A0A087WQS1_MOUSE Loading...

Serum/glucocorticoid regulated kinase 3

AlphaFold DB , UniProt , Accession A0A087WQS1, Species MOUSE (Mus musculus, Mouse), Gene Sgk3, Length 349 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	44.2	Very low	39.4	Very low	229 Å²	229	176.1 Å²	176.1	100%	1.128	84%	0.84	S	S	*	*				0	92.6	0	-161.4	-178.4	-178.1	0	0	107.9
2	Q	34.8	Very low	42.3	Very low	192 Å²	192	167 Å²	167	90%	0.897	81%	0.809	S	S	*	*			trans	-171.5	78.2	170.3	-114.8	161.4	-17.3	0	0	105.5
3	R	36.7	Very low	45.4	Very low	226 Å²	226	161.5 Å²	161.5	85%	0.853	80%	0.796	S	S	*	*				58.4	88.7	101.2	-79.2	-169.5	180	153.6	1.2	111.5	C5	R3-C5 PolarHBondContact O-N 3.3Å
4	D	36.9	Very low	48.7	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	74%	0.744	S	S	*	*			trans	-51.1	116.2	162.5	-61.3	-57.3	0	0	0	110.3	I6	D4-I6 VanDerWaalsContact C-N 3.29Å; D4-I6 HydrophobicContact CB-CG1 4.34Å; D4-I6 PolarHBondContact O-N 3.06Å
5	C	35	Very low	51.7	Low	125 Å²	125	144.8 Å²	144.8	85%	0.845	72%	0.724	S	S	*	*			trans	-80	86.2	158.7	-79.7	0	0	0	0	107.6	R3 M7	R3-C5 PolarHBondContact O-N 3.3Å; C5-M7 PolarHBondContact O-N 3.17Å
6	I	36.2	Very low	54.5	Low	142 Å²	142	136.4 Å²	136.4	73%	0.728	68%	0.683	S	S	*	*			trans	-62.9	103.7	160	-61.4	174.9	0	0	0	106	D4 D8	D4-I6 VanDerWaalsContact C-N 3.29Å; D4-I6 HydrophobicContact CB-CG1 4.34Å; D4-I6 PolarHBondContact O-N 3.06Å; I6-D8 PolarHBondContact O-N 3.13Å; I6-D8 VanDerWaalsContact O-N 3.13Å
7	M	34.8	Very low	56.9	Low	170 Å²	170	130.6 Å²	130.6	84%	0.837	66%	0.658	S	S	*	*			trans	-71.8	101.3	164.8	-76.5	-146.7	-100.5	0	0	107.5	C5 Y9	C5-M7 PolarHBondContact O-N 3.17Å; M7-Y9 PolarHBondContact O-N 2.93Å
8	D	36.7	Very low	59	Low	146 Å²	146	123.5 Å²	123.5	78%	0.781	62%	0.622	S	S	*	*			trans	-54.7	100.8	165	-99.4	-20.8	0	0	0	108.7	I6 K10	I6-D8 PolarHBondContact O-N 3.13Å; I6-D8 VanDerWaalsContact O-N 3.13Å; D8-K10 PolarHBondContact O-N 2.91Å
9	Y	38.5	Very low	60.4	Low	223 Å²	223	120.6 Å²	120.6	88%	0.875	61%	0.613	S	S	*	*			trans	-65.2	92	160.2	-95.3	-95.3	0	0	0	106.8	M7 E11	M7-Y9 PolarHBondContact O-N 2.93Å; Y9-E11 PolarHBondContact O-N 2.9Å
10	K	44.4	Very low	61.7	Low	190 Å²	190	116.6 Å²	116.6	83%	0.826	60%	0.597	S	S	*	*			trans	-57.2	104.2	163.2	-96.9	-178.8	174.2	177.3	0	107.6	D8 S12	D8-K10 PolarHBondContact O-N 2.91Å; K10-S12 PolarHBondContact O-N 3.2Å
11	E	55.6	Low	62.8	Low	145 Å²	145	112.6 Å²	112.6	68%	0.678	58%	0.579	S	S	*	*			trans	-50.7	115.2	165.2	-73.2	-174	157.6	0	0	107.5	Y9 C13	Y9-E11 PolarHBondContact O-N 2.9Å; E11-C13 PolarHBondContact O-N 3.03Å
12	S	73.6	Confident	64.4	Low	67 Å²	67	105.3 Å²	105.3	47%	0.469	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-69.3	117.7	-178.2	-60.6	0	0	0	0	108.4	K10 G41	K10-S12 PolarHBondContact O-N 3.2Å; S12-G41 VanDerWaalsContact CB-N 3.35Å
13	C	82.5	Confident	66.6	Low	95 Å²	95	100.7 Å²	100.7	64%	0.642	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-54.9	135.2	-179.8	-65.1	0	0	0	0	111	E11	E11-C13 PolarHBondContact O-N 3.03Å
14	P	91.6	Very high	68.4	Low	10 Å²	10	92.8 Å²	92.8	7%	0.065	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-67	143.9	176.2	24.8	-31.6	0	0	0	111.8	S39 V40 V102 Y108 M119	P14-S39 CarbonylContact C-O 3.54Å; P14-S39 WeakPolarHBondContact CA-O 3.3Å; P14-V40 HydrophobicContact CB-CG2 3.88Å; P14-V102 HydrophobicContact CB-CB 4.35Å; P14-V102 HydrophobicContact CB-CG1 4Å; P14-V102 HydrophobicContact CG-CB 3.97Å; P14-V102 HydrophobicContact CG-CG1 3.9Å; P14-Y108 HydrophobicContact CG-CD1 4.1Å; P14-Y108 HydrophobicContact CG-CD2 3.93Å; P14-Y108 HydrophobicContact CG-CG 3.73Å; P14-M119 HydrophobicContact CB-CE 3.8Å; P14-M119 HydrophobicContact CB-SD 4.47Å; P14-M119 HydrophobicContact CG-CE 3.78Å
15	S	94.2	Very high	70	Confident	63 Å²	63	94.8 Å²	94.8	44%	0.441	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.3	164.2	68.3	0	0	0	0	110.9	S39	S15-S39 PolarHBondContact N-O 2.83Å; S15-S39 PolarHBondContact O-N 2.83Å; S15-S39 WeakPolarHBondContact OG-CB 3.49Å
16	V	95.8	Very high	71.2	Confident	11 Å²	11	94 Å²	94	7%	0.067	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	149.8	-177.7	-63.9	0	0	0	0	112.8	L37 V38 I98 Q99 V102 L117	V16-L37 CarbonylContact C-O 3.53Å; V16-L37 WeakPolarHBondContact CA-O 3.28Å; V16-V38 HydrophobicContact CG1-CB 4.35Å; V16-V38 HydrophobicContact CG1-CG1 4.08Å; V16-V38 HydrophobicContact CG1-CG2 4.1Å; V16-I98 HydrophobicContact CB-CD1 3.92Å; V16-I98 HydrophobicContact CB-CG1 4.32Å; V16-I98 HydrophobicContact CG2-CB 3.86Å; V16-I98 HydrophobicContact CG2-CD1 3.83Å; V16-I98 HydrophobicContact CG2-CG1 3.65Å; V16-I98 WeakPolarHBondContact CG2-O 3.49Å; V16-Q99 HydrophobicContact CG2-CG 4.35Å; V16-V102 HydrophobicContact CG1-CG1 3.89Å; V16-V102 HydrophobicContact CG2-CG1 3.99Å; V16-V102 HydrophobicContact CG2-CG2 3.76Å; V16-L117 HydrophobicContact CG1-CD1 4.04Å; V16-L117 HydrophobicContact CG1-CD2 4.06Å
17	S	95.1	Very high	73.1	Confident	38 Å²	38	96.4 Å²	96.4	27%	0.266	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	161.5	169.8	61.3	0	0	0	0	112.4	P19 V36 L37 N95	S17-P19 VanDerWaalsContact C-CD 3.5Å; S17-P19 VanDerWaalsContact O-CD 3.3Å; S17-P19 WeakPolarHBondContact O-CD 3.49Å; S17-V36 CarbonylContact O-C 3.1Å; S17-V36 WeakPolarHBondContact O-CA 3.16Å; S17-L37 PolarHBondContact N-O 2.86Å; S17-L37 PolarHBondContact O-N 2.92Å; S17-N95 VanDerWaalsContact CA-OD1 3.25Å; S17-N95 WeakPolarHBondContact CA-OD1 3.48Å
18	I	95.1	Very high	74.5	Confident	2 Å²	2	97.9 Å²	97.9	1%	0.01	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	81.2	173	-48	-173.7	0	0	0	109.6	S20 Y34 K35 V36 F54 R91 L94 N95 I98	I18-S20 VanDerWaalsContact C-N 3.33Å; I18-S20 PolarHBondContact O-N 3.04Å; I18-Y34 HydrophobicContact CG2-CD1 4.19Å; I18-K35 WeakPolarHBondContact CA-O 3.49Å; I18-K35 WeakPolarHBondContact CG2-O 3.48Å; I18-V36 HydrophobicContact CD1-CG2 4.4Å; I18-V36 HydrophobicContact CG1-CG2 4.23Å; I18-F54 HydrophobicContact CD1-CE1 4.15Å; I18-F54 HydrophobicContact CD1-CZ 3.95Å; I18-R91 HydrophobicContact CB-CG 4.11Å; I18-R91 HydrophobicContact CG2-CG 3.68Å; I18-R91 PolarHBondContact O-NH1 2.73Å; I18-L94 HydrophobicContact CD1-CB 3.72Å; I18-N95 HydrophobicContact CB-CB 4.29Å; I18-N95 HydrophobicContact CD1-CB 4.29Å; I18-N95 HydrophobicContact CG1-CB 4.09Å; I18-N95 PolarHBondContact N-OD1 2.86Å; I18-I98 HydrophobicContact CD1-CD1 3.94Å; I18-I98 HydrophobicContact CG1-CD1 3.5Å; I18-I98 HydrophobicContact CG1-CG1 4.46Å
19	P	86.6	Confident	76.1	Confident	69 Å²	69	98.9 Å²	98.9	45%	0.448	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	-34.1	-176	23.1	-36.5	0	0	0	113.9	S17 K35 L37 F46	S17-P19 VanDerWaalsContact C-CD 3.5Å; S17-P19 VanDerWaalsContact O-CD 3.3Å; S17-P19 WeakPolarHBondContact O-CD 3.49Å; P19-K35 VanDerWaalsContact CD-O 3.22Å; P19-K35 WeakPolarHBondContact CD-O 3.32Å; P19-L37 HydrophobicContact CG-CB 4.45Å; P19-F46 HydrophobicContact CG-CE1 4.26Å
20	S	85.3	Confident	78	Confident	40 Å²	40	93.5 Å²	93.5	28%	0.28	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	165.8	-177	70.2	0	0	0	0	112.7	I18 K35	I18-S20 VanDerWaalsContact C-N 3.33Å; I18-S20 PolarHBondContact O-N 3.04Å; S20-K35 PolarHBondContact O-N 3.17Å; S20-K35 WeakPolarHBondContact OG-CD 3.43Å
21	S	84.9	Confident	79.8	Confident	32 Å²	32	86.5 Å²	86.5	22%	0.224	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	138.9	170.8	54.6	0	0	0	0	108.9	V33 I87	S21-V33 CarbonylContact C-O 3.57Å; S21-V33 WeakPolarHBondContact CA-O 3.36Å; S21-I87 WeakPolarHBondContact OG-CG2 3.48Å
22	D	78.3	Confident	81.2	Confident	77 Å²	77	80.2 Å²	80.2	41%	0.412	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135	-175.9	-64.5	-67	0	0	0	110	H24 V33	D22-H24 PolarHBondContact O-N 3.15Å; D22-H24 PolarHBondContact O-ND1 2.86Å; D22-H24 VanDerWaalsContact O-ND1 3.15Å; D22-V33 PolarHBondContact N-O 2.92Å; D22-V33 PolarHBondContact O-N 2.89Å
23	E	81.8	Confident	82	Confident	95 Å²	95	77 Å²	77	44%	0.444	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.6	169.9	-173.2	-179	133.7	0	0	109.7	R30 F82	E23-R30 VanDerWaalsContact CD-NH2 3.28Å; E23-R30 IonicContact OE1-CZ 3.52Å; E23-R30 VanDerWaalsContact OE1-CZ 3.31Å; E23-R30 IonicContact OE1-NE 3.7Å; E23-R30 PolarHBondContact OE1-NE 3.31Å; E23-R30 IonicContact OE1-NH2 2.71Å; E23-R30 PolarHBondContact OE1-NH2 2.79Å; E23-R30 VanDerWaalsContact OE1-NH2 3.15Å; E23-R30 IonicContact OE2-CZ 2.79Å; E23-R30 IonicContact OE2-NE 3.77Å; E23-R30 IonicContact OE2-NH2 2.69Å; E23-R30 PolarHBondContact OE2-NH2 3.09Å; E23-F82 HydrophobicContact CG-CD1 4.05Å; E23-F82 HydrophobicContact CG-CE1 4.17Å; E23-F82 WeakPolarHBondContact OE2-CD1 3.23Å
24	H	73.3	Confident	82.4	Confident	60 Å²	60	72.6 Å²	72.6	28%	0.278	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.1	174.6	-74.9	65.3	0	0	0	109.7	D22 R30 F31 V33	D22-H24 PolarHBondContact O-N 3.15Å; D22-H24 PolarHBondContact O-ND1 2.86Å; D22-H24 VanDerWaalsContact O-ND1 3.15Å; H24-R30 CarbonylContact O-C 3.6Å; H24-R30 WeakPolarHBondContact O-CA 3.46Å; H24-F31 HydrophobicContact CB-CD2 3.75Å; H24-F31 HydrophobicContact CB-CE2 3.35Å; H24-F31 HydrophobicContact CB-CZ 3.83Å; H24-F31 PolarHBondContact N-O 3.21Å; H24-F31 PolarHBondContact O-N 3.14Å; H24-V33 HydrophobicContact CB-CG2 4.01Å; H24-V33 VanDerWaalsContact ND1-CG2 3.34Å; H24-V33 WeakPolarHBondContact ND1-CG2 3.1Å
25	R	71.1	Confident	82.3	Confident	191 Å²	191	74.7 Å²	74.7	72%	0.721	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	120.2	176.5	-167.1	174.1	-177.9	172.2	0.9	108.9	R30	R25-R30 HydrophobicContact CG-CG 4.26Å
26	E	59.7	Low	82.3	Confident	107 Å²	107	71.7 Å²	71.7	50%	0.5	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	117.9	174.7	-164.8	179.7	178	0	0	108.6	K28 K29 F31	E26-K28 PolarHBondContact O-N 2.64Å; E26-K28 VanDerWaalsContact O-N 3.15Å; E26-K29 PolarHBondContact N-O 3.26Å; E26-K29 PolarHBondContact O-N 3.14Å; E26-F31 HydrophobicContact CB-CE1 3.66Å; E26-F31 HydrophobicContact CB-CZ 4.11Å
27	K	76.1	Confident	82.1	Confident	193 Å²	193	73 Å²	73	84%	0.839	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	-117.5	-170.6	-54.7	174.6	-178.2	175.1	0	110.4
28	K	63.7	Low	82.1	Confident	201 Å²	201	71.2 Å²	71.2	87%	0.874	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	0.5	176.1	-64.8	-172.6	178.8	-179	0	113.8	E26	E26-K28 PolarHBondContact O-N 2.64Å; E26-K28 VanDerWaalsContact O-N 3.15Å
29	K	70	Confident	81.9	Confident	168 Å²	168	71.7 Å²	71.7	73%	0.73	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	131.7	-178.6	-65.2	-173.4	179.7	179.2	0	109.8	E26	E26-K29 PolarHBondContact N-O 3.26Å; E26-K29 PolarHBondContact O-N 3.14Å
30	R	78.8	Confident	82	Confident	109 Å²	109	70.3 Å²	70.3	41%	0.411	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	144.9	171.3	-65.9	167.6	62.6	-164.9	0.4	108.2	E23 H24 R25 F82	E23-R30 VanDerWaalsContact CD-NH2 3.28Å; E23-R30 IonicContact OE1-CZ 3.52Å; E23-R30 VanDerWaalsContact OE1-CZ 3.31Å; E23-R30 IonicContact OE1-NE 3.7Å; E23-R30 PolarHBondContact OE1-NE 3.31Å; E23-R30 IonicContact OE1-NH2 2.71Å; E23-R30 PolarHBondContact OE1-NH2 2.79Å; E23-R30 VanDerWaalsContact OE1-NH2 3.15Å; E23-R30 IonicContact OE2-CZ 2.79Å; E23-R30 IonicContact OE2-NE 3.77Å; E23-R30 IonicContact OE2-NH2 2.69Å; E23-R30 PolarHBondContact OE2-NH2 3.09Å; H24-R30 CarbonylContact O-C 3.6Å; H24-R30 WeakPolarHBondContact O-CA 3.46Å; R25-R30 HydrophobicContact CG-CG 4.26Å; R30-F82 VanDerWaalsContact C-CZ 3.43Å; R30-F82 HydrophobicContact CB-CD1 4.37Å; R30-F82 HydrophobicContact CB-CE1 3.5Å; R30-F82 HydrophobicContact CB-CE2 3.75Å; R30-F82 HydrophobicContact CB-CZ 3.17Å; R30-F82 HydrophobicContact CG-CZ 4.44Å; R30-F82 VanDerWaalsContact CZ-CG 3.47Å; R30-F82 WeakPolarHBondContact O-CZ 3.46Å
31	F	83	Confident	82	Confident	43 Å²	43	70.7 Å²	70.7	19%	0.189	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	151	172.3	50.2	-93.4	0	0	0	111.3	H24 E26 V33 R50	H24-F31 HydrophobicContact CB-CD2 3.75Å; H24-F31 HydrophobicContact CB-CE2 3.35Å; H24-F31 HydrophobicContact CB-CZ 3.83Å; H24-F31 PolarHBondContact N-O 3.21Å; H24-F31 PolarHBondContact O-N 3.14Å; E26-F31 HydrophobicContact CB-CE1 3.66Å; E26-F31 HydrophobicContact CB-CZ 4.11Å; F31-V33 HydrophobicContact CD2-CG2 3.68Å; F31-V33 HydrophobicContact CE2-CG2 3.67Å; F31-R50 HydrophobicContact CD2-CG 4.11Å
32	T	85.5	Confident	81.8	Confident	13 Å²	13	81.3 Å²	81.3	8%	0.08	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.3	173.7	-46.4	0	0	0	0	110.2	Y34 I87	T32-Y34 HydrophobicContact CG2-CE1 4.12Å; T32-Y34 HydrophobicContact CG2-CE2 4.15Å; T32-I87 HydrophobicContact CG2-CG2 4.03Å
33	V	89.6	Confident	82.1	Confident	1 Å²	1	80.8 Å²	80.8	1%	0.006	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.4	172	-178.6	0	0	0	0	108.9	S21 D22 H24 F31 F48 R50 P128	S21-V33 CarbonylContact C-O 3.57Å; S21-V33 WeakPolarHBondContact CA-O 3.36Å; D22-V33 PolarHBondContact N-O 2.92Å; D22-V33 PolarHBondContact O-N 2.89Å; H24-V33 HydrophobicContact CB-CG2 4.01Å; H24-V33 VanDerWaalsContact ND1-CG2 3.34Å; H24-V33 WeakPolarHBondContact ND1-CG2 3.1Å; F31-V33 HydrophobicContact CD2-CG2 3.68Å; F31-V33 HydrophobicContact CE2-CG2 3.67Å; V33-F48 HydrophobicContact CG1-CB 3.78Å; V33-F48 HydrophobicContact CG1-CD1 4.09Å; V33-F48 HydrophobicContact CG1-CG 4.42Å; V33-R50 HydrophobicContact CG2-CG 4.28Å; V33-P128 HydrophobicContact CG1-CG 3.87Å; V33-P128 HydrophobicContact CG2-CG 4.41Å
34	Y	90.8	Very high	82.4	Confident	1 Å²	1	82.6 Å²	82.6	0%	0.004	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126	178	-60.4	-83.9	0	0	0	109.5	I18 T32 V36 F48 R49 F54 R90 R91 L94	I18-Y34 HydrophobicContact CG2-CD1 4.19Å; T32-Y34 HydrophobicContact CG2-CE1 4.12Å; T32-Y34 HydrophobicContact CG2-CE2 4.15Å; Y34-V36 PolarHBondContact O-N 3.29Å; Y34-F48 WeakPolarHBondContact O-CA 3.37Å; Y34-R49 WeakPolarHBondContact CB-O 3.26Å; Y34-R49 WeakPolarHBondContact CD2-O 3.23Å; Y34-R49 PolarHBondContact N-O 3.35Å; Y34-R49 PolarHBondContact O-N 2.65Å; Y34-F54 AromaticContact CD2-CE2 3.98Å; Y34-F54 HydrophobicContact CD2-CE2 3.98Å; Y34-F54 HydrophobicContact CG-CE2 4.3Å; Y34-R90 WeakPolarHBondContact OH-CD 3.06Å; Y34-R90 WeakPolarHBondContact OH-CG 3.32Å; Y34-R91 HydrophobicContact CD1-CB 4.13Å; Y34-R91 HydrophobicContact CD1-CG 4.07Å; Y34-R91 HydrophobicContact CE1-CB 3.87Å; Y34-R91 HydrophobicContact CE1-CG 4.33Å; Y34-L94 HydrophobicContact CD1-CD1 4.12Å; Y34-L94 HydrophobicContact CD2-CD1 3.72Å; Y34-L94 HydrophobicContact CE1-CD1 3.96Å; Y34-L94 HydrophobicContact CE2-CD1 3.58Å; Y34-L94 HydrophobicContact CG-CD1 4.01Å
35	K	90.2	Very high	83	Confident	54 Å²	54	81 Å²	81	24%	0.235	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	105	176.6	-175.4	179.8	-174.1	-173.9	0	108.5	I18 P19 S20 F46 F48	I18-K35 WeakPolarHBondContact CA-O 3.49Å; I18-K35 WeakPolarHBondContact CG2-O 3.48Å; P19-K35 VanDerWaalsContact CD-O 3.22Å; P19-K35 WeakPolarHBondContact CD-O 3.32Å; S20-K35 PolarHBondContact O-N 3.17Å; S20-K35 WeakPolarHBondContact OG-CD 3.43Å; K35-F46 HydrophobicContact CD-CD1 4.01Å; K35-F46 HydrophobicContact CD-CE1 4.15Å; K35-F46 HydrophobicContact CD-CG 4.37Å; K35-F46 VanDerWaalsContact CE-CE1 3.41Å; K35-F46 HydrophobicContact CG-CB 4.33Å; K35-F46 HydrophobicContact CG-CD1 3.64Å; K35-F46 HydrophobicContact CG-CE1 4.18Å; K35-F46 HydrophobicContact CG-CG 4.11Å; K35-F48 HydrophobicContact CB-CD1 4.23Å; K35-F48 HydrophobicContact CB-CE1 4.03Å; K35-F48 HydrophobicContact CD-CE1 4.08Å; K35-F48 HydrophobicContact CD-CZ 4.45Å; K35-F48 HydrophobicContact CG-CD1 4.29Å; K35-F48 HydrophobicContact CG-CE1 3.71Å; K35-F48 HydrophobicContact CG-CZ 4.2Å
36	V	93.9	Very high	83.8	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.006	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.9	179.2	-174.7	0	0	0	0	108.9	S17 I18 Y34 V38 F46 V47 F54 I98 L117	S17-V36 CarbonylContact O-C 3.1Å; S17-V36 WeakPolarHBondContact O-CA 3.16Å; I18-V36 HydrophobicContact CD1-CG2 4.4Å; I18-V36 HydrophobicContact CG1-CG2 4.23Å; Y34-V36 PolarHBondContact O-N 3.29Å; V36-V38 HydrophobicContact CG1-CG2 4.03Å; V36-F46 CarbonylContact O-C 3.58Å; V36-F46 VanDerWaalsContact O-CA 3.27Å; V36-F46 WeakPolarHBondContact O-CA 2.81Å; V36-V47 WeakPolarHBondContact CA-O 3.37Å; V36-V47 HydrophobicContact CB-CB 4.33Å; V36-V47 WeakPolarHBondContact CB-O 3.4Å; V36-V47 PolarHBondContact N-O 2.86Å; V36-V47 PolarHBondContact O-N 3.45Å; V36-F54 HydrophobicContact CG2-CZ 3.95Å; V36-I98 HydrophobicContact CG1-CD1 3.62Å; V36-L117 HydrophobicContact CG1-CD2 4.28Å
37	L	92.1	Very high	85	Confident	38 Å²	38	70.7 Å²	70.7	20%	0.199	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.2	167.6	178.2	61.2	0	0	0	108.5	V16 S17 P19 E44 F46	V16-L37 CarbonylContact C-O 3.53Å; V16-L37 WeakPolarHBondContact CA-O 3.28Å; S17-L37 PolarHBondContact N-O 2.86Å; S17-L37 PolarHBondContact O-N 2.92Å; P19-L37 HydrophobicContact CG-CB 4.45Å; L37-E44 HydrophobicContact CD1-CB 4.31Å; L37-F46 HydrophobicContact CB-CD1 4.05Å; L37-F46 HydrophobicContact CB-CE1 3.79Å; L37-F46 HydrophobicContact CD1-CD1 4.05Å; L37-F46 HydrophobicContact CD1-CE1 3.66Å; L37-F46 HydrophobicContact CD1-CZ 4.04Å; L37-F46 HydrophobicContact CG-CE1 4.22Å
38	V	93.9	Very high	85.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130	175.4	-172.9	0	0	0	0	108.2	V16 V36 V40 E44 W45 V47 L117	V16-V38 HydrophobicContact CG1-CB 4.35Å; V16-V38 HydrophobicContact CG1-CG1 4.08Å; V16-V38 HydrophobicContact CG1-CG2 4.1Å; V36-V38 HydrophobicContact CG1-CG2 4.03Å; V38-V40 HydrophobicContact CG1-CG2 4.37Å; V38-E44 CarbonylContact O-C 3.6Å; V38-E44 VanDerWaalsContact O-CA 3.28Å; V38-E44 WeakPolarHBondContact O-CA 3.47Å; V38-W45 HydrophobicContact CB-CD2 4.12Å; V38-W45 HydrophobicContact CB-CH2 4.46Å; V38-W45 HydrophobicContact CB-CZ2 3.84Å; V38-W45 HydrophobicContact CG1-CD2 4.47Å; V38-W45 HydrophobicContact CG1-CH2 3.79Å; V38-W45 HydrophobicContact CG1-CZ2 3.35Å; V38-W45 HydrophobicContact CG1-CZ3 4.47Å; V38-W45 PolarHBondContact N-O 2.8Å; V38-W45 PolarHBondContact O-N 2.86Å; V38-V47 HydrophobicContact CG2-CG2 4Å; V38-L117 HydrophobicContact CG1-CB 4.43Å; V38-L117 HydrophobicContact CG2-CB 4.28Å; V38-L117 HydrophobicContact CG2-CD2 4.01Å
39	S	91.3	Very high	86.9	Confident	13 Å²	13	55.6 Å²	55.6	9%	0.091	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.2	178	-40.8	0	0	0	0	109.5	P14 S15 S43 E44	P14-S39 CarbonylContact C-O 3.54Å; P14-S39 WeakPolarHBondContact CA-O 3.3Å; S15-S39 PolarHBondContact N-O 2.83Å; S15-S39 PolarHBondContact O-N 2.83Å; S15-S39 WeakPolarHBondContact OG-CB 3.49Å; S39-S43 CarbonylContact C-O 3.57Å; S39-S43 VanDerWaalsContact CA-O 3.3Å; S39-S43 WeakPolarHBondContact CA-O 3.34Å; S39-E44 WeakPolarHBondContact CB-OE1 3.33Å; S39-E44 PolarHBondContact OG-OE1 3.35Å
40	V	88.6	Confident	87.9	Confident	40 Å²	40	52.1 Å²	52.1	24%	0.242	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	110.5	177.2	-179.4	0	0	0	0	108.2	P14 V38 R42 S43 W45 M119	P14-V40 HydrophobicContact CB-CG2 3.88Å; V38-V40 HydrophobicContact CG1-CG2 4.37Å; V40-R42 PolarHBondContact O-N 3.34Å; V40-R42 VanDerWaalsContact O-N 3.15Å; V40-S43 PolarHBondContact N-O 2.66Å; V40-S43 PolarHBondContact O-N 3.29Å; V40-W45 HydrophobicContact CB-CH2 3.95Å; V40-W45 HydrophobicContact CB-CZ3 4.09Å; V40-W45 HydrophobicContact CG2-CH2 3.49Å; V40-W45 VanDerWaalsContact CG2-CH2 3.49Å; V40-W45 HydrophobicContact CG2-CZ2 4.45Å; V40-W45 HydrophobicContact CG2-CZ3 4.06Å; V40-M119 HydrophobicContact CG2-CE 4.08Å
41	G	86.3	Confident	88.4	Confident	48 Å²	48	48.1 Å²	48.1	50%	0.495	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	-114.5	-174.3	0	0	0	0	0	111.5	S12	S12-G41 VanDerWaalsContact CB-N 3.35Å
42	R	80.9	Confident	88.7	Confident	255 Å²	255	48.9 Å²	48.9	96%	0.962	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	0.3	177.6	-63.5	-175.5	-179.9	178.2	0.5	113.9	V40	V40-R42 PolarHBondContact O-N 3.34Å; V40-R42 VanDerWaalsContact O-N 3.15Å
43	S	82.9	Confident	89.1	Confident	65 Å²	65	50.2 Å²	50.2	46%	0.455	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	133.9	-176.7	-61.5	0	0	0	0	110	S39 V40	S39-S43 CarbonylContact C-O 3.57Å; S39-S43 VanDerWaalsContact CA-O 3.3Å; S39-S43 WeakPolarHBondContact CA-O 3.34Å; V40-S43 PolarHBondContact N-O 2.66Å; V40-S43 PolarHBondContact O-N 3.29Å
44	E	88.2	Confident	89.3	Confident	134 Å²	134	50.1 Å²	50.1	63%	0.626	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.4	173.8	-56.9	-164.8	111.4	0	0	110.1	L37 V38 S39	L37-E44 HydrophobicContact CD1-CB 4.31Å; V38-E44 CarbonylContact O-C 3.6Å; V38-E44 VanDerWaalsContact O-CA 3.28Å; V38-E44 WeakPolarHBondContact O-CA 3.47Å; S39-E44 WeakPolarHBondContact CB-OE1 3.33Å; S39-E44 PolarHBondContact OG-OE1 3.35Å
45	W	86	Confident	89.4	Confident	25 Å²	25	51.2 Å²	51.2	10%	0.095	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	162.9	176.8	64.2	97.8	0	0	0	111.7	V38 V40 L117 M119 P122	V38-W45 HydrophobicContact CB-CD2 4.12Å; V38-W45 HydrophobicContact CB-CH2 4.46Å; V38-W45 HydrophobicContact CB-CZ2 3.84Å; V38-W45 HydrophobicContact CG1-CD2 4.47Å; V38-W45 HydrophobicContact CG1-CH2 3.79Å; V38-W45 HydrophobicContact CG1-CZ2 3.35Å; V38-W45 HydrophobicContact CG1-CZ3 4.47Å; V38-W45 PolarHBondContact N-O 2.8Å; V38-W45 PolarHBondContact O-N 2.86Å; V40-W45 HydrophobicContact CB-CH2 3.95Å; V40-W45 HydrophobicContact CB-CZ3 4.09Å; V40-W45 HydrophobicContact CG2-CH2 3.49Å; V40-W45 VanDerWaalsContact CG2-CH2 3.49Å; V40-W45 HydrophobicContact CG2-CZ2 4.45Å; V40-W45 HydrophobicContact CG2-CZ3 4.06Å; W45-L117 PolarHBondContact NE1-O 3.37Å; W45-M119 HydrophobicContact CZ2-CG 4.29Å; W45-P122 HydrophobicContact CD2-CB 3.73Å; W45-P122 HydrophobicContact CE3-CB 3.64Å; W45-P122 HydrophobicContact CG-CB 4.3Å; W45-P122 HydrophobicContact CH2-CB 4.19Å; W45-P122 HydrophobicContact CZ2-CB 4.28Å; W45-P122 HydrophobicContact CZ3-CB 3.89Å
46	F	87.8	Confident	89.5	Confident	82 Å²	82	56.2 Å²	56.2	36%	0.36	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.9	173.7	-66.1	-67.8	0	0	0	111	P19 K35 V36 L37 F48	P19-F46 HydrophobicContact CG-CE1 4.26Å; K35-F46 HydrophobicContact CD-CD1 4.01Å; K35-F46 HydrophobicContact CD-CE1 4.15Å; K35-F46 HydrophobicContact CD-CG 4.37Å; K35-F46 VanDerWaalsContact CE-CE1 3.41Å; K35-F46 HydrophobicContact CG-CB 4.33Å; K35-F46 HydrophobicContact CG-CD1 3.64Å; K35-F46 HydrophobicContact CG-CE1 4.18Å; K35-F46 HydrophobicContact CG-CG 4.11Å; V36-F46 CarbonylContact O-C 3.58Å; V36-F46 VanDerWaalsContact O-CA 3.27Å; V36-F46 WeakPolarHBondContact O-CA 2.81Å; L37-F46 HydrophobicContact CB-CD1 4.05Å; L37-F46 HydrophobicContact CB-CE1 3.79Å; L37-F46 HydrophobicContact CD1-CD1 4.05Å; L37-F46 HydrophobicContact CD1-CE1 3.66Å; L37-F46 HydrophobicContact CD1-CZ 4.04Å; L37-F46 HydrophobicContact CG-CE1 4.22Å; F46-F48 HydrophobicContact CB-CE2 4.11Å; F46-F48 HydrophobicContact CB-CZ 4.25Å
47	V	86	Confident	89.5	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.8	169.2	-174	0	0	0	0	108.1	V36 V38 R49 L117 Q118	V36-V47 WeakPolarHBondContact CA-O 3.37Å; V36-V47 HydrophobicContact CB-CB 4.33Å; V36-V47 WeakPolarHBondContact CB-O 3.4Å; V36-V47 PolarHBondContact N-O 2.86Å; V36-V47 PolarHBondContact O-N 3.45Å; V38-V47 HydrophobicContact CG2-CG2 4Å; V47-R49 HydrophobicContact CG1-CG 4.07Å; V47-L117 WeakPolarHBondContact CG2-O 3.42Å; V47-Q118 HydrophobicContact CG1-CG 4.5Å; V47-Q118 HydrophobicContact CG2-CB 4.22Å; V47-Q118 HydrophobicContact CG2-CG 4.31Å
48	F	88.6	Confident	89.7	Confident	56 Å²	56	56.3 Å²	56.3	25%	0.246	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.6	-179.3	-63.2	-89.4	0	0	0	109.1	V33 Y34 K35 F46 P128	V33-F48 HydrophobicContact CG1-CB 3.78Å; V33-F48 HydrophobicContact CG1-CD1 4.09Å; V33-F48 HydrophobicContact CG1-CG 4.42Å; Y34-F48 WeakPolarHBondContact O-CA 3.37Å; K35-F48 HydrophobicContact CB-CD1 4.23Å; K35-F48 HydrophobicContact CB-CE1 4.03Å; K35-F48 HydrophobicContact CD-CE1 4.08Å; K35-F48 HydrophobicContact CD-CZ 4.45Å; K35-F48 HydrophobicContact CG-CD1 4.29Å; K35-F48 HydrophobicContact CG-CE1 3.71Å; K35-F48 HydrophobicContact CG-CZ 4.2Å; F46-F48 HydrophobicContact CB-CE2 4.11Å; F46-F48 HydrophobicContact CB-CZ 4.25Å; F48-P128 HydrophobicContact CB-CG 3.7Å; F48-P128 WeakPolarHBondContact O-CB 3.3Å
