61 Å²	61	22.3 Å²	22.3	33%	0.326	12%	0.12	S	C	.	.	S	Bend	trans	-142.2	159.2	-176.1	58.9	80.7	0	0	0	111	P340 E344 S345 Y346	P340-D342 VanDerWaalsContact C-N 3.28Å; D342-E344 VanDerWaalsContact C-N 3.34Å; D342-E344 PolarHBondContact OD1-N 3.29Å; D342-S345 VanDerWaalsContact CG-OG 3.29Å; D342-S345 VanDerWaalsContact OD1-CB 3.24Å; D342-S345 WeakPolarHBondContact OD1-CB 3.21Å; D342-S345 PolarHBondContact OD1-N 3.21Å; D342-S345 PolarHBondContact OD1-OG 3.34Å; D342-S345 PolarHBondContact OD2-OG 2.92Å; D342-S345 VanDerWaalsContact OD2-OG 3.11Å; D342-Y346 PolarHBondContact O-N 2.92Å
343	S	77.4	Confident	89	Confident	27 Å²	27	21.3 Å²	21.3	19%	0.189	11%	0.114	C	C	.	.	H	α-helix	trans	-70.6	-28.1	-177.2	47.1	0	0	0	0	113.6	Y346 V347 T380	S343-Y346 WeakPolarHBondContact O-CB 3.48Å; S343-Y346 PolarHBondContact O-N 3.41Å; S343-V347 WeakPolarHBondContact O-CG2 3.2Å; S343-V347 PolarHBondContact O-N 2.87Å; S343-V347 VanDerWaalsContact O-N 3.1Å; S343-T380 WeakPolarHBondContact OG-CG2 3.31Å; S343-T380 PolarHBondContact OG-OG1 3.48Å
344	E	76.7	Confident	88.3	Confident	53 Å²	53	21.5 Å²	21.5	25%	0.248	12%	0.117	C	C	.	.	H	α-helix	trans	-68.5	-46.6	-179.8	178.9	173.3	-168.4	0	0	110.9	A205 D342 Y346 V347 H348	A205-E344 VanDerWaalsContact CB-OE1 3.25Å; A205-E344 WeakPolarHBondContact CB-OE1 3.12Å; D342-E344 VanDerWaalsContact C-N 3.34Å; D342-E344 PolarHBondContact OD1-N 3.29Å; E344-Y346 VanDerWaalsContact C-N 3.26Å; E344-Y346 PolarHBondContact O-N 3.01Å; E344-V347 PolarHBondContact O-N 3.27Å; E344-V347 VanDerWaalsContact O-N 3.1Å; E344-H348 VanDerWaalsContact CG-CE1 3.5Å; E344-H348 WeakPolarHBondContact CG-CE1 3.05Å; E344-H348 PolarHBondContact O-N 2.95Å; E344-H348 IonicContact OE1-CE1 3.97Å
345	S	82.1	Confident	87.2	Confident	5 Å²	5	24.8 Å²	24.8	4%	0.035	13%	0.129	C	C	.	.	H	α-helix	trans	-58.4	-39.7	173.7	-59.1	0	0	0	0	110.9	D342 H348 R349	D342-S345 VanDerWaalsContact CG-OG 3.29Å; D342-S345 VanDerWaalsContact OD1-CB 3.24Å; D342-S345 WeakPolarHBondContact OD1-CB 3.21Å; D342-S345 PolarHBondContact OD1-N 3.21Å; D342-S345 PolarHBondContact OD1-OG 3.34Å; D342-S345 PolarHBondContact OD2-OG 2.92Å; D342-S345 VanDerWaalsContact OD2-OG 3.11Å; S345-H348 PolarHBondContact O-N 3.22Å; S345-R349 WeakPolarHBondContact O-CB 3.38Å; S345-R349 WeakPolarHBondContact O-CG 3.43Å; S345-R349 PolarHBondContact O-N 2.61Å
346	Y	88.2	Confident	85.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59	-48.9	173.7	-177.9	-101.1	0	0	0	112.5	Q239 P340 D342 S343 E344 H348 R349 I350 L364 I377 M381 I385	Q239-Y346 VanDerWaalsContact OE1-CE1 3.28Å; Q239-Y346 PolarHBondContact OE1-OH 3.48Å; P340-Y346 HydrophobicContact CG-CD2 4.09Å; P340-Y346 HydrophobicContact CG-CG 4.31Å; D342-Y346 PolarHBondContact O-N 2.92Å; S343-Y346 WeakPolarHBondContact O-CB 3.48Å; S343-Y346 PolarHBondContact O-N 3.41Å; E344-Y346 VanDerWaalsContact C-N 3.26Å; E344-Y346 PolarHBondContact O-N 3.01Å; Y346-H348 VanDerWaalsContact C-N 3.33Å; Y346-H348 PolarHBondContact O-N 3.19Å; Y346-R349 PolarHBondContact O-N 2.74Å; Y346-I350 HydrophobicContact CD1-CD1 4.31Å; Y346-I350 HydrophobicContact CD2-CG2 4.38Å; Y346-I350 HydrophobicContact CE1-CD1 3.82Å; Y346-I350 HydrophobicContact CE1-CG2 4.09Å; Y346-I350 HydrophobicContact CE2-CG2 3.93Å; Y346-I350 PolarHBondContact O-N 3.07Å; Y346-L364 HydrophobicContact CD2-CD2 4.47Å; Y346-L364 HydrophobicContact CE2-CB 4.33Å; Y346-L364 HydrophobicContact CE2-CD2 3.99Å; Y346-I377 HydrophobicContact CD1-CG2 3.43Å; Y346-I377 VanDerWaalsContact CD1-CG2 3.43Å; Y346-I377 HydrophobicContact CD2-CD1 4.16Å; Y346-I377 HydrophobicContact CD2-CG2 4.39Å; Y346-I377 HydrophobicContact CE1-CG2 3.79Å; Y346-I377 HydrophobicContact CG-CD1 4.13Å; Y346-I377 HydrophobicContact CG-CG1 4.48Å; Y346-I377 HydrophobicContact CG-CG2 3.75Å; Y346-M381 HydrophobicContact CD1-CE 4.22Å; Y346-M381 HydrophobicContact CD1-SD 3.35Å; Y346-M381 WeakPolarHBondContact CD1-SD 3.46Å; Y346-M381 HydrophobicContact CE1-CE 3.83Å; Y346-M381 HydrophobicContact CE1-SD 3.36Å; Y346-M381 WeakPolarHBondContact CE1-SD 3.24Å; Y346-I385 HydrophobicContact CE1-CD1 4.1Å
347	V	84.3	Confident	83.9	Confident	37 Å²	37	32.9 Å²	32.9	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-43.4	177.8	172.9	0	0	0	0	111.1	S343 E344 R349 I350 G351 M381	S343-V347 WeakPolarHBondContact O-CG2 3.2Å; S343-V347 PolarHBondContact O-N 2.87Å; S343-V347 VanDerWaalsContact O-N 3.1Å; E344-V347 PolarHBondContact O-N 3.27Å; E344-V347 VanDerWaalsContact O-N 3.1Å; V347-R349 VanDerWaalsContact C-N 3.34Å; V347-R349 PolarHBondContact O-N 3.44Å; V347-I350 WeakPolarHBondContact O-CG1 3.24Å; V347-I350 PolarHBondContact O-N 3.48Å; V347-G351 PolarHBondContact O-N 2.91Å; V347-M381 HydrophobicContact CG2-CG 4.3Å; V347-M381 HydrophobicContact CG2-SD 4.23Å
348	H	82.9	Confident	82.7	Confident	27 Å²	27	37.5 Å²	37.5	13%	0.125	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-35.1	178.3	-69	172.3	0	0	0	113.5	T69 E344 S345 Y346 R352	T69-H348 WeakPolarHBondContact CG2-NE2 3.42Å; T69-H348 PolarHBondContact OG1-CD2 3.26Å; E344-H348 VanDerWaalsContact CG-CE1 3.5Å; E344-H348 WeakPolarHBondContact CG-CE1 3.05Å; E344-H348 PolarHBondContact O-N 2.95Å; E344-H348 IonicContact OE1-CE1 3.97Å; S345-H348 PolarHBondContact O-N 3.22Å; Y346-H348 VanDerWaalsContact C-N 3.33Å; Y346-H348 PolarHBondContact O-N 3.19Å; H348-R352 PolarHBondContact O-NE 3.5Å; H348-R352 PolarHBondContact O-NH2 2.98Å
349	R	92	Very high	81.9	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-70.1	-50.2	176.6	-71.6	177.8	-176.9	-165	-0.9	111.5	F268 D320 N336 D338 S345 Y346 V347 G351 R352	F268-R349 HydrophobicContact CB-CG 4.44Å; F268-R349 HydrophobicContact CD1-CG 3.68Å; F268-R349 HydrophobicContact CD2-CB 3.82Å; F268-R349 HydrophobicContact CD2-CG 3.77Å; F268-R349 HydrophobicContact CE1-CB 4.42Å; F268-R349 HydrophobicContact CE1-CG 3.66Å; F268-R349 HydrophobicContact CE2-CB 3.67Å; F268-R349 HydrophobicContact CE2-CG 3.79Å; F268-R349 HydrophobicContact CG-CB 4.28Å; F268-R349 HydrophobicContact CG-CG 3.71Å; F268-R349 HydrophobicContact CZ-CB 3.99Å; F268-R349 HydrophobicContact CZ-CG 3.74Å; D320-R349 IonicContact OD1-CZ 3.08Å; D320-R349 IonicContact OD1-NE 2.77Å; D320-R349 PolarHBondContact OD1-NE 3.33Å; D320-R349 IonicContact OD1-NH2 3.43Å; D320-R349 IonicContact OD2-CZ 3.92Å; D320-R349 IonicContact OD2-NE 2.85Å; D320-R349 IonicContact OD2-NH2 2.76Å; D320-R349 PolarHBondContact OD2-NH2 3.16Å; N336-R349 WeakPolarHBondContact OD1-CD 3.41Å; N336-R349 PolarHBondContact OD1-NH1 2.95Å; N336-R349 VanDerWaalsContact OD1-NH1 3.11Å; D338-R349 PolarHBondContact O-NH1 3.38Å; S345-R349 WeakPolarHBondContact O-CB 3.38Å; S345-R349 WeakPolarHBondContact O-CG 3.43Å; S345-R349 PolarHBondContact O-N 2.61Å; Y346-R349 PolarHBondContact O-N 2.74Å; V347-R349 VanDerWaalsContact C-N 3.34Å; V347-R349 PolarHBondContact O-N 3.44Å; R349-G351 PolarHBondContact O-N 2.95Å; R349-R352 WeakPolarHBondContact O-CB 3.35Å; R349-R352 VanDerWaalsContact O-CG 3.28Å; R349-R352 WeakPolarHBondContact O-CG 3.37Å; R349-R352 PolarHBondContact O-N 3.29Å; R349-R352 VanDerWaalsContact O-N 3.13Å
350	I	91	Very high	81.7	Confident	9 Å²	9	39.7 Å²	39.7	5%	0.046	24%	0.243	C	C	.	.	H	α-helix	trans	-68.5	-27.3	179.7	70.1	172.3	0	0	0	111.8	I237 Q239 Y346 V347 R352 T353 A362 M381	I237-I350 HydrophobicContact CD1-CB 4.41Å; I237-I350 HydrophobicContact CD1-CD1 4.49Å; I237-I350 HydrophobicContact CD1-CG1 4.3Å; I237-I350 WeakPolarHBondContact CD1-O 3.34Å; Q239-I350 HydrophobicContact CG-CD1 4.47Å; Y346-I350 HydrophobicContact CD1-CD1 4.31Å; Y346-I350 HydrophobicContact CD2-CG2 4.38Å; Y346-I350 HydrophobicContact CE1-CD1 3.82Å; Y346-I350 HydrophobicContact CE1-CG2 4.09Å; Y346-I350 HydrophobicContact CE2-CG2 3.93Å; Y346-I350 PolarHBondContact O-N 3.07Å; V347-I350 WeakPolarHBondContact O-CG1 3.24Å; V347-I350 PolarHBondContact O-N 3.48Å; I350-R352 PolarHBondContact O-N 3.3Å; I350-T353 WeakPolarHBondContact O-CG2 3.43Å; I350-T353 PolarHBondContact O-N 2.91Å; I350-A362 HydrophobicContact CB-CB 3.98Å; I350-A362 HydrophobicContact CG2-CB 3.45Å; I350-A362 VanDerWaalsContact CG2-CB 3.45Å; I350-M381 HydrophobicContact CD1-CE 4.05Å
351	G	86.8	Confident	81.9	Confident	20 Å²	20	44 Å²	44	21%	0.206	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	2.1	171.7	0	0	0	0	0	115.2	V347 R349 T353 R355	V347-G351 PolarHBondContact O-N 2.91Å; R349-G351 PolarHBondContact O-N 2.95Å; G351-T353 VanDerWaalsContact C-N 3.33Å; G351-R355 PolarHBondContact O-NE 2.81Å; G351-R355 PolarHBondContact O-NH2 3.18Å
352	R	87.2	Confident	82.5	Confident	25 Å²	25	38.3 Å²	38.3	9%	0.094	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-19.8	166.8	-59.7	-54.7	119.6	178.4	7	112.9	I266 F268 L326 I331 V334 H348 R349 I350	I266-R352 HydrophobicContact CD1-CG 4.48Å; I266-R352 HydrophobicContact CG2-CB 4.04Å; I266-R352 HydrophobicContact CG2-CG 4.49Å; F268-R352 HydrophobicContact CE2-CG 4.14Å; F268-R352 HydrophobicContact CZ-CG 3.89Å; L326-R352 PolarHBondContact O-NH1 3.18Å; I331-R352 HydrophobicContact CG2-CB 4.46Å; V334-R352 HydrophobicContact CG2-CB 4.07Å; H348-R352 PolarHBondContact O-NE 3.5Å; H348-R352 PolarHBondContact O-NH2 2.98Å; R349-R352 WeakPolarHBondContact O-CB 3.35Å; R349-R352 VanDerWaalsContact O-CG 3.28Å; R349-R352 WeakPolarHBondContact O-CG 3.37Å; R349-R352 PolarHBondContact O-N 3.29Å; R349-R352 VanDerWaalsContact O-N 3.13Å; I350-R352 PolarHBondContact O-N 3.3Å
353	T	89.1	Confident	83.4	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	22%	0.217	C	C	.	.	S	Bend	trans	-110.9	170.3	174	-172.4	0	0	0	0	110.9	I237 I331 S332 V334 I350 G351 G360	I237-T353 HydrophobicContact CD1-CG2 4.31Å; I237-T353 HydrophobicContact CG1-CG2 4.22Å; I237-T353 HydrophobicContact CG2-CG2 4.09Å; I331-T353 WeakPolarHBondContact O-CA 3.33Å; I331-T353 WeakPolarHBondContact O-CB 3.45Å; I331-T353 PolarHBondContact O-OG1 2.86Å; I331-T353 VanDerWaalsContact O-OG1 3.04Å; S332-T353 VanDerWaalsContact C-OG1 3.22Å; S332-T353 WeakPolarHBondContact CA-OG1 3.41Å; S332-T353 PolarHBondContact O-OG1 3.08Å; V334-T353 HydrophobicContact CB-CG2 4.36Å; V334-T353 HydrophobicContact CG2-CG2 3.65Å; I350-T353 WeakPolarHBondContact O-CG2 3.43Å; I350-T353 PolarHBondContact O-N 2.91Å; G351-T353 VanDerWaalsContact C-N 3.33Å; T353-G360 WeakPolarHBondContact OG1-CA 3.29Å
354	G	80	Confident	84.4	Confident	11 Å²	11	34.4 Å²	34.4	11%	0.113	21%	0.208	C	C	.	.	S	Bend	trans	80	25.4	174.2	0	0	0	0	0	113.8	P235 R358	P235-G354 WeakPolarHBondContact CB-O 3.19Å; G354-R358 CarbonylContact C-O 3.5Å; G354-R358 WeakPolarHBondContact CA-O 3.29Å
355	R	74.4	Confident	85.4	Confident	69 Å²	69	31.9 Å²	31.9	26%	0.26	20%	0.197	S	C	.	.			trans	-86.2	156.4	-177.1	-63.9	-176	174.7	-121.7	-12.5	111.4	D327 G351 G357 R358	D327-R355 IonicContact OD1-CZ 3.76Å; D327-R355 IonicContact OD1-NE 2.61Å; D327-R355 IonicContact OD1-NH1 2.7Å; D327-R355 PolarHBondContact OD1-NH1 2.84Å; D327-R355 IonicContact OD2-NH1 3.26Å; G351-R355 PolarHBondContact O-NE 2.81Å; G351-R355 PolarHBondContact O-NH2 3.18Å; R355-G357 PolarHBondContact O-N 2.87Å; R355-G357 VanDerWaalsContact O-N 3.15Å; R355-R358 WeakPolarHBondContact O-CB 3.49Å; R355-R358 PolarHBondContact O-N 2.62Å
356	A	64	Low	86.1	Confident	87 Å²	87	31.7 Å²	31.7	72%	0.719	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	38.3	174.9	0	0	0	0	0	114.6	R358	A356-R358 VanDerWaalsContact C-N 3.25Å; A356-R358 PolarHBondContact O-N 2.81Å
357	G	63.2	Low	86.3	Confident	84 Å²	84	33.8 Å²	33.8	87%	0.866	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	3.7	179.4	0	0	0	0	0	115.4	R355	R355-G357 PolarHBondContact O-N 2.87Å; R355-G357 VanDerWaalsContact O-N 3.15Å
358	R	72.9	Confident	86.6	Confident	127 Å²	127	37.6 Å²	37.6	48%	0.479	22%	0.224	S	C	.	.			trans	-76.7	143.2	173.9	-60.5	175.6	67.6	81.1	-7.5	110	G354 R355 A356	G354-R358 CarbonylContact C-O 3.5Å; G354-R358 WeakPolarHBondContact CA-O 3.29Å; R355-R358 WeakPolarHBondContact O-CB 3.49Å; R355-R358 PolarHBondContact O-N 2.62Å; A356-R358 VanDerWaalsContact C-N 3.25Å; A356-R358 PolarHBondContact O-N 2.81Å
359	A	80.2	Confident	86.9	Confident	65 Å²	65	46 Å²	46	54%	0.537	25%	0.254	S	S	.	.			trans	-67	138.6	168.2	0	0	0	0	0	110	D236	D236-A359 CarbonylContact O-C 3.47Å; D236-A359 WeakPolarHBondContact O-CA 3.14Å
360	G	90.4	Very high	86.8	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	160.2	175.9	0	0	0	0	0	112.2	D236 I237 S238 T353	D236-G360 PolarHBondContact O-N 2.92Å; I237-G360 CarbonylContact C-O 3.59Å; I237-G360 VanDerWaalsContact CA-O 3.29Å; I237-G360 WeakPolarHBondContact CA-O 3.38Å; S238-G360 PolarHBondContact N-O 2.93Å; T353-G360 WeakPolarHBondContact OG1-CA 3.29Å
361	R	94.1	Very high	86.7	Confident	91 Å²	91	50.1 Å²	50.1	34%	0.343	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137	175.6	-59.9	-177.5	67.1	-170.9	-3.1	111	S238 E260 S332 L333 V334	S238-R361 CarbonylContact O-C 3.52Å; S238-R361 WeakPolarHBondContact O-CA 3.23Å; E260-R361 VanDerWaalsContact CD-CZ 3.42Å; E260-R361 VanDerWaalsContact CD-NH1 3.29Å; E260-R361 IonicContact OE1-CZ 2.66Å; E260-R361 IonicContact OE1-NH1 3.42Å; E260-R361 IonicContact OE1-NH2 2.76Å; E260-R361 PolarHBondContact OE1-NH2 3.4Å; E260-R361 IonicContact OE2-CZ 3.34Å; E260-R361 IonicContact OE2-NH1 3.66Å; E260-R361 PolarHBondContact OE2-NH1 2.85Å; E260-R361 IonicContact OE2-NH2 2.61Å; E260-R361 PolarHBondContact OE2-NH2 3.18Å; S332-R361 PolarHBondContact O-N 2.84Å; L333-R361 CarbonylContact C-O 3.56Å; L333-R361 WeakPolarHBondContact CA-O 3.4Å; L333-R361 HydrophobicContact CD1-CB 4.12Å; V334-R361 PolarHBondContact N-O 2.82Å