49	R	90.3	Very high	89.6	Confident	21 Å²	21	59.4 Å²	59.4	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	139.7	-174.8	-65.1	-66.9	177	-114.1	1.6	111.1	Y34 V47 E53 F54 F116	Y34-R49 WeakPolarHBondContact CB-O 3.26Å; Y34-R49 WeakPolarHBondContact CD2-O 3.23Å; Y34-R49 PolarHBondContact N-O 3.35Å; Y34-R49 PolarHBondContact O-N 2.65Å; V47-R49 HydrophobicContact CG1-CG 4.07Å; R49-E53 WeakPolarHBondContact CD-OE1 3.08Å; R49-E53 IonicContact CZ-OE1 3.57Å; R49-E53 IonicContact NE-OE1 2.66Å; R49-E53 IonicContact NH1-OE1 3.39Å; R49-F54 HydrophobicContact CB-CD2 4.05Å; R49-F54 HydrophobicContact CB-CE2 3.36Å; R49-F54 HydrophobicContact CB-CZ 3.85Å; R49-F54 HydrophobicContact CG-CE2 4.42Å; R49-F116 HydrophobicContact CB-CE2 4.3Å; R49-F116 HydrophobicContact CB-CZ 4.06Å; R49-F116 HydrophobicContact CG-CD2 4.46Å; R49-F116 HydrophobicContact CG-CE1 4.2Å; R49-F116 HydrophobicContact CG-CE2 3.74Å; R49-F116 HydrophobicContact CG-CZ 3.57Å; R49-F116 PolarHBondContact NE-O 2.77Å; R49-F116 PolarHBondContact NH2-O 2.76Å
50	R	91.7	Very high	89.7	Confident	94 Å²	94	60.4 Å²	60.4	36%	0.355	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	157.7	168	-60.5	-177.9	-62.6	168.8	-0.7	109.8	F31 V33 A52 E53 F54	F31-R50 HydrophobicContact CD2-CG 4.11Å; V33-R50 HydrophobicContact CG2-CG 4.28Å; R50-A52 PolarHBondContact O-N 3.41Å; R50-A52 VanDerWaalsContact O-N 3.08Å; R50-E53 WeakPolarHBondContact CB-OE2 3.45Å; R50-E53 PolarHBondContact N-OE2 3.26Å; R50-E53 IonicContact NE-OE2 2.71Å; R50-E53 WeakPolarHBondContact O-CB 3.08Å; R50-E53 PolarHBondContact O-N 3.09Å; R50-F54 VanDerWaalsContact O-CD2 3.31Å; R50-F54 WeakPolarHBondContact O-CD2 3.16Å
51	Y	90.1	Very high	89.9	Confident	26 Å²	26	58.5 Å²	58.5	10%	0.102	29%	0.287	C	S	.	.	H	α-helix	trans	-50.2	-38.3	177.1	176.2	-84.2	0	0	0	112.9	E53 F54 D55 P73 K75 R90 L94	Y51-E53 PolarHBondContact O-N 2.97Å; Y51-F54 PolarHBondContact O-N 3.22Å; Y51-D55 HydrophobicContact CD1-CB 4.38Å; Y51-D55 HydrophobicContact CE1-CB 3.85Å; Y51-D55 WeakPolarHBondContact O-CB 3.15Å; Y51-D55 PolarHBondContact O-N 3.47Å; Y51-D55 PolarHBondContact OH-OD1 3.3Å; Y51-P73 VanDerWaalsContact CE2-O 3.25Å; Y51-P73 WeakPolarHBondContact CE2-O 3.34Å; Y51-P73 PolarHBondContact OH-O 3.38Å; Y51-K75 HydrophobicContact CD1-CG 4.42Å; Y51-K75 HydrophobicContact CE1-CD 4.24Å; Y51-K75 HydrophobicContact CE1-CG 3.45Å; Y51-K75 VanDerWaalsContact CE1-CG 3.45Å; Y51-R90 HydrophobicContact CD2-CG 4.18Å; Y51-L94 HydrophobicContact CD2-CD1 4.38Å; Y51-L94 HydrophobicContact CD2-CD2 4.36Å
52	A	88.6	Confident	90.3	Very high	59 Å²	59	61.5 Å²	61.5	49%	0.488	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-31.7	179.4	0	0	0	0	0	113.6	R50 K56	R50-A52 PolarHBondContact O-N 3.41Å; R50-A52 VanDerWaalsContact O-N 3.08Å; A52-K56 WeakPolarHBondContact O-CB 3.48Å; A52-K56 PolarHBondContact O-N 3.43Å
53	E	93.2	Very high	90.8	Very high	40 Å²	40	57.8 Å²	57.8	19%	0.187	28%	0.277	C	S	.	.	H	α-helix	trans	-74.8	-39.5	178.5	-64.9	161.5	77.9	0	0	111	R49 R50 Y51 D55 K56 L57 F116	R49-E53 WeakPolarHBondContact CD-OE1 3.08Å; R49-E53 IonicContact CZ-OE1 3.57Å; R49-E53 IonicContact NE-OE1 2.66Å; R49-E53 IonicContact NH1-OE1 3.39Å; R50-E53 WeakPolarHBondContact CB-OE2 3.45Å; R50-E53 PolarHBondContact N-OE2 3.26Å; R50-E53 IonicContact NE-OE2 2.71Å; R50-E53 WeakPolarHBondContact O-CB 3.08Å; R50-E53 PolarHBondContact O-N 3.09Å; Y51-E53 PolarHBondContact O-N 2.97Å; E53-D55 VanDerWaalsContact C-N 3.35Å; E53-K56 PolarHBondContact O-N 3.27Å; E53-L57 PolarHBondContact O-N 3.06Å; E53-F116 HydrophobicContact CB-CE2 4.05Å
54	F	95.2	Very high	91.3	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-43.7	170.7	-67.6	-93.3	0	0	0	111.3	I18 Y34 V36 R49 R50 Y51 K56 L57 Y58 L94 F97 I98 F116	I18-F54 HydrophobicContact CD1-CE1 4.15Å; I18-F54 HydrophobicContact CD1-CZ 3.95Å; Y34-F54 AromaticContact CD2-CE2 3.98Å; Y34-F54 HydrophobicContact CD2-CE2 3.98Å; Y34-F54 HydrophobicContact CG-CE2 4.3Å; V36-F54 HydrophobicContact CG2-CZ 3.95Å; R49-F54 HydrophobicContact CB-CD2 4.05Å; R49-F54 HydrophobicContact CB-CE2 3.36Å; R49-F54 HydrophobicContact CB-CZ 3.85Å; R49-F54 HydrophobicContact CG-CE2 4.42Å; R50-F54 VanDerWaalsContact O-CD2 3.31Å; R50-F54 WeakPolarHBondContact O-CD2 3.16Å; Y51-F54 PolarHBondContact O-N 3.22Å; F54-K56 PolarHBondContact O-N 2.88Å; F54-L57 PolarHBondContact O-N 2.86Å; F54-Y58 VanDerWaalsContact O-CB 3.29Å; F54-Y58 WeakPolarHBondContact O-CB 2.89Å; F54-Y58 PolarHBondContact O-N 2.93Å; F54-L94 HydrophobicContact CB-CD2 3.73Å; F54-L94 HydrophobicContact CD1-CB 4.41Å; F54-L94 HydrophobicContact CD1-CD2 3.81Å; F54-L94 HydrophobicContact CD1-CG 4.5Å; F54-L94 HydrophobicContact CD2-CD1 3.95Å; F54-L94 HydrophobicContact CD2-CD2 4.17Å; F54-L94 HydrophobicContact CE1-CB 4.21Å; F54-L94 HydrophobicContact CE1-CD2 4.43Å; F54-L94 HydrophobicContact CE2-CD1 3.99Å; F54-L94 HydrophobicContact CG-CD1 4.28Å; F54-L94 HydrophobicContact CG-CD2 3.67Å; F54-L94 HydrophobicContact CG-CG 4.47Å; F54-L94 HydrophobicContact CZ-CB 4.48Å; F54-L94 HydrophobicContact CZ-CD1 4.34Å; F54-F97 AromaticContact CD1-CD1 3.99Å; F54-F97 HydrophobicContact CD1-CD1 3.99Å; F54-F97 HydrophobicContact CD1-CE1 4.22Å; F54-I98 HydrophobicContact CD1-CG2 4.12Å; F54-I98 HydrophobicContact CE1-CG2 3.62Å; F54-F116 HydrophobicContact CD1-CE1 4.13Å; F54-F116 HydrophobicContact CD1-CE2 4.43Å; F54-F116 AromaticContact CD1-CZ 3.5Å; F54-F116 HydrophobicContact CD1-CZ 3.5Å; F54-F116 HydrophobicContact CD2-CZ 4.17Å; F54-F116 AromaticContact CE1-CE1 3.94Å; F54-F116 HydrophobicContact CE1-CE1 3.94Å; F54-F116 AromaticContact CE1-CZ 3.55Å; F54-F116 HydrophobicContact CE1-CZ 3.55Å; F54-F116 HydrophobicContact CE2-CZ 4.2Å; F54-F116 HydrophobicContact CG-CE2 4.4Å; F54-F116 AromaticContact CG-CZ 3.83Å; F54-F116 HydrophobicContact CG-CZ 3.83Å; F54-F116 HydrophobicContact CZ-CE1 4.47Å; F54-F116 AromaticContact CZ-CZ 3.89Å; F54-F116 HydrophobicContact CZ-CZ 3.89Å
55	D	91.8	Very high	91.5	Very high	23 Å²	23	55.6 Å²	55.6	12%	0.123	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-42	177.8	-169.2	84.2	0	0	0	111.6	Y51 E53 N59 I72 K75	Y51-D55 HydrophobicContact CD1-CB 4.38Å; Y51-D55 HydrophobicContact CE1-CB 3.85Å; Y51-D55 WeakPolarHBondContact O-CB 3.15Å; Y51-D55 PolarHBondContact O-N 3.47Å; Y51-D55 PolarHBondContact OH-OD1 3.3Å; E53-D55 VanDerWaalsContact C-N 3.35Å; D55-N59 WeakPolarHBondContact O-CB 3.39Å; D55-N59 VanDerWaalsContact O-CG 3.28Å; D55-N59 PolarHBondContact O-N 3.3Å; D55-N59 PolarHBondContact O-ND2 2.9Å; D55-N59 PolarHBondContact OD2-ND2 3.18Å; D55-I72 HydrophobicContact CB-CD1 4.13Å; D55-K75 VanDerWaalsContact OD1-CE 3.26Å; D55-K75 WeakPolarHBondContact OD1-CE 3.37Å; D55-K75 IonicContact OD1-NZ 3.62Å; D55-K75 WeakPolarHBondContact OD2-CE 3.43Å; D55-K75 IonicContact OD2-NZ 3.15Å; D55-K75 PolarHBondContact OD2-NZ 3.42Å
56	K	92.2	Very high	91.6	Very high	159 Å²	159	59 Å²	59	69%	0.691	29%	0.285	S	S	*	.	H	α-helix	trans	-62.6	-48.5	174.8	-174.5	-178.9	177.1	-173.9	0	111.5	A52 E53 F54 N59 S60	A52-K56 WeakPolarHBondContact O-CB 3.48Å; A52-K56 PolarHBondContact O-N 3.43Å; E53-K56 PolarHBondContact O-N 3.27Å; F54-K56 PolarHBondContact O-N 2.88Å; K56-N59 PolarHBondContact O-N 3.06Å; K56-S60 PolarHBondContact O-N 3.2Å
57	L	94.9	Very high	91.7	Very high	9 Å²	9	59.9 Å²	59.9	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-60.8	-48.5	177.6	178	64.1	0	0	0	111.3	E53 F54 N59 S60 L61 F97 L101 D112 V113 F116	E53-L57 PolarHBondContact O-N 3.06Å; F54-L57 PolarHBondContact O-N 2.86Å; L57-N59 VanDerWaalsContact C-N 3.33Å; L57-N59 PolarHBondContact O-N 3Å; L57-S60 WeakPolarHBondContact O-CB 3.4Å; L57-S60 PolarHBondContact O-N 3.34Å; L57-S60 VanDerWaalsContact O-N 3.15Å; L57-L61 HydrophobicContact CD1-CD1 3.88Å; L57-L61 HydrophobicContact CD1-CG 3.98Å; L57-L61 HydrophobicContact CD2-CD1 4.44Å; L57-L61 HydrophobicContact CG-CD1 3.86Å; L57-L61 HydrophobicContact CG-CG 4.32Å; L57-L61 WeakPolarHBondContact O-CG 3.44Å; L57-L61 PolarHBondContact O-N 2.84Å; L57-F97 HydrophobicContact CD2-CE1 4.2Å; L57-F97 HydrophobicContact CD2-CZ 4.35Å; L57-F97 HydrophobicContact CG-CZ 4.42Å; L57-L101 HydrophobicContact CD2-CD1 3.66Å; L57-D112 HydrophobicContact CD1-CB 3.62Å; L57-V113 HydrophobicContact CD1-CG2 4.21Å; L57-F116 HydrophobicContact CB-CD2 4.27Å; L57-F116 HydrophobicContact CD2-CB 3.81Å; L57-F116 HydrophobicContact CD2-CD1 3.7Å; L57-F116 HydrophobicContact CD2-CD2 3.85Å; L57-F116 HydrophobicContact CD2-CE1 4.21Å; L57-F116 HydrophobicContact CD2-CE2 4.31Å; L57-F116 HydrophobicContact CD2-CG 3.51Å; L57-F116 HydrophobicContact CD2-CZ 4.48Å
58	Y	95.6	Very high	91.7	Very high	33 Å²	33	62.2 Å²	62.2	13%	0.129	32%	0.318	C	S	.	.	H	α-helix	trans	-55.5	-47.1	176.6	164.6	-109.8	0	0	0	111.9	F54 S60 L61 K62 L70 I72 F97	F54-Y58 VanDerWaalsContact O-CB 3.29Å; F54-Y58 WeakPolarHBondContact O-CB 2.89Å; F54-Y58 PolarHBondContact O-N 2.93Å; Y58-S60 VanDerWaalsContact C-N 3.32Å; Y58-S60 PolarHBondContact O-N 3.24Å; Y58-L61 PolarHBondContact O-N 3.18Å; Y58-K62 HydrophobicContact CE1-CD 4.26Å; Y58-K62 HydrophobicContact CE2-CB 4.26Å; Y58-K62 HydrophobicContact CE2-CD 4.21Å; Y58-K62 HydrophobicContact CE2-CG 4.49Å; Y58-K62 WeakPolarHBondContact O-CB 3.28Å; Y58-K62 PolarHBondContact O-N 3.36Å; Y58-K62 PolarHBondContact OH-NZ 2.81Å; Y58-L70 HydrophobicContact CD2-CB 4.13Å; Y58-L70 HydrophobicContact CE2-CB 4.07Å; Y58-L70 VanDerWaalsContact CE2-O 3.25Å; Y58-L70 WeakPolarHBondContact CE2-O 3.2Å; Y58-I72 HydrophobicContact CD1-CD1 3.56Å; Y58-I72 HydrophobicContact CD1-CG1 3.77Å; Y58-I72 HydrophobicContact CD2-CG2 4.12Å; Y58-I72 HydrophobicContact CE1-CD1 4.29Å; Y58-I72 HydrophobicContact CE1-CG1 4.11Å; Y58-I72 HydrophobicContact CG-CD1 3.85Å; Y58-I72 HydrophobicContact CG-CG1 3.95Å; Y58-I72 HydrophobicContact CG-CG2 3.94Å; Y58-F97 HydrophobicContact CD2-CE2 4.25Å
59	N	92.4	Very high	91.6	Very high	65 Å²	65	63 Å²	63	35%	0.348	34%	0.335	S	S	.	.	H	α-helix	trans	-67.9	-30.4	179.6	-73.9	-47.8	0	0	0	113	D55 K56 L57 K63	D55-N59 WeakPolarHBondContact O-CB 3.39Å; D55-N59 VanDerWaalsContact O-CG 3.28Å; D55-N59 PolarHBondContact O-N 3.3Å; D55-N59 PolarHBondContact O-ND2 2.9Å; D55-N59 PolarHBondContact OD2-ND2 3.18Å; K56-N59 PolarHBondContact O-N 3.06Å; L57-N59 VanDerWaalsContact C-N 3.33Å; L57-N59 PolarHBondContact O-N 3Å; N59-K63 WeakPolarHBondContact O-CG 3.25Å
60	S	92.7	Very high	91.6	Very high	34 Å²	34	62.7 Å²	62.7	24%	0.238	34%	0.335	C	S	.	.	H	α-helix	trans	-65.8	-54.4	170.7	-173.4	0	0	0	0	110.6	K56 L57 Y58 K62 K63 Q64 D112	K56-S60 PolarHBondContact O-N 3.2Å; L57-S60 WeakPolarHBondContact O-CB 3.4Å; L57-S60 PolarHBondContact O-N 3.34Å; L57-S60 VanDerWaalsContact O-N 3.15Å; Y58-S60 VanDerWaalsContact C-N 3.32Å; Y58-S60 PolarHBondContact O-N 3.24Å; S60-K62 PolarHBondContact O-N 3.2Å; S60-K63 PolarHBondContact O-N 2.83Å; S60-Q64 PolarHBondContact O-N 2.9Å; S60-Q64 PolarHBondContact OG-NE2 2.74Å; S60-D112 WeakPolarHBondContact CB-OD2 3.3Å; S60-D112 PolarHBondContact OG-OD2 3.44Å
61	L	93.6	Very high	91.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.6	-38.3	-176.2	-65.8	177	0	0	0	112.7	L57 Y58 K63 Q64 F65 L70 L101 L107 V113	L57-L61 HydrophobicContact CD1-CD1 3.88Å; L57-L61 HydrophobicContact CD1-CG 3.98Å; L57-L61 HydrophobicContact CD2-CD1 4.44Å; L57-L61 HydrophobicContact CG-CD1 3.86Å; L57-L61 HydrophobicContact CG-CG 4.32Å; L57-L61 WeakPolarHBondContact O-CG 3.44Å; L57-L61 PolarHBondContact O-N 2.84Å; Y58-L61 PolarHBondContact O-N 3.18Å; L61-K63 PolarHBondContact O-N 3.49Å; L61-Q64 PolarHBondContact O-N 3.15Å; L61-Q64 VanDerWaalsContact O-N 3.09Å; L61-F65 HydrophobicContact CD2-CD2 4.19Å; L61-F65 HydrophobicContact CD2-CE2 4.11Å; L61-F65 PolarHBondContact O-N 2.89Å; L61-L70 HydrophobicContact CB-CD1 3.89Å; L61-L70 HydrophobicContact CD1-CD1 4.26Å; L61-L101 HydrophobicContact CD1-CD1 4.39Å; L61-L101 HydrophobicContact CD1-CD2 3.5Å; L61-L107 HydrophobicContact CD2-CD2 4.32Å; L61-V113 HydrophobicContact CD1-CG2 3.77Å; L61-V113 HydrophobicContact CD2-CG2 4.08Å; L61-V113 HydrophobicContact CG-CG2 4.49Å
62	K	93.4	Very high	91.8	Very high	111 Å²	111	66.4 Å²	66.4	48%	0.483	36%	0.356	S	S	.	.	H	α-helix	trans	-59.4	-34.6	178.2	-173.4	-173.5	-174.5	174.4	0	112.4	Y58 S60 P66	Y58-K62 HydrophobicContact CE1-CD 4.26Å; Y58-K62 HydrophobicContact CE2-CB 4.26Å; Y58-K62 HydrophobicContact CE2-CD 4.21Å; Y58-K62 HydrophobicContact CE2-CG 4.49Å; Y58-K62 WeakPolarHBondContact O-CB 3.28Å; Y58-K62 PolarHBondContact O-N 3.36Å; Y58-K62 PolarHBondContact OH-NZ 2.81Å; S60-K62 PolarHBondContact O-N 3.2Å; K62-P66 WeakPolarHBondContact O-CA 3.42Å
63	K	91.5	Very high	91.9	Very high	176 Å²	176	65.1 Å²	65.1	77%	0.765	34%	0.342	S	S	*	.	H	α-helix	trans	-70.9	-36.1	177.1	-70.7	175.3	-176.6	-177.6	0	111.9	N59 S60 L61	N59-K63 WeakPolarHBondContact O-CG 3.25Å; S60-K63 PolarHBondContact O-N 2.83Å; L61-K63 PolarHBondContact O-N 3.49Å
64	Q	92.6	Very high	91.2	Very high	101 Å²	101	67 Å²	67	47%	0.472	37%	0.365	S	S	.	.	H	α-helix	trans	-86.3	-32	-176.4	-61.5	-171.9	59.4	0	0	112.6	S60 L61 P66 H110	S60-Q64 PolarHBondContact O-N 2.9Å; S60-Q64 PolarHBondContact OG-NE2 2.74Å; L61-Q64 PolarHBondContact O-N 3.15Å; L61-Q64 VanDerWaalsContact O-N 3.09Å; Q64-P66 VanDerWaalsContact C-CD 3.44Å; Q64-P66 WeakPolarHBondContact O-CD 3.4Å; Q64-H110 PolarHBondContact NE2-NE2 2.76Å; Q64-H110 PolarHBondContact OE1-NE2 3.03Å; Q64-H110 VanDerWaalsContact OE1-NE2 3.08Å
65	F	92.5	Very high	90.5	Very high	53 Å²	53	72.7 Å²	72.7	23%	0.232	39%	0.389	C	S	.	.			trans	-128.1	59.6	-175.6	-55.5	-82.5	0	0	0	112.1	L61 A67 M68 L107 H110	L61-F65 HydrophobicContact CD2-CD2 4.19Å; L61-F65 HydrophobicContact CD2-CE2 4.11Å; L61-F65 PolarHBondContact O-N 2.89Å; F65-A67 PolarHBondContact O-N 2.72Å; F65-M68 HydrophobicContact CB-CB 4.42Å; F65-M68 HydrophobicContact CB-CG 4.05Å; F65-M68 HydrophobicContact CB-SD 3.91Å; F65-M68 HydrophobicContact CD1-SD 4.25Å; F65-M68 HydrophobicContact CG-SD 4.21Å; F65-M68 PolarHBondContact O-N 3.42Å; F65-L107 HydrophobicContact CD2-CD2 3.76Å; F65-L107 HydrophobicContact CE2-CD2 3.96Å; F65-L107 HydrophobicContact CG-CD2 4.06Å; F65-L107 HydrophobicContact CZ-CD2 4.42Å; F65-H110 AromaticContact CE2-CD2 3.71Å; F65-H110 AromaticContact CZ-CD2 3.98Å
66	P	89.1	Confident	89.7	Confident	97 Å²	97	75.8 Å²	75.8	63%	0.63	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-62.3	-28.4	-175.9	25.4	-34.6	0	0	0	113.3	K62 Q64 M68	K62-P66 WeakPolarHBondContact O-CA 3.42Å; Q64-P66 VanDerWaalsContact C-CD 3.44Å; Q64-P66 WeakPolarHBondContact O-CD 3.4Å; P66-M68 VanDerWaalsContact C-N 3.28Å; P66-M68 PolarHBondContact O-N 3.31Å
67	A	89.4	Confident	88.4	Confident	100 Å²	100	74.8 Å²	74.8	83%	0.826	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-69.4	-21.1	179.9	0	0	0	0	0	114	F65 A69	F65-A67 PolarHBondContact O-N 2.72Å; A67-A69 VanDerWaalsContact C-N 3.26Å; A67-A69 PolarHBondContact O-N 2.95Å
68	M	85.9	Confident	86.3	Confident	49 Å²	49	82.7 Å²	82.7	24%	0.241	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-79.1	-8	-176.9	-65.4	-170.5	115.9	0	0	113.7	F65 P66 L70 Y104 E106 L107	F65-M68 HydrophobicContact CB-CB 4.42Å; F65-M68 HydrophobicContact CB-CG 4.05Å; F65-M68 HydrophobicContact CB-SD 3.91Å; F65-M68 HydrophobicContact CD1-SD 4.25Å; F65-M68 HydrophobicContact CG-SD 4.21Å; F65-M68 PolarHBondContact O-N 3.42Å; P66-M68 VanDerWaalsContact C-N 3.28Å; P66-M68 PolarHBondContact O-N 3.31Å; M68-L70 HydrophobicContact CB-CD2 4.49Å; M68-L70 HydrophobicContact CB-CG 4.24Å; M68-L70 PolarHBondContact O-N 2.92Å; M68-Y104 HydrophobicContact CE-CD1 3.83Å; M68-Y104 HydrophobicContact CE-CD2 3.74Å; M68-Y104 HydrophobicContact CE-CE1 4.38Å; M68-Y104 HydrophobicContact CE-CE2 4.3Å; M68-Y104 HydrophobicContact CE-CG 3.48Å; M68-Y104 VanDerWaalsContact CE-CG 3.48Å; M68-E106 HydrophobicContact CE-CG 3.92Å; M68-E106 WeakPolarHBondContact CE-OE1 3.16Å; M68-L107 HydrophobicContact CE-CD1 4.02Å; M68-L107 HydrophobicContact CE-CG 4.08Å; M68-L107 HydrophobicContact SD-CD1 3.67Å; M68-L107 HydrophobicContact SD-CD2 3.78Å; M68-L107 HydrophobicContact SD-CG 3.72Å
69	A	87.3	Confident	84.8	Confident	73 Å²	73	83.9 Å²	83.9	60%	0.603	46%	0.456	S	S	*	.			trans	47.5	39.8	176.1	0	0	0	0	0	114.2	A67	A67-A69 VanDerWaalsContact C-N 3.26Å; A67-A69 PolarHBondContact O-N 2.95Å
70	L	90.3	Very high	83.9	Confident	15 Å²	15	85 Å²	85	8%	0.079	46%	0.463	C	S	.	.			trans	-54.8	148.6	178.4	-63.4	175.3	0	0	0	110.9	Y58 L61 M68 F97 L101 L107	Y58-L70 HydrophobicContact CD2-CB 4.13Å; Y58-L70 HydrophobicContact CE2-CB 4.07Å; Y58-L70 VanDerWaalsContact CE2-O 3.25Å; Y58-L70 WeakPolarHBondContact CE2-O 3.2Å; L61-L70 HydrophobicContact CB-CD1 3.89Å; L61-L70 HydrophobicContact CD1-CD1 4.26Å; M68-L70 HydrophobicContact CB-CD2 4.49Å; M68-L70 HydrophobicContact CB-CG 4.24Å; M68-L70 PolarHBondContact O-N 2.92Å; L70-F97 HydrophobicContact CD1-CE2 4.48Å; L70-L101 HydrophobicContact CD1-CD2 4.27Å; L70-L107 HydrophobicContact CD1-CD1 4.47Å; L70-L107 HydrophobicContact CD2-CD1 4.18Å
71	K	91.3	Very high	83.1	Confident	168 Å²	168	86.1 Å²	86.1	73%	0.73	47%	0.466	S	S	*	.			trans	-134.2	146.2	179.4	-63	-177.7	-175.9	174.9	0	110.8	F97	K71-F97 WeakPolarHBondContact O-CD2 3.37Å
72	I	94.1	Very high	82.5	Confident	30 Å²	30	88 Å²	88	15%	0.154	47%	0.474	C	S	.	.			trans	-132.8	154.8	166.6	63	169.8	0	0	0	109.2	D55 Y58 F97	D55-I72 HydrophobicContact CB-CD1 4.13Å; Y58-I72 HydrophobicContact CD1-CD1 3.56Å; Y58-I72 HydrophobicContact CD1-CG1 3.77Å; Y58-I72 HydrophobicContact CD2-CG2 4.12Å; Y58-I72 HydrophobicContact CE1-CD1 4.29Å; Y58-I72 HydrophobicContact CE1-CG1 4.11Å; Y58-I72 HydrophobicContact CG-CD1 3.85Å; Y58-I72 HydrophobicContact CG-CG1 3.95Å; Y58-I72 HydrophobicContact CG-CG2 3.94Å; I72-F97 HydrophobicContact CG2-CB 4.07Å; I72-F97 HydrophobicContact CG2-CD1 3.94Å; I72-F97 HydrophobicContact CG2-CD2 3.49Å; I72-F97 VanDerWaalsContact CG2-CD2 3.49Å; I72-F97 HydrophobicContact CG2-CE1 4.23Å; I72-F97 HydrophobicContact CG2-CE2 3.82Å; I72-F97 HydrophobicContact CG2-CG 3.55Å; I72-F97 HydrophobicContact CG2-CZ 4.18Å
73	P	90.6	Very high	82.1	Confident	31 Å²	31	85.5 Å²	85.5	20%	0.201	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-55.9	142.4	172.1	-25.1	35.4	0	0	0	111.4	Y51 R90 L94	Y51-P73 VanDerWaalsContact CE2-O 3.25Å; Y51-P73 WeakPolarHBondContact CE2-O 3.34Å; Y51-P73 PolarHBondContact OH-O 3.38Å; P73-R90 HydrophobicContact CB-CG 4.28Å; P73-R90 HydrophobicContact CG-CG 4.48Å; P73-L94 HydrophobicContact CG-CG 4.42Å
74	A	79.9	Confident	81.7	Confident	80 Å²	80	81.7 Å²	81.7	66%	0.661	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-68	157.4	-177.7	0	0	0	0	0	113.8	R76 R90	A74-R76 PolarHBondContact O-N 3.41Å; A74-R90 PolarHBondContact O-NH2 2.84Å
75	K	78.8	Confident	81.4	Confident	119 Å²	119	82.4 Å²	82.4	52%	0.517	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-65.6	127.4	164.2	-70.4	178.9	-175.2	167.6	0	108.5	Y51 D55 I77	Y51-K75 HydrophobicContact CD1-CG 4.42Å; Y51-K75 HydrophobicContact CE1-CD 4.24Å; Y51-K75 HydrophobicContact CE1-CG 3.45Å; Y51-K75 VanDerWaalsContact CE1-CG 3.45Å; D55-K75 VanDerWaalsContact OD1-CE 3.26Å; D55-K75 WeakPolarHBondContact OD1-CE 3.37Å; D55-K75 IonicContact OD1-NZ 3.62Å; D55-K75 WeakPolarHBondContact OD2-CE 3.43Å; D55-K75 IonicContact OD2-NZ 3.15Å; D55-K75 PolarHBondContact OD2-NZ 3.42Å; K75-I77 PolarHBondContact O-N 3.24Å
76	R	76.7	Confident	81.1	Confident	88 Å²	88	81.3 Å²	81.3	33%	0.332	46%	0.461	S	S	.	.			trans	-87.8	109.5	172.3	179.8	174.8	-167.8	173.4	11	107.9	A74 F78 D80 N81 F86	A74-R76 PolarHBondContact O-N 3.41Å; R76-F78 WeakPolarHBondContact CG-O 3.3Å; R76-F78 PolarHBondContact NE-O 2.88Å; R76-F78 VanDerWaalsContact NE-O 3.12Å; R76-D80 PolarHBondContact NH1-O 2.97Å; R76-D80 VanDerWaalsContact NH1-O 3.08Å; R76-N81 PolarHBondContact O-ND2 3.28Å; R76-F86 HydrophobicContact CB-CE1 3.88Å; R76-F86 HydrophobicContact CB-CE2 3.91Å; R76-F86 HydrophobicContact CB-CZ 3.29Å; R76-F86 HydrophobicContact CG-CE1 4.43Å; R76-F86 HydrophobicContact CG-CE2 4.36Å; R76-F86 HydrophobicContact CG-CZ 4.04Å
77	I	63.9	Low	81	Confident	138 Å²	138	77.8 Å²	77.8	71%	0.708	44%	0.437	S	S	*	.			trans	-91.1	-17.7	-174.9	-55.3	172.3	0	0	0	110.8	K75	K75-I77 PolarHBondContact O-N 3.24Å
78	F	51.6	Low	81	Confident	176 Å²	176	79.2 Å²	79.2	77%	0.772	42%	0.424	S	S	*	.	S	Bend	trans	-135.5	141.1	177.7	-59.5	-81.1	0	0	0	111.4	R76	R76-F78 WeakPolarHBondContact CG-O 3.3Å; R76-F78 PolarHBondContact NE-O 2.88Å; R76-F78 VanDerWaalsContact NE-O 3.12Å
79	G	63.7	Low	81.2	Confident	57 Å²	57	83.6 Å²	83.6	59%	0.588	45%	0.445	S	S	*	.	S	Bend	trans	95.2	177.1	-178.2	0	0	0	0	0	114.3	N81	G79-N81 PolarHBondContact O-N 3.49Å
80	D	74	Confident	81.5	Confident	90 Å²	90	81 Å²	81	48%	0.481	42%	0.419	S	S	.	.			trans	-73.3	117.4	-177.6	-167.7	0	0	0	0	111.2	R76 F82 D83	R76-D80 PolarHBondContact NH1-O 2.97Å; R76-D80 VanDerWaalsContact NH1-O 3.08Å; D80-F82 PolarHBondContact O-N 3.44Å; D80-F82 WeakPolarHBondContact OD1-CB 3.45Å; D80-F82 WeakPolarHBondContact OD1-CD2 3.45Å; D80-F82 PolarHBondContact OD1-N 3.24Å; D80-D83 HydrophobicContact CB-CB 4.44Å
81	N	74.6	Confident	81.7	Confident	56 Å²	56	83.7 Å²	83.7	30%	0.299	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.4	175.2	-86.8	-58.1	0	0	0	112.8	R76 G79	R76-N81 PolarHBondContact O-ND2 3.28Å; G79-N81 PolarHBondContact O-N 3.49Å
82	F	81.6	Confident	81.8	Confident	41 Å²	41	78.5 Å²	78.5	18%	0.18	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	7	179.2	-56.8	-80.3	0	0	0	113.6	E23 R30 D80	E23-F82 HydrophobicContact CG-CD1 4.05Å; E23-F82 HydrophobicContact CG-CE1 4.17Å; E23-F82 WeakPolarHBondContact OE2-CD1 3.23Å; R30-F82 VanDerWaalsContact C-CZ 3.43Å; R30-F82 HydrophobicContact CB-CD1 4.37Å; R30-F82 HydrophobicContact CB-CE1 3.5Å; R30-F82 HydrophobicContact CB-CE2 3.75Å; R30-F82 HydrophobicContact CB-CZ 3.17Å; R30-F82 HydrophobicContact CG-CZ 4.44Å; R30-F82 VanDerWaalsContact CZ-CG 3.47Å; R30-F82 WeakPolarHBondContact O-CZ 3.46Å; D80-F82 PolarHBondContact O-N 3.44Å; D80-F82 WeakPolarHBondContact OD1-CB 3.45Å; D80-F82 WeakPolarHBondContact OD1-CD2 3.45Å; D80-F82 PolarHBondContact OD1-N 3.24Å
83	D	84.1	Confident	81.9	Confident	57 Å²	57	77.9 Å²	77.9	31%	0.305	42%	0.418	S	S	.	.			trans	-55.8	125.5	170.8	173.8	-105.2	0	0	0	110.4	D80 D85 F86 I87	D80-D83 HydrophobicContact CB-CB 4.44Å; D83-D85 PolarHBondContact O-N 3.45Å; D83-D85 PolarHBondContact OD1-N 3.2Å; D83-F86 HydrophobicContact CB-CB 3.87Å; D83-F86 WeakPolarHBondContact O-CB 3.26Å; D83-F86 PolarHBondContact O-N 3.13Å; D83-F86 VanDerWaalsContact OD1-CB 3.29Å; D83-F86 WeakPolarHBondContact OD1-CB 3.47Å; D83-F86 PolarHBondContact OD1-N 2.69Å; D83-I87 WeakPolarHBondContact O-CG1 3.46Å; D83-I87 PolarHBondContact O-N 2.9Å
84	P	84.1	Confident	82.2	Confident	97 Å²	97	76.4 Å²	76.4	63%	0.63	41%	0.408	S	S	*	.	H	α-helix	trans	-60.2	-39.7	-174	-27	35	0	0	0	114.1	I87 K88	P84-I87 PolarHBondContact O-N 2.81Å; P84-K88 WeakPolarHBondContact O-CB 3.31Å; P84-K88 PolarHBondContact O-N 2.84Å
85	D	86	Confident	83	Confident	116 Å²	116	74 Å²	74	62%	0.62	38%	0.384	S	S	*	.	H	α-helix	trans	-68.2	-40.3	179	-75.6	-32.8	0	0	0	111	D83 K88 Q89	D83-D85 PolarHBondContact O-N 3.45Å; D83-D85 PolarHBondContact OD1-N 3.2Å; D85-K88 WeakPolarHBondContact O-CB 3.48Å; D85-K88 PolarHBondContact O-N 3.41Å; D85-Q89 WeakPolarHBondContact O-CB 3.45Å; D85-Q89 PolarHBondContact O-N 2.89Å
86	F	86.6	Confident	83.8	Confident	29 Å²	29	74.1 Å²	74.1	13%	0.127	39%	0.386	C	S	.	.	H	α-helix	trans	-62.3	-46	173.3	-179.2	-112.8	0	0	0	113	R76 D83 K88 Q89 R90	R76-F86 HydrophobicContact CB-CE1 3.88Å; R76-F86 HydrophobicContact CB-CE2 3.91Å; R76-F86 HydrophobicContact CB-CZ 3.29Å; R76-F86 HydrophobicContact CG-CE1 4.43Å; R76-F86 HydrophobicContact CG-CE2 4.36Å; R76-F86 HydrophobicContact CG-CZ 4.04Å; D83-F86 HydrophobicContact CB-CB 3.87Å; D83-F86 WeakPolarHBondContact O-CB 3.26Å; D83-F86 PolarHBondContact O-N 3.13Å; D83-F86 VanDerWaalsContact OD1-CB 3.29Å; D83-F86 WeakPolarHBondContact OD1-CB 3.47Å; D83-F86 PolarHBondContact OD1-N 2.69Å; F86-K88 VanDerWaalsContact C-N 3.28Å; F86-K88 PolarHBondContact O-N 3.47Å; F86-Q89 PolarHBondContact O-N 3.4Å; F86-R90 VanDerWaalsContact CE1-NH1 3.28Å; F86-R90 VanDerWaalsContact O-CB 3.3Å; F86-R90 WeakPolarHBondContact O-CB 3.42Å; F86-R90 PolarHBondContact O-N 2.85Å
87	I	86.6	Confident	84.8	Confident	23 Å²	23	70 Å²	70	12%	0.118	37%	0.371	C	S	.	.	H	α-helix	trans	-59.7	-43.2	175.2	-70.8	168.8	0	0	0	110	S21 T32 D83 P84 R90 R91	S21-I87 WeakPolarHBondContact OG-CG2 3.48Å; T32-I87 HydrophobicContact CG2-CG2 4.03Å; D83-I87 WeakPolarHBondContact O-CG1 3.46Å; D83-I87 PolarHBondContact O-N 2.9Å; P84-I87 PolarHBondContact O-N 2.81Å; I87-R90 PolarHBondContact O-N 2.88Å; I87-R91 VanDerWaalsContact O-CB 3.31Å; I87-R91 WeakPolarHBondContact O-CB 3.33Å; I87-R91 PolarHBondContact O-N 3.4Å
88	K	88.6	Confident	86.4	Confident	130 Å²	130	63.4 Å²	63.4	57%	0.565	34%	0.337	S	S	*	.	H	α-helix	trans	-61.7	-46.7	178.2	-175.9	-178.1	177.2	-174.8	0	111.8	P84 D85 F86 R91 A92	P84-K88 WeakPolarHBondContact O-CB 3.31Å; P84-K88 PolarHBondContact O-N 2.84Å; D85-K88 WeakPolarHBondContact O-CB 3.48Å; D85-K88 PolarHBondContact O-N 3.41Å; F86-K88 VanDerWaalsContact C-N 3.28Å; F86-K88 PolarHBondContact O-N 3.47Å; K88-R91 PolarHBondContact O-N 2.78Å; K88-A92 PolarHBondContact O-N 3.17Å
89	Q	90.4	Very high	88.5	Confident	142 Å²	142	59.2 Å²	59.2	66%	0.664	32%	0.32	S	S	*	.	H	α-helix	trans	-64.9	-44.1	177.7	-170.9	-177.3	17	0	0	111.6	D85 F86 A92 G93	D85-Q89 WeakPolarHBondContact O-CB 3.45Å; D85-Q89 PolarHBondContact O-N 2.89Å; F86-Q89 PolarHBondContact O-N 3.4Å; Q89-A92 PolarHBondContact O-N 2.82Å; Q89-G93 PolarHBondContact O-N 3.23Å; Q89-G93 VanDerWaalsContact O-N 3.08Å
90	R	93.3	Very high	89.9	Confident	18 Å²	18	58.7 Å²	58.7	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-43.5	176.7	-179.5	177.6	-85.2	169	-8.9	111.3	Y34 Y51 P73 A74 F86 I87 A92 G93 L94	Y34-R90 WeakPolarHBondContact OH-CD 3.06Å; Y34-R90 WeakPolarHBondContact OH-CG 3.32Å; Y51-R90 HydrophobicContact CD2-CG 4.18Å; P73-R90 HydrophobicContact CB-CG 4.28Å; P73-R90 HydrophobicContact CG-CG 4.48Å; A74-R90 PolarHBondContact O-NH2 2.84Å; F86-R90 VanDerWaalsContact CE1-NH1 3.28Å; F86-R90 VanDerWaalsContact O-CB 3.3Å; F86-R90 WeakPolarHBondContact O-CB 3.42Å; F86-R90 PolarHBondContact O-N 2.85Å; I87-R90 PolarHBondContact O-N 2.88Å; R90-A92 VanDerWaalsContact C-N 3.31Å; R90-A92 PolarHBondContact O-N 3.37Å; R90-G93 PolarHBondContact O-N 2.87Å; R90-L94 HydrophobicContact CG-CD1 4.09Å; R90-L94 HydrophobicContact CG-CG 4.33Å; R90-L94 WeakPolarHBondContact O-CB 3.27Å; R90-L94 VanDerWaalsContact O-CG 3.3Å; R90-L94 WeakPolarHBondContact O-CG 3.2Å; R90-L94 PolarHBondContact O-N 3.42Å
91	R	94.9	Very high	90.9	Very high	72 Å²	72	54.4 Å²	54.4	27%	0.272	28%	0.281	S	S	.	.	H	α-helix	trans	-57.8	-44.7	175.1	-174.6	175.5	62.8	85.8	2	111.3	I18 Y34 I87 K88 L94 N95	I18-R91 HydrophobicContact CB-CG 4.11Å; I18-R91 HydrophobicContact CG2-CG 3.68Å; I18-R91 PolarHBondContact O-NH1 2.73Å; Y34-R91 HydrophobicContact CD1-CB 4.13Å; Y34-R91 HydrophobicContact CD1-CG 4.07Å; Y34-R91 HydrophobicContact CE1-CB 3.87Å; Y34-R91 HydrophobicContact CE1-CG 4.33Å; I87-R91 VanDerWaalsContact O-CB 3.31Å; I87-R91 WeakPolarHBondContact O-CB 3.33Å; I87-R91 PolarHBondContact O-N 3.4Å; K88-R91 PolarHBondContact O-N 2.78Å; R91-L94 PolarHBondContact O-N 3.06Å; R91-N95 WeakPolarHBondContact O-CB 3.18Å; R91-N95 PolarHBondContact O-N 3.21Å
92	A	94.2	Very high	91.9	Very high	58 Å²	58	52.7 Å²	52.7	48%	0.479	27%	0.272	S	S	.	.	H	α-helix	trans	-60.8	-47.2	178.6	0	0	0	0	0	112.1	K88 Q89 R90 N95 E96	K88-A92 PolarHBondContact O-N 3.17Å; Q89-A92 PolarHBondContact O-N 2.82Å; R90-A92 VanDerWaalsContact C-N 3.31Å; R90-A92 PolarHBondContact O-N 3.37Å; A92-N95 WeakPolarHBondContact O-CB 3.12Å; A92-N95 PolarHBondContact O-N 2.86Å; A92-E96 PolarHBondContact O-N 3.35Å
93	G	95.8	Very high	92.4	Very high	18 Å²	18	59.2 Å²	59.2	19%	0.186	30%	0.296	C	S	.	.	H	α-helix	trans	-71.9	-30.4	178.8	0	0	0	0	0	114.1	Q89 R90 N95 F97	Q89-G93 PolarHBondContact O-N 3.23Å; Q89-G93 VanDerWaalsContact O-N 3.08Å; R90-G93 PolarHBondContact O-N 2.87Å; G93-N95 VanDerWaalsContact C-N 3.33Å; G93-F97 PolarHBondContact O-N 2.91Å
94	L	97.1	Very high	92.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-35	170.1	-69.7	179	0	0	0	111.9	I18 Y34 Y51 F54 P73 R90 R91 F97 I98	I18-L94 HydrophobicContact CD1-CB 3.72Å; Y34-L94 HydrophobicContact CD1-CD1 4.12Å; Y34-L94 HydrophobicContact CD2-CD1 3.72Å; Y34-L94 HydrophobicContact CE1-CD1 3.96Å; Y34-L94 HydrophobicContact CE2-CD1 3.58Å; Y34-L94 HydrophobicContact CG-CD1 4.01Å; Y51-L94 HydrophobicContact CD2-CD1 4.38Å; Y51-L94 HydrophobicContact CD2-CD2 4.36Å; F54-L94 HydrophobicContact CB-CD2 3.73Å; F54-L94 HydrophobicContact CD1-CB 4.41Å; F54-L94 HydrophobicContact CD1-CD2 3.81Å; F54-L94 HydrophobicContact CD1-CG 4.5Å; F54-L94 HydrophobicContact CD2-CD1 3.95Å; F54-L94 HydrophobicContact CD2-CD2 4.17Å; F54-L94 HydrophobicContact CE1-CB 4.21Å; F54-L94 HydrophobicContact CE1-CD2 4.43Å; F54-L94 HydrophobicContact CE2-CD1 3.99Å; F54-L94 HydrophobicContact CG-CD1 4.28Å; F54-L94 HydrophobicContact CG-CD2 3.67Å; F54-L94 HydrophobicContact CG-CG 4.47Å; F54-L94 HydrophobicContact CZ-CB 4.48Å; F54-L94 HydrophobicContact CZ-CD1 4.34Å; P73-L94 HydrophobicContact CG-CG 4.42Å; R90-L94 HydrophobicContact CG-CD1 4.09Å; R90-L94 HydrophobicContact CG-CG 4.33Å; R90-L94 WeakPolarHBondContact O-CB 3.27Å; R90-L94 VanDerWaalsContact O-CG 3.3Å; R90-L94 WeakPolarHBondContact O-CG 3.2Å; R90-L94 PolarHBondContact O-N 3.42Å; R91-L94 PolarHBondContact O-N 3.06Å; L94-F97 WeakPolarHBondContact O-CB 3.12Å; L94-F97 PolarHBondContact O-N 2.9Å; L94-I98 PolarHBondContact O-N 3.15Å; L94-I98 VanDerWaalsContact O-N 3.13Å
95	N	96.4	Very high	93.1	Very high	30 Å²	30	59.3 Å²	59.3	16%	0.16	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-45.9	174.3	-176.9	87.3	0	0	0	111.3	S17 I18 R91 A92 G93 F97 I98 Q99	S17-N95 VanDerWaalsContact CA-OD1 3.25Å; S17-N95 WeakPolarHBondContact CA-OD1 3.48Å; I18-N95 HydrophobicContact CB-CB 4.29Å; I18-N95 HydrophobicContact CD1-CB 4.29Å; I18-N95 HydrophobicContact CG1-CB 4.09Å; I18-N95 PolarHBondContact N-OD1 2.86Å; R91-N95 WeakPolarHBondContact O-CB 3.18Å; R91-N95 PolarHBondContact O-N 3.21Å; A92-N95 WeakPolarHBondContact O-CB 3.12Å; A92-N95 PolarHBondContact O-N 2.86Å; G93-N95 VanDerWaalsContact C-N 3.33Å; N95-F97 VanDerWaalsContact C-N 3.31Å; N95-F97 PolarHBondContact O-N 2.84Å; N95-I98 WeakPolarHBondContact O-CG1 3.22Å; N95-I98 PolarHBondContact O-N 3.36Å; N95-Q99 PolarHBondContact ND2-NE2 3.33Å; N95-Q99 VanDerWaalsContact ND2-NE2 3.12Å; N95-Q99 PolarHBondContact ND2-OE1 2.97Å; N95-Q99 WeakPolarHBondContact O-CB 3.32Å; N95-Q99 VanDerWaalsContact O-CG 3.27Å; N95-Q99 WeakPolarHBondContact O-CG 3.39Å; N95-Q99 PolarHBondContact O-N 2.99Å
96	E	96.5	Very high	93.4	Very high	120 Å²	120	58.3 Å²	58.3	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-59.4	-42.3	174.5	-170.8	-172.2	166.4	0	0	111.7	A92 Q99 N100	A92-E96 PolarHBondContact O-N 3.35Å; E96-Q99 PolarHBondContact O-N 3.08Å; E96-N100 PolarHBondContact O-N 3.33Å; E96-N100 PolarHBondContact O-ND2 3.21Å
97	F	97	Very high	93.7	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.009	27%	0.274	C	S	.	.	H	α-helix	trans	-57.1	-53.4	176.8	170.1	-110.3	0	0	0	112.3	F54 L57 Y58 L70 K71 I72 G93 L94 N95 Q99 N100 L101	F54-F97 AromaticContact CD1-CD1 3.99Å; F54-F97 HydrophobicContact CD1-CD1 3.99Å; F54-F97 HydrophobicContact CD1-CE1 4.22Å; L57-F97 HydrophobicContact CD2-CE1 4.2Å; L57-F97 HydrophobicContact CD2-CZ 4.35Å; L57-F97 HydrophobicContact CG-CZ 4.42Å; Y58-F97 HydrophobicContact CD2-CE2 4.25Å; L70-F97 HydrophobicContact CD1-CE2 4.48Å; K71-F97 WeakPolarHBondContact O-CD2 3.37Å; I72-F97 HydrophobicContact CG2-CB 4.07Å; I72-F97 HydrophobicContact CG2-CD1 3.94Å; I72-F97 HydrophobicContact CG2-CD2 3.49Å; I72-F97 VanDerWaalsContact CG2-CD2 3.49Å; I72-F97 HydrophobicContact CG2-CE1 4.23Å; I72-F97 HydrophobicContact CG2-CE2 3.82Å; I72-F97 HydrophobicContact CG2-CG 3.55Å; I72-F97 HydrophobicContact CG2-CZ 4.18Å; G93-F97 PolarHBondContact O-N 2.91Å; L94-F97 WeakPolarHBondContact O-CB 3.12Å; L94-F97 PolarHBondContact O-N 2.9Å; N95-F97 VanDerWaalsContact C-N 3.31Å; N95-F97 PolarHBondContact O-N 2.84Å; F97-Q99 VanDerWaalsContact C-N 3.32Å; F97-Q99 PolarHBondContact O-N 3.37Å; F97-N100 WeakPolarHBondContact O-CB 3.41Å; F97-N100 PolarHBondContact O-N 3.11Å; F97-L101 HydrophobicContact CD1-CD1 4.42Å; F97-L101 HydrophobicContact CE1-CD1 3.83Å; F97-L101 HydrophobicContact CE1-CG 4.42Å; F97-L101 HydrophobicContact CE2-CD2 4Å; F97-L101 HydrophobicContact CE2-CG 4.39Å; F97-L101 HydrophobicContact CZ-CD1 3.88Å; F97-L101 HydrophobicContact CZ-CD2 4.06Å; F97-L101 HydrophobicContact CZ-CG 4.23Å; F97-L101 WeakPolarHBondContact O-CG 3.44Å; F97-L101 PolarHBondContact O-N 2.94Å; F97-L101 VanDerWaalsContact O-N 3.13Å
98	I	96.5	Very high	93.9	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.4	-31.4	-178.9	61.1	172.7	0	0	0	112.7	V16 I18 V36 F54 L94 N95 N100 L101 V102 F116	V16-I98 HydrophobicContact CB-CD1 3.92Å; V16-I98 HydrophobicContact CB-CG1 4.32Å; V16-I98 HydrophobicContact CG2-CB 3.86Å; V16-I98 HydrophobicContact CG2-CD1 3.83Å; V16-I98 HydrophobicContact CG2-CG1 3.65Å; V16-I98 WeakPolarHBondContact CG2-O 3.49Å; I18-I98 HydrophobicContact CD1-CD1 3.94Å; I18-I98 HydrophobicContact CG1-CD1 3.5Å; I18-I98 HydrophobicContact CG1-CG1 4.46Å; V36-I98 HydrophobicContact CG1-CD1 3.62Å; F54-I98 HydrophobicContact CD1-CG2 4.12Å; F54-I98 HydrophobicContact CE1-CG2 3.62Å; L94-I98 PolarHBondContact O-N 3.15Å; L94-I98 VanDerWaalsContact O-N 3.13Å; N95-I98 WeakPolarHBondContact O-CG1 3.22Å; N95-I98 PolarHBondContact O-N 3.36Å; I98-N100 VanDerWaalsContact C-N 3.31Å; I98-L101 WeakPolarHBondContact O-CB 3.47Å; I98-L101 PolarHBondContact O-N 2.84Å; I98-V102 PolarHBondContact O-N 2.78Å; I98-F116 HydrophobicContact CG2-CE1 4.13Å
99	Q	96	Very high	94.1	Very high	88 Å²	88	54 Å²	54	41%	0.411	26%	0.263	S	S	.	.	H	α-helix	trans	-63.5	-38.8	173	-76.4	179.1	-17.7	0	0	111.4	V16 N95 E96 F97 L101 V102 R103	V16-Q99 HydrophobicContact CG2-CG 4.35Å; N95-Q99 PolarHBondContact ND2-NE2 3.33Å; N95-Q99 VanDerWaalsContact ND2-NE2 3.12Å; N95-Q99 PolarHBondContact ND2-OE1 2.97Å; N95-Q99 WeakPolarHBondContact O-CB 3.32Å; N95-Q99 VanDerWaalsContact O-CG 3.27Å; N95-Q99 WeakPolarHBondContact O-CG 3.39Å; N95-Q99 PolarHBondContact O-N 2.99Å; E96-Q99 PolarHBondContact O-N 3.08Å; F97-Q99 VanDerWaalsContact C-N 3.32Å; F97-Q99 PolarHBondContact O-N 3.37Å; Q99-L101 VanDerWaalsContact C-N 3.34Å; Q99-V102 VanDerWaalsContact O-CG2 3.3Å; Q99-V102 WeakPolarHBondContact O-CG2 3.1Å; Q99-V102 PolarHBondContact O-N 2.9Å; Q99-R103 PolarHBondContact O-N 3.21Å
100	N	94.6	Very high	94.2	Very high	46 Å²	46	48.3 Å²	48.3	25%	0.246	24%	0.236	C	C	.	.	H	α-helix	trans	-66.1	-35.3	173.2	-76.3	-34.3	0	0	0	112.3	E96 F97 I98 V102 R103 Y104	E96-N100 PolarHBondContact O-N 3.33Å; E96-N100 PolarHBondContact O-ND2 3.21Å; F97-N100 WeakPolarHBondContact O-CB 3.41Å; F97-N100 PolarHBondContact O-N 3.11Å; I98-N100 VanDerWaalsContact C-N 3.31Å; N100-V102 VanDerWaalsContact C-N 3.34Å; N100-V102 PolarHBondContact O-N 2.56Å; N100-R103 WeakPolarHBondContact O-CB 3.27Å; N100-R103 PolarHBondContact O-N 3.39Å; N100-Y104 VanDerWaalsContact O-CD2 3.23Å; N100-Y104 WeakPolarHBondContact O-CD2 3.49Å
101	L	94.9	Very high	94.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-41.2	176.4	-60.6	-176	0	0	0	112.4	L57 L61 L70 F97 I98 Q99 R103 L107 Y108 V113	L57-L101 HydrophobicContact CD2-CD1 3.66Å; L61-L101 HydrophobicContact CD1-CD1 4.39Å; L61-L101 HydrophobicContact CD1-CD2 3.5Å; L70-L101 HydrophobicContact CD1-CD2 4.27Å; F97-L101 HydrophobicContact CD1-CD1 4.42Å; F97-L101 HydrophobicContact CE1-CD1 3.83Å; F97-L101 HydrophobicContact CE1-CG 4.42Å; F97-L101 HydrophobicContact CE2-CD2 4Å; F97-L101 HydrophobicContact CE2-CG 4.39Å; F97-L101 HydrophobicContact CZ-CD1 3.88Å; F97-L101 HydrophobicContact CZ-CD2 4.06Å; F97-L101 HydrophobicContact CZ-CG 4.23Å; F97-L101 WeakPolarHBondContact O-CG 3.44Å; F97-L101 PolarHBondContact O-N 2.94Å; F97-L101 VanDerWaalsContact O-N 3.13Å; I98-L101 WeakPolarHBondContact O-CB 3.47Å; I98-L101 PolarHBondContact O-N 2.84Å; Q99-L101 VanDerWaalsContact C-N 3.34Å; L101-R103 VanDerWaalsContact C-N 3.29Å; L101-R103 PolarHBondContact O-N 3.17Å; L101-L107 HydrophobicContact CD2-CD1 3.98Å; L101-L107 VanDerWaalsContact O-CB 3.31Å; L101-L107 WeakPolarHBondContact O-CB 3.26Å; L101-Y108 PolarHBondContact O-N 3.35Å; L101-V113 HydrophobicContact CB-CG1 4.22Å; L101-V113 HydrophobicContact CD1-CG1 4.24Å; L101-V113 HydrophobicContact CD1-CG2 4.26Å
102	V	94.1	Very high	93.9	Very high	19 Å²	19	51.3 Å²	51.3	12%	0.115	26%	0.264	C	S	.	.	H	α-helix	trans	-81.4	-8.3	-179.5	-60.6	0	0	0	0	114.2	P14 V16 I98 Q99 N100 Y108 L117	P14-V102 HydrophobicContact CB-CB 4.35Å; P14-V102 HydrophobicContact CB-CG1 4Å; P14-V102 HydrophobicContact CG-CB 3.97Å; P14-V102 HydrophobicContact CG-CG1 3.9Å; V16-V102 HydrophobicContact CG1-CG1 3.89Å; V16-V102 HydrophobicContact CG2-CG1 3.99Å; V16-V102 HydrophobicContact CG2-CG2 3.76Å; I98-V102 PolarHBondContact O-N 2.78Å; Q99-V102 VanDerWaalsContact O-CG2 3.3Å; Q99-V102 WeakPolarHBondContact O-CG2 3.1Å; Q99-V102 PolarHBondContact O-N 2.9Å; N100-V102 VanDerWaalsContact C-N 3.34Å; N100-V102 PolarHBondContact O-N 2.56Å; V102-Y108 WeakPolarHBondContact O-CD1 3.47Å; V102-L117 HydrophobicContact CG1-CD1 3.9Å
103	R	92.6	Very high	93.9	Very high	178 Å²	178	48.5 Å²	48.5	67%	0.672	24%	0.241	S	C	*	.	H	α-helix	trans	-75.3	-26.7	177.1	-173.6	172.5	179.8	159.5	1.3	113	Q99 N100 L101	Q99-R103 PolarHBondContact O-N 3.21Å; N100-R103 WeakPolarHBondContact O-CB 3.27Å; N100-R103 PolarHBondContact O-N 3.39Å; L101-R103 VanDerWaalsContact C-N 3.29Å; L101-R103 PolarHBondContact O-N 3.17Å
104	Y	91.5	Very high	93.8	Very high	91 Å²	91	50.3 Å²	50.3	36%	0.357	24%	0.242	S	C	.	.	S	Bend	trans	-114.2	120.6	-173.6	-61.2	-73.2	0	0	0	110.8	M68 N100 E106 L107 Y108	M68-Y104 HydrophobicContact CE-CD1 3.83Å; M68-Y104 HydrophobicContact CE-CD2 3.74Å; M68-Y104 HydrophobicContact CE-CE1 4.38Å; M68-Y104 HydrophobicContact CE-CE2 4.3Å; M68-Y104 HydrophobicContact CE-CG 3.48Å; M68-Y104 VanDerWaalsContact CE-CG 3.48Å; N100-Y104 VanDerWaalsContact O-CD2 3.23Å; N100-Y104 WeakPolarHBondContact O-CD2 3.49Å; Y104-E106 VanDerWaalsContact C-N 3.27Å; Y104-E106 PolarHBondContact O-N 3.07Å; Y104-L107 HydrophobicContact CD2-CD1 4.01Å; Y104-L107 PolarHBondContact O-N 2.81Å; Y104-Y108 VanDerWaalsContact O-CD1 3.3Å; Y104-Y108 WeakPolarHBondContact O-CD1 3.04Å; Y104-Y108 PolarHBondContact O-N 3.02Å; Y104-Y108 VanDerWaalsContact O-N 3.09Å
105	P	91.3	Very high	93.4	Very high	66 Å²	66	53.3 Å²	53.3	43%	0.429	27%	0.267	S	S	.	.	H	α-helix	trans	-52.6	-40.3	179	-28.5	36.4	0	0	0	115	L107 Y108 N109	P105-L107 PolarHBondContact O-N 3.12Å; P105-Y108 HydrophobicContact CB-CE1 4.02Å; P105-Y108 HydrophobicContact CG-CE1 4.08Å; P105-N109 VanDerWaalsContact O-CB 3.23Å; P105-N109 WeakPolarHBondContact O-CB 3.3Å; P105-N109 PolarHBondContact O-N 2.77Å; P105-N109 PolarHBondContact O-ND2 2.97Å
106	E	91.7	Very high	93.2	Very high	94 Å²	94	52.7 Å²	52.7	44%	0.439	26%	0.263	S	S	.	.	H	α-helix	trans	-61.7	-29.2	176.8	59.2	-88.2	-155.6	0	0	113.1	M68 Y104	M68-E106 HydrophobicContact CE-CG 3.92Å; M68-E106 WeakPolarHBondContact CE-OE1 3.16Å; Y104-E106 VanDerWaalsContact C-N 3.27Å; Y104-E106 PolarHBondContact O-N 3.07Å
107	L	93	Very high	93	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-87.6	-48.8	179.3	-69	-176.4	0	0	0	111.8	L61 F65 M68 L70 L101 Y104 P105 N109 H110 V113	L61-L107 HydrophobicContact CD2-CD2 4.32Å; F65-L107 HydrophobicContact CD2-CD2 3.76Å; F65-L107 HydrophobicContact CE2-CD2 3.96Å; F65-L107 HydrophobicContact CG-CD2 4.06Å; F65-L107 HydrophobicContact CZ-CD2 4.42Å; M68-L107 HydrophobicContact CE-CD1 4.02Å; M68-L107 HydrophobicContact CE-CG 4.08Å; M68-L107 HydrophobicContact SD-CD1 3.67Å; M68-L107 HydrophobicContact SD-CD2 3.78Å; M68-L107 HydrophobicContact SD-CG 3.72Å; L70-L107 HydrophobicContact CD1-CD1 4.47Å; L70-L107 HydrophobicContact CD2-CD1 4.18Å; L101-L107 HydrophobicContact CD2-CD1 3.98Å; L101-L107 VanDerWaalsContact O-CB 3.31Å; L101-L107 WeakPolarHBondContact O-CB 3.26Å; Y104-L107 HydrophobicContact CD2-CD1 4.01Å; Y104-L107 PolarHBondContact O-N 2.81Å; P105-L107 PolarHBondContact O-N 3.12Å; L107-N109 PolarHBondContact O-N 2.81Å; L107-H110 WeakPolarHBondContact O-CB 3.15Å; L107-H110 PolarHBondContact O-N 2.76Å; L107-V113 WeakPolarHBondContact O-CB 3.42Å; L107-V113 WeakPolarHBondContact O-CG2 3.25Å
108	Y	92.6	Very high	92.6	Very high	25 Å²	25	48.4 Å²	48.4	10%	0.098	24%	0.243	C	C	.	.	H	α-helix	trans	-72.6	-19.8	-178.4	74	-110.7	0	0	0	113.5	P14 L101 V102 Y104 P105 H110 R114 M119	P14-Y108 HydrophobicContact CG-CD1 4.1Å; P14-Y108 HydrophobicContact CG-CD2 3.93Å; P14-Y108 HydrophobicContact CG-CG 3.73Å; L101-Y108 PolarHBondContact O-N 3.35Å; V102-Y108 WeakPolarHBondContact O-CD1 3.47Å; Y104-Y108 VanDerWaalsContact O-CD1 3.3Å; Y104-Y108 WeakPolarHBondContact O-CD1 3.04Å; Y104-Y108 PolarHBondContact O-N 3.02Å; Y104-Y108 VanDerWaalsContact O-N 3.09Å; P105-Y108 HydrophobicContact CB-CE1 4.02Å; P105-Y108 HydrophobicContact CG-CE1 4.08Å; Y108-H110 VanDerWaalsContact C-N 3.33Å; Y108-R114 WeakPolarHBondContact O-CG 3.34Å; Y108-M119 HydrophobicContact CD2-CE 4.47Å
109	N	90.9	Very high	92	Very high	68 Å²	68	49.5 Å²	49.5	36%	0.364	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-8.9	169	-70.2	-35.3	0	0	0	113.1	P105 L107	P105-N109 VanDerWaalsContact O-CB 3.23Å; P105-N109 WeakPolarHBondContact O-CB 3.3Å; P105-N109 PolarHBondContact O-N 2.77Å; P105-N109 PolarHBondContact O-ND2 2.97Å; L107-N109 PolarHBondContact O-N 2.81Å
110	H	93.3	Very high	91.2	Very high	21 Å²	21	50.3 Å²	50.3	10%	0.097	26%	0.256	C	S	.	.	S	Bend	trans	-65.8	133.3	177.5	-171.7	-84.9	0	0	0	111	Q64 F65 L107 Y108 D112 V113 R114	Q64-H110 PolarHBondContact NE2-NE2 2.76Å; Q64-H110 PolarHBondContact OE1-NE2 3.03Å; Q64-H110 VanDerWaalsContact OE1-NE2 3.08Å; F65-H110 AromaticContact CE2-CD2 3.71Å; F65-H110 AromaticContact CZ-CD2 3.98Å; L107-H110 WeakPolarHBondContact O-CB 3.15Å; L107-H110 PolarHBondContact O-N 2.76Å; Y108-H110 VanDerWaalsContact C-N 3.33Å; H110-D112 VanDerWaalsContact C-N 3.33Å; H110-D112 IonicContact CE1-OD2 3.83Å; H110-D112 WeakPolarHBondContact ND1-CB 3.24Å; H110-D112 PolarHBondContact ND1-N 3.41Å; H110-D112 VanDerWaalsContact ND1-N 3.15Å; H110-D112 PolarHBondContact O-N 3.48Å; H110-V113 HydrophobicContact CB-CB 4.46Å; H110-V113 HydrophobicContact CB-CG2 4.19Å; H110-V113 PolarHBondContact O-N 3.19Å; H110-R114 WeakPolarHBondContact O-CG 3.27Å; H110-R114 PolarHBondContact O-N 3.43Å
111	P	90.6	Very high	89.8	Confident	89 Å²	89	51.6 Å²	51.6	58%	0.578	27%	0.268	S	S	*	.	H	α-helix	trans	-52.7	-44.1	-176.4	-28.7	34.7	0	0	0	114.2	V113 R114 A115	P111-V113 VanDerWaalsContact C-N 3.3Å; P111-V113 PolarHBondContact O-N 2.98Å; P111-R114 PolarHBondContact O-N 3.36Å; P111-A115 VanDerWaalsContact O-CB 3.26Å; P111-A115 WeakPolarHBondContact O-CB 3.43Å; P111-A115 PolarHBondContact O-N 3.05Å
112	D	92.5	Very high	87.9	Confident	64 Å²	64	54.3 Å²	54.3	34%	0.342	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-35	179	-65.8	-8.2	0	0	0	112.6	L57 S60 H110 F116	L57-D112 HydrophobicContact CD1-CB 3.62Å; S60-D112 WeakPolarHBondContact CB-OD2 3.3Å; S60-D112 PolarHBondContact OG-OD2 3.44Å; H110-D112 VanDerWaalsContact C-N 3.33Å; H110-D112 IonicContact CE1-OD2 3.83Å; H110-D112 WeakPolarHBondContact ND1-CB 3.24Å; H110-D112 PolarHBondContact ND1-N 3.41Å; H110-D112 VanDerWaalsContact ND1-N 3.15Å; H110-D112 PolarHBondContact O-N 3.48Å; D112-F116 WeakPolarHBondContact O-CB 3.22Å; D112-F116 PolarHBondContact O-N 3.45Å
113	V	94	Very high	85.5	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-75	-44.4	179.2	178	0	0	0	0	109.9	L57 L61 L101 L107 H110 P111 A115 F116 L117	L57-V113 HydrophobicContact CD1-CG2 4.21Å; L61-V113 HydrophobicContact CD1-CG2 3.77Å; L61-V113 HydrophobicContact CD2-CG2 4.08Å; L61-V113 HydrophobicContact CG-CG2 4.49Å; L101-V113 HydrophobicContact CB-CG1 4.22Å; L101-V113 HydrophobicContact CD1-CG1 4.24Å; L101-V113 HydrophobicContact CD1-CG2 4.26Å; L107-V113 WeakPolarHBondContact O-CB 3.42Å; L107-V113 WeakPolarHBondContact O-CG2 3.25Å; H110-V113 HydrophobicContact CB-CB 4.46Å; H110-V113 HydrophobicContact CB-CG2 4.19Å; H110-V113 PolarHBondContact O-N 3.19Å; P111-V113 VanDerWaalsContact C-N 3.3Å; P111-V113 PolarHBondContact O-N 2.98Å; V113-A115 VanDerWaalsContact C-N 3.31Å; V113-A115 PolarHBondContact O-N 3.39Å; V113-F116 PolarHBondContact O-N 2.99Å; V113-L117 HydrophobicContact CG1-CD1 3.91Å; V113-L117 HydrophobicContact CG1-CG 4.4Å; V113-L117 WeakPolarHBondContact O-CB 3.27Å; V113-L117 WeakPolarHBondContact O-CG 3.36Å; V113-L117 PolarHBondContact O-N 3.48Å
114	R	92.6	Very high	83.2	Confident	55 Å²	55	60.8 Å²	60.8	21%	0.208	31%	0.313	C	S	.	.	H	α-helix	trans	-60	-41.4	175	-64	-175.9	71.7	85.2	-3.2	111.8	Y108 H110 P111 Q118 M119 D120	Y108-R114 WeakPolarHBondContact O-CG 3.34Å; H110-R114 WeakPolarHBondContact O-CG 3.27Å; H110-R114 PolarHBondContact O-N 3.43Å; P111-R114 PolarHBondContact O-N 3.36Å; R114-Q118 CarbonylContact O-C 3.36Å; R114-Q118 VanDerWaalsContact O-CA 3.27Å; R114-Q118 WeakPolarHBondContact O-CA 3.49Å; R114-Q118 PolarHBondContact O-N 3.19Å; R114-M119 HydrophobicContact CB-CB 4.28Å; R114-M119 HydrophobicContact CG-SD 4.31Å; R114-M119 PolarHBondContact O-N 3.17Å; R114-D120 WeakPolarHBondContact CB-OD2 3.37Å; R114-D120 IonicContact CZ-OD1 2.68Å; R114-D120 VanDerWaalsContact CZ-OD1 3.3Å; R114-D120 IonicContact CZ-OD2 3.3Å; R114-D120 IonicContact NE-OD1 3.79Å; R114-D120 PolarHBondContact NE-OD1 3.32Å; R114-D120 VanDerWaalsContact NE-OD1 3.14Å; R114-D120 IonicContact NE-OD2 3.14Å; R114-D120 PolarHBondContact NE-OD2 3.13Å; R114-D120 IonicContact NH2-OD1 3.77Å; R114-D120 PolarHBondContact NH2-OD1 2.92Å; R114-D120 IonicContact NH2-OD2 2.64Å
115	A	88.3	Confident	80.7	Confident	64 Å²	64	63.1 Å²	63.1	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-66.9	-45.6	174.4	0	0	0	0	0	111.6	P111 V113 L117 Q118	P111-A115 VanDerWaalsContact O-CB 3.26Å; P111-A115 WeakPolarHBondContact O-CB 3.43Å; P111-A115 PolarHBondContact O-N 3.05Å; V113-A115 VanDerWaalsContact C-N 3.31Å; V113-A115 PolarHBondContact O-N 3.39Å; A115-L117 VanDerWaalsContact C-N 3.31Å; A115-L117 PolarHBondContact O-N 3.33Å; A115-Q118 PolarHBondContact O-N 3.38Å
116	F	93.6	Very high	78.1	Confident	17 Å²	17	61 Å²	61	8%	0.075	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-40.3	178.3	-178.8	-93.9	0	0	0	112.4	R49 E53 F54 L57 I98 D112 V113	R49-F116 HydrophobicContact CB-CE2 4.3Å; R49-F116 HydrophobicContact CB-CZ 4.06Å; R49-F116 HydrophobicContact CG-CD2 4.46Å; R49-F116 HydrophobicContact CG-CE1 4.2Å; R49-F116 HydrophobicContact CG-CE2 3.74Å; R49-F116 HydrophobicContact CG-CZ 3.57Å; R49-F116 PolarHBondContact NE-O 2.77Å; R49-F116 PolarHBondContact NH2-O 2.76Å; E53-F116 HydrophobicContact CB-CE2 4.05Å; F54-F116 HydrophobicContact CD1-CE1 4.13Å; F54-F116 HydrophobicContact CD1-CE2 4.43Å; F54-F116 AromaticContact CD1-CZ 3.5Å; F54-F116 HydrophobicContact CD1-CZ 3.5Å; F54-F116 HydrophobicContact CD2-CZ 4.17Å; F54-F116 AromaticContact CE1-CE1 3.94Å; F54-F116 HydrophobicContact CE1-CE1 3.94Å; F54-F116 AromaticContact CE1-CZ 3.55Å; F54-F116 HydrophobicContact CE1-CZ 3.55Å; F54-F116 HydrophobicContact CE2-CZ 4.2Å; F54-F116 HydrophobicContact CG-CE2 4.4Å; F54-F116 AromaticContact CG-CZ 3.83Å; F54-F116 HydrophobicContact CG-CZ 3.83Å; F54-F116 HydrophobicContact CZ-CE1 4.47Å; F54-F116 AromaticContact CZ-CZ 3.89Å; F54-F116 HydrophobicContact CZ-CZ 3.89Å; L57-F116 HydrophobicContact CB-CD2 4.27Å; L57-F116 HydrophobicContact CD2-CB 3.81Å; L57-F116 HydrophobicContact CD2-CD1 3.7Å; L57-F116 HydrophobicContact CD2-CD2 3.85Å; L57-F116 HydrophobicContact CD2-CE1 4.21Å; L57-F116 HydrophobicContact CD2-CE2 4.31Å; L57-F116 HydrophobicContact CD2-CG 3.51Å; L57-F116 HydrophobicContact CD2-CZ 4.48Å; I98-F116 HydrophobicContact CG2-CE1 4.13Å; D112-F116 WeakPolarHBondContact O-CB 3.22Å; D112-F116 PolarHBondContact O-N 3.45Å; V113-F116 PolarHBondContact O-N 2.99Å
117	L	92.6	Very high	75.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-91	-3.8	178	-63.1	178.9	0	0	0	113.7	V16 V36 V38 W45 V47 V102 V113 A115 M119	V16-L117 HydrophobicContact CG1-CD1 4.04Å; V16-L117 HydrophobicContact CG1-CD2 4.06Å; V36-L117 HydrophobicContact CG1-CD2 4.28Å; V38-L117 HydrophobicContact CG1-CB 4.43Å; V38-L117 HydrophobicContact CG2-CB 4.28Å; V38-L117 HydrophobicContact CG2-CD2 4.01Å; W45-L117 PolarHBondContact NE1-O 3.37Å; V47-L117 WeakPolarHBondContact CG2-O 3.42Å; V102-L117 HydrophobicContact CG1-CD1 3.9Å; V113-L117 HydrophobicContact CG1-CD1 3.91Å; V113-L117 HydrophobicContact CG1-CG 4.4Å; V113-L117 WeakPolarHBondContact O-CB 3.27Å; V113-L117 WeakPolarHBondContact O-CG 3.36Å; V113-L117 PolarHBondContact O-N 3.48Å; A115-L117 VanDerWaalsContact C-N 3.31Å; A115-L117 PolarHBondContact O-N 3.33Å; L117-M119 VanDerWaalsContact C-N 3.31Å; L117-M119 HydrophobicContact CB-CG 3.87Å; L117-M119 HydrophobicContact CB-SD 4.34Å; L117-M119 HydrophobicContact CD1-SD 4.2Å; L117-M119 PolarHBondContact O-N 3.05Å