362	A	96.2	Very high	86.5	Confident	2 Å²	2	56.1 Å²	56.1	2%	0.017	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	121	178.2	0	0	0	0	0	110.5	I237 S238 Q239 S240 V334 I350	I237-A362 HydrophobicContact CG2-CB 3.81Å; S238-A362 PolarHBondContact O-N 2.83Å; Q239-A362 CarbonylContact C-O 3.5Å; Q239-A362 WeakPolarHBondContact CA-O 3.24Å; Q239-A362 HydrophobicContact CG-CB 4.09Å; S240-A362 PolarHBondContact N-O 2.82Å; V334-A362 HydrophobicContact CB-CB 4.46Å; V334-A362 CarbonylContact O-C 3.53Å; V334-A362 VanDerWaalsContact O-CA 3.28Å; V334-A362 WeakPolarHBondContact O-CA 3.06Å; I350-A362 HydrophobicContact CB-CB 3.98Å; I350-A362 HydrophobicContact CG2-CB 3.45Å; I350-A362 VanDerWaalsContact CG2-CB 3.45Å
363	L	97.9	Very high	86.5	Confident	7 Å²	7	55.8 Å²	55.8	4%	0.037	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.5	175.1	179.4	61	0	0	0	109.7	S240 W242 F256 V334 V335 N336 F365 V388	S240-L363 CarbonylContact O-C 3.6Å; S240-L363 WeakPolarHBondContact O-CA 3.35Å; S240-L363 WeakPolarHBondContact OG-CD1 3.37Å; W242-L363 HydrophobicContact CB-CD1 4.45Å; F256-L363 HydrophobicContact CB-CD2 3.83Å; F256-L363 HydrophobicContact CD1-CD2 3.47Å; F256-L363 VanDerWaalsContact CD1-CD2 3.47Å; F256-L363 HydrophobicContact CD2-CD2 3.72Å; F256-L363 HydrophobicContact CE1-CD1 4.35Å; F256-L363 HydrophobicContact CE1-CD2 3.88Å; F256-L363 HydrophobicContact CE2-CD2 4.11Å; F256-L363 HydrophobicContact CG-CD2 3.4Å; F256-L363 HydrophobicContact CZ-CD1 4.5Å; F256-L363 HydrophobicContact CZ-CD2 4.19Å; V334-L363 PolarHBondContact O-N 2.98Å; V335-L363 CarbonylContact C-O 3.52Å; V335-L363 WeakPolarHBondContact CA-O 3.42Å; N336-L363 PolarHBondContact N-O 2.81Å; L363-F365 HydrophobicContact CD2-CD1 4.47Å; L363-F365 HydrophobicContact CD2-CE1 3.67Å; L363-F365 HydrophobicContact CD2-CZ 4.48Å; L363-F365 HydrophobicContact CG-CD1 4.25Å; L363-F365 HydrophobicContact CG-CE1 3.92Å; L363-V388 HydrophobicContact CD1-CG2 3.84Å
364	L	98	Very high	86.6	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.3	-180	174.2	62.5	0	0	0	111.4	S240 Y241 W242 N336 I339 Y346 V366 L374 I377	S240-L364 PolarHBondContact O-N 3.12Å; Y241-L364 CarbonylContact C-O 3.58Å; Y241-L364 WeakPolarHBondContact CA-O 3.32Å; Y241-L364 WeakPolarHBondContact CB-O 3.45Å; W242-L364 PolarHBondContact N-O 3.3Å; N336-L364 HydrophobicContact CB-CB 4.37Å; N336-L364 HydrophobicContact CB-CD1 3.37Å; N336-L364 HydrophobicContact CB-CG 4.47Å; I339-L364 HydrophobicContact CB-CD1 3.88Å; I339-L364 HydrophobicContact CD1-CD1 4.39Å; I339-L364 HydrophobicContact CD1-CD2 4.15Å; I339-L364 HydrophobicContact CG1-CD1 3.9Å; I339-L364 HydrophobicContact CG1-CD2 4.37Å; Y346-L364 HydrophobicContact CD2-CD2 4.47Å; Y346-L364 HydrophobicContact CE2-CB 4.33Å; Y346-L364 HydrophobicContact CE2-CD2 3.99Å; L364-V366 HydrophobicContact CD2-CG2 3.96Å; L364-V366 HydrophobicContact CG-CG2 3.73Å; L364-L374 HydrophobicContact CD2-CD1 3.88Å; L364-I377 HydrophobicContact CD2-CD1 4.4Å
365	F	98.4	Very high	87	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	131.5	171	-68.2	-2.3	0	0	0	110	W242 V244 K249 L253 F256 V335 N336 Y337 L363	W242-F365 HydrophobicContact CB-CD1 4.28Å; W242-F365 AromaticContact CE3-CD1 3.76Å; W242-F365 HydrophobicContact CE3-CD1 3.76Å; W242-F365 HydrophobicContact CE3-CD2 4.38Å; W242-F365 AromaticContact CE3-CE1 3.96Å; W242-F365 HydrophobicContact CE3-CE1 3.96Å; W242-F365 AromaticContact CE3-CG 3.99Å; W242-F365 HydrophobicContact CE3-CG 3.99Å; W242-F365 HydrophobicContact CE3-CZ 4.37Å; W242-F365 HydrophobicContact CZ3-CD2 4.46Å; W242-F365 HydrophobicContact CZ3-CG 4.46Å; V244-F365 HydrophobicContact CG2-CB 3.94Å; K249-F365 HydrophobicContact CB-CD2 4.28Å; K249-F365 HydrophobicContact CB-CE2 4.44Å; K249-F365 HydrophobicContact CD-CD2 4.32Å; K249-F365 HydrophobicContact CG-CD2 4.21Å; L253-F365 HydrophobicContact CB-CE2 4.12Å; L253-F365 HydrophobicContact CB-CZ 4.24Å; L253-F365 HydrophobicContact CD1-CZ 4.36Å; F256-F365 AromaticContact CD2-CE1 3.68Å; F256-F365 HydrophobicContact CD2-CE1 3.68Å; F256-F365 AromaticContact CD2-CZ 3.78Å; F256-F365 HydrophobicContact CD2-CZ 3.78Å; F256-F365 AromaticContact CE2-CE1 3.75Å; F256-F365 HydrophobicContact CE2-CE1 3.75Å; F256-F365 HydrophobicContact CE2-CZ 4.19Å; V335-F365 HydrophobicContact CG1-CE1 4.33Å; V335-F365 HydrophobicContact CG1-CZ 4.25Å; N336-F365 PolarHBondContact O-N 2.89Å; Y337-F365 HydrophobicContact CD2-CD2 4.07Å; Y337-F365 HydrophobicContact CD2-CE2 4Å; Y337-F365 HydrophobicContact CE2-CE2 4.48Å; Y337-F365 HydrophobicContact CG-CD2 4.42Å; Y337-F365 WeakPolarHBondContact O-CB 3.39Å; L363-F365 HydrophobicContact CD2-CD1 4.47Å; L363-F365 HydrophobicContact CD2-CE1 3.67Å; L363-F365 HydrophobicContact CD2-CZ 4.48Å; L363-F365 HydrophobicContact CG-CD1 4.25Å; L363-F365 HydrophobicContact CG-CE1 3.92Å
366	V	97	Very high	87.2	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	114.5	-176.1	-172.4	0	0	0	0	110.4	Y241 W242 T243 V244 I339 L364 E370 L374	Y241-V366 HydrophobicContact CD2-CB 4.2Å; Y241-V366 HydrophobicContact CD2-CG2 3.8Å; Y241-V366 HydrophobicContact CG-CG2 4.27Å; W242-V366 PolarHBondContact O-N 2.93Å; T243-V366 CarbonylContact C-O 3.55Å; T243-V366 WeakPolarHBondContact CA-O 3.37Å; V244-V366 PolarHBondContact N-O 3.3Å; I339-V366 HydrophobicContact CD1-CG1 4.43Å; I339-V366 HydrophobicContact CD1-CG2 4.24Å; L364-V366 HydrophobicContact CD2-CG2 3.96Å; L364-V366 HydrophobicContact CG-CG2 3.73Å; V366-E370 HydrophobicContact CG1-CB 4.18Å; V366-L374 HydrophobicContact CG1-CB 4.23Å; V366-L374 HydrophobicContact CG1-CD2 4.43Å; V366-L374 HydrophobicContact CG2-CB 4.48Å; V366-L374 HydrophobicContact CG2-CD2 4.34Å
367	E	93.4	Very high	88.1	Confident	44 Å²	44	56.4 Å²	56.4	21%	0.206	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	158.9	169.5	-64.7	176.6	-159.7	0	0	111.4	V244 K249 R369 E370 R371	V244-E367 HydrophobicContact CB-CG 3.93Å; V244-E367 HydrophobicContact CG1-CG 4.26Å; V244-E367 HydrophobicContact CG2-CG 4.1Å; K249-E367 WeakPolarHBondContact CE-OE1 3.33Å; K249-E367 IonicContact NZ-OE1 3.94Å; K249-E367 PolarHBondContact NZ-OE1 3.31Å; E367-R369 HydrophobicContact CB-CG 4.27Å; E367-R369 PolarHBondContact O-N 3.41Å; E367-R369 VanDerWaalsContact O-N 3.16Å; E367-R369 IonicContact OE1-NH2 3.07Å; E367-R369 IonicContact OE2-CZ 3.7Å; E367-R369 IonicContact OE2-NE 3.12Å; E367-R369 PolarHBondContact OE2-NE 2.93Å; E367-R369 IonicContact OE2-NH2 2.84Å; E367-R369 PolarHBondContact OE2-NH2 3.26Å; E367-E370 HydrophobicContact CB-CG 4.11Å; E367-E370 WeakPolarHBondContact CB-OE2 3.5Å; E367-E370 PolarHBondContact N-OE2 3.01Å; E367-E370 WeakPolarHBondContact O-CA 3.48Å; E367-E370 WeakPolarHBondContact O-CB 3.42Å; E367-E370 PolarHBondContact O-N 2.78Å; E367-R371 PolarHBondContact O-N 3.44Å