118	Q	88.7	Confident	72.8	Confident	32 Å²	32	59.6 Å²	59.6	15%	0.15	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	39.2	-178.5	-61.3	176.3	-13.4	0	0	114.2	V47 R114 A115 D120 S121 S126	V47-Q118 HydrophobicContact CG1-CG 4.5Å; V47-Q118 HydrophobicContact CG2-CB 4.22Å; V47-Q118 HydrophobicContact CG2-CG 4.31Å; R114-Q118 CarbonylContact O-C 3.36Å; R114-Q118 VanDerWaalsContact O-CA 3.27Å; R114-Q118 WeakPolarHBondContact O-CA 3.49Å; R114-Q118 PolarHBondContact O-N 3.19Å; A115-Q118 PolarHBondContact O-N 3.38Å; Q118-D120 PolarHBondContact O-N 3.01Å; Q118-S121 CarbonylContact O-C 3.58Å; Q118-S121 PolarHBondContact O-N 2.87Å; Q118-S126 PolarHBondContact NE2-OG 2.81Å; Q118-S126 PolarHBondContact OE1-OG 3.07Å
119	M	83.6	Confident	70.2	Confident	23 Å²	23	61.8 Å²	61.8	11%	0.113	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-30.7	-176.2	-66.2	-179.6	67.5	0	0	113.8	P14 V40 W45 Y108 R114 L117	P14-M119 HydrophobicContact CB-CE 3.8Å; P14-M119 HydrophobicContact CB-SD 4.47Å; P14-M119 HydrophobicContact CG-CE 3.78Å; V40-M119 HydrophobicContact CG2-CE 4.08Å; W45-M119 HydrophobicContact CZ2-CG 4.29Å; Y108-M119 HydrophobicContact CD2-CE 4.47Å; R114-M119 HydrophobicContact CB-CB 4.28Å; R114-M119 HydrophobicContact CG-SD 4.31Å; R114-M119 PolarHBondContact O-N 3.17Å; L117-M119 VanDerWaalsContact C-N 3.31Å; L117-M119 HydrophobicContact CB-CG 3.87Å; L117-M119 HydrophobicContact CB-SD 4.34Å; L117-M119 HydrophobicContact CD1-SD 4.2Å; L117-M119 PolarHBondContact O-N 3.05Å
120	D	79.2	Confident	68	Low	104 Å²	104	64.2 Å²	64.2	56%	0.556	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-6.9	-178.5	-65.8	-54.8	0	0	0	114	R114 Q118	R114-D120 WeakPolarHBondContact CB-OD2 3.37Å; R114-D120 IonicContact CZ-OD1 2.68Å; R114-D120 VanDerWaalsContact CZ-OD1 3.3Å; R114-D120 IonicContact CZ-OD2 3.3Å; R114-D120 IonicContact NE-OD1 3.79Å; R114-D120 PolarHBondContact NE-OD1 3.32Å; R114-D120 VanDerWaalsContact NE-OD1 3.14Å; R114-D120 IonicContact NE-OD2 3.14Å; R114-D120 PolarHBondContact NE-OD2 3.13Å; R114-D120 IonicContact NH2-OD1 3.77Å; R114-D120 PolarHBondContact NH2-OD1 2.92Å; R114-D120 IonicContact NH2-OD2 2.64Å; Q118-D120 PolarHBondContact O-N 3.01Å
121	S	65.1	Low	65.2	Low	74 Å²	74	70.2 Å²	70.2	52%	0.517	37%	0.372	S	S	.	.			trans	-151.5	65.6	179.4	-73.2	0	0	0	0	110.7	Q118 R123	Q118-S121 CarbonylContact O-C 3.58Å; Q118-S121 PolarHBondContact O-N 2.87Å; S121-R123 PolarHBondContact O-N 3.23Å
122	P	53.9	Low	62.8	Low	56 Å²	56	74.9 Å²	74.9	36%	0.364	39%	0.386	S	S	.	.			trans	-63.5	-4.7	179	25	-33.2	0	0	0	113.3	W45 H124	W45-P122 HydrophobicContact CD2-CB 3.73Å; W45-P122 HydrophobicContact CE3-CB 3.64Å; W45-P122 HydrophobicContact CG-CB 4.3Å; W45-P122 HydrophobicContact CH2-CB 4.19Å; W45-P122 HydrophobicContact CZ2-CB 4.28Å; W45-P122 HydrophobicContact CZ3-CB 3.89Å; P122-H124 PolarHBondContact O-N 2.8Å
123	R	44.7	Very low	59.9	Low	227 Å²	227	79.7 Å²	79.7	86%	0.857	41%	0.411	S	S	*	.	S	Bend	trans	-96.3	46.6	177.3	-65.9	-171.6	178.6	-173.9	1.3	113.4	S121	S121-R123 PolarHBondContact O-N 3.23Å
124	H	43.8	Very low	57.1	Low	107 Å²	107	88.1 Å²	88.1	50%	0.495	45%	0.451	S	S	.	.			trans	-148.5	95.9	162.9	-86.6	-71.9	0	0	0	109.7	P122 S126	P122-H124 PolarHBondContact O-N 2.8Å; H124-S126 PolarHBondContact O-N 2.84Å; H124-S126 PolarHBondContact O-OG 3.38Å; H124-S126 VanDerWaalsContact O-OG 3.06Å
125	Q	39.3	Very low	54.4	Low	139 Å²	139	97.2 Å²	97.2	65%	0.65	49%	0.485	S	S	*	.			trans	-55.6	96.1	159.1	-75.6	177.8	1.5	0	0	108.1
126	S	35.8	Very low	51.8	Low	21 Å²	21	99.6 Å²	99.6	15%	0.147	50%	0.498	C	S	.	.			trans	-112.8	104.5	178.5	37.9	0	0	0	0	107.4	Q118 H124	Q118-S126 PolarHBondContact NE2-OG 2.81Å; Q118-S126 PolarHBondContact OE1-OG 3.07Å; H124-S126 PolarHBondContact O-N 2.84Å; H124-S126 PolarHBondContact O-OG 3.38Å; H124-S126 VanDerWaalsContact O-OG 3.06Å
127	D	37.7	Very low	49.3	Very low	39 Å²	39	105.6 Å²	105.6	21%	0.209	54%	0.536	C	S	.	.			trans	-65.5	139.7	163.2	-171	-39.6	0	0	0	107.8	S129 K170	D127-S129 PolarHBondContact O-N 3.15Å; D127-K170 IonicContact OD1-NZ 3.76Å; D127-K170 PolarHBondContact OD1-NZ 2.88Å; D127-K170 WeakPolarHBondContact OD2-CE 3.4Å; D127-K170 IonicContact OD2-NZ 2.86Å; D127-K170 PolarHBondContact OD2-NZ 3.24Å
128	P	36.5	Very low	46.5	Very low	26 Å²	26	111.3 Å²	111.3	17%	0.169	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	39	-164	25.9	-18.6	0	0	0	114.4	V33 F48	V33-P128 HydrophobicContact CG1-CG 3.87Å; V33-P128 HydrophobicContact CG2-CG 4.41Å; F48-P128 HydrophobicContact CB-CG 3.7Å; F48-P128 WeakPolarHBondContact O-CB 3.3Å
129	S	38.4	Very low	43.9	Very low	72 Å²	72	118.7 Å²	118.7	50%	0.503	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.4	2.5	173.5	62.3	0	0	0	0	114	D127	D127-S129 PolarHBondContact O-N 3.15Å
130	E	43	Very low	41.5	Very low	119 Å²	119	123.8 Å²	123.8	56%	0.556	64%	0.642	S	S	*	*			trans	-103.2	83.7	176.4	-66.2	-177.1	174.5	0	0	109.2	Q194	E130-Q194 PolarHBondContact OE1-NE2 2.91Å
131	D	36.2	Very low	39.5	Very low	147 Å²	147	127 Å²	127	79%	0.786	65%	0.653	S	S	*	*			trans	-177.6	61.7	158.9	-96.2	-16.4	0	0	0	111.8
132	E	38.5	Very low	38.4	Very low	187 Å²	187	129.1 Å²	129.1	87%	0.874	67%	0.669	S	S	*	*	S	Bend	trans	-154.4	78.6	150.1	-75.6	-150	179.8	0	0	108.6
133	D	32	Very low	37.8	Very low	165 Å²	165	129.8 Å²	129.8	88%	0.882	67%	0.671	S	S	*	*			trans	-168.5	8	154.2	-99.4	-21.5	0	0	0	114.8	R135	D133-R135 VanDerWaalsContact C-N 3.29Å; D133-R135 PolarHBondContact O-N 3.26Å; D133-R135 VanDerWaalsContact O-N 3.08Å
134	E	36.5	Very low	38	Very low	177 Å²	177	122.5 Å²	122.5	83%	0.827	66%	0.655	S	S	*	*			trans	-85.2	67.7	169.2	-70.9	-149.9	150.6	0	0	112.3
135	R	35.4	Very low	39	Very low	246 Å²	246	126.1 Å²	126.1	93%	0.928	67%	0.665	S	S	*	*			trans	-147.7	71.2	153.3	-148.3	176	-167.3	-143.1	2.5	112.4	D133	D133-R135 VanDerWaalsContact C-N 3.29Å; D133-R135 PolarHBondContact O-N 3.26Å; D133-R135 VanDerWaalsContact O-N 3.08Å
136	S	34.3	Very low	40.4	Very low	113 Å²	113	125.8 Å²	125.8	79%	0.79	67%	0.667	S	S	*	*			trans	-149.6	123.6	145.6	55.9	0	0	0	0	111.2
137	T	39.7	Very low	42.2	Very low	143 Å²	143	125.5 Å²	125.5	88%	0.877	66%	0.664	S	S	*	*			trans	-56.2	123	177.3	38.5	0	0	0	0	113
138	S	34.3	Very low	43.9	Very low	120 Å²	120	129 Å²	129	84%	0.839	68%	0.683	S	S	*	*			trans	-175.1	138.8	130.8	45.1	0	0	0	0	112.9
139	K	32.9	Very low	45.7	Very low	188 Å²	188	128.4 Å²	128.4	82%	0.817	68%	0.678	S	S	*	*			trans	-16.5	152.2	177.7	-67.3	175.3	178.4	179.6	0	120.3	H141	K139-H141 PolarHBondContact O-N 3.09Å
140	P	35.2	Very low	47.3	Very low	130 Å²	130	126.4 Å²	126.4	84%	0.844	67%	0.669	S	S	*	*			trans	-76.1	98.3	179.5	32.9	-33	0	0	0	110.8	S142	P140-S142 PolarHBondContact O-N 3.35Å
141	H	36.9	Very low	48.7	Very low	170 Å²	170	126.6 Å²	126.6	79%	0.787	68%	0.681	S	S	*	*			trans	-83.1	104.9	159.4	-93.4	-56.6	0	0	0	109.5	K139 T143	K139-H141 PolarHBondContact O-N 3.09Å; H141-T143 PolarHBondContact O-N 3.2Å; H141-T143 PolarHBondContact O-OG1 2.77Å
142	S	42.2	Very low	50.7	Low	120 Å²	120	120.2 Å²	120.2	84%	0.839	65%	0.647	S	S	*	*			trans	-45.9	103	159.9	174.3	0	0	0	0	110.2	P140	P140-S142 PolarHBondContact O-N 3.35Å
143	T	41.3	Very low	52.7	Low	69 Å²	69	112.7 Å²	112.7	42%	0.423	62%	0.619	S	S	.	*			trans	-144.9	53.6	172	50.1	0	0	0	0	111.4	H141 R145	H141-T143 PolarHBondContact O-N 3.2Å; H141-T143 PolarHBondContact O-OG1 2.77Å; T143-R145 PolarHBondContact O-N 3.42Å
144	S	48.5	Very low	55.3	Low	74 Å²	74	107.5 Å²	107.5	52%	0.517	59%	0.592	S	S	.	*			trans	-76.2	72.3	159.7	-74.4	0	0	0	0	109.6	T233	S144-T233 WeakPolarHBondContact OG-CG2 3.46Å; S144-T233 PolarHBondContact OG-O 3.43Å
145	R	64.9	Low	57.7	Low	183 Å²	183	104.5 Å²	104.5	69%	0.691	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-77.2	127.7	169.6	-65.3	-174.4	-163.2	174.7	4.3	108.3	T143 I147	T143-R145 PolarHBondContact O-N 3.42Å; R145-I147 PolarHBondContact O-N 3.29Å
146	N	68.6	Low	60.3	Low	132 Å²	132	100.1 Å²	100.1	71%	0.706	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-63.3	129.9	167.9	-86.7	-31.5	0	0	0	109.4
147	I	72.6	Confident	63	Low	15 Å²	15	95.2 Å²	95.2	8%	0.077	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-92.3	133.6	-178.5	-62.7	177.6	0	0	0	107.7	R145 L149 K195 V198 R211 Q231 L236	R145-I147 PolarHBondContact O-N 3.29Å; I147-L149 HydrophobicContact CG2-CD2 4.49Å; I147-L149 PolarHBondContact O-N 2.79Å; I147-K195 HydrophobicContact CD1-CD 4.26Å; I147-K195 HydrophobicContact CD1-CG 4.01Å; I147-V198 HydrophobicContact CD1-CG1 4.42Å; I147-R211 VanDerWaalsContact CG2-CZ 3.49Å; I147-Q231 PolarHBondContact O-NE2 2.93Å; I147-L236 HydrophobicContact CB-CD2 4.35Å; I147-L236 HydrophobicContact CD1-CD1 3.98Å; I147-L236 HydrophobicContact CD1-CD2 4.12Å; I147-L236 HydrophobicContact CD1-CG 4.32Å
148	N	74.6	Confident	65.6	Low	114 Å²	114	94.3 Å²	94.3	61%	0.61	53%	0.527	S	S	*	.			trans	-69.1	113.9	179.7	178.3	-27.4	0	0	0	110.8	G150 R211	N148-G150 VanDerWaalsContact C-N 3.29Å; N148-G150 PolarHBondContact O-N 2.67Å; N148-G150 PolarHBondContact OD1-N 3.42Å; N148-R211 PolarHBondContact O-NE 2.93Å; N148-R211 PolarHBondContact O-NH2 3.03Å
149	L	73.1	Confident	68.3	Low	12 Å²	12	90.2 Å²	90.2	6%	0.063	50%	0.498	C	S	.	.			trans	-91.8	21.6	-176.7	-63.5	-179.4	0	0	0	114	I147 T152 G153 L215 F230 Q231 L236	I147-L149 HydrophobicContact CG2-CD2 4.49Å; I147-L149 PolarHBondContact O-N 2.79Å; L149-T152 PolarHBondContact O-OG1 3.46Å; L149-G153 PolarHBondContact O-N 3.42Å; L149-L215 VanDerWaalsContact C-CD2 3.4Å; L149-L215 WeakPolarHBondContact O-CD2 3.47Å; L149-F230 VanDerWaalsContact CD1-C 3.47Å; L149-F230 VanDerWaalsContact CD1-CA 3.45Å; L149-Q231 HydrophobicContact CD1-CB 4.13Å; L149-Q231 HydrophobicContact CD1-CG 4.24Å; L149-L236 HydrophobicContact CD2-CD2 4.03Å
150	G	71.8	Confident	71.2	Confident	30 Å²	30	85.7 Å²	85.7	31%	0.309	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	55.4	-156.9	176.1	0	0	0	0	0	113.6	N148 T152 G153	N148-G150 VanDerWaalsContact C-N 3.29Å; N148-G150 PolarHBondContact O-N 2.67Å; N148-G150 PolarHBondContact OD1-N 3.42Å; G150-T152 PolarHBondContact O-N 3.28Å; G150-G153 PolarHBondContact O-N 3.4Å
151	P	73.8	Confident	73.7	Confident	124 Å²	124	82.2 Å²	82.2	81%	0.805	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-63.9	-23.1	-179.5	-21.5	33.1	0	0	0	114.1	G153	P151-G153 VanDerWaalsContact C-N 3.3Å
152	T	77	Confident	76.4	Confident	13 Å²	13	74.4 Å²	74.4	8%	0.08	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-84.8	-6.9	-179.7	61.7	0	0	0	0	113	L149 G150 N154 L215 L226 Y228 S229	L149-T152 PolarHBondContact O-OG1 3.46Å; G150-T152 PolarHBondContact O-N 3.28Å; T152-N154 PolarHBondContact O-N 3.25Å; T152-L215 WeakPolarHBondContact OG1-CD2 3.22Å; T152-L226 HydrophobicContact CG2-CD2 3.88Å; T152-Y228 CarbonylContact O-C 3.57Å; T152-Y228 WeakPolarHBondContact O-CA 3.24Å; T152-Y228 WeakPolarHBondContact O-CB 3.36Å; T152-S229 PolarHBondContact O-N 3Å; T152-S229 PolarHBondContact OG1-OG 3.44Å; T152-S229 VanDerWaalsContact OG1-OG 3.11Å
153	G	81.1	Confident	78.7	Confident	28 Å²	28	72.1 Å²	72.1	29%	0.289	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-68.8	115.9	-177.4	0	0	0	0	0	112.1	L149 G150 P151 P155 S229	L149-G153 PolarHBondContact O-N 3.42Å; G150-G153 PolarHBondContact O-N 3.4Å; P151-G153 VanDerWaalsContact C-N 3.3Å; G153-P155 WeakPolarHBondContact O-CD 3.47Å; G153-S229 CarbonylContact C-O 3.57Å; G153-S229 WeakPolarHBondContact CA-O 3.44Å
154	N	86.6	Confident	81	Confident	57 Å²	57	71.3 Å²	71.3	31%	0.305	39%	0.393	S	S	.	.			trans	-103	107.2	173.2	-173.8	-19.1	0	0	0	110	T152 H156 A157 Y228 S229 F230	T152-N154 PolarHBondContact O-N 3.25Å; N154-H156 PolarHBondContact O-N 3.38Å; N154-H156 WeakPolarHBondContact OD1-CB 3.47Å; N154-H156 PolarHBondContact OD1-N 3.01Å; N154-A157 HydrophobicContact CB-CB 4.01Å; N154-A157 PolarHBondContact OD1-N 3.42Å; N154-Y228 HydrophobicContact CB-CD2 4.01Å; N154-Y228 HydrophobicContact CB-CG 4.41Å; N154-S229 PolarHBondContact N-O 3.05Å; N154-F230 WeakPolarHBondContact O-CB 3.4Å
155	P	86.3	Confident	82.5	Confident	113 Å²	113	72.2 Å²	72.2	73%	0.734	39%	0.392	S	S	*	.	S	Bend	trans	-72.5	-15.6	-179.3	30	-34.9	0	0	0	113.4	G153	G153-P155 WeakPolarHBondContact O-CD 3.47Å
156	H	90.9	Very high	83.4	Confident	155 Å²	155	70.4 Å²	70.4	72%	0.718	39%	0.389	S	S	*	.	S	Bend	trans	-93	-20.2	-177.8	-59.4	-66.7	0	0	0	113.2	N154	N154-H156 PolarHBondContact O-N 3.38Å; N154-H156 WeakPolarHBondContact OD1-CB 3.47Å; N154-H156 PolarHBondContact OD1-N 3.01Å
157	A	91.6	Very high	84.1	Confident	9 Å²	9	66.3 Å²	66.3	7%	0.074	37%	0.368	C	S	.	.			trans	-71.5	140.1	-179.2	0	0	0	0	0	112.2	N154 D161 Y228 F230	N154-A157 HydrophobicContact CB-CB 4.01Å; N154-A157 PolarHBondContact OD1-N 3.42Å; A157-D161 WeakPolarHBondContact CA-OD2 3.26Å; A157-Y228 HydrophobicContact CB-CD2 4.15Å; A157-Y228 HydrophobicContact CB-CE2 3.67Å; A157-F230 HydrophobicContact CB-CB 3.86Å; A157-F230 HydrophobicContact CB-CD1 3.81Å; A157-F230 HydrophobicContact CB-CD2 4.48Å; A157-F230 HydrophobicContact CB-CE1 4.48Å; A157-F230 HydrophobicContact CB-CG 3.8Å; A157-F230 WeakPolarHBondContact O-CD2 3.35Å
158	K	92.9	Very high	84.4	Confident	124 Å²	124	69 Å²	69	54%	0.539	38%	0.382	S	S	.	.			trans	-133.8	155.5	-177.8	-62.6	178	-173.1	175.5	0	111	T160 D161	K158-T160 WeakPolarHBondContact CB-OG1 3.46Å; K158-T160 PolarHBondContact O-N 2.77Å; K158-T160 VanDerWaalsContact O-N 3.14Å; K158-D161 PolarHBondContact N-OD2 2.87Å; K158-D161 VanDerWaalsContact O-CB 3.32Å; K158-D161 WeakPolarHBondContact O-CB 3.23Å; K158-D161 VanDerWaalsContact O-CG 3.26Å; K158-D161 PolarHBondContact O-N 3.02Å; K158-D161 VanDerWaalsContact O-N 3.09Å
159	P	91.1	Very high	84.4	Confident	34 Å²	34	64.8 Å²	64.8	22%	0.221	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-57.6	-29.6	173.5	-22.1	32.2	0	0	0	113	D161 F162 F164 F230 T232 Y237	P159-D161 PolarHBondContact O-N 2.78Å; P159-F162 PolarHBondContact O-N 3.18Å; P159-F164 HydrophobicContact CB-CE2 4.17Å; P159-F164 HydrophobicContact CB-CZ 4.35Å; P159-F164 WeakPolarHBondContact O-CE2 3.48Å; P159-F230 HydrophobicContact CG-CE2 3.95Å; P159-T232 HydrophobicContact CG-CG2 3.69Å; P159-Y237 HydrophobicContact CB-CE1 4.35Å; P159-Y237 HydrophobicContact CG-CE1 4.16Å; P159-Y237 HydrophobicContact CG-CE2 4.06Å
160	T	93.6	Very high	84.2	Confident	94 Å²	94	69.7 Å²	69.7	58%	0.577	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-66.3	-15.3	179.8	47.8	0	0	0	0	114.2	K158 F162 K182	K158-T160 WeakPolarHBondContact CB-OG1 3.46Å; K158-T160 PolarHBondContact O-N 2.77Å; K158-T160 VanDerWaalsContact O-N 3.14Å; T160-F162 PolarHBondContact O-N 3.27Å; T160-K182 WeakPolarHBondContact O-CD 3.19Å; T160-K182 WeakPolarHBondContact O-CE 3.32Å; T160-K182 PolarHBondContact O-NZ 2.79Å
161	D	88.7	Confident	83.8	Confident	57 Å²	57	70.7 Å²	70.7	31%	0.305	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-75.2	-6.6	178.8	-53.6	-17.2	0	0	0	111.9	A157 K158 P159 K182	A157-D161 WeakPolarHBondContact CA-OD2 3.26Å; K158-D161 PolarHBondContact N-OD2 2.87Å; K158-D161 VanDerWaalsContact O-CB 3.32Å; K158-D161 WeakPolarHBondContact O-CB 3.23Å; K158-D161 VanDerWaalsContact O-CG 3.26Å; K158-D161 PolarHBondContact O-N 3.02Å; K158-D161 VanDerWaalsContact O-N 3.09Å; P159-D161 PolarHBondContact O-N 2.78Å; D161-K182 WeakPolarHBondContact O-CB 3.49Å; D161-K182 PolarHBondContact O-N 3.39Å
162	F	93.1	Very high	82.8	Confident	6 Å²	6	69.9 Å²	69.9	3%	0.026	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.2	-176.3	-62.4	-90.2	0	0	0	111.9	P159 T160 F164 A179 K180 R181 Y188 V190 Y228 F230 V239	P159-F162 PolarHBondContact O-N 3.18Å; T160-F162 PolarHBondContact O-N 3.27Å; F162-F164 HydrophobicContact CB-CE1 4.27Å; F162-F164 HydrophobicContact CB-CE2 4.2Å; F162-F164 HydrophobicContact CB-CZ 4.01Å; F162-A179 HydrophobicContact CB-CB 4.16Å; F162-A179 HydrophobicContact CD1-CB 4.02Å; F162-A179 HydrophobicContact CG-CB 4.43Å; F162-K180 CarbonylContact C-O 3.54Å; F162-K180 WeakPolarHBondContact CA-O 3.48Å; F162-R181 HydrophobicContact CD1-CB 3.86Å; F162-R181 HydrophobicContact CD1-CG 4.34Å; F162-R181 HydrophobicContact CE1-CB 3.77Å; F162-R181 HydrophobicContact CE1-CG 4.07Å; F162-Y188 HydrophobicContact CE1-CD2 4.14Å; F162-V190 HydrophobicContact CD1-CG2 4.42Å; F162-V190 HydrophobicContact CE1-CG2 4.34Å; F162-Y228 HydrophobicContact CZ-CE2 4.36Å; F162-Y228 AromaticContact CZ-CZ 3.96Å; F162-Y228 WeakPolarHBondContact CZ-OH 3.18Å; F162-F230 HydrophobicContact CD2-CZ 4.44Å; F162-F230 AromaticContact CE2-CE1 3.81Å; F162-F230 HydrophobicContact CE2-CE1 3.81Å; F162-F230 HydrophobicContact CE2-CZ 4.01Å; F162-F230 HydrophobicContact CZ-CE1 4.46Å; F162-V239 HydrophobicContact CE1-CG1 4.19Å; F162-V239 HydrophobicContact CE2-CG2 4.37Å; F162-V239 HydrophobicContact CZ-CG1 4.07Å; F162-V239 HydrophobicContact CZ-CG2 3.73Å
163	D	89.9	Confident	82	Confident	71 Å²	71	70.9 Å²	70.9	38%	0.38	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	107.2	161.3	-62.5	-45.4	0	0	0	108.1	L165 A179 K180 K182	D163-L165 HydrophobicContact CB-CD2 4.25Å; D163-L165 PolarHBondContact O-N 3Å; D163-A179 CarbonylContact O-C 3.59Å; D163-A179 VanDerWaalsContact O-CA 3.26Å; D163-A179 WeakPolarHBondContact O-CA 3.44Å; D163-K180 HydrophobicContact CB-CB 4.46Å; D163-K180 PolarHBondContact N-O 2.84Å; D163-K180 PolarHBondContact O-N 3.36Å; D163-K182 VanDerWaalsContact CG-CE 3.49Å; D163-K182 WeakPolarHBondContact OD1-CE 3.32Å; D163-K182 IonicContact OD1-NZ 2.62Å
164	F	90.3	Very high	81.7	Confident	52 Å²	52	70.7 Å²	70.7	23%	0.228	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.1	177.5	-62.5	-76.4	0	0	0	109.9	P159 F162 L177 A179 V190 Y237	P159-F164 HydrophobicContact CB-CE2 4.17Å; P159-F164 HydrophobicContact CB-CZ 4.35Å; P159-F164 WeakPolarHBondContact O-CE2 3.48Å; F162-F164 HydrophobicContact CB-CE1 4.27Å; F162-F164 HydrophobicContact CB-CE2 4.2Å; F162-F164 HydrophobicContact CB-CZ 4.01Å; F164-L177 HydrophobicContact CD1-CB 3.91Å; F164-L177 HydrophobicContact CD1-CD1 3.48Å; F164-L177 VanDerWaalsContact CD1-CD1 3.48Å; F164-L177 HydrophobicContact CD1-CG 4.33Å; F164-L177 HydrophobicContact CE1-CD1 3.89Å; F164-L177 HydrophobicContact CG-CD1 4.11Å; F164-A179 HydrophobicContact CD1-CB 3.78Å; F164-A179 HydrophobicContact CE1-CB 4.1Å; F164-V190 HydrophobicContact CE1-CB 4.18Å; F164-V190 HydrophobicContact CE1-CG1 4.13Å; F164-V190 HydrophobicContact CE1-CG2 4.36Å; F164-Y237 HydrophobicContact CZ-CE1 4.43Å
165	L	80	Confident	81.5	Confident	94 Å²	94	71 Å²	71	49%	0.492	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-49.6	-167.9	-55	178.3	0	0	0	112.4	D163 L178 K180 F187	D163-L165 HydrophobicContact CB-CD2 4.25Å; D163-L165 PolarHBondContact O-N 3Å; L165-L178 HydrophobicContact CB-CG 4.36Å; L165-L178 HydrophobicContact CD1-CD2 4.41Å; L165-L178 HydrophobicContact CD1-CG 4.26Å; L165-L178 PolarHBondContact N-O 3.09Å; L165-K180 HydrophobicContact CD1-CB 4.22Å; L165-F187 HydrophobicContact CD1-CD1 3.99Å; L165-F187 HydrophobicContact CD1-CE1 3.55Å
166	K	83.4	Confident	81.5	Confident	144 Å²	144	67.2 Å²	67.2	63%	0.626	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.1	144.5	-171.9	-175.1	177.9	175.8	-176.4	0	111.5	I168 L177 L178	K166-I168 HydrophobicContact CG-CG2 4.49Å; K166-I168 PolarHBondContact O-N 3.25Å; K166-L177 CarbonylContact O-C 3.48Å; K166-L177 WeakPolarHBondContact O-CA 3.47Å; K166-L178 HydrophobicContact CB-CB 4.39Å; K166-L178 PolarHBondContact N-O 3.29Å; K166-L178 PolarHBondContact O-N 3.29Å
167	V	83.8	Confident	81.4	Confident	46 Å²	46	60.5 Å²	60.5	28%	0.279	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.2	165.5	-176.3	0	0	0	0	108.7	K170 L177	V167-K170 HydrophobicContact CG1-CG 3.91Å; V167-L177 HydrophobicContact CB-CD2 4.29Å; V167-L177 HydrophobicContact CG2-CD2 3.63Å
168	I	79.1	Confident	81.3	Confident	72 Å²	72	61.4 Å²	61.4	37%	0.369	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-11	-179.2	60.5	174.6	0	0	0	113.1	K166 V176 L178 A189 F242	K166-I168 HydrophobicContact CG-CG2 4.49Å; K166-I168 PolarHBondContact O-N 3.25Å; I168-V176 HydrophobicContact CD1-CG1 3.85Å; I168-V176 HydrophobicContact CG1-CB 4.03Å; I168-V176 HydrophobicContact CG1-CG1 3.7Å; I168-V176 WeakPolarHBondContact CG1-O 3.45Å; I168-V176 PolarHBondContact N-O 3.32Å; I168-L178 HydrophobicContact CD1-CB 4.36Å; I168-L178 HydrophobicContact CG2-CB 3.71Å; I168-A189 HydrophobicContact CD1-CB 3.95Å; I168-F242 HydrophobicContact CD1-CD2 4.16Å; I168-F242 HydrophobicContact CD1-CE2 4.15Å
169	G	73.6	Confident	81.4	Confident	26 Å²	26	55.5 Å²	55.5	27%	0.268	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	148.7	172.7	0	0	0	0	0	111.7	K175 V176	G169-K175 CarbonylContact O-C 3.54Å; G169-K175 WeakPolarHBondContact O-CA 3.04Å; G169-V176 PolarHBondContact N-O 3.1Å; G169-V176 PolarHBondContact O-N 3.06Å
170	K	70.3	Confident	81.5	Confident	115 Å²	115	57.8 Å²	57.8	50%	0.5	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	128.1	172.3	-67	-176.9	-179.1	-179.4	0	108.1	D127 V167	D127-K170 IonicContact OD1-NZ 3.76Å; D127-K170 PolarHBondContact OD1-NZ 2.88Å; D127-K170 WeakPolarHBondContact OD2-CE 3.4Å; D127-K170 IonicContact OD2-NZ 2.86Å; D127-K170 PolarHBondContact OD2-NZ 3.24Å; V167-K170 HydrophobicContact CG1-CG 3.91Å
171	G	62.8	Low	81.6	Confident	50 Å²	50	55.8 Å²	55.8	52%	0.515	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	172.8	176.5	0	0	0	0	0	111.1	F173 G174	G171-F173 PolarHBondContact O-N 3.4Å; G171-F173 VanDerWaalsContact O-N 3.13Å; G171-G174 PolarHBondContact N-O 3.29Å; G171-G174 PolarHBondContact O-N 2.94Å
172	S	53.8	Low	81.8	Confident	108 Å²	108	58.8 Å²	58.8	76%	0.755	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.2	-177.8	-41.7	0	0	0	0	113.5
173	F	59.5	Low	81.7	Confident	34 Å²	34	65.9 Å²	65.9	15%	0.149	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	0.6	-172.6	-47.5	-64.5	0	0	0	113.9	G171 L193 I197 E203 I207	G171-F173 PolarHBondContact O-N 3.4Å; G171-F173 VanDerWaalsContact O-N 3.13Å; F173-L193 HydrophobicContact CB-CD2 3.99Å; F173-I197 HydrophobicContact CD1-CG2 4.18Å; F173-E203 HydrophobicContact CE1-CG 4.49Å; F173-E203 VanDerWaalsContact CE1-OE2 3.28Å; F173-E203 WeakPolarHBondContact CE1-OE2 3.43Å; F173-I207 HydrophobicContact CD1-CD1 4.02Å; F173-I207 HydrophobicContact CD1-CG1 4.44Å; F173-I207 HydrophobicContact CG-CD1 4.37Å; F173-I207 HydrophobicContact CG-CG1 4.45Å
174	G	74.3	Confident	81.9	Confident	24 Å²	24	65.1 Å²	65.1	25%	0.247	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.1	-165	-173.5	0	0	0	0	0	115.3	G171 V192	G171-G174 PolarHBondContact N-O 3.29Å; G171-G174 PolarHBondContact O-N 2.94Å; G174-V192 WeakPolarHBondContact CA-O 3.24Å
175	K	82.6	Confident	82	Confident	62 Å²	62	64 Å²	64	27%	0.27	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	152.5	-179.2	64.1	-175.2	179.5	-175.7	0	111.7	G169 L177 V192	G169-K175 CarbonylContact O-C 3.54Å; G169-K175 WeakPolarHBondContact O-CA 3.04Å; K175-L177 HydrophobicContact CD-CD2 4.12Å; K175-L177 HydrophobicContact CG-CD2 4.35Å; K175-L177 HydrophobicContact CG-CG 4.38Å; K175-V192 HydrophobicContact CG-CB 4.47Å; K175-V192 PolarHBondContact N-O 2.87Å; K175-V192 PolarHBondContact O-N 3Å
176	V	86.1	Confident	82.7	Confident	35 Å²	35	65.6 Å²	65.6	21%	0.212	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.2	173.3	-169.7	0	0	0	0	108.3	I168 G169 A189 V190 K191	I168-V176 HydrophobicContact CD1-CG1 3.85Å; I168-V176 HydrophobicContact CG1-CB 4.03Å; I168-V176 HydrophobicContact CG1-CG1 3.7Å; I168-V176 WeakPolarHBondContact CG1-O 3.45Å; I168-V176 PolarHBondContact N-O 3.32Å; G169-V176 PolarHBondContact N-O 3.1Å; G169-V176 PolarHBondContact O-N 3.06Å; V176-A189 HydrophobicContact CG1-CB 4Å; V176-V190 WeakPolarHBondContact CA-O 3.34Å; V176-K191 HydrophobicContact CG2-CB 4.26Å; V176-K191 HydrophobicContact CG2-CG 4.09Å
177	L	88.3	Confident	83.1	Confident	14 Å²	14	63.6 Å²	63.6	7%	0.073	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.8	-177.8	-59.2	170.7	0	0	0	109.7	F164 K166 V167 K175 A179 A189 V190 V192	F164-L177 HydrophobicContact CD1-CB 3.91Å; F164-L177 HydrophobicContact CD1-CD1 3.48Å; F164-L177 VanDerWaalsContact CD1-CD1 3.48Å; F164-L177 HydrophobicContact CD1-CG 4.33Å; F164-L177 HydrophobicContact CE1-CD1 3.89Å; F164-L177 HydrophobicContact CG-CD1 4.11Å; K166-L177 CarbonylContact O-C 3.48Å; K166-L177 WeakPolarHBondContact O-CA 3.47Å; V167-L177 HydrophobicContact CB-CD2 4.29Å; V167-L177 HydrophobicContact CG2-CD2 3.63Å; K175-L177 HydrophobicContact CD-CD2 4.12Å; K175-L177 HydrophobicContact CG-CD2 4.35Å; K175-L177 HydrophobicContact CG-CG 4.38Å; L177-A179 PolarHBondContact O-N 3.48Å; L177-A189 CarbonylContact O-C 3.57Å; L177-V190 PolarHBondContact N-O 2.96Å; L177-V190 PolarHBondContact O-N 3.29Å; L177-V192 HydrophobicContact CD1-CG2 3.87Å; L177-V192 HydrophobicContact CG-CG2 4.5Å