368	N	88.6	Confident	89.3	Confident	117 Å²	117	54.1 Å²	54.1	63%	0.626	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-56.7	-37.7	-177.8	-167.4	41.3	0	0	0	113.3	E370 R371	N368-E370 PolarHBondContact O-N 3.22Å; N368-R371 WeakPolarHBondContact O-CG 3.45Å; N368-R371 PolarHBondContact O-N 3.17Å; N368-R371 PolarHBondContact OD1-NE 3.36Å
369	R	89.2	Confident	89.5	Confident	202 Å²	202	56.4 Å²	56.4	76%	0.762	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-67.4	-19.4	175.7	66.5	-175.4	168.5	172.4	-2.7	113.5	E367	E367-R369 HydrophobicContact CB-CG 4.27Å; E367-R369 PolarHBondContact O-N 3.41Å; E367-R369 VanDerWaalsContact O-N 3.16Å; E367-R369 IonicContact OE1-NH2 3.07Å; E367-R369 IonicContact OE2-CZ 3.7Å; E367-R369 IonicContact OE2-NE 3.12Å; E367-R369 PolarHBondContact OE2-NE 2.93Å; E367-R369 IonicContact OE2-NH2 2.84Å; E367-R369 PolarHBondContact OE2-NH2 3.26Å
370	E	90.7	Very high	89.2	Confident	17 Å²	17	57.7 Å²	57.7	8%	0.079	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-96.4	-2.7	-175.3	-60.3	176.1	140.7	0	0	113	R270 I339 V366 E367 N368 R372 L373 L374	R270-E370 IonicContact NH2-OE1 3.69Å; I339-E370 HydrophobicContact CG2-CB 3.83Å; I339-E370 HydrophobicContact CG2-CG 3.84Å; I339-E370 VanDerWaalsContact CG2-OE1 3.3Å; I339-E370 WeakPolarHBondContact CG2-OE1 3.19Å; I339-E370 WeakPolarHBondContact CG2-OE2 3.44Å; V366-E370 HydrophobicContact CG1-CB 4.18Å; E367-E370 HydrophobicContact CB-CG 4.11Å; E367-E370 WeakPolarHBondContact CB-OE2 3.5Å; E367-E370 PolarHBondContact N-OE2 3.01Å; E367-E370 WeakPolarHBondContact O-CA 3.48Å; E367-E370 WeakPolarHBondContact O-CB 3.42Å; E367-E370 PolarHBondContact O-N 2.78Å; N368-E370 PolarHBondContact O-N 3.22Å; E370-R372 PolarHBondContact O-N 3.49Å; E370-L373 HydrophobicContact CB-CD1 4.44Å; E370-L373 WeakPolarHBondContact O-CA 3.49Å; E370-L373 WeakPolarHBondContact O-CB 3.34Å; E370-L373 PolarHBondContact O-N 2.95Å; E370-L374 PolarHBondContact O-N 3.27Å
371	R	90.1	Very high	88.6	Confident	81 Å²	81	58.4 Å²	58.4	31%	0.306	25%	0.252	S	S	.	.	H	α-helix	trans	-52.6	-28	178.6	-74.9	-172	179	-87	0.2	114	E367 N368 R375	E367-R371 PolarHBondContact O-N 3.44Å; N368-R371 WeakPolarHBondContact O-CG 3.45Å; N368-R371 PolarHBondContact O-N 3.17Å; N368-R371 PolarHBondContact OD1-NE 3.36Å; R371-R375 WeakPolarHBondContact O-CG 3.29Å; R371-R375 PolarHBondContact O-N 3.42Å; R371-R375 VanDerWaalsContact O-N 3.15Å
372	R	82	Confident	87.9	Confident	146 Å²	146	62.5 Å²	62.5	55%	0.551	27%	0.272	S	S	*	.	H	α-helix	trans	-67.5	-37.9	174.4	-173.8	-179.6	63.2	76.6	-1.1	112.2	E370 N376	E370-R372 PolarHBondContact O-N 3.49Å; R372-N376 VanDerWaalsContact O-CG 3.29Å; R372-N376 PolarHBondContact O-N 3.45Å; R372-N376 VanDerWaalsContact O-N 3.09Å; R372-N376 PolarHBondContact O-OD1 2.96Å
373	L	86	Confident	87.3	Confident	18 Å²	18	65.9 Å²	65.9	9%	0.094	29%	0.29	C	S	.	.	H	α-helix	trans	-67.2	-43.3	177.4	-62.4	174.9	0	0	0	110.4	I339 M341 E370 R375 N376 I377	I339-L373 HydrophobicContact CD1-CB 3.63Å; I339-L373 HydrophobicContact CG1-CB 4.09Å; I339-L373 HydrophobicContact CG2-CD1 3.8Å; M341-L373 HydrophobicContact SD-CD1 4.19Å; E370-L373 HydrophobicContact CB-CD1 4.44Å; E370-L373 WeakPolarHBondContact O-CA 3.49Å; E370-L373 WeakPolarHBondContact O-CB 3.34Å; E370-L373 PolarHBondContact O-N 2.95Å; L373-R375 PolarHBondContact O-N 3.19Å; L373-N376 WeakPolarHBondContact O-CB 3.26Å; L373-N376 PolarHBondContact O-N 3.48Å; L373-N376 VanDerWaalsContact O-N 3.12Å; L373-I377 WeakPolarHBondContact O-CG1 3.36Å; L373-I377 PolarHBondContact O-N 3.35Å
374	L	92.4	Very high	86.9	Confident	6 Å²	6	71.4 Å²	71.4	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-55.5	-52.1	173.6	174.6	65	0	0	0	111.2	Y241 I339 L364 V366 E370 N376 I377 E378 I385	Y241-L374 HydrophobicContact CD1-CD1 4.41Å; Y241-L374 HydrophobicContact CD1-CD2 4.07Å; Y241-L374 HydrophobicContact CD2-CD2 3.89Å; Y241-L374 HydrophobicContact CE1-CD2 3.9Å; Y241-L374 HydrophobicContact CE2-CD2 3.7Å; Y241-L374 HydrophobicContact CG-CD1 4.4Å; Y241-L374 HydrophobicContact CG-CD2 4.06Å; I339-L374 HydrophobicContact CD1-CB 4.18Å; L364-L374 HydrophobicContact CD2-CD1 3.88Å; V366-L374 HydrophobicContact CG1-CB 4.23Å; V366-L374 HydrophobicContact CG1-CD2 4.43Å; V366-L374 HydrophobicContact CG2-CB 4.48Å; V366-L374 HydrophobicContact CG2-CD2 4.34Å; E370-L374 PolarHBondContact O-N 3.27Å; L374-N376 PolarHBondContact O-N 3.1Å; L374-I377 WeakPolarHBondContact O-CB 3.38Å; L374-I377 PolarHBondContact O-N 2.94Å; L374-E378 HydrophobicContact CD1-CG 4.21Å; L374-E378 HydrophobicContact CG-CG 4.47Å; L374-E378 WeakPolarHBondContact O-CG 3.18Å; L374-E378 PolarHBondContact O-N 3.48Å; L374-I385 HydrophobicContact CD1-CD1 4.1Å
375	R	87.3	Confident	86.7	Confident	114 Å²	114	71.6 Å²	71.6	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-58.5	-34.4	177.9	-73.3	-171.5	-63.9	-100.5	4.3	113	R371 L373 R379	R371-R375 WeakPolarHBondContact O-CG 3.29Å; R371-R375 PolarHBondContact O-N 3.42Å; R371-R375 VanDerWaalsContact O-N 3.15Å; L373-R375 PolarHBondContact O-N 3.19Å; R375-R379 WeakPolarHBondContact O-CB 3.47Å; R375-R379 WeakPolarHBondContact O-CD 3.42Å; R375-R379 WeakPolarHBondContact O-CG 3.28Å; R375-R379 PolarHBondContact O-N 2.97Å
376	N	79	Confident	86.6	Confident	59 Å²	59	75 Å²	75	32%	0.316	35%	0.347	S	S	.	.	H	α-helix	trans	-68.8	-42.8	176.3	-74.6	-4.3	0	0	0	111.3	R372 L373 L374 R379 T380	R372-N376 VanDerWaalsContact O-CG 3.29Å; R372-N376 PolarHBondContact O-N 3.45Å; R372-N376 VanDerWaalsContact O-N 3.09Å; R372-N376 PolarHBondContact O-OD1 2.96Å; L373-N376 WeakPolarHBondContact O-CB 3.26Å; L373-N376 PolarHBondContact O-N 3.48Å; L373-N376 VanDerWaalsContact O-N 3.12Å; L374-N376 PolarHBondContact O-N 3.1Å; N376-R379 PolarHBondContact O-N 3.27Å; N376-T380 PolarHBondContact O-N 2.69Å; N376-T380 PolarHBondContact O-OG1 2.99Å; N376-T380 VanDerWaalsContact O-OG1 3.1Å
377	I	83.6	Confident	86.6	Confident	2 Å²	2	79.9 Å²	79.9	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-58.5	-52.6	174.8	-66.3	165.9	0	0	0	110.2	I339 P340 Y346 L364 L373 L374 R379 T380 M381 I385	I339-I377 HydrophobicContact CD1-CD1 4.1Å; I339-I377 HydrophobicContact CG1-CD1 3.95Å; P340-I377 HydrophobicContact CG-CD1 4.14Å; Y346-I377 HydrophobicContact CD1-CG2 3.43Å; Y346-I377 VanDerWaalsContact CD1-CG2 3.43Å; Y346-I377 HydrophobicContact CD2-CD1 4.16Å; Y346-I377 HydrophobicContact CD2-CG2 4.39Å; Y346-I377 HydrophobicContact CE1-CG2 3.79Å; Y346-I377 HydrophobicContact CG-CD1 4.13Å; Y346-I377 HydrophobicContact CG-CG1 4.48Å; Y346-I377 HydrophobicContact CG-CG2 3.75Å; L364-I377 HydrophobicContact CD2-CD1 4.4Å; L373-I377 WeakPolarHBondContact O-CG1 3.36Å; L373-I377 PolarHBondContact O-N 3.35Å; L374-I377 WeakPolarHBondContact O-CB 3.38Å; L374-I377 PolarHBondContact O-N 2.94Å; I377-R379 VanDerWaalsContact C-N 3.35Å; I377-R379 PolarHBondContact O-N 3.21Å; I377-T380 PolarHBondContact O-N 2.82Å; I377-M381 HydrophobicContact CG2-CG 4.42Å; I377-M381 HydrophobicContact CG2-SD 3.62Å; I377-M381 WeakPolarHBondContact O-CB 3.44Å; I377-M381 WeakPolarHBondContact O-CG 3.16Å; I377-M381 PolarHBondContact O-N 3.37Å; I377-I385 HydrophobicContact CG2-CD1 4.06Å