178	L	90.8	Very high	83.7	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.141	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	122.8	159.4	174.1	61.3	0	0	0	108	L165 K166 I168 F187 F242	L165-L178 HydrophobicContact CB-CG 4.36Å; L165-L178 HydrophobicContact CD1-CD2 4.41Å; L165-L178 HydrophobicContact CD1-CG 4.26Å; L165-L178 PolarHBondContact N-O 3.09Å; K166-L178 HydrophobicContact CB-CB 4.39Å; K166-L178 PolarHBondContact N-O 3.29Å; K166-L178 PolarHBondContact O-N 3.29Å; I168-L178 HydrophobicContact CD1-CB 4.36Å; I168-L178 HydrophobicContact CG2-CB 3.71Å; L178-F187 HydrophobicContact CD1-CB 4.19Å; L178-F187 HydrophobicContact CD1-CD1 3.98Å; L178-F242 HydrophobicContact CD1-CD1 3.96Å; L178-F242 HydrophobicContact CD1-CD2 3.68Å; L178-F242 HydrophobicContact CD1-CE1 4.01Å; L178-F242 HydrophobicContact CD1-CE2 3.75Å; L178-F242 HydrophobicContact CD1-CG 3.79Å; L178-F242 HydrophobicContact CD1-CZ 3.91Å; L178-F242 HydrophobicContact CD2-CZ 4.4Å
179	A	93.6	Very high	84.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142.4	-179.5	0	0	0	0	0	111.1	F162 D163 F164 L177 F187 Y188 V190	F162-A179 HydrophobicContact CB-CB 4.16Å; F162-A179 HydrophobicContact CD1-CB 4.02Å; F162-A179 HydrophobicContact CG-CB 4.43Å; D163-A179 CarbonylContact O-C 3.59Å; D163-A179 VanDerWaalsContact O-CA 3.26Å; D163-A179 WeakPolarHBondContact O-CA 3.44Å; F164-A179 HydrophobicContact CD1-CB 3.78Å; F164-A179 HydrophobicContact CE1-CB 4.1Å; L177-A179 PolarHBondContact O-N 3.48Å; A179-F187 CarbonylContact O-C 3.53Å; A179-F187 WeakPolarHBondContact O-CA 3.4Å; A179-Y188 PolarHBondContact N-O 3.25Å; A179-Y188 PolarHBondContact O-N 3.41Å; A179-V190 HydrophobicContact CB-CG2 3.67Å
180	K	94.8	Very high	85.2	Confident	83 Å²	83	57.6 Å²	57.6	36%	0.361	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	123.7	169.4	-171.5	-179.8	-176.5	-177.8	0	108.6	F162 D163 L165 G185 K186 F187	F162-K180 CarbonylContact C-O 3.54Å; F162-K180 WeakPolarHBondContact CA-O 3.48Å; D163-K180 HydrophobicContact CB-CB 4.46Å; D163-K180 PolarHBondContact N-O 2.84Å; D163-K180 PolarHBondContact O-N 3.36Å; L165-K180 HydrophobicContact CD1-CB 4.22Å; K180-G185 WeakPolarHBondContact CE-O 3.34Å; K180-G185 WeakPolarHBondContact CG-O 3.37Å; K180-K186 CarbonylContact C-O 3.56Å; K180-K186 WeakPolarHBondContact CA-O 3.39Å; K180-F187 HydrophobicContact CB-CD1 4.2Å; K180-F187 HydrophobicContact CB-CE1 4.15Å; K180-F187 HydrophobicContact CD-CE1 4.34Å; K180-F187 HydrophobicContact CD-CZ 4.22Å; K180-F187 HydrophobicContact CG-CE1 4.35Å
181	R	95.4	Very high	86	Confident	52 Å²	52	53.1 Å²	53.1	20%	0.196	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	130.6	175.8	-177	168.3	72.3	165.2	4.3	109.2	F162 L183 D184 G185 K186 Y188	F162-R181 HydrophobicContact CD1-CB 3.86Å; F162-R181 HydrophobicContact CD1-CG 4.34Å; F162-R181 HydrophobicContact CE1-CB 3.77Å; F162-R181 HydrophobicContact CE1-CG 4.07Å; R181-L183 VanDerWaalsContact C-N 3.35Å; R181-L183 HydrophobicContact CG-CB 4.42Å; R181-L183 PolarHBondContact O-N 3.2Å; R181-D184 WeakPolarHBondContact CB-OD1 3.48Å; R181-D184 IonicContact CZ-OD1 2.73Å; R181-D184 IonicContact CZ-OD2 3.69Å; R181-D184 VanDerWaalsContact NE-CG 3.29Å; R181-D184 IonicContact NE-OD1 2.71Å; R181-D184 PolarHBondContact NE-OD1 3.08Å; R181-D184 IonicContact NE-OD2 3.64Å; R181-D184 PolarHBondContact NE-OD2 3.34Å; R181-D184 VanDerWaalsContact NH2-CG 3.26Å; R181-D184 IonicContact NH2-OD1 3.67Å; R181-D184 IonicContact NH2-OD2 2.71Å; R181-D184 PolarHBondContact NH2-OD2 3.23Å; R181-G185 WeakPolarHBondContact O-CA 3.48Å; R181-G185 PolarHBondContact O-N 3.26Å; R181-K186 PolarHBondContact N-O 2.9Å; R181-Y188 HydrophobicContact CB-CD2 3.85Å; R181-Y188 HydrophobicContact CB-CE2 3.61Å; R181-Y188 HydrophobicContact CG-CE2 4.5Å; R181-Y188 PolarHBondContact NH2-OH 2.83Å
182	K	93.2	Very high	87.2	Confident	119 Å²	119	51.2 Å²	51.2	52%	0.517	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-35	-173.9	-69.8	176.7	179.7	168.2	0	113.2	T160 D161 D163	T160-K182 WeakPolarHBondContact O-CD 3.19Å; T160-K182 WeakPolarHBondContact O-CE 3.32Å; T160-K182 PolarHBondContact O-NZ 2.79Å; D161-K182 WeakPolarHBondContact O-CB 3.49Å; D161-K182 PolarHBondContact O-N 3.39Å; D163-K182 VanDerWaalsContact CG-CE 3.49Å; D163-K182 WeakPolarHBondContact OD1-CE 3.32Å; D163-K182 IonicContact OD1-NZ 2.62Å
183	L	90.9	Very high	88.5	Confident	155 Å²	155	46.1 Å²	46.1	81%	0.812	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-45.6	-174.5	-178.2	65.6	0	0	0	112.7	R181	R181-L183 VanDerWaalsContact C-N 3.35Å; R181-L183 HydrophobicContact CG-CB 4.42Å; R181-L183 PolarHBondContact O-N 3.2Å
184	D	92.9	Very high	89.3	Confident	55 Å²	55	47.8 Å²	47.8	29%	0.294	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-1.8	-173.9	68.2	-21.7	0	0	0	113.7	R181 K186 Y188	R181-D184 WeakPolarHBondContact CB-OD1 3.48Å; R181-D184 IonicContact CZ-OD1 2.73Å; R181-D184 IonicContact CZ-OD2 3.69Å; R181-D184 VanDerWaalsContact NE-CG 3.29Å; R181-D184 IonicContact NE-OD1 2.71Å; R181-D184 PolarHBondContact NE-OD1 3.08Å; R181-D184 IonicContact NE-OD2 3.64Å; R181-D184 PolarHBondContact NE-OD2 3.34Å; R181-D184 VanDerWaalsContact NH2-CG 3.26Å; R181-D184 IonicContact NH2-OD1 3.67Å; R181-D184 IonicContact NH2-OD2 2.71Å; R181-D184 PolarHBondContact NH2-OD2 3.23Å; D184-K186 HydrophobicContact CB-CG 4.4Å; D184-K186 PolarHBondContact O-N 3.07Å; D184-K186 VanDerWaalsContact O-N 3.17Å; D184-K186 PolarHBondContact OD1-N 3.42Å; D184-K186 VanDerWaalsContact OD2-CD 3.26Å; D184-K186 WeakPolarHBondContact OD2-CD 3.32Å; D184-K186 VanDerWaalsContact OD2-CG 3.32Å; D184-K186 WeakPolarHBondContact OD2-CG 3.35Å; D184-Y188 PolarHBondContact OD2-OH 2.9Å
185	G	92.1	Very high	89.4	Confident	28 Å²	28	46.9 Å²	46.9	29%	0.289	23%	0.228	S	C	.	.			trans	67.6	9.6	179.9	0	0	0	0	0	114.9	K180 R181	K180-G185 WeakPolarHBondContact CE-O 3.34Å; K180-G185 WeakPolarHBondContact CG-O 3.37Å; R181-G185 WeakPolarHBondContact O-CA 3.48Å; R181-G185 PolarHBondContact O-N 3.26Å
186	K	94.6	Very high	88.8	Confident	129 Å²	129	51 Å²	51	56%	0.561	25%	0.246	S	C	*	.			trans	-81.1	151.7	-178.4	-67.2	-171	-173	-179.2	0	112	K180 R181 D184 Y188	K180-K186 CarbonylContact C-O 3.56Å; K180-K186 WeakPolarHBondContact CA-O 3.39Å; R181-K186 PolarHBondContact N-O 2.9Å; D184-K186 HydrophobicContact CB-CG 4.4Å; D184-K186 PolarHBondContact O-N 3.07Å; D184-K186 VanDerWaalsContact O-N 3.17Å; D184-K186 PolarHBondContact OD1-N 3.42Å; D184-K186 VanDerWaalsContact OD2-CD 3.26Å; D184-K186 WeakPolarHBondContact OD2-CD 3.32Å; D184-K186 VanDerWaalsContact OD2-CG 3.32Å; D184-K186 WeakPolarHBondContact OD2-CG 3.35Å; K186-Y188 HydrophobicContact CB-CD2 4.49Å; K186-Y188 HydrophobicContact CB-CE2 3.68Å; K186-Y188 WeakPolarHBondContact O-CD2 3.06Å
187	F	93.8	Very high	87.8	Confident	101 Å²	101	51.7 Å²	51.7	44%	0.443	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	140.3	177.3	-65.6	-88.2	0	0	0	111.2	L165 L178 A179 K180 F242	L165-F187 HydrophobicContact CD1-CD1 3.99Å; L165-F187 HydrophobicContact CD1-CE1 3.55Å; L178-F187 HydrophobicContact CD1-CB 4.19Å; L178-F187 HydrophobicContact CD1-CD1 3.98Å; A179-F187 CarbonylContact O-C 3.53Å; A179-F187 WeakPolarHBondContact O-CA 3.4Å; K180-F187 HydrophobicContact CB-CD1 4.2Å; K180-F187 HydrophobicContact CB-CE1 4.15Å; K180-F187 HydrophobicContact CD-CE1 4.34Å; K180-F187 HydrophobicContact CD-CZ 4.22Å; K180-F187 HydrophobicContact CG-CE1 4.35Å; F187-F242 HydrophobicContact CB-CB 4.4Å; F187-F242 HydrophobicContact CB-CD1 4.08Å; F187-F242 HydrophobicContact CB-CG 4.49Å
188	Y	94.8	Very high	86.3	Confident	9 Å²	9	51.1 Å²	51.1	4%	0.035	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153.6	-177.7	-66.1	-82	0	0	0	110.6	F162 A179 R181 D184 K186 H227 V239	F162-Y188 HydrophobicContact CE1-CD2 4.14Å; A179-Y188 PolarHBondContact N-O 3.25Å; A179-Y188 PolarHBondContact O-N 3.41Å; R181-Y188 HydrophobicContact CB-CD2 3.85Å; R181-Y188 HydrophobicContact CB-CE2 3.61Å; R181-Y188 HydrophobicContact CG-CE2 4.5Å; R181-Y188 PolarHBondContact NH2-OH 2.83Å; D184-Y188 PolarHBondContact OD2-OH 2.9Å; K186-Y188 HydrophobicContact CB-CD2 4.49Å; K186-Y188 HydrophobicContact CB-CE2 3.68Å; K186-Y188 WeakPolarHBondContact O-CD2 3.06Å; Y188-H227 AromaticContact CE1-CD2 3.79Å; Y188-H227 AromaticContact CE1-CE1 3.84Å; Y188-H227 AromaticContact CE1-CG 3.85Å; Y188-H227 AromaticContact CE1-ND1 3.87Å; Y188-H227 AromaticContact CE1-NE2 3.77Å; Y188-V239 HydrophobicContact CD1-CG1 3.57Å; Y188-V239 HydrophobicContact CD2-CG1 4.48Å; Y188-V239 HydrophobicContact CE1-CG1 4.15Å; Y188-V239 HydrophobicContact CG-CG1 3.75Å
189	A	92.6	Very high	84.7	Confident	9 Å²	9	52.4 Å²	52.4	7%	0.074	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114.1	163.8	0	0	0	0	0	108.4	I168 V176 L177 L240	I168-A189 HydrophobicContact CD1-CB 3.95Å; V176-A189 HydrophobicContact CG1-CB 4Å; L177-A189 CarbonylContact O-C 3.57Å; A189-L240 HydrophobicContact CB-CB 4.27Å; A189-L240 PolarHBondContact N-O 3.14Å; A189-L240 WeakPolarHBondContact O-CA 3.35Å; A189-L240 VanDerWaalsContact O-CB 3.32Å; A189-L240 WeakPolarHBondContact O-CB 2.98Å; A189-L240 PolarHBondContact O-N 2.9Å
190	V	92.3	Very high	82.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	107	-179	-175.4	0	0	0	0	109.5	F162 F164 V176 L177 A179 V192 Y237 F238	F162-V190 HydrophobicContact CD1-CG2 4.42Å; F162-V190 HydrophobicContact CE1-CG2 4.34Å; F164-V190 HydrophobicContact CE1-CB 4.18Å; F164-V190 HydrophobicContact CE1-CG1 4.13Å; F164-V190 HydrophobicContact CE1-CG2 4.36Å; V176-V190 WeakPolarHBondContact CA-O 3.34Å; L177-V190 PolarHBondContact N-O 2.96Å; L177-V190 PolarHBondContact O-N 3.29Å; A179-V190 HydrophobicContact CB-CG2 3.67Å; V190-V192 HydrophobicContact CG1-CG2 4.09Å; V190-Y237 HydrophobicContact CG1-CD1 3.96Å; V190-F238 CarbonylContact C-O 3.56Å; V190-F238 WeakPolarHBondContact CA-O 3.38Å
191	K	87.8	Confident	80.7	Confident	21 Å²	21	64.2 Å²	64.2	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122.3	173.5	-170.4	172.7	-173.2	178.3	0	109.3	V176 L193 E210 Y237 F238 L240 D304	V176-K191 HydrophobicContact CG2-CB 4.26Å; V176-K191 HydrophobicContact CG2-CG 4.09Å; K191-L193 HydrophobicContact CD-CD1 4.37Å; K191-L193 HydrophobicContact CG-CD1 3.94Å; K191-E210 VanDerWaalsContact CE-OE1 3.24Å; K191-E210 WeakPolarHBondContact CE-OE1 3.2Å; K191-E210 IonicContact NZ-OE1 2.69Å; K191-E210 PolarHBondContact NZ-OE1 3.48Å; K191-E210 IonicContact NZ-OE2 2.86Å; K191-Y237 CarbonylContact O-C 3.55Å; K191-Y237 WeakPolarHBondContact O-CA 3.31Å; K191-F238 HydrophobicContact CB-CB 4.27Å; K191-F238 PolarHBondContact N-O 2.88Å; K191-F238 PolarHBondContact O-N 2.87Å; K191-L240 HydrophobicContact CB-CD1 4.13Å; K191-D304 IonicContact NZ-OD1 3.31Å; K191-D304 PolarHBondContact NZ-OD1 3.37Å
192	V	87.6	Confident	78.6	Confident	10 Å²	10	72 Å²	72	6%	0.061	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	119.5	-176.8	-172.2	0	0	0	0	109.5	G174 K175 L177 V190 K235 L236 Y237	G174-V192 WeakPolarHBondContact CA-O 3.24Å; K175-V192 HydrophobicContact CG-CB 4.47Å; K175-V192 PolarHBondContact N-O 2.87Å; K175-V192 PolarHBondContact O-N 3Å; L177-V192 HydrophobicContact CD1-CG2 3.87Å; L177-V192 HydrophobicContact CG-CG2 4.5Å; V190-V192 HydrophobicContact CG1-CG2 4.09Å; V192-K235 HydrophobicContact CG1-CB 4.24Å; V192-K235 HydrophobicContact CG1-CD 4.01Å; V192-K235 HydrophobicContact CG1-CG 4.4Å; V192-L236 WeakPolarHBondContact CA-O 3.36Å; V192-Y237 HydrophobicContact CB-CD1 4.49Å; V192-Y237 HydrophobicContact CB-CE1 4.44Å; V192-Y237 HydrophobicContact CG1-CD1 4.22Å; V192-Y237 HydrophobicContact CG1-CE1 3.83Å; V192-Y237 HydrophobicContact CG2-CD1 3.71Å; V192-Y237 HydrophobicContact CG2-CE1 3.75Å
193	L	79.7	Confident	76.4	Confident	2 Å²	2	70 Å²	70	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	144	177.1	-57.3	91.5	0	0	0	111	F173 K191 V198 K235 L236 F238	F173-L193 HydrophobicContact CB-CD2 3.99Å; K191-L193 HydrophobicContact CD-CD1 4.37Å; K191-L193 HydrophobicContact CG-CD1 3.94Å; L193-V198 HydrophobicContact CB-CG2 4.41Å; L193-K235 CarbonylContact O-C 3.58Å; L193-K235 VanDerWaalsContact O-CA 3.27Å; L193-K235 WeakPolarHBondContact O-CA 3.48Å; L193-L236 HydrophobicContact CB-CB 4.44Å; L193-L236 PolarHBondContact N-O 2.71Å; L193-L236 PolarHBondContact O-N 2.87Å; L193-F238 HydrophobicContact CD1-CD2 3.6Å; L193-F238 HydrophobicContact CD1-CE2 3.56Å
194	Q	76.5	Confident	74.4	Confident	68 Å²	68	66 Å²	66	32%	0.318	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.3	178.2	-58.2	-173	11.3	0	0	111.1	E130 K196 I197 V198	E130-Q194 PolarHBondContact OE1-NE2 2.91Å; Q194-K196 PolarHBondContact O-N 2.81Å; Q194-I197 HydrophobicContact CB-CD1 4.01Å; Q194-I197 HydrophobicContact CB-CG1 4.1Å; Q194-I197 HydrophobicContact CG-CD1 4.29Å; Q194-I197 PolarHBondContact O-N 3.39Å; Q194-I197 VanDerWaalsContact O-N 3.09Å; Q194-V198 WeakPolarHBondContact O-CG2 3.35Å; Q194-V198 PolarHBondContact O-N 3.13Å; Q194-V198 VanDerWaalsContact O-N 3.1Å
195	K	76.4	Confident	72.3	Confident	6 Å²	6	72.1 Å²	72.1	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-59.2	-33.1	-179.5	-72.3	-179.6	172.9	-178.7	0	112.9	I147 I197 V198 L199 T232 T233 E234 L236	I147-K195 HydrophobicContact CD1-CD 4.26Å; I147-K195 HydrophobicContact CD1-CG 4.01Å; K195-I197 VanDerWaalsContact C-N 3.29Å; K195-I197 PolarHBondContact O-N 2.91Å; K195-V198 CarbonylContact O-C 3.53Å; K195-V198 PolarHBondContact O-N 2.85Å; K195-V198 VanDerWaalsContact O-N 3.17Å; K195-L199 HydrophobicContact CB-CD1 4.26Å; K195-L199 VanDerWaalsContact O-CB 3.24Å; K195-L199 WeakPolarHBondContact O-CB 3Å; K195-L199 WeakPolarHBondContact O-CG 3.35Å; K195-L199 PolarHBondContact O-N 3.01Å; K195-T232 VanDerWaalsContact CE-O 3.25Å; K195-T232 WeakPolarHBondContact CE-O 3.27Å; K195-T232 PolarHBondContact NZ-O 3.43Å; K195-T233 WeakPolarHBondContact CD-O 3.48Å; K195-E234 VanDerWaalsContact CB-O 3.3Å; K195-E234 WeakPolarHBondContact CB-O 3.28Å; K195-E234 WeakPolarHBondContact CG-O 3.33Å; K195-E234 PolarHBondContact N-O 2.87Å; K195-L236 HydrophobicContact CG-CD2 4.4Å; K195-L236 HydrophobicContact CG-CG 4.18Å
196	K	71.6	Confident	70.2	Confident	148 Å²	148	74.2 Å²	74.2	64%	0.643	33%	0.333	S	S	*	.	H	α-helix	trans	-59.7	-40.2	177.3	-170.8	-178.6	178.7	-173.7	0	111.9	Q194 N200	Q194-K196 PolarHBondContact O-N 2.81Å; K196-N200 PolarHBondContact O-N 2.74Å
197	I	64.3	Low	68.2	Low	49 Å²	49	68.4 Å²	68.4	25%	0.251	31%	0.307	S	S	.	.	H	α-helix	trans	-70	-44.8	174.8	-57	176.2	0	0	0	109.5	F173 Q194 K195 L199 N200	F173-I197 HydrophobicContact CD1-CG2 4.18Å; Q194-I197 HydrophobicContact CB-CD1 4.01Å; Q194-I197 HydrophobicContact CB-CG1 4.1Å; Q194-I197 HydrophobicContact CG-CD1 4.29Å; Q194-I197 PolarHBondContact O-N 3.39Å; Q194-I197 VanDerWaalsContact O-N 3.09Å; K195-I197 VanDerWaalsContact C-N 3.29Å; K195-I197 PolarHBondContact O-N 2.91Å; I197-L199 VanDerWaalsContact C-N 3.28Å; I197-L199 PolarHBondContact O-N 3.09Å; I197-N200 PolarHBondContact O-N 3.32Å
198	V	57.2	Low	66.2	Low	2 Å²	2	66.1 Å²	66.1	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-36.6	176.1	-178.1	0	0	0	0	113.5	I147 L193 Q194 K195 Q204 I207 M208 L236	I147-V198 HydrophobicContact CD1-CG1 4.42Å; L193-V198 HydrophobicContact CB-CG2 4.41Å; Q194-V198 WeakPolarHBondContact O-CG2 3.35Å; Q194-V198 PolarHBondContact O-N 3.13Å; Q194-V198 VanDerWaalsContact O-N 3.1Å; K195-V198 CarbonylContact O-C 3.53Å; K195-V198 PolarHBondContact O-N 2.85Å; K195-V198 VanDerWaalsContact O-N 3.17Å; V198-Q204 WeakPolarHBondContact O-CG 3.5Å; V198-I207 HydrophobicContact CB-CD1 4.23Å; V198-I207 HydrophobicContact CB-CG2 4.16Å; V198-I207 HydrophobicContact CG1-CB 4.18Å; V198-I207 HydrophobicContact CG1-CD1 4.43Å; V198-I207 HydrophobicContact CG1-CG2 3.52Å; V198-I207 HydrophobicContact CG2-CD1 4.12Å; V198-I207 HydrophobicContact CG2-CG2 3.78Å; V198-M208 HydrophobicContact CG1-CE 4.28Å; V198-L236 HydrophobicContact CG2-CD1 4.42Å
199	L	56.6	Low	64.2	Low	55 Å²	55	66.5 Å²	66.5	29%	0.288	30%	0.304	S	S	.	.	H	α-helix	trans	-88.8	-6.8	-174.3	-67.1	170.2	0	0	0	113.2	K195 I197 R201 Q204	K195-L199 HydrophobicContact CB-CD1 4.26Å; K195-L199 VanDerWaalsContact O-CB 3.24Å; K195-L199 WeakPolarHBondContact O-CB 3Å; K195-L199 WeakPolarHBondContact O-CG 3.35Å; K195-L199 PolarHBondContact O-N 3.01Å; I197-L199 VanDerWaalsContact C-N 3.28Å; I197-L199 PolarHBondContact O-N 3.09Å; L199-R201 PolarHBondContact O-N 2.93Å; L199-Q204 PolarHBondContact O-NE2 2.69Å
200	N	56.2	Low	62.3	Low	103 Å²	103	66.3 Å²	66.3	55%	0.551	30%	0.301	S	S	*	.	S	Bend	trans	-69.4	121.2	171.7	-96.5	-20.4	0	0	0	110.5	K196 I197 K202 E203	K196-N200 PolarHBondContact O-N 2.74Å; I197-N200 PolarHBondContact O-N 3.32Å; N200-K202 PolarHBondContact O-N 2.78Å; N200-E203 PolarHBondContact O-N 3.08Å; N200-E203 VanDerWaalsContact O-N 3.16Å
201	R	48	Very low	60.6	Low	228 Å²	228	68.2 Å²	68.2	86%	0.86	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-18.7	-165.8	-74.2	-176.9	177.5	-175.9	-0.5	116.3	L199	L199-R201 PolarHBondContact O-N 2.93Å
202	K	51.7	Low	59.3	Low	215 Å²	215	70.4 Å²	70.4	94%	0.935	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-23.4	179.8	-76.1	-176	176.6	-180	0	113.6	N200	N200-K202 PolarHBondContact O-N 2.78Å
203	E	46.8	Very low	57.9	Low	77 Å²	77	70 Å²	70	36%	0.36	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-2.9	-172.8	-65.2	-176.3	154	0	0	114.4	F173 N200 K205 H206 I207	F173-E203 HydrophobicContact CE1-CG 4.49Å; F173-E203 VanDerWaalsContact CE1-OE2 3.28Å; F173-E203 WeakPolarHBondContact CE1-OE2 3.43Å; N200-E203 PolarHBondContact O-N 3.08Å; N200-E203 VanDerWaalsContact O-N 3.16Å; E203-K205 PolarHBondContact O-N 2.95Å; E203-H206 PolarHBondContact O-N 2.93Å; E203-I207 HydrophobicContact CB-CD1 4.3Å; E203-I207 PolarHBondContact O-N 2.98Å
204	Q	48.2	Very low	56.8	Low	72 Å²	72	70.4 Å²	70.4	34%	0.336	32%	0.321	S	S	.	.	H	α-helix	trans	-50.1	-37	-179.6	-79.1	-176.8	-34.5	0	0	113.5	V198 L199 H206 M208	V198-Q204 WeakPolarHBondContact O-CG 3.5Å; L199-Q204 PolarHBondContact O-NE2 2.69Å; Q204-H206 PolarHBondContact O-N 3.22Å; Q204-M208 VanDerWaalsContact O-CB 3.24Å; Q204-M208 WeakPolarHBondContact O-CB 2.93Å; Q204-M208 WeakPolarHBondContact O-CG 3.1Å; Q204-M208 PolarHBondContact O-N 3.41Å
205	K	49.6	Very low	55.7	Low	182 Å²	182	68 Å²	68	79%	0.791	31%	0.31	S	S	*	.	H	α-helix	trans	-67.3	-33.8	-179.1	-69.7	-177.6	178.9	179.1	0	113.4	E203 A209	E203-K205 PolarHBondContact O-N 2.95Å; K205-A209 PolarHBondContact O-N 2.96Å
206	H	48.8	Very low	55	Low	73 Å²	73	72.9 Å²	72.9	34%	0.338	33%	0.332	S	S	.	.	H	α-helix	trans	-76.4	-44.1	-177.4	-72.9	-140.1	0	0	0	110.4	E203 Q204 A209 E210	E203-H206 PolarHBondContact O-N 2.93Å; Q204-H206 PolarHBondContact O-N 3.22Å; H206-A209 WeakPolarHBondContact O-CB 3.2Å; H206-A209 PolarHBondContact O-N 3.36Å; H206-E210 PolarHBondContact O-N 2.84Å; H206-E210 VanDerWaalsContact O-N 3.08Å
207	I	51.3	Low	54.7	Low	6 Å²	6	69.2 Å²	69.2	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-75.1	-30.2	-177.1	-59.8	162.9	0	0	0	111.5	F173 V198 E203 A209 R211	F173-I207 HydrophobicContact CD1-CD1 4.02Å; F173-I207 HydrophobicContact CD1-CG1 4.44Å; F173-I207 HydrophobicContact CG-CD1 4.37Å; F173-I207 HydrophobicContact CG-CG1 4.45Å; V198-I207 HydrophobicContact CB-CD1 4.23Å; V198-I207 HydrophobicContact CB-CG2 4.16Å; V198-I207 HydrophobicContact CG1-CB 4.18Å; V198-I207 HydrophobicContact CG1-CD1 4.43Å; V198-I207 HydrophobicContact CG1-CG2 3.52Å; V198-I207 HydrophobicContact CG2-CD1 4.12Å; V198-I207 HydrophobicContact CG2-CG2 3.78Å; E203-I207 HydrophobicContact CB-CD1 4.3Å; E203-I207 PolarHBondContact O-N 2.98Å; I207-A209 VanDerWaalsContact C-N 3.3Å; I207-R211 WeakPolarHBondContact O-CB 3.5Å; I207-R211 PolarHBondContact O-N 3.35Å
208	M	53.1	Low	55.2	Low	54 Å²	54	67.7 Å²	67.7	27%	0.266	31%	0.312	S	S	.	.	H	α-helix	trans	-68.7	-29.4	171.1	-68.3	-68.8	147.2	0	0	112.3	V198 Q204 R211 N212	V198-M208 HydrophobicContact CG1-CE 4.28Å; Q204-M208 VanDerWaalsContact O-CB 3.24Å; Q204-M208 WeakPolarHBondContact O-CB 2.93Å; Q204-M208 WeakPolarHBondContact O-CG 3.1Å; Q204-M208 PolarHBondContact O-N 3.41Å; M208-R211 PolarHBondContact SD-NH1 2.85Å; M208-N212 WeakPolarHBondContact O-CB 3.3Å; M208-N212 PolarHBondContact O-N 2.81Å; M208-N212 PolarHBondContact O-ND2 3.26Å; M208-N212 PolarHBondContact O-OD1 3.43Å
209	A	51.6	Low	56.4	Low	17 Å²	17	74.7 Å²	74.7	14%	0.14	34%	0.342	C	S	.	.	H	α-helix	trans	-73.6	-45.5	174.7	0	0	0	0	0	111.7	K205 H206 I207 R211 N212 V213 C308	K205-A209 PolarHBondContact O-N 2.96Å; H206-A209 WeakPolarHBondContact O-CB 3.2Å; H206-A209 PolarHBondContact O-N 3.36Å; I207-A209 VanDerWaalsContact C-N 3.3Å; A209-R211 VanDerWaalsContact C-N 3.29Å; A209-R211 PolarHBondContact O-N 3.5Å; A209-N212 PolarHBondContact O-N 3.45Å; A209-V213 WeakPolarHBondContact O-CG2 3.47Å; A209-V213 PolarHBondContact O-N 2.68Å; A209-C308 VanDerWaalsContact CB-O 3.27Å; A209-C308 WeakPolarHBondContact CB-O 3.43Å
210	E	52.8	Low	58	Low	4 Å²	4	73.8 Å²	73.8	2%	0.019	34%	0.336	C	S	.	.	H	α-helix	trans	-55.5	-47	171.2	178.2	178	-179.4	0	0	111.1	K191 H206 L214 G306	K191-E210 VanDerWaalsContact CE-OE1 3.24Å; K191-E210 WeakPolarHBondContact CE-OE1 3.2Å; K191-E210 IonicContact NZ-OE1 2.69Å; K191-E210 PolarHBondContact NZ-OE1 3.48Å; K191-E210 IonicContact NZ-OE2 2.86Å; H206-E210 PolarHBondContact O-N 2.84Å; H206-E210 VanDerWaalsContact O-N 3.08Å; E210-L214 HydrophobicContact CG-CD1 3.85Å; E210-L214 WeakPolarHBondContact O-CB 3.4Å; E210-L214 WeakPolarHBondContact O-CG 3.48Å; E210-L214 PolarHBondContact O-N 2.62Å; E210-G306 VanDerWaalsContact CD-CA 3.43Å; E210-G306 WeakPolarHBondContact OE2-CA 3.37Å
211	R	57.7	Low	59.8	Low	40 Å²	40	73.6 Å²	73.6	15%	0.151	34%	0.341	C	S	.	.	H	α-helix	trans	-56.8	-57.3	174.4	174.8	176.5	164.1	-137.5	-12.7	110.1	I147 N148 I207 M208 A209 V213 L214 L215	I147-R211 VanDerWaalsContact CG2-CZ 3.49Å; N148-R211 PolarHBondContact O-NE 2.93Å; N148-R211 PolarHBondContact O-NH2 3.03Å; I207-R211 WeakPolarHBondContact O-CB 3.5Å; I207-R211 PolarHBondContact O-N 3.35Å; M208-R211 PolarHBondContact SD-NH1 2.85Å; A209-R211 VanDerWaalsContact C-N 3.29Å; A209-R211 PolarHBondContact O-N 3.5Å; R211-V213 VanDerWaalsContact C-N 3.29Å; R211-V213 PolarHBondContact O-N 3.43Å; R211-L214 PolarHBondContact O-N 2.88Å; R211-L215 HydrophobicContact CG-CD1 3.44Å; R211-L215 VanDerWaalsContact CG-CD1 3.44Å; R211-L215 HydrophobicContact CG-CG 3.83Å; R211-L215 WeakPolarHBondContact O-CB 3.39Å; R211-L215 WeakPolarHBondContact O-CG 3.31Å; R211-L215 PolarHBondContact O-N 3.32Å
212	N	59.6	Low	62	Low	68 Å²	68	64.5 Å²	64.5	36%	0.364	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-37.8	-174.5	-69.2	-12.9	0	0	0	113.1	M208 A209 L215 K216 E310	M208-N212 WeakPolarHBondContact O-CB 3.3Å; M208-N212 PolarHBondContact O-N 2.81Å; M208-N212 PolarHBondContact O-ND2 3.26Å; M208-N212 PolarHBondContact O-OD1 3.43Å; A209-N212 PolarHBondContact O-N 3.45Å; N212-L215 PolarHBondContact O-N 3.13Å; N212-K216 WeakPolarHBondContact O-CG 3.25Å; N212-K216 PolarHBondContact O-N 2.62Å; N212-E310 WeakPolarHBondContact CB-OE1 3.09Å
213	V	57.8	Low	63.8	Low	1 Å²	1	54.7 Å²	54.7	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-67.9	-48.4	177.8	169.5	0	0	0	0	111.4	A209 R211 L215 K216 I282 F305 C308 E310	A209-V213 WeakPolarHBondContact O-CG2 3.47Å; A209-V213 PolarHBondContact O-N 2.68Å; R211-V213 VanDerWaalsContact C-N 3.29Å; R211-V213 PolarHBondContact O-N 3.43Å; V213-L215 VanDerWaalsContact C-N 3.29Å; V213-L215 PolarHBondContact O-N 3Å; V213-K216 PolarHBondContact O-N 3.06Å; V213-I282 HydrophobicContact CG1-CD1 4.12Å; V213-I282 HydrophobicContact CG1-CG2 4.04Å; V213-I282 HydrophobicContact CG2-CD1 4.16Å; V213-I282 HydrophobicContact CG2-CG1 4.34Å; V213-I282 HydrophobicContact CG2-CG2 3.86Å; V213-F305 HydrophobicContact CG1-CB 4.1Å; V213-F305 HydrophobicContact CG1-CD1 3.99Å; V213-F305 HydrophobicContact CG1-CG 4.21Å; V213-C308 HydrophobicContact CB-CB 4.22Å; V213-C308 HydrophobicContact CG1-CB 4.09Å; V213-C308 HydrophobicContact CG2-CB 3.74Å; V213-E310 WeakPolarHBondContact CA-OE1 3.48Å; V213-E310 HydrophobicContact CG2-CG 3.53Å; V213-E310 WeakPolarHBondContact CG2-OE1 3.29Å; V213-E310 PolarHBondContact N-OE1 2.93Å