378	E	88.4	Confident	86.7	Confident	37 Å²	37	80.1 Å²	80.1	17%	0.173	37%	0.374	C	S	.	.	H	α-helix	trans	-58.8	-43.2	-179.7	-69.7	-176.7	129.2	0	0	112.6	L374 M381 K382 L383 T384 I385	L374-E378 HydrophobicContact CD1-CG 4.21Å; L374-E378 HydrophobicContact CG-CG 4.47Å; L374-E378 WeakPolarHBondContact O-CG 3.18Å; L374-E378 PolarHBondContact O-N 3.48Å; E378-M381 PolarHBondContact O-N 3.32Å; E378-K382 WeakPolarHBondContact O-CA 3.44Å; E378-K382 PolarHBondContact O-N 3.24Å; E378-L383 VanDerWaalsContact CA-O 3.22Å; E378-L383 WeakPolarHBondContact CA-O 3.08Å; E378-L383 WeakPolarHBondContact CB-O 3.19Å; E378-L383 WeakPolarHBondContact CG-O 3.44Å; E378-L383 PolarHBondContact O-N 3.22Å; E378-T384 WeakPolarHBondContact OE1-CA 3.39Å; E378-I385 HydrophobicContact CG-CD1 4.32Å; E378-I385 HydrophobicContact CG-CG1 4.19Å; E378-I385 PolarHBondContact OE1-N 3.5Å
379	R	77.8	Confident	86.9	Confident	175 Å²	175	82.9 Å²	82.9	66%	0.66	38%	0.383	S	S	*	.	H	α-helix	trans	-62.2	-47.2	176.9	-77.2	170.6	-174.6	180	-1.6	112.3	R375 N376 I377 M381 K382	R375-R379 WeakPolarHBondContact O-CB 3.47Å; R375-R379 WeakPolarHBondContact O-CD 3.42Å; R375-R379 WeakPolarHBondContact O-CG 3.28Å; R375-R379 PolarHBondContact O-N 2.97Å; N376-R379 PolarHBondContact O-N 3.27Å; I377-R379 VanDerWaalsContact C-N 3.35Å; I377-R379 PolarHBondContact O-N 3.21Å; R379-M381 VanDerWaalsContact C-N 3.35Å; R379-K382 PolarHBondContact O-N 3.36Å
380	T	72.5	Confident	87.1	Confident	91 Å²	91	75.1 Å²	75.1	56%	0.558	36%	0.357	S	S	*	.	H	α-helix	trans	-65.6	-41.8	179.5	-57.6	0	0	0	0	111	S343 N376 I377 K382	S343-T380 WeakPolarHBondContact OG-CG2 3.31Å; S343-T380 PolarHBondContact OG-OG1 3.48Å; N376-T380 PolarHBondContact O-N 2.69Å; N376-T380 PolarHBondContact O-OG1 2.99Å; N376-T380 VanDerWaalsContact O-OG1 3.1Å; I377-T380 PolarHBondContact O-N 2.82Å; T380-K382 PolarHBondContact O-N 2.65Å
381	M	77.5	Confident	87.2	Confident	17 Å²	17	74.8 Å²	74.8	8%	0.084	36%	0.356	C	S	.	.	H	α-helix	trans	-78.1	-10	-179.7	-68.5	-177.8	68.2	0	0	114	R234 Y346 V347 I350 I377 E378 R379 L383	R234-M381 PolarHBondContact NH2-O 3.4Å; Y346-M381 HydrophobicContact CD1-CE 4.22Å; Y346-M381 HydrophobicContact CD1-SD 3.35Å; Y346-M381 WeakPolarHBondContact CD1-SD 3.46Å; Y346-M381 HydrophobicContact CE1-CE 3.83Å; Y346-M381 HydrophobicContact CE1-SD 3.36Å; Y346-M381 WeakPolarHBondContact CE1-SD 3.24Å; V347-M381 HydrophobicContact CG2-CG 4.3Å; V347-M381 HydrophobicContact CG2-SD 4.23Å; I350-M381 HydrophobicContact CD1-CE 4.05Å; I377-M381 HydrophobicContact CG2-CG 4.42Å; I377-M381 HydrophobicContact CG2-SD 3.62Å; I377-M381 WeakPolarHBondContact O-CB 3.44Å; I377-M381 WeakPolarHBondContact O-CG 3.16Å; I377-M381 PolarHBondContact O-N 3.37Å; E378-M381 PolarHBondContact O-N 3.32Å; R379-M381 VanDerWaalsContact C-N 3.35Å; M381-L383 PolarHBondContact O-N 2.86Å
382	K	80.4	Confident	87.1	Confident	176 Å²	176	74.8 Å²	74.8	77%	0.765	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	36.7	-172.5	-58.5	180	-179.1	177.6	0	112.4	E378 R379 T380	E378-K382 WeakPolarHBondContact O-CA 3.44Å; E378-K382 PolarHBondContact O-N 3.24Å; R379-K382 PolarHBondContact O-N 3.36Å; T380-K382 PolarHBondContact O-N 2.65Å
383	L	82.7	Confident	87.3	Confident	74 Å²	74	71.4 Å²	71.4	39%	0.387	37%	0.365	S	S	.	.			trans	-135.7	142.7	176.5	-73.3	-168.5	0	0	0	109.7	E378 M381	E378-L383 VanDerWaalsContact CA-O 3.22Å; E378-L383 WeakPolarHBondContact CA-O 3.08Å; E378-L383 WeakPolarHBondContact CB-O 3.19Å; E378-L383 WeakPolarHBondContact CG-O 3.44Å; E378-L383 PolarHBondContact O-N 3.22Å; M381-L383 PolarHBondContact O-N 2.86Å
384	T	89.3	Confident	87.3	Confident	122 Å²	122	78.1 Å²	78.1	75%	0.748	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-81.7	129.6	165.2	-52.1	0	0	0	0	108.7	E378	E378-T384 WeakPolarHBondContact OE1-CA 3.39Å
385	I	94.3	Very high	87	Confident	4 Å²	4	81.4 Å²	81.4	2%	0.021	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-90.4	119.4	172.3	-59.6	169.9	0	0	0	106.2	Q239 S240 Y241 Y346 L374 I377 E378	Q239-I385 HydrophobicContact CB-CG2 4.23Å; S240-I385 VanDerWaalsContact C-CG2 3.46Å; Y241-I385 HydrophobicContact CD1-CB 4.23Å; Y241-I385 HydrophobicContact CD1-CG2 4Å; Y241-I385 WeakPolarHBondContact CD1-O 3.27Å; Y241-I385 WeakPolarHBondContact CE1-O 3.46Å; Y346-I385 HydrophobicContact CE1-CD1 4.1Å; L374-I385 HydrophobicContact CD1-CD1 4.1Å; I377-I385 HydrophobicContact CG2-CD1 4.06Å; E378-I385 HydrophobicContact CG-CD1 4.32Å; E378-I385 HydrophobicContact CG-CG1 4.19Å; E378-I385 PolarHBondContact OE1-N 3.5Å
386	P	96.1	Very high	87	Confident	72 Å²	72	76.4 Å²	76.4	47%	0.468	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.6	139.7	-178.7	26.3	-34.3	0	0	0	111.4	Q239 S240 Y241	Q239-P386 WeakPolarHBondContact O-CD 3.18Å; Q239-P386 WeakPolarHBondContact O-CG 3.42Å; S240-P386 CarbonylContact C-O 3.51Å; S240-P386 VanDerWaalsContact CA-O 3.3Å; S240-P386 WeakPolarHBondContact CA-O 3.46Å; Y241-P386 WeakPolarHBondContact CD1-O 3.48Å; Y241-P386 PolarHBondContact N-O 3.34Å
387	E	97.1	Very high	87.3	Confident	103 Å²	103	74.8 Å²	74.8	48%	0.481	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-75.9	138.5	171.1	-166.4	164.2	-165.3	0	0	109.7	Y241 T243	Y241-E387 HydrophobicContact CD1-CB 4.24Å; Y241-E387 HydrophobicContact CD2-CG 4.34Å; Y241-E387 HydrophobicContact CE1-CB 3.56Å; Y241-E387 HydrophobicContact CE1-CG 4.15Å; Y241-E387 HydrophobicContact CE2-CB 4.11Å; Y241-E387 HydrophobicContact CE2-CG 3.75Å; Y241-E387 VanDerWaalsContact CZ-CB 3.5Å; Y241-E387 CarbonylContact O-C 3.58Å; Y241-E387 VanDerWaalsContact O-CA 3.3Å; Y241-E387 WeakPolarHBondContact O-CA 3.38Å; Y241-E387 PolarHBondContact OH-OE2 3.14Å; Y241-E387 VanDerWaalsContact OH-OE2 3.1Å; T243-E387 VanDerWaalsContact CB-OE1 3.25Å; T243-E387 WeakPolarHBondContact CB-OE1 3.38Å; T243-E387 PolarHBondContact OG1-OE1 3.06Å
388	V	95.5	Very high	87.4	Confident	49 Å²	49	80.7 Å²	80.7	30%	0.297	42%	0.418	S	S	.	.			trans	-118.1	150	173.5	-67.5	0	0	0	0	110.7	Y241 W242 F256 L363	Y241-V388 WeakPolarHBondContact O-CG2 3.3Å; Y241-V388 PolarHBondContact O-N 3.04Å; W242-V388 HydrophobicContact CB-CG2 4.27Å; F256-V388 HydrophobicContact CE1-CG2 4.12Å; F256-V388 HydrophobicContact CZ-CG2 4.27Å; L363-V388 HydrophobicContact CD1-CG2 3.84Å