214	L	57.1	Low	65.8	Low	11 Å²	11	51.5 Å²	51.5	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-63	-37.2	175	-74.7	175.2	0	0	0	111.4	E210 R211 K216 N217 L226 F238 L240 F305	E210-L214 HydrophobicContact CG-CD1 3.85Å; E210-L214 WeakPolarHBondContact O-CB 3.4Å; E210-L214 WeakPolarHBondContact O-CG 3.48Å; E210-L214 PolarHBondContact O-N 2.62Å; R211-L214 PolarHBondContact O-N 2.88Å; L214-K216 VanDerWaalsContact C-N 3.3Å; L214-K216 PolarHBondContact O-N 3.32Å; L214-N217 PolarHBondContact O-N 3.1Å; L214-L226 HydrophobicContact CB-CD2 4.11Å; L214-L226 WeakPolarHBondContact O-CD2 3.38Å; L214-F238 HydrophobicContact CB-CD1 4.45Å; L214-F238 HydrophobicContact CB-CE1 4.33Å; L214-F238 HydrophobicContact CD1-CD1 3.86Å; L214-F238 HydrophobicContact CD1-CE1 4.02Å; L214-F238 HydrophobicContact CD1-CG 4.34Å; L214-L240 HydrophobicContact CD2-CD2 4.38Å; L214-F305 HydrophobicContact CD2-CB 4.35Å; L214-F305 HydrophobicContact CD2-CD2 3.65Å; L214-F305 HydrophobicContact CD2-CE2 4.36Å; L214-F305 HydrophobicContact CD2-CG 4.32Å; L214-F305 HydrophobicContact CG-CB 4.38Å
215	L	53.6	Low	67.7	Low	17 Å²	17	49 Å²	49	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-70.8	-19.5	178.5	-71	-169.8	0	0	0	114	L149 T152 R211 N212 V213 N217	L149-L215 VanDerWaalsContact C-CD2 3.4Å; L149-L215 WeakPolarHBondContact O-CD2 3.47Å; T152-L215 WeakPolarHBondContact OG1-CD2 3.22Å; R211-L215 HydrophobicContact CG-CD1 3.44Å; R211-L215 VanDerWaalsContact CG-CD1 3.44Å; R211-L215 HydrophobicContact CG-CG 3.83Å; R211-L215 WeakPolarHBondContact O-CB 3.39Å; R211-L215 WeakPolarHBondContact O-CG 3.31Å; R211-L215 PolarHBondContact O-N 3.32Å; N212-L215 PolarHBondContact O-N 3.13Å; V213-L215 VanDerWaalsContact C-N 3.29Å; V213-L215 PolarHBondContact O-N 3Å; L215-N217 PolarHBondContact O-N 3.46Å
216	K	62	Low	69.4	Low	109 Å²	109	41.1 Å²	41.1	47%	0.474	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-2.6	175.1	-81	177.2	-171.3	173.4	0	113.7	N212 V213 L214 V218 I282 E310	N212-K216 WeakPolarHBondContact O-CG 3.25Å; N212-K216 PolarHBondContact O-N 2.62Å; V213-K216 PolarHBondContact O-N 3.06Å; L214-K216 VanDerWaalsContact C-N 3.3Å; L214-K216 PolarHBondContact O-N 3.32Å; K216-V218 VanDerWaalsContact C-N 3.33Å; K216-V218 HydrophobicContact CB-CG2 4.31Å; K216-V218 PolarHBondContact O-N 3.02Å; K216-I282 HydrophobicContact CD-CD1 4.41Å; K216-E310 WeakPolarHBondContact CD-OE1 3.45Å; K216-E310 WeakPolarHBondContact CE-OE1 3.41Å; K216-E310 WeakPolarHBondContact CE-OE2 2.97Å; K216-E310 IonicContact NZ-OE1 3.69Å; K216-E310 PolarHBondContact NZ-OE1 3.34Å; K216-E310 IonicContact NZ-OE2 3.35Å; K216-E310 PolarHBondContact NZ-OE2 3.05Å
217	N	64.3	Low	71.3	Confident	71 Å²	71	41.8 Å²	41.8	38%	0.38	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	52.1	179	-167.2	18.5	0	0	0	111.4	L214 L215 K219	L214-N217 PolarHBondContact O-N 3.1Å; L215-N217 PolarHBondContact O-N 3.46Å; N217-K219 WeakPolarHBondContact ND2-CE 3.37Å; N217-K219 PolarHBondContact O-N 3.26Å; N217-K219 WeakPolarHBondContact OD1-CE 3.47Å
218	V	76.3	Confident	73.1	Confident	17 Å²	17	42.9 Å²	42.9	10%	0.103	22%	0.218	C	C	.	.			trans	-60.9	121.7	177.7	179.3	0	0	0	0	108.5	K216 L223 Y276 L277 I280 I282	K216-V218 VanDerWaalsContact C-N 3.33Å; K216-V218 HydrophobicContact CB-CG2 4.31Å; K216-V218 PolarHBondContact O-N 3.02Å; V218-L223 HydrophobicContact CG1-CD1 3.45Å; V218-L223 VanDerWaalsContact CG1-CD1 3.45Å; V218-Y276 HydrophobicContact CG1-CD1 4.22Å; V218-Y276 HydrophobicContact CG1-CE1 3.45Å; V218-Y276 VanDerWaalsContact CG1-CE1 3.45Å; V218-L277 HydrophobicContact CG1-CD2 3.79Å; V218-I280 HydrophobicContact CG1-CD1 4.14Å; V218-I280 HydrophobicContact CG2-CD1 3.99Å; V218-I282 HydrophobicContact CG2-CD1 3.91Å
219	K	82.5	Confident	74.6	Confident	149 Å²	149	40.3 Å²	40.3	65%	0.648	21%	0.205	S	C	*	.			trans	-121.1	112.8	-177.2	-72.3	-176.4	-178	-174.1	0	110.3	N217 Y276	N217-K219 WeakPolarHBondContact ND2-CE 3.37Å; N217-K219 PolarHBondContact O-N 3.26Å; N217-K219 WeakPolarHBondContact OD1-CE 3.47Å; K219-Y276 PolarHBondContact O-OH 3.02Å
220	H	89.9	Confident	76.5	Confident	36 Å²	36	39.5 Å²	39.5	17%	0.167	20%	0.199	C	C	.	.			trans	-152	142.4	176.4	-168.2	-91	0	0	0	109	F222 L223 S272 Y276	H220-F222 AromaticContact CE1-CD2 3.58Å; H220-F222 PolarHBondContact ND1-N 3.08Å; H220-F222 PolarHBondContact O-N 3.4Å; H220-F222 VanDerWaalsContact O-N 3.13Å; H220-L223 HydrophobicContact CB-CB 3.99Å; H220-L223 HydrophobicContact CB-CD1 3.67Å; H220-L223 HydrophobicContact CB-CG 3.74Å; H220-L223 PolarHBondContact O-N 3.19Å; H220-L223 VanDerWaalsContact O-N 3.09Å; H220-S272 PolarHBondContact CE1-OG 3.38Å; H220-S272 PolarHBondContact NE2-OG 3.01Å; H220-Y276 HydrophobicContact CB-CD1 3.62Å; H220-Y276 HydrophobicContact CB-CE1 3.8Å; H220-Y276 HydrophobicContact CB-CG 4.42Å; H220-Y276 AromaticContact CD2-CD1 3.65Å; H220-Y276 AromaticContact CD2-CG 3.57Å; H220-Y276 AromaticContact CG-CD1 3.82Å
221	P	92.9	Very high	78.1	Confident	99 Å²	99	41.6 Å²	41.6	64%	0.643	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.1	-176.8	20.6	-34.2	0	0	0	114.1
222	F	94.1	Very high	79.6	Confident	36 Å²	36	41.8 Å²	41.8	16%	0.158	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	17	-177.9	-48.2	-46.4	0	0	0	114.1	H220 E269 A273 H299 V300 L302	H220-F222 AromaticContact CE1-CD2 3.58Å; H220-F222 PolarHBondContact ND1-N 3.08Å; H220-F222 PolarHBondContact O-N 3.4Å; H220-F222 VanDerWaalsContact O-N 3.13Å; F222-E269 HydrophobicContact CD1-CB 4.23Å; F222-E269 HydrophobicContact CD1-CG 4.35Å; F222-E269 HydrophobicContact CD2-CB 3.8Å; F222-E269 HydrophobicContact CD2-CG 4.26Å; F222-E269 WeakPolarHBondContact CD2-O 3.17Å; F222-E269 HydrophobicContact CE1-CB 4.28Å; F222-E269 HydrophobicContact CE1-CG 3.92Å; F222-E269 WeakPolarHBondContact CE1-OE1 3.26Å; F222-E269 HydrophobicContact CE2-CB 3.88Å; F222-E269 HydrophobicContact CE2-CG 3.85Å; F222-E269 HydrophobicContact CG-CB 4.01Å; F222-E269 HydrophobicContact CZ-CB 4.12Å; F222-E269 HydrophobicContact CZ-CG 3.66Å; F222-A273 HydrophobicContact CB-CB 4.04Å; F222-H299 HydrophobicContact CE1-CB 4.35Å; F222-V300 VanDerWaalsContact CA-O 3.27Å; F222-V300 WeakPolarHBondContact CA-O 3.11Å; F222-V300 WeakPolarHBondContact CB-O 3.23Å; F222-V300 WeakPolarHBondContact CD1-O 3.32Å; F222-L302 PolarHBondContact O-N 3.37Å
223	L	89.8	Confident	80.9	Confident	10 Å²	10	42.9 Å²	42.9	5%	0.052	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-119.8	137	175.2	-68.4	-175.9	0	0	0	109	V218 H220 G225 A273 Y276 L277 L302 F305	V218-L223 HydrophobicContact CG1-CD1 3.45Å; V218-L223 VanDerWaalsContact CG1-CD1 3.45Å; H220-L223 HydrophobicContact CB-CB 3.99Å; H220-L223 HydrophobicContact CB-CD1 3.67Å; H220-L223 HydrophobicContact CB-CG 3.74Å; H220-L223 PolarHBondContact O-N 3.19Å; H220-L223 VanDerWaalsContact O-N 3.09Å; L223-G225 PolarHBondContact O-N 3.37Å; L223-A273 HydrophobicContact CD2-CB 3.88Å; L223-A273 HydrophobicContact CG-CB 4.27Å; L223-Y276 HydrophobicContact CD1-CD1 3.94Å; L223-Y276 HydrophobicContact CD1-CE1 4.2Å; L223-L277 HydrophobicContact CD1-CD1 4.38Å; L223-L277 HydrophobicContact CD1-CD2 3.74Å; L223-L277 HydrophobicContact CD1-CG 3.95Å; L223-L277 HydrophobicContact CD2-CD1 4.17Å; L223-L302 HydrophobicContact CD2-CB 3.81Å; L223-L302 HydrophobicContact CD2-CD1 3.96Å; L223-L302 HydrophobicContact CD2-CG 4.27Å; L223-F305 HydrophobicContact CB-CZ 4.06Å; L223-F305 HydrophobicContact CD1-CE1 4.4Å; L223-F305 HydrophobicContact CD1-CZ 4.34Å; L223-F305 HydrophobicContact CD2-CE1 4.02Å; L223-F305 HydrophobicContact CD2-CZ 3.92Å; L223-F305 HydrophobicContact CG-CZ 4.32Å
224	V	89.4	Confident	82.1	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.055	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-61.7	129.1	177.6	67.1	0	0	0	0	111	L240 D241 V301 L302 T303 F305	V224-L240 HydrophobicContact CG2-CB 4.11Å; V224-D241 HydrophobicContact CG2-CB 4.09Å; V224-V301 HydrophobicContact CB-CG1 3.95Å; V224-L302 WeakPolarHBondContact CG1-O 3.49Å; V224-L302 PolarHBondContact N-O 3.28Å; V224-T303 HydrophobicContact CB-CG2 4.14Å; V224-T303 HydrophobicContact CG1-CG2 4.29Å; V224-F305 HydrophobicContact CG1-CD2 4.32Å; V224-F305 HydrophobicContact CG1-CE2 3.61Å; V224-F305 HydrophobicContact CG1-CZ 4.48Å
225	G	86.9	Confident	83.4	Confident	19 Å²	19	50.3 Å²	50.3	20%	0.196	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-77.7	138.3	179.8	0	0	0	0	0	112.4	L223 L240 D241	L223-G225 PolarHBondContact O-N 3.37Å; G225-L240 CarbonylContact O-C 3.58Å; G225-L240 VanDerWaalsContact O-CA 3.26Å; G225-L240 WeakPolarHBondContact O-CA 3.29Å; G225-D241 VanDerWaalsContact CA-OD2 3.23Å; G225-D241 WeakPolarHBondContact CA-OD2 3.38Å; G225-D241 PolarHBondContact N-OD2 3.47Å; G225-D241 PolarHBondContact O-N 3.08Å
226	L	86.9	Confident	84.9	Confident	18 Å²	18	49.7 Å²	49.7	9%	0.094	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.2	166.3	177.7	68.9	0	0	0	109.4	T152 L214 Y228 F238 L240	T152-L226 HydrophobicContact CG2-CD2 3.88Å; L214-L226 HydrophobicContact CB-CD2 4.11Å; L214-L226 WeakPolarHBondContact O-CD2 3.38Å; L226-Y228 WeakPolarHBondContact CD1-O 3.37Å; L226-F238 HydrophobicContact CD1-CB 3.99Å; L226-F238 HydrophobicContact CD1-CD1 4.14Å; L226-F238 HydrophobicContact CD2-CD1 4.44Å; L226-L240 HydrophobicContact CB-CD2 4.12Å; L226-L240 HydrophobicContact CD1-CD2 3.88Å; L226-L240 HydrophobicContact CD1-CG 4.48Å
227	H	87.9	Confident	86.2	Confident	87 Å²	87	45.4 Å²	45.4	40%	0.403	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-54.9	175.6	-71.4	-100.6	0	0	0	111	Y188 V239 D241	Y188-H227 AromaticContact CE1-CD2 3.79Å; Y188-H227 AromaticContact CE1-CE1 3.84Å; Y188-H227 AromaticContact CE1-CG 3.85Å; Y188-H227 AromaticContact CE1-ND1 3.87Å; Y188-H227 AromaticContact CE1-NE2 3.77Å; H227-V239 HydrophobicContact CB-CG1 4.38Å; H227-V239 WeakPolarHBondContact CB-O 3.18Å; H227-V239 PolarHBondContact N-O 3.47Å; H227-D241 IonicContact CD2-OD1 3.84Å; H227-D241 IonicContact CE1-OD1 3.75Å; H227-D241 IonicContact NE2-OD1 3.9Å; H227-D241 PolarHBondContact NE2-OD1 3.15Å
228	Y	88.1	Confident	87.3	Confident	28 Å²	28	42.2 Å²	42.2	11%	0.11	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	167.6	177.4	56.3	-86.1	0	0	0	110.2	T152 N154 A157 F162 L226 F230 V239	T152-Y228 CarbonylContact O-C 3.57Å; T152-Y228 WeakPolarHBondContact O-CA 3.24Å; T152-Y228 WeakPolarHBondContact O-CB 3.36Å; N154-Y228 HydrophobicContact CB-CD2 4.01Å; N154-Y228 HydrophobicContact CB-CG 4.41Å; A157-Y228 HydrophobicContact CB-CD2 4.15Å; A157-Y228 HydrophobicContact CB-CE2 3.67Å; F162-Y228 HydrophobicContact CZ-CE2 4.36Å; F162-Y228 AromaticContact CZ-CZ 3.96Å; F162-Y228 WeakPolarHBondContact CZ-OH 3.18Å; L226-Y228 WeakPolarHBondContact CD1-O 3.37Å; Y228-F230 HydrophobicContact CD2-CD1 4.1Å; Y228-F230 AromaticContact CE2-CD1 3.91Å; Y228-F230 HydrophobicContact CE2-CD1 3.91Å; Y228-F230 HydrophobicContact CE2-CE1 4.23Å; Y228-V239 HydrophobicContact CD1-CB 4.4Å; Y228-V239 HydrophobicContact CD2-CB 4.4Å; Y228-V239 HydrophobicContact CD2-CG2 3.94Å; Y228-V239 HydrophobicContact CE1-CB 4.25Å; Y228-V239 HydrophobicContact CE1-CG1 4.09Å; Y228-V239 HydrophobicContact CE1-CG2 4.38Å; Y228-V239 HydrophobicContact CE2-CB 4.29Å; Y228-V239 HydrophobicContact CE2-CG2 3.6Å; Y228-V239 HydrophobicContact CG-CB 4.47Å; Y228-V239 HydrophobicContact CG-CG2 4.49Å; Y228-V239 WeakPolarHBondContact O-CB 3.31Å; Y228-V239 PolarHBondContact O-N 2.85Å
229	S	86.5	Confident	88	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	151.5	172.9	57.9	0	0	0	0	110.8	T152 G153 N154 Y237	T152-S229 PolarHBondContact O-N 3Å; T152-S229 PolarHBondContact OG1-OG 3.44Å; T152-S229 VanDerWaalsContact OG1-OG 3.11Å; G153-S229 CarbonylContact C-O 3.57Å; G153-S229 WeakPolarHBondContact CA-O 3.44Å; N154-S229 PolarHBondContact N-O 3.05Å; S229-Y237 CarbonylContact C-O 3.5Å; S229-Y237 WeakPolarHBondContact CA-O 3.39Å; S229-Y237 VanDerWaalsContact CB-O 3.32Å; S229-Y237 WeakPolarHBondContact CB-O 3.47Å
230	F	89.8	Confident	88.4	Confident	1 Å²	1	35.1 Å²	35.1	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	173.1	175.7	66.1	-86	0	0	0	110.1	L149 N154 A157 P159 F162 Y228 Y237 V239	L149-F230 VanDerWaalsContact CD1-C 3.47Å; L149-F230 VanDerWaalsContact CD1-CA 3.45Å; N154-F230 WeakPolarHBondContact O-CB 3.4Å; A157-F230 HydrophobicContact CB-CB 3.86Å; A157-F230 HydrophobicContact CB-CD1 3.81Å; A157-F230 HydrophobicContact CB-CD2 4.48Å; A157-F230 HydrophobicContact CB-CE1 4.48Å; A157-F230 HydrophobicContact CB-CG 3.8Å; A157-F230 WeakPolarHBondContact O-CD2 3.35Å; P159-F230 HydrophobicContact CG-CE2 3.95Å; F162-F230 HydrophobicContact CD2-CZ 4.44Å; F162-F230 AromaticContact CE2-CE1 3.81Å; F162-F230 HydrophobicContact CE2-CE1 3.81Å; F162-F230 HydrophobicContact CE2-CZ 4.01Å; F162-F230 HydrophobicContact CZ-CE1 4.46Å; Y228-F230 HydrophobicContact CD2-CD1 4.1Å; Y228-F230 AromaticContact CE2-CD1 3.91Å; Y228-F230 HydrophobicContact CE2-CD1 3.91Å; Y228-F230 HydrophobicContact CE2-CE1 4.23Å; F230-Y237 AromaticContact CD2-CD2 3.88Å; F230-Y237 HydrophobicContact CD2-CD2 3.88Å; F230-Y237 HydrophobicContact CD2-CG 4.01Å; F230-Y237 VanDerWaalsContact CE1-CB 3.47Å; F230-Y237 HydrophobicContact CE1-CG 4.1Å; F230-Y237 AromaticContact CE2-CD1 3.9Å; F230-Y237 HydrophobicContact CE2-CD1 3.9Å; F230-Y237 AromaticContact CE2-CD2 3.51Å; F230-Y237 HydrophobicContact CE2-CD2 3.51Å; F230-Y237 HydrophobicContact CE2-CE1 4.47Å; F230-Y237 HydrophobicContact CE2-CE2 4.14Å; F230-Y237 AromaticContact CE2-CG 3.38Å; F230-Y237 HydrophobicContact CE2-CG 3.38Å; F230-Y237 AromaticContact CZ-CD1 3.69Å; F230-Y237 HydrophobicContact CZ-CD1 3.69Å; F230-Y237 HydrophobicContact CZ-CD2 4.09Å; F230-Y237 HydrophobicContact CZ-CE1 4.5Å; F230-Y237 AromaticContact CZ-CG 3.45Å; F230-Y237 HydrophobicContact CZ-CG 3.45Å; F230-Y237 VanDerWaalsContact CZ-CG 3.45Å; F230-Y237 PolarHBondContact N-O 3.16Å; F230-Y237 PolarHBondContact O-N 2.97Å; F230-V239 HydrophobicContact CD1-CG2 4.18Å; F230-V239 HydrophobicContact CE1-CG2 3.75Å
231	Q	87.9	Confident	88.5	Confident	48 Å²	48	36.7 Å²	36.7	22%	0.224	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.1	-176.8	66.3	-168.2	-58.9	0	0	111.9	I147 L149 K235 L236	I147-Q231 PolarHBondContact O-NE2 2.93Å; L149-Q231 HydrophobicContact CD1-CB 4.13Å; L149-Q231 HydrophobicContact CD1-CG 4.24Å; Q231-K235 CarbonylContact C-O 3.45Å; Q231-K235 VanDerWaalsContact CA-O 3.28Å; Q231-K235 WeakPolarHBondContact CA-O 3.38Å; Q231-K235 WeakPolarHBondContact CB-O 3.36Å; Q231-L236 HydrophobicContact CB-CD2 3.65Å
232	T	88.6	Confident	88.4	Confident	44 Å²	44	35.6 Å²	35.6	27%	0.27	18%	0.181	S	C	.	.			trans	-109.7	-176.6	163.5	62.9	0	0	0	0	109.4	P159 K195 E234 K235 Y237	P159-T232 HydrophobicContact CG-CG2 3.69Å; K195-T232 VanDerWaalsContact CE-O 3.25Å; K195-T232 WeakPolarHBondContact CE-O 3.27Å; K195-T232 PolarHBondContact NZ-O 3.43Å; T232-E234 PolarHBondContact O-N 3.29Å; T232-E234 PolarHBondContact OG1-N 3.43Å; T232-K235 PolarHBondContact N-O 3.35Å; T232-K235 PolarHBondContact OG1-N 2.84Å; T232-K235 VanDerWaalsContact OG1-N 3.15Å; T232-Y237 HydrophobicContact CG2-CE2 3.81Å
233	T	86.6	Confident	88.3	Confident	90 Å²	90	34.9 Å²	34.9	55%	0.552	18%	0.179	S	C	*	.	S	Bend	trans	-50.1	-38.8	172.7	-49.4	0	0	0	0	112	S144 K195	S144-T233 WeakPolarHBondContact OG-CG2 3.46Å; S144-T233 PolarHBondContact OG-O 3.43Å; K195-T233 WeakPolarHBondContact CD-O 3.48Å
234	E	82.6	Confident	88.1	Confident	123 Å²	123	39.2 Å²	39.2	58%	0.575	20%	0.203	S	C	*	.	S	Bend	trans	-113.2	-18.4	-170.3	-63.4	176.8	-178.7	0	0	114.8	K195 T232	K195-E234 VanDerWaalsContact CB-O 3.3Å; K195-E234 WeakPolarHBondContact CB-O 3.28Å; K195-E234 WeakPolarHBondContact CG-O 3.33Å; K195-E234 PolarHBondContact N-O 2.87Å; T232-E234 PolarHBondContact O-N 3.29Å; T232-E234 PolarHBondContact OG1-N 3.43Å
235	K	85.4	Confident	87.8	Confident	46 Å²	46	39.9 Å²	39.9	20%	0.2	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151.8	-167	-65.8	173.2	-174	173.8	0	112.9	V192 L193 Q231 T232 Y237	V192-K235 HydrophobicContact CG1-CB 4.24Å; V192-K235 HydrophobicContact CG1-CD 4.01Å; V192-K235 HydrophobicContact CG1-CG 4.4Å; L193-K235 CarbonylContact O-C 3.58Å; L193-K235 VanDerWaalsContact O-CA 3.27Å; L193-K235 WeakPolarHBondContact O-CA 3.48Å; Q231-K235 CarbonylContact C-O 3.45Å; Q231-K235 VanDerWaalsContact CA-O 3.28Å; Q231-K235 WeakPolarHBondContact CA-O 3.38Å; Q231-K235 WeakPolarHBondContact CB-O 3.36Å; T232-K235 PolarHBondContact N-O 3.35Å; T232-K235 PolarHBondContact OG1-N 2.84Å; T232-K235 VanDerWaalsContact OG1-N 3.15Å; K235-Y237 HydrophobicContact CB-CD2 4.32Å; K235-Y237 HydrophobicContact CB-CE2 3.51Å
236	L	84.4	Confident	87.8	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	142.2	168	-63.3	-177.2	0	0	0	109.4	I147 L149 V192 L193 K195 V198 Q231 F238	I147-L236 HydrophobicContact CB-CD2 4.35Å; I147-L236 HydrophobicContact CD1-CD1 3.98Å; I147-L236 HydrophobicContact CD1-CD2 4.12Å; I147-L236 HydrophobicContact CD1-CG 4.32Å; L149-L236 HydrophobicContact CD2-CD2 4.03Å; V192-L236 WeakPolarHBondContact CA-O 3.36Å; L193-L236 HydrophobicContact CB-CB 4.44Å; L193-L236 PolarHBondContact N-O 2.71Å; L193-L236 PolarHBondContact O-N 2.87Å; K195-L236 HydrophobicContact CG-CD2 4.4Å; K195-L236 HydrophobicContact CG-CG 4.18Å; V198-L236 HydrophobicContact CG2-CD1 4.42Å; Q231-L236 HydrophobicContact CB-CD2 3.65Å; L236-F238 HydrophobicContact CB-CE2 3.97Å; L236-F238 HydrophobicContact CD1-CE2 4.48Å
237	Y	88.9	Confident	87.7	Confident	20 Å²	20	43.6 Å²	43.6	8%	0.078	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128.8	-178.8	-63.5	-101.4	0	0	0	109.5	P159 F164 V190 K191 V192 S229 F230 T232 K235	P159-Y237 HydrophobicContact CB-CE1 4.35Å; P159-Y237 HydrophobicContact CG-CE1 4.16Å; P159-Y237 HydrophobicContact CG-CE2 4.06Å; F164-Y237 HydrophobicContact CZ-CE1 4.43Å; V190-Y237 HydrophobicContact CG1-CD1 3.96Å; K191-Y237 CarbonylContact O-C 3.55Å; K191-Y237 WeakPolarHBondContact O-CA 3.31Å; V192-Y237 HydrophobicContact CB-CD1 4.49Å; V192-Y237 HydrophobicContact CB-CE1 4.44Å; V192-Y237 HydrophobicContact CG1-CD1 4.22Å; V192-Y237 HydrophobicContact CG1-CE1 3.83Å; V192-Y237 HydrophobicContact CG2-CD1 3.71Å; V192-Y237 HydrophobicContact CG2-CE1 3.75Å; S229-Y237 CarbonylContact C-O 3.5Å; S229-Y237 WeakPolarHBondContact CA-O 3.39Å; S229-Y237 VanDerWaalsContact CB-O 3.32Å; S229-Y237 WeakPolarHBondContact CB-O 3.47Å; F230-Y237 AromaticContact CD2-CD2 3.88Å; F230-Y237 HydrophobicContact CD2-CD2 3.88Å; F230-Y237 HydrophobicContact CD2-CG 4.01Å; F230-Y237 VanDerWaalsContact CE1-CB 3.47Å; F230-Y237 HydrophobicContact CE1-CG 4.1Å; F230-Y237 AromaticContact CE2-CD1 3.9Å; F230-Y237 HydrophobicContact CE2-CD1 3.9Å; F230-Y237 AromaticContact CE2-CD2 3.51Å; F230-Y237 HydrophobicContact CE2-CD2 3.51Å; F230-Y237 HydrophobicContact CE2-CE1 4.47Å; F230-Y237 HydrophobicContact CE2-CE2 4.14Å; F230-Y237 AromaticContact CE2-CG 3.38Å; F230-Y237 HydrophobicContact CE2-CG 3.38Å; F230-Y237 AromaticContact CZ-CD1 3.69Å; F230-Y237 HydrophobicContact CZ-CD1 3.69Å; F230-Y237 HydrophobicContact CZ-CD2 4.09Å; F230-Y237 HydrophobicContact CZ-CE1 4.5Å; F230-Y237 AromaticContact CZ-CG 3.45Å; F230-Y237 HydrophobicContact CZ-CG 3.45Å; F230-Y237 VanDerWaalsContact CZ-CG 3.45Å; F230-Y237 PolarHBondContact N-O 3.16Å; F230-Y237 PolarHBondContact O-N 2.97Å; T232-Y237 HydrophobicContact CG2-CE2 3.81Å; K235-Y237 HydrophobicContact CB-CD2 4.32Å; K235-Y237 HydrophobicContact CB-CE2 3.51Å
238	F	87.4	Confident	87.4	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120	174.8	-63	-95.9	0	0	0	108.4	V190 K191 L193 L214 L226 L236	V190-F238 CarbonylContact C-O 3.56Å; V190-F238 WeakPolarHBondContact CA-O 3.38Å; K191-F238 HydrophobicContact CB-CB 4.27Å; K191-F238 PolarHBondContact N-O 2.88Å; K191-F238 PolarHBondContact O-N 2.87Å; L193-F238 HydrophobicContact CD1-CD2 3.6Å; L193-F238 HydrophobicContact CD1-CE2 3.56Å; L214-F238 HydrophobicContact CB-CD1 4.45Å; L214-F238 HydrophobicContact CB-CE1 4.33Å; L214-F238 HydrophobicContact CD1-CD1 3.86Å; L214-F238 HydrophobicContact CD1-CE1 4.02Å; L214-F238 HydrophobicContact CD1-CG 4.34Å; L226-F238 HydrophobicContact CD1-CB 3.99Å; L226-F238 HydrophobicContact CD1-CD1 4.14Å; L226-F238 HydrophobicContact CD2-CD1 4.44Å; L236-F238 HydrophobicContact CB-CE2 3.97Å; L236-F238 HydrophobicContact CD1-CE2 4.48Å
239	V	91.6	Very high	87	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	105.4	-176.7	-175.1	0	0	0	0	108.5	F162 Y188 H227 Y228 F230	F162-V239 HydrophobicContact CE1-CG1 4.19Å; F162-V239 HydrophobicContact CE2-CG2 4.37Å; F162-V239 HydrophobicContact CZ-CG1 4.07Å; F162-V239 HydrophobicContact CZ-CG2 3.73Å; Y188-V239 HydrophobicContact CD1-CG1 3.57Å; Y188-V239 HydrophobicContact CD2-CG1 4.48Å; Y188-V239 HydrophobicContact CE1-CG1 4.15Å; Y188-V239 HydrophobicContact CG-CG1 3.75Å; H227-V239 HydrophobicContact CB-CG1 4.38Å; H227-V239 WeakPolarHBondContact CB-O 3.18Å; H227-V239 PolarHBondContact N-O 3.47Å; Y228-V239 HydrophobicContact CD1-CB 4.4Å; Y228-V239 HydrophobicContact CD2-CB 4.4Å; Y228-V239 HydrophobicContact CD2-CG2 3.94Å; Y228-V239 HydrophobicContact CE1-CB 4.25Å; Y228-V239 HydrophobicContact CE1-CG1 4.09Å; Y228-V239 HydrophobicContact CE1-CG2 4.38Å; Y228-V239 HydrophobicContact CE2-CB 4.29Å; Y228-V239 HydrophobicContact CE2-CG2 3.6Å; Y228-V239 HydrophobicContact CG-CB 4.47Å; Y228-V239 HydrophobicContact CG-CG2 4.49Å; Y228-V239 WeakPolarHBondContact O-CB 3.31Å; Y228-V239 PolarHBondContact O-N 2.85Å; F230-V239 HydrophobicContact CD1-CG2 4.18Å; F230-V239 HydrophobicContact CE1-CG2 3.75Å
240	L	91	Very high	86.7	Confident	17 Å²	17	48.1 Å²	48.1	9%	0.089	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	160.4	-172.8	-57	157.4	0	0	0	110.7	A189 K191 L214 V224 G225 L226 F242	A189-L240 HydrophobicContact CB-CB 4.27Å; A189-L240 PolarHBondContact N-O 3.14Å; A189-L240 WeakPolarHBondContact O-CA 3.35Å; A189-L240 VanDerWaalsContact O-CB 3.32Å; A189-L240 WeakPolarHBondContact O-CB 2.98Å; A189-L240 PolarHBondContact O-N 2.9Å; K191-L240 HydrophobicContact CB-CD1 4.13Å; L214-L240 HydrophobicContact CD2-CD2 4.38Å; V224-L240 HydrophobicContact CG2-CB 4.11Å; G225-L240 CarbonylContact O-C 3.58Å; G225-L240 VanDerWaalsContact O-CA 3.26Å; G225-L240 WeakPolarHBondContact O-CA 3.29Å; L226-L240 HydrophobicContact CB-CD2 4.12Å; L226-L240 HydrophobicContact CD1-CD2 3.88Å; L226-L240 HydrophobicContact CD1-CG 4.48Å; L240-F242 PolarHBondContact O-N 2.8Å
241	D	91.2	Very high	86.2	Confident	69 Å²	69	49.6 Å²	49.6	37%	0.369	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	135.3	167.8	-72.5	-45.2	0	0	0	111.2	V224 G225 H227	V224-D241 HydrophobicContact CG2-CB 4.09Å; G225-D241 VanDerWaalsContact CA-OD2 3.23Å; G225-D241 WeakPolarHBondContact CA-OD2 3.38Å; G225-D241 PolarHBondContact N-OD2 3.47Å; G225-D241 PolarHBondContact O-N 3.08Å; H227-D241 IonicContact CD2-OD1 3.84Å; H227-D241 IonicContact CE1-OD1 3.75Å; H227-D241 IonicContact NE2-OD1 3.9Å; H227-D241 PolarHBondContact NE2-OD1 3.15Å
242	F	92.1	Very high	85.8	Confident	76 Å²	76	49.5 Å²	49.5	33%	0.333	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-87.5	118.6	169.7	177.4	-116.9	0	0	0	109.9	I168 L178 F187 L240 N244	I168-F242 HydrophobicContact CD1-CD2 4.16Å; I168-F242 HydrophobicContact CD1-CE2 4.15Å; L178-F242 HydrophobicContact CD1-CD1 3.96Å; L178-F242 HydrophobicContact CD1-CD2 3.68Å; L178-F242 HydrophobicContact CD1-CE1 4.01Å; L178-F242 HydrophobicContact CD1-CE2 3.75Å; L178-F242 HydrophobicContact CD1-CG 3.79Å; L178-F242 HydrophobicContact CD1-CZ 3.91Å; L178-F242 HydrophobicContact CD2-CZ 4.4Å; F187-F242 HydrophobicContact CB-CB 4.4Å; F187-F242 HydrophobicContact CB-CD1 4.08Å; F187-F242 HydrophobicContact CB-CG 4.49Å; L240-F242 PolarHBondContact O-N 2.8Å; F242-N244 HydrophobicContact CD1-CB 4.41Å; F242-N244 HydrophobicContact CE1-CB 3.85Å; F242-N244 HydrophobicContact CZ-CB 4.37Å
243	V	90.4	Very high	85.1	Confident	21 Å²	21	53.9 Å²	53.9	13%	0.127	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-101.1	121.1	179.8	-175.3	0	0	0	0	108.8	L293 L294 D295 V301	V243-L293 HydrophobicContact CB-CB 4.26Å; V243-L293 HydrophobicContact CB-CD1 3.87Å; V243-L293 HydrophobicContact CG1-CB 3.72Å; V243-L293 HydrophobicContact CG1-CD1 4.25Å; V243-L293 HydrophobicContact CG2-CD1 4.43Å; V243-L294 WeakPolarHBondContact CG1-O 3.5Å; V243-D295 HydrophobicContact CG1-CB 4.33Å; V243-V301 HydrophobicContact CG1-CB 4.28Å; V243-V301 HydrophobicContact CG1-CG2 4.22Å; V243-V301 HydrophobicContact CG2-CB 4.11Å; V243-V301 HydrophobicContact CG2-CG1 3.83Å; V243-V301 HydrophobicContact CG2-CG2 4.31Å
244	N	86.1	Confident	84.7	Confident	101 Å²	101	57.3 Å²	57.3	54%	0.54	28%	0.279	S	S	.	.			trans	-105.6	-5.1	-165.8	67.5	-24.5	0	0	0	115.6	F242 G246 S296	F242-N244 HydrophobicContact CD1-CB 4.41Å; F242-N244 HydrophobicContact CE1-CB 3.85Å; F242-N244 HydrophobicContact CZ-CB 4.37Å; N244-G246 VanDerWaalsContact C-N 3.29Å; N244-G246 PolarHBondContact O-N 2.81Å; N244-S296 WeakPolarHBondContact OD1-CB 3.21Å; N244-S296 PolarHBondContact OD1-N 3.08Å
245	G	83.9	Confident	84.6	Confident	23 Å²	23	54.8 Å²	54.8	24%	0.237	27%	0.268	C	S	.	.	S	Bend	trans	-82.7	-2.2	179.3	0	0	0	0	0	114.4	H251 L294	G245-H251 PolarHBondContact O-NE2 3.02Å; G245-L294 CarbonylContact C-O 3.56Å; G245-L294 WeakPolarHBondContact CA-O 3.42Å; G245-L294 PolarHBondContact N-O 3.32Å
246	G	85.6	Confident	84.2	Confident	32 Å²	32	63.5 Å²	63.5	33%	0.33	30%	0.299	S	S	.	.			trans	79.4	-177.3	174.9	0	0	0	0	0	114	N244 L293 L294	N244-G246 VanDerWaalsContact C-N 3.29Å; N244-G246 PolarHBondContact O-N 2.81Å; G246-L293 CarbonylContact O-C 3.54Å; G246-L293 WeakPolarHBondContact O-CA 3.35Å; G246-L294 PolarHBondContact O-N 2.93Å
247	E	85.1	Confident	84	Confident	83 Å²	83	67.3 Å²	67.3	39%	0.388	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-72.3	135.2	-178.3	-65.8	169.6	-142	0	0	111.3	F249 F250 H251 L293	E247-F249 PolarHBondContact O-N 2.84Å; E247-F250 HydrophobicContact CB-CB 4.36Å; E247-F250 WeakPolarHBondContact O-CB 3.33Å; E247-F250 PolarHBondContact O-N 2.81Å; E247-H251 PolarHBondContact O-CD2 2.89Å; E247-H251 VanDerWaalsContact O-CD2 3.26Å; E247-L293 HydrophobicContact CB-CD2 4.26Å; E247-L293 HydrophobicContact CG-CD2 3.64Å
248	L	83.1	Confident	83.8	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.099	33%	0.329	C	S	.	.	H	α-helix	trans	-56.3	-34.9	175.1	-180	62.3	0	0	0	111.4	F250 H251 L252 F258 Y266 I292 L294	L248-F250 VanDerWaalsContact C-N 3.33Å; L248-F250 PolarHBondContact O-N 2.78Å; L248-H251 PolarHBondContact O-N 3.34Å; L248-L252 PolarHBondContact O-N 3.39Å; L248-F258 HydrophobicContact CD1-CE2 3.69Å; L248-F258 HydrophobicContact CD1-CZ 3.91Å; L248-F258 HydrophobicContact CG-CE2 4.19Å; L248-Y266 HydrophobicContact CD1-CD2 3.67Å; L248-Y266 HydrophobicContact CD1-CE1 4.46Å; L248-Y266 HydrophobicContact CD1-CE2 3.47Å; L248-Y266 VanDerWaalsContact CD1-CE2 3.47Å; L248-Y266 HydrophobicContact CD1-CG 4.24Å; L248-Y266 HydrophobicContact CD2-CD2 4.28Å; L248-Y266 HydrophobicContact CD2-CG 4.4Å; L248-I292 HydrophobicContact CB-CB 4.2Å; L248-I292 HydrophobicContact CB-CG2 3.87Å; L248-I292 WeakPolarHBondContact CB-O 3.35Å; L248-I292 HydrophobicContact CD2-CB 4.45Å; L248-I292 HydrophobicContact CD2-CG2 3.65Å; L248-I292 HydrophobicContact CG-CG2 4.4Å; L248-I292 PolarHBondContact N-O 3.02Å; L248-L294 HydrophobicContact CD1-CD1 4Å; L248-L294 HydrophobicContact CD1-CD2 4.09Å; L248-L294 HydrophobicContact CD1-CG 4.18Å
249	F	79.4	Confident	83.8	Confident	71 Å²	71	71.6 Å²	71.6	31%	0.311	35%	0.354	S	S	.	.	H	α-helix	trans	-60.9	-39.1	176.4	-166.6	-108.8	0	0	0	113.3	E247 H251 L252 Q253 P289 I327	E247-F249 PolarHBondContact O-N 2.84Å; F249-H251 VanDerWaalsContact C-N 3.27Å; F249-H251 PolarHBondContact O-N 3.03Å; F249-L252 PolarHBondContact O-N 2.89Å; F249-Q253 WeakPolarHBondContact O-CB 3.44Å; F249-Q253 PolarHBondContact O-N 3.31Å; F249-P289 HydrophobicContact CB-CB 3.52Å; F249-P289 HydrophobicContact CD2-CB 3.64Å; F249-P289 HydrophobicContact CD2-CG 3.97Å; F249-P289 HydrophobicContact CG-CB 3.81Å; F249-I327 HydrophobicContact CD2-CD1 4.28Å; F249-I327 HydrophobicContact CE2-CD1 3.82Å
250	F	78.6	Confident	83.7	Confident	119 Å²	119	77 Å²	77	52%	0.522	38%	0.379	S	S	.	.	H	α-helix	trans	-60.2	-41.3	177.9	173.1	-94.8	0	0	0	110.9	E247 L248 R254	E247-F250 HydrophobicContact CB-CB 4.36Å; E247-F250 WeakPolarHBondContact O-CB 3.33Å; E247-F250 PolarHBondContact O-N 2.81Å; L248-F250 VanDerWaalsContact C-N 3.33Å; L248-F250 PolarHBondContact O-N 2.78Å; F250-R254 PolarHBondContact O-N 3.39Å
251	H	81.3	Confident	83.8	Confident	32 Å²	32	80.5 Å²	80.5	15%	0.148	40%	0.403	C	S	.	.	H	α-helix	trans	-67.1	-43.1	175.3	-64.2	-83.2	0	0	0	111.8	G245 E247 L248 F249 R254 E255 F258	G245-H251 PolarHBondContact O-NE2 3.02Å; E247-H251 PolarHBondContact O-CD2 2.89Å; E247-H251 VanDerWaalsContact O-CD2 3.26Å; L248-H251 PolarHBondContact O-N 3.34Å; F249-H251 VanDerWaalsContact C-N 3.27Å; F249-H251 PolarHBondContact O-N 3.03Å; H251-R254 PolarHBondContact O-N 3.33Å; H251-E255 PolarHBondContact O-N 2.93Å; H251-E255 VanDerWaalsContact O-N 3.14Å; H251-F258 HydrophobicContact CB-CE1 4.3Å; H251-F258 HydrophobicContact CB-CZ 4Å
252	L	77.9	Confident	83.6	Confident	46 Å²	46	80.4 Å²	80.4	24%	0.241	40%	0.397	C	S	.	.	H	α-helix	trans	-62.1	-44.8	177.6	-178.4	63.4	0	0	0	111.8	L248 F249 R254 E255 R256 F258	L248-L252 PolarHBondContact O-N 3.39Å; F249-L252 PolarHBondContact O-N 2.89Å; L252-R254 VanDerWaalsContact C-N 3.3Å; L252-R254 PolarHBondContact O-N 3.38Å; L252-E255 CarbonylContact O-C 3.58Å; L252-E255 PolarHBondContact O-N 3.29Å; L252-R256 CarbonylContact O-C 3.5Å; L252-R256 WeakPolarHBondContact O-CA 3.27Å; L252-R256 PolarHBondContact O-N 3.23Å; L252-F258 HydrophobicContact CB-CE1 4.31Å; L252-F258 HydrophobicContact CB-CE2 3.87Å; L252-F258 HydrophobicContact CB-CZ 3.68Å; L252-F258 HydrophobicContact CD1-CD1 4.24Å; L252-F258 HydrophobicContact CD1-CD2 3.82Å; L252-F258 HydrophobicContact CD1-CE1 4.31Å; L252-F258 HydrophobicContact CD1-CE2 3.9Å; L252-F258 HydrophobicContact CD1-CG 4Å; L252-F258 HydrophobicContact CD1-CZ 4.16Å; L252-F258 HydrophobicContact CG-CE2 4.41Å
253	Q	74.6	Confident	83.4	Confident	136 Å²	136	78.1 Å²	78.1	64%	0.636	39%	0.392	S	S	*	.	H	α-helix	trans	-62.9	-37.9	-179.7	-173	-179.5	0.4	0	0	111.8	F249	F249-Q253 WeakPolarHBondContact O-CB 3.44Å; F249-Q253 PolarHBondContact O-N 3.31Å
254	R	78.8	Confident	83.5	Confident	162 Å²	162	83.2 Å²	83.2	61%	0.611	41%	0.409	S	S	*	.	H	α-helix	trans	-68.7	-36.6	177.5	-169.6	178.8	65.9	-177.1	-2	112.3	F250 H251 L252	F250-R254 PolarHBondContact O-N 3.39Å; H251-R254 PolarHBondContact O-N 3.33Å; L252-R254 VanDerWaalsContact C-N 3.3Å; L252-R254 PolarHBondContact O-N 3.38Å
255	E	79.1	Confident	83.8	Confident	70 Å²	70	82.9 Å²	82.9	33%	0.327	40%	0.403	S	S	.	.	H	α-helix	trans	-94.7	-6.3	-176.4	-66.3	178.2	-141.7	0	0	113.7	H251 L252 S257 R262	H251-E255 PolarHBondContact O-N 2.93Å; H251-E255 VanDerWaalsContact O-N 3.14Å; L252-E255 CarbonylContact O-C 3.58Å; L252-E255 PolarHBondContact O-N 3.29Å; E255-S257 PolarHBondContact O-N 2.73Å; E255-R262 IonicContact OE1-CZ 3.59Å; E255-R262 IonicContact OE1-NH1 3.96Å; E255-R262 PolarHBondContact OE1-NH1 3.04Å; E255-R262 IonicContact OE1-NH2 3.78Å; E255-R262 IonicContact OE2-CZ 3.99Å; E255-R262 IonicContact OE2-NH1 2.87Å; E255-R262 PolarHBondContact OE2-NH1 3.25Å
256	R	76.9	Confident	84.1	Confident	229 Å²	229	82.6 Å²	82.6	86%	0.864	40%	0.395	S	S	*	.	S	Bend	trans	66.1	-41.1	-173.4	-53.9	-179.5	177.3	-176.3	-0.9	114.6	L252	L252-R256 CarbonylContact O-C 3.5Å; L252-R256 WeakPolarHBondContact O-CA 3.27Å; L252-R256 PolarHBondContact O-N 3.23Å
257	S	81.3	Confident	84.3	Confident	83 Å²	83	81.7 Å²	81.7	58%	0.58	38%	0.384	S	S	*	.	S	Bend	trans	-152.8	157.3	173.9	61.2	0	0	0	0	110.7	E255	E255-S257 PolarHBondContact O-N 2.73Å
258	F	84.4	Confident	84.7	Confident	33 Å²	33	80.6 Å²	80.6	15%	0.145	39%	0.389	C	S	.	.			trans	-96.4	141.6	170.3	-64.2	-37.9	0	0	0	110.9	L248 H251 L252 R262 A263 Y266	L248-F258 HydrophobicContact CD1-CE2 3.69Å; L248-F258 HydrophobicContact CD1-CZ 3.91Å; L248-F258 HydrophobicContact CG-CE2 4.19Å; H251-F258 HydrophobicContact CB-CE1 4.3Å; H251-F258 HydrophobicContact CB-CZ 4Å; L252-F258 HydrophobicContact CB-CE1 4.31Å; L252-F258 HydrophobicContact CB-CE2 3.87Å; L252-F258 HydrophobicContact CB-CZ 3.68Å; L252-F258 HydrophobicContact CD1-CD1 4.24Å; L252-F258 HydrophobicContact CD1-CD2 3.82Å; L252-F258 HydrophobicContact CD1-CE1 4.31Å; L252-F258 HydrophobicContact CD1-CE2 3.9Å; L252-F258 HydrophobicContact CD1-CG 4Å; L252-F258 HydrophobicContact CD1-CZ 4.16Å; L252-F258 HydrophobicContact CG-CE2 4.41Å; F258-R262 HydrophobicContact CB-CB 4.38Å; F258-R262 HydrophobicContact CB-CG 4.41Å; F258-R262 HydrophobicContact CG-CG 4.43Å; F258-A263 HydrophobicContact CB-CB 4.4Å; F258-Y266 HydrophobicContact CD2-CD2 4.13Å; F258-Y266 HydrophobicContact CD2-CE2 4.11Å; F258-Y266 HydrophobicContact CE2-CD2 4.07Å; F258-Y266 AromaticContact CE2-CE2 3.87Å; F258-Y266 HydrophobicContact CE2-CE2 3.87Å; F258-Y266 HydrophobicContact CZ-CE2 4.24Å
259	P	88.1	Confident	85.2	Confident	81 Å²	81	80.2 Å²	80.2	53%	0.526	39%	0.387	S	S	.	.			trans	-56.9	146.9	166.4	-23	33.5	0	0	0	111	P261 R262 A263	P259-P261 VanDerWaalsContact C-CD 3.44Å; P259-P261 VanDerWaalsContact C-N 3.32Å; P259-R262 WeakPolarHBondContact O-CB 3.37Å; P259-R262 PolarHBondContact O-N 3.4Å; P259-A263 PolarHBondContact O-N 2.49Å
260	E	88.9	Confident	85.7	Confident	115 Å²	115	77.7 Å²	77.7	54%	0.537	38%	0.377	S	S	.	.	H	α-helix	trans	-51.2	-42.8	-177.5	-167.8	-165	144.5	0	0	113.8	R262 A263 R264	E260-R262 VanDerWaalsContact C-N 3.29Å; E260-R262 PolarHBondContact O-N 3.4Å; E260-A263 PolarHBondContact O-N 2.86Å; E260-R264 VanDerWaalsContact O-CB 3.29Å; E260-R264 WeakPolarHBondContact O-CB 3.42Å; E260-R264 PolarHBondContact O-N 3Å; E260-R264 IonicContact OE1-CZ 2.78Å; E260-R264 IonicContact OE1-NH2 2.69Å; E260-R264 PolarHBondContact OE1-NH2 2.96Å
261	P	92	Very high	86.3	Confident	90 Å²	90	74.8 Å²	74.8	58%	0.584	38%	0.375	S	S	*	.	H	α-helix	trans	-59.4	-37.6	177.1	-25.4	36.1	0	0	0	113.6	P259 F265	P259-P261 VanDerWaalsContact C-CD 3.44Å; P259-P261 VanDerWaalsContact C-N 3.32Å; P261-F265 PolarHBondContact O-N 3.44Å; P261-F265 VanDerWaalsContact O-N 3.12Å
262	R	88.8	Confident	86.8	Confident	67 Å²	67	75.9 Å²	75.9	25%	0.253	39%	0.386	S	S	.	.	H	α-helix	trans	-74.4	-42.1	178.6	-176.2	178.2	-176.3	-176.3	-1.1	111.4	E255 F258 P259 E260 R264 F265 Y266	E255-R262 IonicContact OE1-CZ 3.59Å; E255-R262 IonicContact OE1-NH1 3.96Å; E255-R262 PolarHBondContact OE1-NH1 3.04Å; E255-R262 IonicContact OE1-NH2 3.78Å; E255-R262 IonicContact OE2-CZ 3.99Å; E255-R262 IonicContact OE2-NH1 2.87Å; E255-R262 PolarHBondContact OE2-NH1 3.25Å; F258-R262 HydrophobicContact CB-CB 4.38Å; F258-R262 HydrophobicContact CB-CG 4.41Å; F258-R262 HydrophobicContact CG-CG 4.43Å; P259-R262 WeakPolarHBondContact O-CB 3.37Å; P259-R262 PolarHBondContact O-N 3.4Å; E260-R262 VanDerWaalsContact C-N 3.29Å; E260-R262 PolarHBondContact O-N 3.4Å; R262-R264 VanDerWaalsContact C-N 3.32Å; R262-R264 PolarHBondContact O-N 2.83Å; R262-F265 WeakPolarHBondContact O-CB 3.4Å; R262-F265 PolarHBondContact O-N 2.96Å; R262-Y266 HydrophobicContact CG-CD2 4.18Å; R262-Y266 HydrophobicContact CG-CE2 3.59Å; R262-Y266 PolarHBondContact NE-OH 3.25Å; R262-Y266 PolarHBondContact NH2-OH 2.99Å; R262-Y266 WeakPolarHBondContact O-CD2 3.38Å; R262-Y266 PolarHBondContact O-N 3.46Å
263	A	87.8	Confident	87.4	Confident	27 Å²	27	73.7 Å²	73.7	22%	0.223	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-43.3	174.8	0	0	0	0	0	111.4	F258 P259 E260 F265 Y266 A267	F258-A263 HydrophobicContact CB-CB 4.4Å; P259-A263 PolarHBondContact O-N 2.49Å; E260-A263 PolarHBondContact O-N 2.86Å; A263-F265 VanDerWaalsContact C-N 3.34Å; A263-F265 PolarHBondContact O-N 3.4Å; A263-Y266 PolarHBondContact O-N 2.9Å; A263-A267 VanDerWaalsContact O-CB 3.29Å; A263-A267 WeakPolarHBondContact O-CB 3.45Å; A263-A267 PolarHBondContact O-N 3.45Å
264	R	91.1	Very high	87.9	Confident	129 Å²	129	68.6 Å²	68.6	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-41.3	175.9	-170.9	-171.9	-58.3	153.1	0.2	112.2	E260 R262 A267 A268 L335	E260-R264 VanDerWaalsContact O-CB 3.29Å; E260-R264 WeakPolarHBondContact O-CB 3.42Å; E260-R264 PolarHBondContact O-N 3Å; E260-R264 IonicContact OE1-CZ 2.78Å; E260-R264 IonicContact OE1-NH2 2.69Å; E260-R264 PolarHBondContact OE1-NH2 2.96Å; R262-R264 VanDerWaalsContact C-N 3.32Å; R262-R264 PolarHBondContact O-N 2.83Å; R264-A267 PolarHBondContact O-N 2.94Å; R264-A268 WeakPolarHBondContact O-CB 3.46Å; R264-A268 PolarHBondContact O-N 2.71Å; R264-L335 HydrophobicContact CG-CD2 4.37Å
265	F	93.1	Very high	88.2	Confident	94 Å²	94	62.7 Å²	62.7	41%	0.412	34%	0.341	S	S	.	.	H	α-helix	trans	-58.9	-54.6	176.8	178.5	-96	0	0	0	111.5	P261 R262 A263 A267 A268 E269 H299	P261-F265 PolarHBondContact O-N 3.44Å; P261-F265 VanDerWaalsContact O-N 3.12Å; R262-F265 WeakPolarHBondContact O-CB 3.4Å; R262-F265 PolarHBondContact O-N 2.96Å; A263-F265 VanDerWaalsContact C-N 3.34Å; A263-F265 PolarHBondContact O-N 3.4Å; F265-A267 PolarHBondContact O-N 3.4Å; F265-A268 PolarHBondContact O-N 3.39Å; F265-E269 WeakPolarHBondContact CZ-OE1 3.34Å; F265-E269 PolarHBondContact O-N 3.36Å; F265-H299 AromaticContact CZ-CE1 3.9Å; F265-H299 AromaticContact CZ-ND1 3.68Å
266	Y	90.8	Very high	88.6	Confident	17 Å²	17	62.7 Å²	62.7	7%	0.067	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-40.2	178.3	-61.8	-38.9	0	0	0	112.7	L248 F258 R262 A263 A268 E269 I270 L294 G298 V300	L248-Y266 HydrophobicContact CD1-CD2 3.67Å; L248-Y266 HydrophobicContact CD1-CE1 4.46Å; L248-Y266 HydrophobicContact CD1-CE2 3.47Å; L248-Y266 VanDerWaalsContact CD1-CE2 3.47Å; L248-Y266 HydrophobicContact CD1-CG 4.24Å; L248-Y266 HydrophobicContact CD2-CD2 4.28Å; L248-Y266 HydrophobicContact CD2-CG 4.4Å; F258-Y266 HydrophobicContact CD2-CD2 4.13Å; F258-Y266 HydrophobicContact CD2-CE2 4.11Å; F258-Y266 HydrophobicContact CE2-CD2 4.07Å; F258-Y266 AromaticContact CE2-CE2 3.87Å; F258-Y266 HydrophobicContact CE2-CE2 3.87Å; F258-Y266 HydrophobicContact CZ-CE2 4.24Å; R262-Y266 HydrophobicContact CG-CD2 4.18Å; R262-Y266 HydrophobicContact CG-CE2 3.59Å; R262-Y266 PolarHBondContact NE-OH 3.25Å; R262-Y266 PolarHBondContact NH2-OH 2.99Å; R262-Y266 WeakPolarHBondContact O-CD2 3.38Å; R262-Y266 PolarHBondContact O-N 3.46Å; A263-Y266 PolarHBondContact O-N 2.9Å; Y266-A268 VanDerWaalsContact C-N 3.3Å; Y266-A268 PolarHBondContact O-N 2.89Å; Y266-E269 PolarHBondContact O-N 3.27Å; Y266-I270 WeakPolarHBondContact O-CB 3.25Å; Y266-I270 WeakPolarHBondContact O-CD1 3.36Å; Y266-I270 WeakPolarHBondContact O-CG1 3.34Å; Y266-I270 PolarHBondContact O-N 3.17Å; Y266-L294 HydrophobicContact CD1-CD2 4.31Å; Y266-L294 HydrophobicContact CE1-CD2 3.78Å; Y266-G298 WeakPolarHBondContact CE1-O 3.19Å; Y266-V300 HydrophobicContact CD1-CG2 3.73Å; Y266-V300 HydrophobicContact CG-CG2 4.21Å
267	A	89.1	Confident	88.9	Confident	12 Å²	12	51.8 Å²	51.8	10%	0.099	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-38	177.7	0	0	0	0	0	112.3	A263 R264 F265 A271 V331 L335	A263-A267 VanDerWaalsContact O-CB 3.29Å; A263-A267 WeakPolarHBondContact O-CB 3.45Å; A263-A267 PolarHBondContact O-N 3.45Å; R264-A267 PolarHBondContact O-N 2.94Å; F265-A267 PolarHBondContact O-N 3.4Å; A267-A271 WeakPolarHBondContact O-CB 3.33Å; A267-A271 PolarHBondContact O-N 2.84Å; A267-V331 HydrophobicContact CB-CG1 4.25Å; A267-L335 HydrophobicContact CB-CD1 3.45Å; A267-L335 VanDerWaalsContact CB-CD1 3.45Å
268	A	92.7	Very high	89	Confident	60 Å²	60	51.2 Å²	51.2	50%	0.496	29%	0.285	S	S	.	.	H	α-helix	trans	-65	-42.6	176.5	0	0	0	0	0	112.1	R264 F265 Y266 A271 S272	R264-A268 WeakPolarHBondContact O-CB 3.46Å; R264-A268 PolarHBondContact O-N 2.71Å; F265-A268 PolarHBondContact O-N 3.39Å; Y266-A268 VanDerWaalsContact C-N 3.3Å; Y266-A268 PolarHBondContact O-N 2.89Å; A268-A271 PolarHBondContact O-N 2.74Å; A268-S272 WeakPolarHBondContact O-CB 3.48Å; A268-S272 PolarHBondContact O-N 2.77Å
269	E	94.6	Very high	89	Confident	11 Å²	11	53.4 Å²	53.4	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-44.5	177.1	-64.2	-172.7	147.5	0	0	111.9	F222 F265 Y266 S272 A273 H299 V300	F222-E269 HydrophobicContact CD1-CB 4.23Å; F222-E269 HydrophobicContact CD1-CG 4.35Å; F222-E269 HydrophobicContact CD2-CB 3.8Å; F222-E269 HydrophobicContact CD2-CG 4.26Å; F222-E269 WeakPolarHBondContact CD2-O 3.17Å; F222-E269 HydrophobicContact CE1-CB 4.28Å; F222-E269 HydrophobicContact CE1-CG 3.92Å; F222-E269 WeakPolarHBondContact CE1-OE1 3.26Å; F222-E269 HydrophobicContact CE2-CB 3.88Å; F222-E269 HydrophobicContact CE2-CG 3.85Å; F222-E269 HydrophobicContact CG-CB 4.01Å; F222-E269 HydrophobicContact CZ-CB 4.12Å; F222-E269 HydrophobicContact CZ-CG 3.66Å; F265-E269 WeakPolarHBondContact CZ-OE1 3.34Å; F265-E269 PolarHBondContact O-N 3.36Å; Y266-E269 PolarHBondContact O-N 3.27Å; E269-S272 PolarHBondContact O-N 2.9Å; E269-A273 PolarHBondContact O-N 2.97Å; E269-H299 IonicContact OE1-CE1 3.61Å; E269-H299 IonicContact OE1-CG 3.52Å; E269-H299 IonicContact OE1-ND1 3.68Å; E269-H299 PolarHBondContact OE1-ND1 2.99Å; E269-V300 HydrophobicContact CB-CB 3.98Å; E269-V300 HydrophobicContact CB-CG2 4.28Å; E269-V300 WeakPolarHBondContact OE2-CB 3.43Å; E269-V300 WeakPolarHBondContact OE2-CG2 3.42Å; E269-V300 PolarHBondContact OE2-N 3.47Å
270	I	90.8	Very high	88.7	Confident	19 Å²	19	52.5 Å²	52.5	10%	0.097	30%	0.295	C	S	.	.	H	α-helix	trans	-60	-48.3	174.8	-65.9	163.2	0	0	0	110.1	Y266 S272 A273 L274 L287 I292 V300 L302	Y266-I270 WeakPolarHBondContact O-CB 3.25Å; Y266-I270 WeakPolarHBondContact O-CD1 3.36Å; Y266-I270 WeakPolarHBondContact O-CG1 3.34Å; Y266-I270 PolarHBondContact O-N 3.17Å; I270-S272 VanDerWaalsContact C-N 3.32Å; I270-S272 PolarHBondContact O-N 2.89Å; I270-A273 PolarHBondContact O-N 3.04Å; I270-L274 HydrophobicContact CG2-CD1 3.84Å; I270-L274 HydrophobicContact CG2-CG 4.33Å; I270-L274 VanDerWaalsContact O-CG 3.32Å; I270-L274 WeakPolarHBondContact O-CG 3.2Å; I270-L274 PolarHBondContact O-N 2.92Å; I270-L287 HydrophobicContact CG2-CD1 4.13Å; I270-L287 HydrophobicContact CG2-CD2 4.18Å; I270-I292 HydrophobicContact CD1-CD1 3.99Å; I270-I292 HydrophobicContact CD1-CG2 4.41Å; I270-V300 HydrophobicContact CG1-CG1 3.84Å; I270-V300 HydrophobicContact CG1-CG2 4.29Å; I270-L302 HydrophobicContact CG1-CD2 4.41Å
271	A	90	Very high	88.1	Confident	58 Å²	58	51.2 Å²	51.2	48%	0.479	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-39.3	179.8	0	0	0	0	0	112	A267 A268 L274 G275	A267-A271 WeakPolarHBondContact O-CB 3.33Å; A267-A271 PolarHBondContact O-N 2.84Å; A268-A271 PolarHBondContact O-N 2.74Å; A271-L274 PolarHBondContact O-N 3.24Å; A271-G275 PolarHBondContact O-N 3.37Å
272	S	93.1	Very high	87.3	Confident	55 Å²	55	46.9 Å²	46.9	39%	0.385	26%	0.26	S	S	.	.	H	α-helix	trans	-60.4	-47.4	174.7	173.5	0	0	0	0	111.5	H220 A268 E269 I270 G275 Y276	H220-S272 PolarHBondContact CE1-OG 3.38Å; H220-S272 PolarHBondContact NE2-OG 3.01Å; A268-S272 WeakPolarHBondContact O-CB 3.48Å; A268-S272 PolarHBondContact O-N 2.77Å; E269-S272 PolarHBondContact O-N 2.9Å; I270-S272 VanDerWaalsContact C-N 3.32Å; I270-S272 PolarHBondContact O-N 2.89Å; S272-G275 PolarHBondContact O-N 3.46Å; S272-Y276 PolarHBondContact O-N 3.26Å
273	A	89.2	Confident	86.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-45.9	177.6	0	0	0	0	0	112.6	F222 L223 E269 I270 Y276 L277 L302	F222-A273 HydrophobicContact CB-CB 4.04Å; L223-A273 HydrophobicContact CD2-CB 3.88Å; L223-A273 HydrophobicContact CG-CB 4.27Å; E269-A273 PolarHBondContact O-N 2.97Å; I270-A273 PolarHBondContact O-N 3.04Å; A273-Y276 PolarHBondContact O-N 3.24Å; A273-L277 WeakPolarHBondContact O-CG 3.43Å; A273-L277 PolarHBondContact O-N 3.42Å; A273-L302 HydrophobicContact CB-CD1 3.71Å; A273-L302 HydrophobicContact CB-CG 4.38Å
274	L	85.8	Confident	85.7	Confident	28 Å²	28	44.3 Å²	44.3	15%	0.147	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-41.6	178.3	-66.8	175.3	0	0	0	111.8	I270 A271 Y276 L277 H278 Y284 L287 L302	I270-L274 HydrophobicContact CG2-CD1 3.84Å; I270-L274 HydrophobicContact CG2-CG 4.33Å; I270-L274 VanDerWaalsContact O-CG 3.32Å; I270-L274 WeakPolarHBondContact O-CG 3.2Å; I270-L274 PolarHBondContact O-N 2.92Å; A271-L274 PolarHBondContact O-N 3.24Å; L274-Y276 VanDerWaalsContact C-N 3.31Å; L274-Y276 PolarHBondContact O-N 3.38Å; L274-L277 PolarHBondContact O-N 3.22Å; L274-H278 WeakPolarHBondContact O-CB 3.4Å; L274-H278 PolarHBondContact O-N 2.97Å; L274-H278 PolarHBondContact O-ND1 2.88Å; L274-Y284 HydrophobicContact CD2-CD1 4.16Å; L274-Y284 HydrophobicContact CD2-CG 4.09Å; L274-L287 HydrophobicContact CD1-CD2 4.06Å; L274-L302 HydrophobicContact CD2-CD1 4.38Å
275	G	85.7	Confident	84.5	Confident	39 Å²	39	40.5 Å²	40.5	40%	0.402	23%	0.234	S	C	.	.	H	α-helix	trans	-59.2	-42.9	175.4	0	0	0	0	0	112	A271 S272 H278 S279	A271-G275 PolarHBondContact O-N 3.37Å; S272-G275 PolarHBondContact O-N 3.46Å; G275-H278 PolarHBondContact O-N 3.02Å; G275-S279 PolarHBondContact O-N 3.3Å
276	Y	87.1	Confident	83.3	Confident	69 Å²	69	37.2 Å²	37.2	27%	0.271	22%	0.22	S	C	.	.	H	α-helix	trans	-61.4	-49.6	173.4	171.2	-114	0	0	0	112.1	V218 K219 H220 L223 S272 A273 L274 H278 S279 I280	V218-Y276 HydrophobicContact CG1-CD1 4.22Å; V218-Y276 HydrophobicContact CG1-CE1 3.45Å; V218-Y276 VanDerWaalsContact CG1-CE1 3.45Å; K219-Y276 PolarHBondContact O-OH 3.02Å; H220-Y276 HydrophobicContact CB-CD1 3.62Å; H220-Y276 HydrophobicContact CB-CE1 3.8Å; H220-Y276 HydrophobicContact CB-CG 4.42Å; H220-Y276 AromaticContact CD2-CD1 3.65Å; H220-Y276 AromaticContact CD2-CG 3.57Å; H220-Y276 AromaticContact CG-CD1 3.82Å; L223-Y276 HydrophobicContact CD1-CD1 3.94Å; L223-Y276 HydrophobicContact CD1-CE1 4.2Å; S272-Y276 PolarHBondContact O-N 3.26Å; A273-Y276 PolarHBondContact O-N 3.24Å; L274-Y276 VanDerWaalsContact C-N 3.31Å; L274-Y276 PolarHBondContact O-N 3.38Å; Y276-H278 VanDerWaalsContact C-N 3.3Å; Y276-H278 PolarHBondContact O-N 3.02Å; Y276-S279 WeakPolarHBondContact O-CB 3.5Å; Y276-S279 PolarHBondContact O-N 3.43Å; Y276-S279 PolarHBondContact O-OG 3.43Å; Y276-I280 HydrophobicContact CE1-CD1 4.19Å; Y276-I280 HydrophobicContact CE2-CG2 4.36Å; Y276-I280 PolarHBondContact O-N 3.18Å
277	L	83.1	Confident	82.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.4	-44.4	176.8	-71.3	174.8	0	0	0	111.8	V218 L223 A273 L274 S279 I280 K281 I282 Y284 F305	V218-L277 HydrophobicContact CG1-CD2 3.79Å; L223-L277 HydrophobicContact CD1-CD1 4.38Å; L223-L277 HydrophobicContact CD1-CD2 3.74Å; L223-L277 HydrophobicContact CD1-CG 3.95Å; L223-L277 HydrophobicContact CD2-CD1 4.17Å; A273-L277 WeakPolarHBondContact O-CG 3.43Å; A273-L277 PolarHBondContact O-N 3.42Å; L274-L277 PolarHBondContact O-N 3.22Å; L277-S279 VanDerWaalsContact C-N 3.31Å; L277-S279 PolarHBondContact O-N 3.4Å; L277-I280 CarbonylContact O-C 3.53Å; L277-I280 WeakPolarHBondContact O-CG1 3.48Å; L277-I280 PolarHBondContact O-N 2.71Å; L277-K281 PolarHBondContact O-N 3.15Å; L277-I282 CarbonylContact C-O 3.56Å; L277-I282 HydrophobicContact CB-CB 4.29Å; L277-I282 WeakPolarHBondContact CB-O 3.3Å; L277-I282 HydrophobicContact CD2-CB 4.24Å; L277-I282 HydrophobicContact CD2-CD1 4.49Å; L277-I282 HydrophobicContact CD2-CG2 4.05Å; L277-I282 PolarHBondContact O-N 2.73Å; L277-I282 VanDerWaalsContact O-O 3.07Å; L277-Y284 HydrophobicContact CD1-CD2 3.85Å; L277-Y284 HydrophobicContact CD1-CG 4.2Å; L277-F305 HydrophobicContact CD1-CE1 4.31Å; L277-F305 HydrophobicContact CD2-CE1 4.35Å
278	H	83.3	Confident	81.7	Confident	71 Å²	71	40.8 Å²	40.8	33%	0.329	24%	0.236	S	C	.	.	H	α-helix	trans	-63.3	-36.1	177	-64.8	165.8	0	0	0	112.4	L274 G275 Y276 I280 K281 I282	L274-H278 WeakPolarHBondContact O-CB 3.4Å; L274-H278 PolarHBondContact O-N 2.97Å; L274-H278 PolarHBondContact O-ND1 2.88Å; G275-H278 PolarHBondContact O-N 3.02Å; Y276-H278 VanDerWaalsContact C-N 3.3Å; Y276-H278 PolarHBondContact O-N 3.02Å; H278-I280 PolarHBondContact O-N 3.42Å; H278-K281 PolarHBondContact O-N 3.24Å; H278-I282 PolarHBondContact CD2-O 3.42Å; H278-I282 PolarHBondContact N-O 3.44Å
279	S	84.3	Confident	80.5	Confident	80 Å²	80	38.8 Å²	38.8	56%	0.559	22%	0.218	S	C	*	.	H	α-helix	trans	-60.8	-30.7	176.8	81.2	0	0	0	0	112.7	G275 Y276 L277	G275-S279 PolarHBondContact O-N 3.3Å; Y276-S279 WeakPolarHBondContact O-CB 3.5Å; Y276-S279 PolarHBondContact O-N 3.43Å; Y276-S279 PolarHBondContact O-OG 3.43Å; L277-S279 VanDerWaalsContact C-N 3.31Å; L277-S279 PolarHBondContact O-N 3.4Å
280	I	82.3	Confident	79.3	Confident	62 Å²	62	43.1 Å²	43.1	32%	0.318	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	19.3	176.5	62.8	174.7	0	0	0	113	V218 Y276 L277 H278 I282	V218-I280 HydrophobicContact CG1-CD1 4.14Å; V218-I280 HydrophobicContact CG2-CD1 3.99Å; Y276-I280 HydrophobicContact CE1-CD1 4.19Å; Y276-I280 HydrophobicContact CE2-CG2 4.36Å; Y276-I280 PolarHBondContact O-N 3.18Å; L277-I280 CarbonylContact O-C 3.53Å; L277-I280 WeakPolarHBondContact O-CG1 3.48Å; L277-I280 PolarHBondContact O-N 2.71Å; H278-I280 PolarHBondContact O-N 3.42Å; I280-I282 VanDerWaalsContact C-N 3.32Å; I280-I282 HydrophobicContact CD1-CD1 3.58Å; I280-I282 HydrophobicContact CD1-CG1 4.33Å; I280-I282 HydrophobicContact CG1-CB 4.42Å; I280-I282 HydrophobicContact CG1-CD1 3.86Å; I280-I282 HydrophobicContact CG1-CG1 4.04Å; I280-I282 PolarHBondContact O-N 3.24Å