389	E	93.5	Very high	87.1	Confident	175 Å²	175	81.8 Å²	81.8	82%	0.818	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-81.9	155.7	172.1	-63.8	-171.6	170.6	0	0	111.2
390	L	93	Very high	87.5	Confident	40 Å²	40	80.2 Å²	80.2	21%	0.209	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-64.9	133.8	172.7	-177.1	73.5	0	0	0	109.6	W242 M247 A252 R255 F256 N392	W242-L390 HydrophobicContact CZ2-CD1 4.32Å; M247-L390 HydrophobicContact CB-CD2 4.38Å; M247-L390 HydrophobicContact CE-CD2 4.04Å; M247-L390 HydrophobicContact SD-CD1 4.4Å; M247-L390 HydrophobicContact SD-CD2 3.51Å; M247-L390 VanDerWaalsContact SD-CD2 3.51Å; A252-L390 HydrophobicContact CB-CD1 3.61Å; R255-L390 HydrophobicContact CB-CD1 4.4Å; F256-L390 HydrophobicContact CD2-CD1 4.33Å; F256-L390 HydrophobicContact CE2-CD1 3.83Å; F256-L390 HydrophobicContact CZ-CD1 4.33Å; L390-N392 PolarHBondContact O-N 3.24Å; L390-N392 VanDerWaalsContact O-N 3.08Å
391	P	92.6	Very high	88	Confident	9 Å²	9	81.8 Å²	81.8	6%	0.058	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-53.4	119.5	173	-28.4	36.3	0	0	0	111.2	R255 F256 A259 L395 L396	R255-P391 HydrophobicContact CB-CB 4.33Å; R255-P391 WeakPolarHBondContact CD-O 3.42Å; R255-P391 PolarHBondContact NH1-O 3.4Å; F256-P391 HydrophobicContact CD1-CG 3.83Å; F256-P391 VanDerWaalsContact CE1-CD 3.49Å; F256-P391 HydrophobicContact CE1-CG 4.04Å; F256-P391 HydrophobicContact CG-CG 4.37Å; A259-P391 HydrophobicContact CB-CB 3.88Å; A259-P391 HydrophobicContact CB-CG 3.75Å; P391-L395 HydrophobicContact CB-CD2 4.11Å; P391-L396 HydrophobicContact CB-CD2 4.03Å; P391-L396 HydrophobicContact CB-CG 4.29Å
392	N	89.3	Confident	88.3	Confident	81 Å²	81	85 Å²	85	43%	0.433	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-81.1	166.6	179.3	69.1	18.3	0	0	0	110.7	L390 E394 L395 L396	L390-N392 PolarHBondContact O-N 3.24Å; L390-N392 VanDerWaalsContact O-N 3.08Å; N392-E394 PolarHBondContact O-N 3.11Å; N392-E394 PolarHBondContact OD1-N 3.11Å; N392-L395 PolarHBondContact O-N 3Å; N392-L395 WeakPolarHBondContact OD1-CB 3.39Å; N392-L395 PolarHBondContact OD1-N 3.32Å; N392-L396 WeakPolarHBondContact O-CG 3.19Å; N392-L396 PolarHBondContact O-N 3.01Å; N392-L396 VanDerWaalsContact O-N 3.13Å
393	A	85.7	Confident	88.3	Confident	76 Å²	76	81.1 Å²	81.1	63%	0.628	42%	0.417	S	S	*	.	H	α-helix	trans	-61.6	-30.7	-176.9	0	0	0	0	0	112.9	G397	A393-G397 PolarHBondContact O-N 3.28Å
394	E	85.8	Confident	88.2	Confident	159 Å²	159	84.1 Å²	84.1	74%	0.743	43%	0.427	S	S	*	.	H	α-helix	trans	-66.3	-47.9	177.5	-174.4	-179.4	178.1	0	0	111.5	N392 L396 G397 K398	N392-E394 PolarHBondContact O-N 3.11Å; N392-E394 PolarHBondContact OD1-N 3.11Å; E394-L396 VanDerWaalsContact C-N 3.34Å; E394-L396 PolarHBondContact O-N 3.35Å; E394-G397 PolarHBondContact O-N 2.97Å; E394-K398 PolarHBondContact O-N 3.41Å
395	L	86.8	Confident	87.7	Confident	75 Å²	75	80.7 Å²	80.7	39%	0.393	41%	0.411	S	S	.	.	H	α-helix	trans	-60.4	-44.8	176.4	179.2	60.7	0	0	0	111.2	P391 N392 K398 R399	P391-L395 HydrophobicContact CB-CD2 4.11Å; N392-L395 PolarHBondContact O-N 3Å; N392-L395 WeakPolarHBondContact OD1-CB 3.39Å; N392-L395 PolarHBondContact OD1-N 3.32Å; L395-K398 PolarHBondContact O-N 2.94Å; L395-R399 WeakPolarHBondContact O-CG 3.39Å; L395-R399 PolarHBondContact O-N 2.9Å
396	L	86.4	Confident	86.8	Confident	8 Å²	8	89.4 Å²	89.4	4%	0.042	44%	0.444	C	S	.	.	H	α-helix	trans	-63.7	-42.1	177	-63.2	175.7	0	0	0	111.4	R255 E258 A259 P391 N392 E394 K398 R399 R400	R255-L396 HydrophobicContact CB-CD1 4.19Å; R255-L396 HydrophobicContact CG-CD1 3.82Å; E258-L396 HydrophobicContact CB-CD2 3.97Å; E258-L396 HydrophobicContact CG-CD2 3.92Å; A259-L396 HydrophobicContact CB-CD2 3.99Å; P391-L396 HydrophobicContact CB-CD2 4.03Å; P391-L396 HydrophobicContact CB-CG 4.29Å; N392-L396 WeakPolarHBondContact O-CG 3.19Å; N392-L396 PolarHBondContact O-N 3.01Å; N392-L396 VanDerWaalsContact O-N 3.13Å; E394-L396 VanDerWaalsContact C-N 3.34Å; E394-L396 PolarHBondContact O-N 3.35Å; L396-K398 PolarHBondContact O-N 3.05Å; L396-R399 PolarHBondContact O-N 3.36Å; L396-R400 VanDerWaalsContact O-CG 3.28Å; L396-R400 WeakPolarHBondContact O-CG 3.31Å; L396-R400 PolarHBondContact O-N 3.08Å
397	G	84.4	Confident	85.6	Confident	26 Å²	26	92.4 Å²	92.4	27%	0.268	45%	0.45	S	S	.	.	H	α-helix	trans	-58.6	-45.7	174.6	0	0	0	0	0	112.3	A393 E394 R400 L401	A393-G397 PolarHBondContact O-N 3.28Å; E394-G397 PolarHBondContact O-N 2.97Å; G397-R400 PolarHBondContact O-N 2.94Å; G397-L401 WeakPolarHBondContact O-CG 3.42Å; G397-L401 PolarHBondContact O-N 3.26Å
398	K	85.6	Confident	84.4	Confident	125 Å²	125	90.5 Å²	90.5	54%	0.543	44%	0.443	S	S	.	.	H	α-helix	trans	-60.8	-46.4	175.7	-171.2	-177.9	178.4	-172.5	0	111.8	E394 L395 L396 R400 L401 E402	E394-K398 PolarHBondContact O-N 3.41Å; L395-K398 PolarHBondContact O-N 2.94Å; L396-K398 PolarHBondContact O-N 3.05Å; K398-R400 PolarHBondContact O-N 2.76Å; K398-L401 WeakPolarHBondContact O-CB 3.47Å; K398-L401 PolarHBondContact O-N 2.89Å; K398-E402 VanDerWaalsContact CE-OE1 3.24Å; K398-E402 WeakPolarHBondContact CE-OE1 3.5Å; K398-E402 WeakPolarHBondContact O-CG 3.21Å; K398-E402 PolarHBondContact O-N 2.89Å
399	R	84	Confident	83.1	Confident	61 Å²	61	91.5 Å²	91.5	23%	0.23	45%	0.452	C	S	.	.	H	α-helix	trans	-61.5	-40.5	177.3	-73.9	-63.3	-153.9	158.8	12.2	112.7	A259 D261 L395 L396 E402 K403	A259-R399 VanDerWaalsContact O-CZ 3.24Å; A259-R399 PolarHBondContact O-NE 3.4Å; A259-R399 VanDerWaalsContact O-NE 3.09Å; A259-R399 PolarHBondContact O-NH2 3.25Å; D261-R399 IonicContact OD2-CZ 2.92Å; D261-R399 IonicContact OD2-NH1 2.76Å; D261-R399 PolarHBondContact OD2-NH1 3.2Å; D261-R399 IonicContact OD2-NH2 2.71Å; L395-R399 WeakPolarHBondContact O-CG 3.39Å; L395-R399 PolarHBondContact O-N 2.9Å; L396-R399 PolarHBondContact O-N 3.36Å; R399-E402 WeakPolarHBondContact CD-OE2 3.49Å; R399-E402 IonicContact NH1-OE2 2.86Å; R399-E402 PolarHBondContact O-N 2.98Å; R399-K403 PolarHBondContact O-N 2.72Å
400	R	84.9	Confident	81.8	Confident	142 Å²	142	84.9 Å²	84.9	54%	0.536	43%	0.428	S	S	.	.	H	α-helix	trans	-61	-43.9	174.6	-72.5	170.1	-174.4	174	5	111.6	E258 L396 G397 K398 K403 F404	E258-R400 VanDerWaalsContact CD-NH2 3.3Å; E258-R400 IonicContact OE1-CZ 3.21Å; E258-R400 IonicContact OE1-NE 2.64Å; E258-R400 PolarHBondContact OE1-NE 3.17Å; E258-R400 IonicContact OE1-NH2 2.94Å; E258-R400 PolarHBondContact OE1-NH2 2.78Å; E258-R400 IonicContact OE2-CZ 3.78Å; E258-R400 IonicContact OE2-NE 3.89Å; E258-R400 IonicContact OE2-NH2 2.85Å; E258-R400 PolarHBondContact OE2-NH2 3.03Å; L396-R400 VanDerWaalsContact O-CG 3.28Å; L396-R400 WeakPolarHBondContact O-CG 3.31Å; L396-R400 PolarHBondContact O-N 3.08Å; G397-R400 PolarHBondContact O-N 2.94Å; K398-R400 PolarHBondContact O-N 2.76Å; R400-K403 PolarHBondContact O-N 3.29Å; R400-F404 VanDerWaalsContact O-CB 3.32Å; R400-F404 WeakPolarHBondContact O-CB 3.02Å; R400-F404 PolarHBondContact O-N 2.8Å
401	L	83.3	Confident	80.2	Confident	123 Å²	123	84.8 Å²	84.8	64%	0.644	43%	0.43	S	S	*	.	H	α-helix	trans	-64.2	-41.8	176.7	-70.5	170.6	0	0	0	112	G397 K398 F404 A405	G397-L401 WeakPolarHBondContact O-CG 3.42Å; G397-L401 PolarHBondContact O-N 3.26Å; K398-L401 WeakPolarHBondContact O-CB 3.47Å; K398-L401 PolarHBondContact O-N 2.89Å; L401-F404 PolarHBondContact O-N 2.82Å; L401-A405 VanDerWaalsContact O-CB 3.31Å; L401-A405 WeakPolarHBondContact O-CB 3.32Å; L401-A405 PolarHBondContact O-N 3.29Å
402	E	84.3	Confident	78.4	Confident	86 Å²	86	89.6 Å²	89.6	40%	0.402	45%	0.452	S	S	.	.	H	α-helix	trans	-62.1	-47.4	175.8	-72.7	170	-178.9	0	0	111.7	K398 R399 F404 A405 W406	K398-E402 VanDerWaalsContact CE-OE1 3.24Å; K398-E402 WeakPolarHBondContact CE-OE1 3.5Å; K398-E402 WeakPolarHBondContact O-CG 3.21Å; K398-E402 PolarHBondContact O-N 2.89Å; R399-E402 WeakPolarHBondContact CD-OE2 3.49Å; R399-E402 IonicContact NH1-OE2 2.86Å; R399-E402 PolarHBondContact O-N 2.98Å; E402-F404 VanDerWaalsContact C-N 3.34Å; E402-F404 PolarHBondContact O-N 2.79Å; E402-A405 PolarHBondContact O-N 2.87Å; E402-W406 WeakPolarHBondContact O-CB 3.19Å; E402-W406 PolarHBondContact O-N 3.04Å
403	K	80.3	Confident	76.5	Confident	94 Å²	94	91.8 Å²	91.8	41%	0.409	46%	0.463	S	S	.	.	H	α-helix	trans	-61	-42.3	175.8	-76.6	178.3	176.3	171.3	0	111.7	E258 R399 R400 W406 F407	E258-K403 PolarHBondContact O-NZ 3.25Å; R399-K403 PolarHBondContact O-N 2.72Å; R400-K403 PolarHBondContact O-N 3.29Å; K403-W406 PolarHBondContact O-N 3.36Å; K403-F407 WeakPolarHBondContact O-CB 3.3Å; K403-F407 PolarHBondContact O-N 3.23Å
404	F	80.1	Confident	74.7	Confident	136 Å²	136	98.1 Å²	98.1	60%	0.596	47%	0.47	S	S	*	.	H	α-helix	trans	-66.3	-42.5	177	-173.6	-103.7	0	0	0	112.5	R400 L401 E402 F407 N408	R400-F404 VanDerWaalsContact O-CB 3.32Å; R400-F404 WeakPolarHBondContact O-CB 3.02Å; R400-F404 PolarHBondContact O-N 2.8Å; L401-F404 PolarHBondContact O-N 2.82Å; E402-F404 VanDerWaalsContact C-N 3.34Å; E402-F404 PolarHBondContact O-N 2.79Å; F404-F407 PolarHBondContact O-N 3.02Å; F404-N408 WeakPolarHBondContact CD1-ND2 3.08Å; F404-N408 WeakPolarHBondContact CE1-ND2 3.36Å; F404-N408 WeakPolarHBondContact CZ-ND2 3.27Å; F404-N408 PolarHBondContact O-N 2.77Å; F404-N408 PolarHBondContact O-ND2 3.21Å
405	A	79.2	Confident	72.7	Confident	51 Å²	51	98.9 Å²	98.9	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-42.4	176.3	0	0	0	0	0	111.5	L401 E402 N408 S409	L401-A405 VanDerWaalsContact O-CB 3.31Å; L401-A405 WeakPolarHBondContact O-CB 3.32Å; L401-A405 PolarHBondContact O-N 3.29Å; E402-A405 PolarHBondContact O-N 2.87Å; A405-N408 PolarHBondContact O-N 2.91Å; A405-S409 WeakPolarHBondContact O-CB 3.41Å; A405-S409 PolarHBondContact O-N 2.96Å; A405-S409 PolarHBondContact O-OG 3.17Å
406	W	74.4	Confident	70.8	Confident	186 Å²	186	100.5 Å²	100.5	71%	0.705	48%	0.476	S	S	*	.	H	α-helix	trans	-61.7	-45.7	176.1	179.6	81.6	0	0	0	112	E402 K403 N408 S409 A410	E402-W406 WeakPolarHBondContact O-CB 3.19Å; E402-W406 PolarHBondContact O-N 3.04Å; K403-W406 PolarHBondContact O-N 3.36Å; W406-N408 PolarHBondContact O-N 3.49Å; W406-S409 PolarHBondContact O-N 3.13Å; W406-A410 WeakPolarHBondContact O-CB 3.42Å; W406-A410 PolarHBondContact O-N 3.35Å
407	F	71.3	Confident	68.9	Low	136 Å²	136	105.9 Å²	105.9	60%	0.596	51%	0.508	S	S	*	.	H	α-helix	trans	-60.5	-44.9	176.8	-173.7	-96.8	0	0	0	112.2	K403 F404 S409 A410 S411	K403-F407 WeakPolarHBondContact O-CB 3.3Å; K403-F407 PolarHBondContact O-N 3.23Å; F404-F407 PolarHBondContact O-N 3.02Å; F407-S409 PolarHBondContact O-N 3.23Å; F407-A410 PolarHBondContact O-N 3.3Å; F407-S411 PolarHBondContact O-N 3.02Å
408	N	72.9	Confident	67.2	Low	63 Å²	63	108.8 Å²	108.8	34%	0.337	53%	0.53	S	S	.	.	H	α-helix	trans	-64.3	-40.4	177.1	-75.9	-55.1	0	0	0	112.5	F404 A405 W406 S411 H412	F404-N408 WeakPolarHBondContact CD1-ND2 3.08Å; F404-N408 WeakPolarHBondContact CE1-ND2 3.36Å; F404-N408 WeakPolarHBondContact CZ-ND2 3.27Å; F404-N408 PolarHBondContact O-N 2.77Å; F404-N408 PolarHBondContact O-ND2 3.21Å; A405-N408 PolarHBondContact O-N 2.91Å; W406-N408 PolarHBondContact O-N 3.49Å; N408-S411 PolarHBondContact O-N 2.7Å; N408-S411 PolarHBondContact O-OG 3.19Å; N408-H412 PolarHBondContact O-N 3.44Å; N408-H412 VanDerWaalsContact O-N 3.11Å
409	S	68.2	Low	64.9	Low	69 Å²	69	111.2 Å²	111.2	48%	0.483	54%	0.54	S	S	.	.	H	α-helix	trans	-62.7	-46.2	176.3	-52	0	0	0	0	111.6	A405 W406 F407 S411 H412 L413	A405-S409 WeakPolarHBondContact O-CB 3.41Å; A405-S409 PolarHBondContact O-N 2.96Å; A405-S409 PolarHBondContact O-OG 3.17Å; W406-S409 PolarHBondContact O-N 3.13Å; F407-S409 PolarHBondContact O-N 3.23Å; S409-S411 VanDerWaalsContact C-N 3.27Å; S409-S411 PolarHBondContact O-N 3.31Å; S409-H412 PolarHBondContact O-N 2.9Å; S409-L413 PolarHBondContact O-N 3.11Å; S409-L413 VanDerWaalsContact O-N 3.15Å
410	A	65	Low	62.5	Low	37 Å²	37	119 Å²	119	31%	0.306	57%	0.57	S	S	.	*	H	α-helix	trans	-63.2	-33.9	177.2	0	0	0	0	0	112.3	W406 F407 R414	W406-A410 WeakPolarHBondContact O-CB 3.42Å; W406-A410 PolarHBondContact O-N 3.35Å; F407-A410 PolarHBondContact O-N 3.3Å; A410-R414 PolarHBondContact O-N 3.47Å
411	S	60.6	Low	60.3	Low	37 Å²	37	118.5 Å²	118.5	26%	0.259	59%	0.585	S	S	.	*	H	α-helix	trans	-69.1	-34.9	175.4	82.1	0	0	0	0	113.1	F407 N408 S409 R414 R415	F407-S411 PolarHBondContact O-N 3.02Å; N408-S411 PolarHBondContact O-N 2.7Å; N408-S411 PolarHBondContact O-OG 3.19Å; S409-S411 VanDerWaalsContact C-N 3.27Å; S409-S411 PolarHBondContact O-N 3.31Å; S411-R414 PolarHBondContact O-N 3.01Å; S411-R415 PolarHBondContact O-N 3.36Å; S411-R415 VanDerWaalsContact O-N 3.11Å
412	H	53.4	Low	58.1	Low	111 Å²	111	115.5 Å²	115.5	51%	0.514	58%	0.583	S	S	.	*	H	α-helix	trans	-67.4	-42.9	174.9	-99.4	56.4	0	0	0	111.5	N408 S409 R414 R415 D416	N408-H412 PolarHBondContact O-N 3.44Å; N408-H412 VanDerWaalsContact O-N 3.11Å; S409-H412 PolarHBondContact O-N 2.9Å; H412-R414 VanDerWaalsContact C-N 3.25Å; H412-R414 PolarHBondContact O-N 3.09Å; H412-R415 PolarHBondContact O-N 3.07Å; H412-D416 PolarHBondContact O-N 3.38Å
413	L	49.9	Very low	55.7	Low	126 Å²	126	118.4 Å²	118.4	66%	0.66	61%	0.607	S	S	*	*	H	α-helix	trans	-57.6	-36.6	172.9	-88.5	138.7	0	0	0	112.6	S409 V417	S409-L413 PolarHBondContact O-N 3.11Å; S409-L413 VanDerWaalsContact O-N 3.15Å; L413-V417 WeakPolarHBondContact O-CG2 3.36Å
414	R	47.9	Very low	53.3	Low	210 Å²	210	118.1 Å²	118.1	79%	0.792	63%	0.631	S	S	*	*	H	α-helix	trans	-70.4	-32.9	173.6	-74.1	-173.1	-179.8	-167.1	1.2	113.4	A410 S411 H412	A410-R414 PolarHBondContact O-N 3.47Å; S411-R414 PolarHBondContact O-N 3.01Å; H412-R414 VanDerWaalsContact C-N 3.25Å; H412-R414 PolarHBondContact O-N 3.09Å
415	R	44.9	Very low	50.9	Low	175 Å²	175	115.5 Å²	115.5	66%	0.66	64%	0.642	S	S	*	*	H	α-helix	trans	-74.2	-35.2	178.4	-78.8	-177.3	177.1	165.3	1.4	113	S411 H412 V417 A418	S411-R415 PolarHBondContact O-N 3.36Å; S411-R415 VanDerWaalsContact O-N 3.11Å; H412-R415 PolarHBondContact O-N 3.07Å; R415-V417 VanDerWaalsContact C-N 3.33Å; R415-V417 PolarHBondContact O-N 2.77Å; R415-A418 PolarHBondContact O-N 3.16Å
416	D	46	Very low	48.6	Very low	109 Å²	109	116.1 Å²	116.1	58%	0.583	65%	0.654	S	S	*	*	H	α-helix	trans	-72.7	-27.1	-179.7	-75.2	-22	0	0	0	112.9	H412 A418 K419	H412-D416 PolarHBondContact O-N 3.38Å; D416-A418 VanDerWaalsContact C-N 3.32Å; D416-K419 PolarHBondContact O-N 2.84Å
417	V	47.3	Very low	46.4	Very low	120 Å²	120	116 Å²	116	73%	0.727	66%	0.659	S	S	*	*	H	α-helix	trans	-69	-31.6	171.7	176.8	0	0	0	0	111.7	L413 R415 K419	L413-V417 WeakPolarHBondContact O-CG2 3.36Å; R415-V417 VanDerWaalsContact C-N 3.33Å; R415-V417 PolarHBondContact O-N 2.77Å; V417-K419 VanDerWaalsContact C-N 3.28Å; V417-K419 PolarHBondContact O-N 3.32Å
418	A	47.7	Very low	44.4	Very low	87 Å²	87	121.1 Å²	121.1	72%	0.719	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-11	-179.7	0	0	0	0	0	114.2	R415 D416	R415-A418 PolarHBondContact O-N 3.16Å; D416-A418 VanDerWaalsContact C-N 3.32Å
419	K	37	Very low	42.1	Very low	176 Å²	176	126.2 Å²	126.2	77%	0.765	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	17.5	-173.6	-83	-169.3	178.1	-179.1	0	115.4	D416 V417 P421	D416-K419 PolarHBondContact O-N 2.84Å; V417-K419 VanDerWaalsContact C-N 3.28Å; V417-K419 PolarHBondContact O-N 3.32Å; K419-P421 VanDerWaalsContact O-CD 3.24Å; K419-P421 WeakPolarHBondContact O-CD 3.49Å
420	R	34.4	Very low	40.2	Very low	225 Å²	225	129 Å²	129	85%	0.849	71%	0.712	S	S	*	*			trans	-89.8	107.9	167.7	-72.1	-171.3	179.1	-176.5	0.7	110.2
421	P	38.2	Very low	38.7	Very low	131 Å²	131	133.3 Å²	133.3	85%	0.851	73%	0.734	S	S	*	*			trans	-83	117.3	171.2	30.3	-20.4	0	0	0	108.1	K419	K419-P421 VanDerWaalsContact O-CD 3.24Å; K419-P421 WeakPolarHBondContact O-CD 3.49Å
422	G	37.1	Very low	37.4	Very low	60 Å²	60	136.6 Å²	136.6	62%	0.619	76%	0.764	S	S	*	*			trans	147.7	122.1	166.4	0	0	0	0	0	114.8
423	T	33.8	Very low	36.2	Very low	147 Å²	147	134.9 Å²	134.9	90%	0.902	78%	0.776	S	S	*	*			trans	69.5	90.7	155.2	61.6	0	0	0	0	118.3
424	G	30.7	Very low	35.3	Very low	88 Å²	88	134 Å²	134	91%	0.907	78%	0.78	S	S	*	*			trans	51.7	110.7	130.9	0	0	0	0	0	119.9
425	G	29.8	Very low	34.5	Very low	81 Å²	81	131.3 Å²	131.3	84%	0.835	79%	0.787	S	S	*	*			trans	140.9	114.8	151.3	0	0	0	0	0	114.9
426	G	29.6	Very low	33.9	Very low	64 Å²	64	128.4 Å²	128.4	66%	0.66	79%	0.792	S	S	*	*			trans	79.2	84	150.9	0	0	0	0	0	117.1	W428	G426-W428 PolarHBondContact O-N 3.15Å
427	F	29.3	Very low	33.1	Very low	184 Å²	184	126.2 Å²	126.2	81%	0.807	80%	0.796	S	S	*	*			trans	-71.2	100.7	169.8	-139.1	-87.7	0	0	0	109.8	F429	F427-F429 AromaticContact CD1-CD2 3.53Å; F427-F429 HydrophobicContact CD1-CD2 3.53Å; F427-F429 AromaticContact CD1-CE2 3.66Å; F427-F429 HydrophobicContact CD1-CE2 3.66Å; F427-F429 AromaticContact CE1-CD2 3.68Å; F427-F429 HydrophobicContact CE1-CD2 3.68Å; F427-F429 AromaticContact CE1-CE2 3.34Å; F427-F429 HydrophobicContact CE1-CE2 3.34Å; F427-F429 HydrophobicContact CE1-CZ 4.19Å; F427-F429 HydrophobicContact CZ-CE2 4.48Å; F427-F429 PolarHBondContact O-N 3.31Å
428	W	27.9	Very low	32.3	Very low	243 Å²	243	126.6 Å²	126.6	92%	0.92	80%	0.798	S	S	*	*			trans	-90	98.3	170.7	-77.2	83.2	0	0	0	109.6	G426 C430	G426-W428 PolarHBondContact O-N 3.15Å; W428-C430 PolarHBondContact O-N 3.21Å
429	F	25.1	Very low	31.3	Very low	171 Å²	171	128.8 Å²	128.8	75%	0.75	80%	0.802	S	S	*	*			trans	-71.4	103.9	166.7	-107.9	-86.8	0	0	0	108.7	F427	F427-F429 AromaticContact CD1-CD2 3.53Å; F427-F429 HydrophobicContact CD1-CD2 3.53Å; F427-F429 AromaticContact CD1-CE2 3.66Å; F427-F429 HydrophobicContact CD1-CE2 3.66Å; F427-F429 AromaticContact CE1-CD2 3.68Å; F427-F429 HydrophobicContact CE1-CD2 3.68Å; F427-F429 AromaticContact CE1-CE2 3.34Å; F427-F429 HydrophobicContact CE1-CE2 3.34Å; F427-F429 HydrophobicContact CE1-CZ 4.19Å; F427-F429 HydrophobicContact CZ-CE2 4.48Å; F427-F429 PolarHBondContact O-N 3.31Å
430	C	28.9	Very low	30.9	Very low	127 Å²	127	128.5 Å²	128.5	86%	0.858	80%	0.804	S	S	*	*			trans	-93.5	107.3	163.4	-154.5	0	0	0	0	107.4	W428 A432	W428-C430 PolarHBondContact O-N 3.21Å; C430-A432 PolarHBondContact O-N 3.29Å
431	T	33.2	Very low	31	Very low	127 Å²	127	132.3 Å²	132.3	78%	0.779	82%	0.82	S	S	*	*			trans	-65	128.2	-176.4	37	0	0	0	0	111.8
432	A	34.1	Very low	30.7	Very low	106 Å²	106	132.4 Å²	132.4	88%	0.876	82%	0.818	S	S	*	*			trans	-65	139.1	176.5	0	0	0	0	0	112.8	C430	C430-A432 PolarHBondContact O-N 3.29Å
433	G	28.3	Very low	30.3	Very low	75 Å²	75	136.2 Å²	136.2	77%	0.773	83%	0.829	S	S	*	*			trans	-142.1	75.2	168.4	0	0	0	0	0	110.2
434	S	31.1	Very low	30.1	Very low	108 Å²	108	135.6 Å²	135.6	76%	0.755	83%	0.825	S	S	*	*			trans	175.7	106.4	154.9	28.6	0	0	0	0	108.7	C436	S434-C436 PolarHBondContact O-N 3.17Å; S434-C436 VanDerWaalsContact O-N 3.13Å
435	V	30.8	Very low	30.1	Very low	153 Å²	153	138.4 Å²	138.4	93%	0.927	82%	0.82	S	S	*	*			trans	-73.2	97.4	172.1	177.6	0	0	0	0	107	G437	V435-G437 PolarHBondContact O-N 3.07Å
436	C	31.4	Very low	30.1	Very low	114 Å²	114	142 Å²	142	77%	0.77	82%	0.819	S	S	*	*			trans	-78.9	99	165.3	-78	0	0	0	0	108.3	S434 V438	S434-C436 PolarHBondContact O-N 3.17Å; S434-C436 VanDerWaalsContact O-N 3.13Å; C436-V438 PolarHBondContact O-N 3.12Å
437	G	29	Very low	30.1	Very low	64 Å²	64	147.2 Å²	147.2	66%	0.66	83%	0.83	S	S	*	*			trans	-67.7	115.5	164.7	0	0	0	0	0	109.3	V435 V439	V435-G437 PolarHBondContact O-N 3.07Å; G437-V439 PolarHBondContact O-N 3.31Å
438	V	30.6	Very low	30.2	Very low	127 Å²	127	144.6 Å²	144.6	77%	0.77	83%	0.831	S	S	*	*			trans	-71.2	112.2	168.8	179.8	0	0	0	0	106.9	C436 E440	C436-V438 PolarHBondContact O-N 3.12Å; V438-E440 HydrophobicContact CG1-CG 4.12Å; V438-E440 PolarHBondContact O-N 3.49Å
439	V	27.9	Very low	30.4	Very low	133 Å²	133	137 Å²	137	81%	0.806	83%	0.825	S	S	*	*			trans	-86.5	100.5	165.9	-179	0	0	0	0	106.3	G437	G437-V439 PolarHBondContact O-N 3.31Å
440	E	27.5	Very low	30.8	Very low	171 Å²	171	134.2 Å²	134.2	80%	0.799	83%	0.831	S	S	*	*			trans	-73.5	135.8	161.1	-74	-178.7	158.4	0	0	108.1	V438	V438-E440 HydrophobicContact CG1-CG 4.12Å; V438-E440 PolarHBondContact O-N 3.49Å
441	Y	36.9	Very low	31	Very low	305 Å²	305	134.8 Å²	134.8	100%	1.196	83%	0.828	S	S	*	*			trans	-59.8	0	-176.4	-84.1	-87.6	0	0	0	113.9

Retrieved 441 of 441 residues in 1019.6 ms (Link to these results)

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