281	K	76.6	Confident	78.8	Confident	87 Å²	87	42.6 Å²	42.6	38%	0.378	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	37.2	176.2	-49.6	-59.8	-177.8	-174.4	0	113.7	L277 H278 E310 G311 I312	L277-K281 PolarHBondContact O-N 3.15Å; H278-K281 PolarHBondContact O-N 3.24Å; K281-E310 CarbonylContact O-C 3.6Å; K281-E310 WeakPolarHBondContact O-CA 3.43Å; K281-G311 PolarHBondContact O-N 2.88Å; K281-I312 WeakPolarHBondContact CD-O 3.46Å
282	I	74.8	Confident	78.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.9	174	-59.8	176	0	0	0	108.7	V213 K216 V218 L277 H278 I280 C308	V213-I282 HydrophobicContact CG1-CD1 4.12Å; V213-I282 HydrophobicContact CG1-CG2 4.04Å; V213-I282 HydrophobicContact CG2-CD1 4.16Å; V213-I282 HydrophobicContact CG2-CG1 4.34Å; V213-I282 HydrophobicContact CG2-CG2 3.86Å; K216-I282 HydrophobicContact CD-CD1 4.41Å; V218-I282 HydrophobicContact CG2-CD1 3.91Å; L277-I282 CarbonylContact C-O 3.56Å; L277-I282 HydrophobicContact CB-CB 4.29Å; L277-I282 WeakPolarHBondContact CB-O 3.3Å; L277-I282 HydrophobicContact CD2-CB 4.24Å; L277-I282 HydrophobicContact CD2-CD1 4.49Å; L277-I282 HydrophobicContact CD2-CG2 4.05Å; L277-I282 PolarHBondContact O-N 2.73Å; L277-I282 VanDerWaalsContact O-O 3.07Å; H278-I282 PolarHBondContact CD2-O 3.42Å; H278-I282 PolarHBondContact N-O 3.44Å; I280-I282 VanDerWaalsContact C-N 3.32Å; I280-I282 HydrophobicContact CD1-CD1 3.58Å; I280-I282 HydrophobicContact CD1-CG1 4.33Å; I280-I282 HydrophobicContact CG1-CB 4.42Å; I280-I282 HydrophobicContact CG1-CD1 3.86Å; I280-I282 HydrophobicContact CG1-CG1 4.04Å; I280-I282 PolarHBondContact O-N 3.24Å; I282-C308 HydrophobicContact CG2-CB 4.08Å
283	V	71.1	Confident	78.6	Confident	37 Å²	37	39.4 Å²	39.4	22%	0.224	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.1	174.1	-176	0	0	0	0	109.1	R285 C308 K309 I312	V283-R285 HydrophobicContact CB-CG 4.14Å; V283-R285 HydrophobicContact CG1-CG 3.6Å; V283-C308 CarbonylContact O-C 3.5Å; V283-C308 WeakPolarHBondContact O-CA 3.36Å; V283-K309 PolarHBondContact N-O 3.47Å; V283-K309 PolarHBondContact O-N 2.96Å; V283-I312 HydrophobicContact CB-CD1 3.97Å; V283-I312 HydrophobicContact CG2-CB 4.16Å; V283-I312 HydrophobicContact CG2-CD1 3.51Å; V283-I312 HydrophobicContact CG2-CG1 4.42Å; V283-I312 HydrophobicContact CG2-CG2 4.25Å
284	Y	70.6	Confident	78.7	Confident	3 Å²	3	39.6 Å²	39.6	1%	0.012	21%	0.207	C	C	.	.			trans	-71	-31.9	-171	-173.3	-106.9	0	0	0	114.1	L274 L277 D286 L287 L302 T303 F305	L274-Y284 HydrophobicContact CD2-CD1 4.16Å; L274-Y284 HydrophobicContact CD2-CG 4.09Å; L277-Y284 HydrophobicContact CD1-CD2 3.85Å; L277-Y284 HydrophobicContact CD1-CG 4.2Å; Y284-D286 PolarHBondContact O-N 2.9Å; Y284-L287 HydrophobicContact CD1-CB 4.13Å; Y284-L287 HydrophobicContact CD1-CD1 4.15Å; Y284-L287 HydrophobicContact CE1-CB 4.29Å; Y284-L287 HydrophobicContact CE1-CD1 3.86Å; Y284-L302 HydrophobicContact CE1-CD1 4.45Å; Y284-L302 HydrophobicContact CE2-CB 4.21Å; Y284-T303 PolarHBondContact OH-N 3.29Å; Y284-T303 PolarHBondContact OH-O 2.82Å; Y284-F305 AromaticContact CD2-CD1 3.9Å; Y284-F305 HydrophobicContact CD2-CD1 3.9Å; Y284-F305 HydrophobicContact CD2-CE1 4.01Å; Y284-F305 AromaticContact CE2-CD1 3.91Å; Y284-F305 HydrophobicContact CE2-CD1 3.91Å; Y284-F305 AromaticContact CE2-CE1 3.93Å; Y284-F305 HydrophobicContact CE2-CE1 3.93Å
285	R	65.9	Low	78.9	Confident	48 Å²	48	40.4 Å²	40.4	18%	0.181	21%	0.211	C	C	.	.			trans	52.6	-14.7	171.7	-61.5	-160.7	-58.9	167	2	119.4	V283 L307	V283-R285 HydrophobicContact CB-CG 4.14Å; V283-R285 HydrophobicContact CG1-CG 3.6Å; R285-L307 HydrophobicContact CB-CB 4.49Å; R285-L307 PolarHBondContact NE-O 3.12Å; R285-L307 PolarHBondContact NH2-O 3.46Å
286	D	67.9	Low	79.1	Confident	25 Å²	25	43 Å²	43	13%	0.134	22%	0.223	C	C	.	.			trans	-123.4	48.2	179.4	-158.5	29.4	0	0	0	111.5	Y284 K288 N291 L307	Y284-D286 PolarHBondContact O-N 2.9Å; D286-K288 PolarHBondContact O-N 3.43Å; D286-K288 VanDerWaalsContact O-N 3.08Å; D286-K288 IonicContact OD1-NZ 2.78Å; D286-K288 IonicContact OD2-NZ 2.73Å; D286-K288 PolarHBondContact OD2-NZ 3.42Å; D286-N291 PolarHBondContact O-ND2 2.92Å; D286-N291 PolarHBondContact OD2-ND2 3.15Å; D286-L307 HydrophobicContact CB-CB 4.04Å; D286-L307 HydrophobicContact CB-CD1 3.8Å; D286-L307 HydrophobicContact CB-CG 4.11Å
287	L	75	Confident	79.2	Confident	45 Å²	45	46.9 Å²	46.9	24%	0.236	25%	0.246	C	C	.	.			trans	-75.6	100.3	174.6	-167.5	70.7	0	0	0	109.1	I270 L274 Y284 I292 L302	I270-L287 HydrophobicContact CG2-CD1 4.13Å; I270-L287 HydrophobicContact CG2-CD2 4.18Å; L274-L287 HydrophobicContact CD1-CD2 4.06Å; Y284-L287 HydrophobicContact CD1-CB 4.13Å; Y284-L287 HydrophobicContact CD1-CD1 4.15Å; Y284-L287 HydrophobicContact CE1-CB 4.29Å; Y284-L287 HydrophobicContact CE1-CD1 3.86Å; L287-I292 HydrophobicContact CD1-CD1 4.1Å; L287-I292 HydrophobicContact CD1-CG1 4.29Å; L287-L302 HydrophobicContact CD1-CD2 4.07Å
288	K	71.7	Confident	79.6	Confident	60 Å²	60	47.9 Å²	47.9	26%	0.261	26%	0.257	S	S	.	.			trans	-139.7	155.3	177.2	66	-177.8	-172.6	-131.3	0	109.9	D286 E290 N291	D286-K288 PolarHBondContact O-N 3.43Å; D286-K288 VanDerWaalsContact O-N 3.08Å; D286-K288 IonicContact OD1-NZ 2.78Å; D286-K288 IonicContact OD2-NZ 2.73Å; D286-K288 PolarHBondContact OD2-NZ 3.42Å; K288-E290 VanDerWaalsContact CB-OE2 3.23Å; K288-E290 WeakPolarHBondContact CB-OE2 3.29Å; K288-E290 VanDerWaalsContact CD-OE2 3.3Å; K288-E290 WeakPolarHBondContact CD-OE2 3.46Å; K288-E290 HydrophobicContact CG-CB 4.39Å; K288-E290 WeakPolarHBondContact CG-OE2 3.2Å; K288-E290 PolarHBondContact O-N 2.86Å; K288-E290 VanDerWaalsContact O-N 3.16Å; K288-N291 WeakPolarHBondContact CE-ND2 3.46Å; K288-N291 WeakPolarHBondContact CE-OD1 3.33Å; K288-N291 HydrophobicContact CG-CB 4.1Å; K288-N291 PolarHBondContact O-N 3.16Å
289	P	67.3	Low	80.2	Confident	18 Å²	18	47.4 Å²	47.4	12%	0.117	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-60.8	-28.8	-172.5	-22.7	33.4	0	0	0	114.5	F249 N291 I292 I327	F249-P289 HydrophobicContact CB-CB 3.52Å; F249-P289 HydrophobicContact CD2-CB 3.64Å; F249-P289 HydrophobicContact CD2-CG 3.97Å; F249-P289 HydrophobicContact CG-CB 3.81Å; P289-N291 PolarHBondContact O-N 2.92Å; P289-I292 PolarHBondContact O-N 3.08Å; P289-I327 HydrophobicContact CG-CB 4.22Å; P289-I327 HydrophobicContact CG-CD1 3.38Å; P289-I327 HydrophobicContact CG-CG1 4.35Å; P289-I327 HydrophobicContact CG-CG2 3.79Å
290	E	70.5	Confident	80.6	Confident	101 Å²	101	43.6 Å²	43.6	47%	0.472	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-65.3	-23.3	176.2	-54.6	88.4	162	0	0	112.2	K288	K288-E290 VanDerWaalsContact CB-OE2 3.23Å; K288-E290 WeakPolarHBondContact CB-OE2 3.29Å; K288-E290 VanDerWaalsContact CD-OE2 3.3Å; K288-E290 WeakPolarHBondContact CD-OE2 3.46Å; K288-E290 HydrophobicContact CG-CB 4.39Å; K288-E290 WeakPolarHBondContact CG-OE2 3.2Å; K288-E290 PolarHBondContact O-N 2.86Å; K288-E290 VanDerWaalsContact O-N 3.16Å
291	N	80.7	Confident	81.1	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.043	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-95.3	-2.3	-179.9	-70.2	-8	0	0	0	113	D286 K288 P289 T303	D286-N291 PolarHBondContact O-ND2 2.92Å; D286-N291 PolarHBondContact OD2-ND2 3.15Å; K288-N291 WeakPolarHBondContact CE-ND2 3.46Å; K288-N291 WeakPolarHBondContact CE-OD1 3.33Å; K288-N291 HydrophobicContact CG-CB 4.1Å; K288-N291 PolarHBondContact O-N 3.16Å; P289-N291 PolarHBondContact O-N 2.92Å; N291-T303 PolarHBondContact O-N 2.94Å; N291-T303 PolarHBondContact O-OG1 3.39Å
292	I	87.6	Confident	81.7	Confident	16 Å²	16	37.1 Å²	37.1	8%	0.082	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	104.2	-179.8	-53.4	173.1	0	0	0	108.2	L248 I270 L287 P289 V300 L302	L248-I292 HydrophobicContact CB-CB 4.2Å; L248-I292 HydrophobicContact CB-CG2 3.87Å; L248-I292 WeakPolarHBondContact CB-O 3.35Å; L248-I292 HydrophobicContact CD2-CB 4.45Å; L248-I292 HydrophobicContact CD2-CG2 3.65Å; L248-I292 HydrophobicContact CG-CG2 4.4Å; L248-I292 PolarHBondContact N-O 3.02Å; I270-I292 HydrophobicContact CD1-CD1 3.99Å; I270-I292 HydrophobicContact CD1-CG2 4.41Å; L287-I292 HydrophobicContact CD1-CD1 4.1Å; L287-I292 HydrophobicContact CD1-CG1 4.29Å; P289-I292 PolarHBondContact O-N 3.08Å; I292-V300 HydrophobicContact CG2-CG1 3.8Å; I292-V300 HydrophobicContact CG2-CG2 4.32Å; I292-L302 HydrophobicContact CB-CD2 4.44Å; I292-L302 HydrophobicContact CG1-CD2 3.83Å; I292-L302 HydrophobicContact CG2-CD2 4.34Å
293	L	90.4	Very high	82.1	Confident	30 Å²	30	38.2 Å²	38.2	16%	0.157	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	161.3	177.6	-55.8	-171.2	0	0	0	110.9	V243 G246 E247 V300 V301 T303	V243-L293 HydrophobicContact CB-CB 4.26Å; V243-L293 HydrophobicContact CB-CD1 3.87Å; V243-L293 HydrophobicContact CG1-CB 3.72Å; V243-L293 HydrophobicContact CG1-CD1 4.25Å; V243-L293 HydrophobicContact CG2-CD1 4.43Å; G246-L293 CarbonylContact O-C 3.54Å; G246-L293 WeakPolarHBondContact O-CA 3.35Å; E247-L293 HydrophobicContact CB-CD2 4.26Å; E247-L293 HydrophobicContact CG-CD2 3.64Å; L293-V300 CarbonylContact O-C 3.57Å; L293-V300 WeakPolarHBondContact O-CA 3.3Å; L293-V301 PolarHBondContact N-O 2.94Å; L293-V301 PolarHBondContact O-N 3.18Å; L293-T303 HydrophobicContact CB-CG2 4.45Å; L293-T303 HydrophobicContact CD1-CG2 3.54Å; L293-T303 HydrophobicContact CG-CG2 3.76Å
294	L	90.8	Very high	82.2	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.026	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	138.1	167.1	-64.6	-176.9	0	0	0	109.9	V243 G245 G246 L248 Y266 H299 V300	V243-L294 WeakPolarHBondContact CG1-O 3.5Å; G245-L294 CarbonylContact C-O 3.56Å; G245-L294 WeakPolarHBondContact CA-O 3.42Å; G245-L294 PolarHBondContact N-O 3.32Å; G246-L294 PolarHBondContact O-N 2.93Å; L248-L294 HydrophobicContact CD1-CD1 4Å; L248-L294 HydrophobicContact CD1-CD2 4.09Å; L248-L294 HydrophobicContact CD1-CG 4.18Å; Y266-L294 HydrophobicContact CD1-CD2 4.31Å; Y266-L294 HydrophobicContact CE1-CD2 3.78Å; L294-H299 CarbonylContact C-O 3.58Å; L294-H299 VanDerWaalsContact CA-O 3.31Å; L294-H299 WeakPolarHBondContact CA-O 3.4Å; L294-V300 HydrophobicContact CD2-CG2 4.21Å
295	D	90.4	Very high	82.1	Confident	44 Å²	44	39.1 Å²	39.1	24%	0.235	21%	0.208	C	C	.	.			trans	-78.3	-176.6	170.4	75.5	6.4	0	0	0	112.3	V243 M297 G298 H299 V301	V243-D295 HydrophobicContact CG1-CB 4.33Å; D295-M297 PolarHBondContact O-N 3.12Å; D295-M297 WeakPolarHBondContact OD1-CA 3.43Å; D295-M297 WeakPolarHBondContact OD1-CB 3.36Å; D295-M297 PolarHBondContact OD1-N 3.29Å; D295-G298 PolarHBondContact O-N 2.79Å; D295-G298 VanDerWaalsContact O-N 3.14Å; D295-G298 PolarHBondContact OD1-N 3.24Å; D295-H299 PolarHBondContact N-O 2.71Å; D295-H299 PolarHBondContact OD1-N 3.14Å; D295-H299 IonicContact OD2-CD2 3.69Å; D295-V301 HydrophobicContact CB-CG2 4.14Å
296	S	89.1	Confident	81.5	Confident	94 Å²	94	37.1 Å²	37.1	66%	0.657	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.4	179.6	52.7	0	0	0	0	114.4	N244	N244-S296 WeakPolarHBondContact OD1-CB 3.21Å; N244-S296 PolarHBondContact OD1-N 3.08Å
297	M	90.9	Very high	80.6	Confident	150 Å²	150	37.8 Å²	37.8	74%	0.739	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-9.2	178.6	-66.5	-177.4	60.3	0	0	112.3	D295	D295-M297 PolarHBondContact O-N 3.12Å; D295-M297 WeakPolarHBondContact OD1-CA 3.43Å; D295-M297 WeakPolarHBondContact OD1-CB 3.36Å; D295-M297 PolarHBondContact OD1-N 3.29Å
298	G	91	Very high	79.6	Confident	22 Å²	22	35.6 Å²	35.6	23%	0.227	19%	0.194	C	C	.	.	S	Bend	trans	91.3	15.9	179.8	0	0	0	0	0	114.3	Y266 D295	Y266-G298 WeakPolarHBondContact CE1-O 3.19Å; D295-G298 PolarHBondContact O-N 2.79Å; D295-G298 VanDerWaalsContact O-N 3.14Å; D295-G298 PolarHBondContact OD1-N 3.24Å
299	H	94.9	Very high	78.6	Confident	61 Å²	61	36 Å²	36	28%	0.282	20%	0.196	S	C	.	.			trans	-83.1	148.2	172.9	-66.5	-70.9	0	0	0	111.5	F222 F265 E269 L294 D295	F222-H299 HydrophobicContact CE1-CB 4.35Å; F265-H299 AromaticContact CZ-CE1 3.9Å; F265-H299 AromaticContact CZ-ND1 3.68Å; E269-H299 IonicContact OE1-CE1 3.61Å; E269-H299 IonicContact OE1-CG 3.52Å; E269-H299 IonicContact OE1-ND1 3.68Å; E269-H299 PolarHBondContact OE1-ND1 2.99Å; L294-H299 CarbonylContact C-O 3.58Å; L294-H299 VanDerWaalsContact CA-O 3.31Å; L294-H299 WeakPolarHBondContact CA-O 3.4Å; D295-H299 PolarHBondContact N-O 2.71Å; D295-H299 PolarHBondContact OD1-N 3.14Å; D295-H299 IonicContact OD2-CD2 3.69Å
300	V	93.4	Very high	78	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	134.1	176.1	169	0	0	0	0	111.1	F222 Y266 E269 I270 I292 L293 L294 L302	F222-V300 VanDerWaalsContact CA-O 3.27Å; F222-V300 WeakPolarHBondContact CA-O 3.11Å; F222-V300 WeakPolarHBondContact CB-O 3.23Å; F222-V300 WeakPolarHBondContact CD1-O 3.32Å; Y266-V300 HydrophobicContact CD1-CG2 3.73Å; Y266-V300 HydrophobicContact CG-CG2 4.21Å; E269-V300 HydrophobicContact CB-CB 3.98Å; E269-V300 HydrophobicContact CB-CG2 4.28Å; E269-V300 WeakPolarHBondContact OE2-CB 3.43Å; E269-V300 WeakPolarHBondContact OE2-CG2 3.42Å; E269-V300 PolarHBondContact OE2-N 3.47Å; I270-V300 HydrophobicContact CG1-CG1 3.84Å; I270-V300 HydrophobicContact CG1-CG2 4.29Å; I292-V300 HydrophobicContact CG2-CG1 3.8Å; I292-V300 HydrophobicContact CG2-CG2 4.32Å; L293-V300 CarbonylContact O-C 3.57Å; L293-V300 WeakPolarHBondContact O-CA 3.3Å; L294-V300 HydrophobicContact CD2-CG2 4.21Å; V300-L302 HydrophobicContact CG1-CD2 3.99Å; V300-L302 HydrophobicContact CG1-CG 4.37Å
301	V	92.3	Very high	76.8	Confident	13 Å²	13	35.3 Å²	35.3	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	113.7	166.5	-173.8	0	0	0	0	109.1	V224 V243 L293 D295	V224-V301 HydrophobicContact CB-CG1 3.95Å; V243-V301 HydrophobicContact CG1-CB 4.28Å; V243-V301 HydrophobicContact CG1-CG2 4.22Å; V243-V301 HydrophobicContact CG2-CB 4.11Å; V243-V301 HydrophobicContact CG2-CG1 3.83Å; V243-V301 HydrophobicContact CG2-CG2 4.31Å; L293-V301 PolarHBondContact N-O 2.94Å; L293-V301 PolarHBondContact O-N 3.18Å; D295-V301 HydrophobicContact CB-CG2 4.14Å
302	L	89.3	Confident	75.1	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	134	172.8	-58.5	-174.8	0	0	0	110.3	F222 L223 V224 I270 A273 L274 Y284 L287 I292 V300	F222-L302 PolarHBondContact O-N 3.37Å; L223-L302 HydrophobicContact CD2-CB 3.81Å; L223-L302 HydrophobicContact CD2-CD1 3.96Å; L223-L302 HydrophobicContact CD2-CG 4.27Å; V224-L302 WeakPolarHBondContact CG1-O 3.49Å; V224-L302 PolarHBondContact N-O 3.28Å; I270-L302 HydrophobicContact CG1-CD2 4.41Å; A273-L302 HydrophobicContact CB-CD1 3.71Å; A273-L302 HydrophobicContact CB-CG 4.38Å; L274-L302 HydrophobicContact CD2-CD1 4.38Å; Y284-L302 HydrophobicContact CE1-CD1 4.45Å; Y284-L302 HydrophobicContact CE2-CB 4.21Å; L287-L302 HydrophobicContact CD1-CD2 4.07Å; I292-L302 HydrophobicContact CB-CD2 4.44Å; I292-L302 HydrophobicContact CG1-CD2 3.83Å; I292-L302 HydrophobicContact CG2-CD2 4.34Å; V300-L302 HydrophobicContact CG1-CD2 3.99Å; V300-L302 HydrophobicContact CG1-CG 4.37Å
303	T	84.3	Confident	72.8	Confident	23 Å²	23	37 Å²	37	14%	0.141	22%	0.222	C	C	.	.			trans	-122.3	176.5	-177.3	63.3	0	0	0	0	112.3	V224 Y284 N291 L293	V224-T303 HydrophobicContact CB-CG2 4.14Å; V224-T303 HydrophobicContact CG1-CG2 4.29Å; Y284-T303 PolarHBondContact OH-N 3.29Å; Y284-T303 PolarHBondContact OH-O 2.82Å; N291-T303 PolarHBondContact O-N 2.94Å; N291-T303 PolarHBondContact O-OG1 3.39Å; L293-T303 HydrophobicContact CB-CG2 4.45Å; L293-T303 HydrophobicContact CD1-CG2 3.54Å; L293-T303 HydrophobicContact CG-CG2 3.76Å
304	D	72.6	Confident	70.5	Confident	51 Å²	51	43.6 Å²	43.6	27%	0.273	26%	0.256	S	S	.	.			trans	55.2	74.2	172.9	-159.7	14.4	0	0	0	116.2	K191 G306	K191-D304 IonicContact NZ-OD1 3.31Å; K191-D304 PolarHBondContact NZ-OD1 3.37Å; D304-G306 PolarHBondContact O-N 3.19Å; D304-G306 PolarHBondContact OD1-N 2.81Å
305	F	67.6	Low	68	Low	8 Å²	8	48.2 Å²	48.2	4%	0.035	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-73.4	16.4	173.6	-60.6	-85.9	0	0	0	114	V213 L214 L223 V224 L277 Y284 L307 C308	V213-F305 HydrophobicContact CG1-CB 4.1Å; V213-F305 HydrophobicContact CG1-CD1 3.99Å; V213-F305 HydrophobicContact CG1-CG 4.21Å; L214-F305 HydrophobicContact CD2-CB 4.35Å; L214-F305 HydrophobicContact CD2-CD2 3.65Å; L214-F305 HydrophobicContact CD2-CE2 4.36Å; L214-F305 HydrophobicContact CD2-CG 4.32Å; L214-F305 HydrophobicContact CG-CB 4.38Å; L223-F305 HydrophobicContact CB-CZ 4.06Å; L223-F305 HydrophobicContact CD1-CE1 4.4Å; L223-F305 HydrophobicContact CD1-CZ 4.34Å; L223-F305 HydrophobicContact CD2-CE1 4.02Å; L223-F305 HydrophobicContact CD2-CZ 3.92Å; L223-F305 HydrophobicContact CG-CZ 4.32Å; V224-F305 HydrophobicContact CG1-CD2 4.32Å; V224-F305 HydrophobicContact CG1-CE2 3.61Å; V224-F305 HydrophobicContact CG1-CZ 4.48Å; L277-F305 HydrophobicContact CD1-CE1 4.31Å; L277-F305 HydrophobicContact CD2-CE1 4.35Å; Y284-F305 AromaticContact CD2-CD1 3.9Å; Y284-F305 HydrophobicContact CD2-CD1 3.9Å; Y284-F305 HydrophobicContact CD2-CE1 4.01Å; Y284-F305 AromaticContact CE2-CD1 3.91Å; Y284-F305 HydrophobicContact CE2-CD1 3.91Å; Y284-F305 AromaticContact CE2-CE1 3.93Å; Y284-F305 HydrophobicContact CE2-CE1 3.93Å; F305-L307 PolarHBondContact O-N 2.87Å; F305-L307 VanDerWaalsContact O-N 3.1Å; F305-C308 HydrophobicContact CB-CB 4.46Å; F305-C308 VanDerWaalsContact CD1-SG 3.59Å; F305-C308 WeakPolarHBondContact O-CB 3.4Å; F305-C308 PolarHBondContact O-N 3.37Å; F305-C308 PolarHBondContact O-SG 3.32Å
306	G	54	Low	65.4	Low	5 Å²	5	50.1 Å²	50.1	5%	0.052	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-59.3	-23.7	-170.5	0	0	0	0	0	116.1	E210 D304	E210-G306 VanDerWaalsContact CD-CA 3.43Å; E210-G306 WeakPolarHBondContact OE2-CA 3.37Å; D304-G306 PolarHBondContact O-N 3.19Å; D304-G306 PolarHBondContact OD1-N 2.81Å
307	L	49.7	Very low	62.9	Low	39 Å²	39	52 Å²	52	20%	0.204	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-113.6	10	178.4	-54	-176.7	0	0	0	113.2	R285 D286 F305	R285-L307 HydrophobicContact CB-CB 4.49Å; R285-L307 PolarHBondContact NE-O 3.12Å; R285-L307 PolarHBondContact NH2-O 3.46Å; D286-L307 HydrophobicContact CB-CB 4.04Å; D286-L307 HydrophobicContact CB-CD1 3.8Å; D286-L307 HydrophobicContact CB-CG 4.11Å; F305-L307 PolarHBondContact O-N 2.87Å; F305-L307 VanDerWaalsContact O-N 3.1Å
308	C	53.7	Low	60.2	Low	0 Å²	0	47.4 Å²	47.4	0%	0	29%	0.287	C	S	.	.			trans	-61.7	144.9	-179.6	-69.4	0	0	0	0	111.7	A209 V213 I282 V283 F305	A209-C308 VanDerWaalsContact CB-O 3.27Å; A209-C308 WeakPolarHBondContact CB-O 3.43Å; V213-C308 HydrophobicContact CB-CB 4.22Å; V213-C308 HydrophobicContact CG1-CB 4.09Å; V213-C308 HydrophobicContact CG2-CB 3.74Å; I282-C308 HydrophobicContact CG2-CB 4.08Å; V283-C308 CarbonylContact O-C 3.5Å; V283-C308 WeakPolarHBondContact O-CA 3.36Å; F305-C308 HydrophobicContact CB-CB 4.46Å; F305-C308 VanDerWaalsContact CD1-SG 3.59Å; F305-C308 WeakPolarHBondContact O-CB 3.4Å; F305-C308 PolarHBondContact O-N 3.37Å; F305-C308 PolarHBondContact O-SG 3.32Å
309	K	50.6	Low	57.4	Low	67 Å²	67	53.1 Å²	53.1	29%	0.291	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	132.1	176.3	-172.9	168.8	167.2	-168	0	110.5	V283 I312 T318	V283-K309 PolarHBondContact N-O 3.47Å; V283-K309 PolarHBondContact O-N 2.96Å; K309-I312 HydrophobicContact CB-CD1 3.77Å; K309-I312 HydrophobicContact CD-CD1 3.8Å; K309-I312 HydrophobicContact CD-CG1 4.37Å; K309-I312 HydrophobicContact CG-CD1 3.62Å; K309-I312 HydrophobicContact CG-CG1 4.13Å; K309-T318 HydrophobicContact CD-CG2 4.02Å
310	E	53.3	Low	54.6	Low	45 Å²	45	53 Å²	53	21%	0.21	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	163.6	-179.4	-53.2	-166.5	146	0	0	112.3	N212 V213 K216 K281 I312	N212-E310 WeakPolarHBondContact CB-OE1 3.09Å; V213-E310 WeakPolarHBondContact CA-OE1 3.48Å; V213-E310 HydrophobicContact CG2-CG 3.53Å; V213-E310 WeakPolarHBondContact CG2-OE1 3.29Å; V213-E310 PolarHBondContact N-OE1 2.93Å; K216-E310 WeakPolarHBondContact CD-OE1 3.45Å; K216-E310 WeakPolarHBondContact CE-OE1 3.41Å; K216-E310 WeakPolarHBondContact CE-OE2 2.97Å; K216-E310 IonicContact NZ-OE1 3.69Å; K216-E310 PolarHBondContact NZ-OE1 3.34Å; K216-E310 IonicContact NZ-OE2 3.35Å; K216-E310 PolarHBondContact NZ-OE2 3.05Å; K281-E310 CarbonylContact O-C 3.6Å; K281-E310 WeakPolarHBondContact O-CA 3.43Å; E310-I312 VanDerWaalsContact C-N 3.28Å; E310-I312 PolarHBondContact O-N 3.43Å
311	G	46.2	Very low	51.5	Low	61 Å²	61	61.7 Å²	61.7	63%	0.629	36%	0.359	S	S	*	.			trans	72.9	22.3	166.4	0	0	0	0	0	113.6	K281	K281-G311 PolarHBondContact O-N 2.88Å
312	I	44.9	Very low	48.6	Very low	21 Å²	21	64.1 Å²	64.1	11%	0.108	38%	0.376	C	S	.	.			trans	-89.3	114	176.6	-62.6	169.5	0	0	0	107.4	K281 V283 K309 E310 D316 T318	K281-I312 WeakPolarHBondContact CD-O 3.46Å; V283-I312 HydrophobicContact CB-CD1 3.97Å; V283-I312 HydrophobicContact CG2-CB 4.16Å; V283-I312 HydrophobicContact CG2-CD1 3.51Å; V283-I312 HydrophobicContact CG2-CG1 4.42Å; V283-I312 HydrophobicContact CG2-CG2 4.25Å; K309-I312 HydrophobicContact CB-CD1 3.77Å; K309-I312 HydrophobicContact CD-CD1 3.8Å; K309-I312 HydrophobicContact CD-CG1 4.37Å; K309-I312 HydrophobicContact CG-CD1 3.62Å; K309-I312 HydrophobicContact CG-CG1 4.13Å; E310-I312 VanDerWaalsContact C-N 3.28Å; E310-I312 PolarHBondContact O-N 3.43Å; I312-D316 HydrophobicContact CG2-CB 3.83Å; I312-T318 HydrophobicContact CD1-CG2 3.49Å; I312-T318 VanDerWaalsContact CD1-CG2 3.49Å; I312-T318 HydrophobicContact CG1-CG2 4.22Å
313	A	39.8	Very low	46	Very low	39 Å²	39	67 Å²	67	32%	0.322	41%	0.406	S	S	.	.			trans	-71	162	167.8	0	0	0	0	0	110.4	S315 D316	A313-S315 PolarHBondContact O-N 3.12Å; A313-D316 WeakPolarHBondContact CB-OD2 3.29Å; A313-D316 PolarHBondContact N-OD2 3.48Å; A313-D316 PolarHBondContact O-N 3.24Å
314	I	42.3	Very low	43.5	Very low	167 Å²	167	71 Å²	71	86%	0.856	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.1	-177.5	-66.2	164.7	0	0	0	111.8
315	S	37.8	Very low	41.8	Very low	103 Å²	103	73.8 Å²	73.8	72%	0.72	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-6.4	177.5	53.6	0	0	0	0	115.1	A313	A313-S315 PolarHBondContact O-N 3.12Å
316	D	35.7	Very low	40.3	Very low	84 Å²	84	81 Å²	81	45%	0.449	49%	0.485	S	S	.	.			trans	-89.2	123.7	-172.5	-70.3	-20.7	0	0	0	111.3	I312 A313	I312-D316 HydrophobicContact CG2-CB 3.83Å; A313-D316 WeakPolarHBondContact CB-OD2 3.29Å; A313-D316 PolarHBondContact N-OD2 3.48Å; A313-D316 PolarHBondContact O-N 3.24Å
317	T	37	Very low	39.6	Very low	133 Å²	133	83.9 Å²	83.9	82%	0.816	50%	0.498	S	S	*	.			trans	-89	143.9	172.3	49.6	0	0	0	0	111
318	T	34.2	Very low	39.2	Very low	53 Å²	53	84.4 Å²	84.4	33%	0.325	50%	0.501	S	S	.	.			trans	-105	126.4	173.9	66.5	0	0	0	0	110.6	K309 I312 T320	K309-T318 HydrophobicContact CD-CG2 4.02Å; I312-T318 HydrophobicContact CD1-CG2 3.49Å; I312-T318 VanDerWaalsContact CD1-CG2 3.49Å; I312-T318 HydrophobicContact CG1-CG2 4.22Å; T318-T320 VanDerWaalsContact C-N 3.27Å; T318-T320 PolarHBondContact O-N 2.88Å
319	T	32.4	Very low	38.5	Very low	143 Å²	143	89.9 Å²	89.9	88%	0.877	53%	0.53	S	S	*	.			trans	-82.5	7	-177.6	53.1	0	0	0	0	114.7
320	T	34.7	Very low	37.9	Very low	57 Å²	57	91.1 Å²	91.1	35%	0.35	55%	0.547	S	S	.	.			trans	-94.5	114	-175.7	-41.1	0	0	0	0	110.3	T318 C322	T318-T320 VanDerWaalsContact C-N 3.27Å; T318-T320 PolarHBondContact O-N 2.88Å; T320-C322 PolarHBondContact O-N 2.69Å
321	F	28.5	Very low	37.3	Very low	183 Å²	183	91.6 Å²	91.6	80%	0.803	55%	0.553	S	S	*	*			trans	-69.5	109.8	175.9	-152.2	-91.6	0	0	0	109.9
322	C	32.7	Very low	37	Very low	65 Å²	65	91.3 Å²	91.3	44%	0.439	54%	0.536	S	S	.	.			trans	-145.3	128.1	177.9	-65.7	0	0	0	0	109.7	T320	T320-C322 PolarHBondContact O-N 2.69Å
323	G	34.2	Very low	36.7	Very low	60 Å²	60	93.5 Å²	93.5	62%	0.619	55%	0.553	S	S	*	*			trans	145	142.6	176.8	0	0	0	0	0	112.6
324	T	32.5	Very low	36.5	Very low	106 Å²	106	95.8 Å²	95.8	65%	0.65	57%	0.566	S	S	*	*			trans	-95.5	126.3	168.2	-49.3	0	0	0	0	108.3	E326	T324-E326 VanDerWaalsContact C-N 3.27Å; T324-E326 PolarHBondContact O-N 2.86Å; T324-E326 VanDerWaalsContact O-N 3.12Å
325	P	36.1	Very low	36.1	Very low	111 Å²	111	90.7 Å²	90.7	72%	0.721	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-12.9	-166.4	-22.8	33.7	0	0	0	116.9
326	E	36	Very low	35.7	Very low	159 Å²	159	88.9 Å²	88.9	74%	0.743	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-19.3	-152.8	-69	174.3	176.1	0	0	115.3	T324	T324-E326 VanDerWaalsContact C-N 3.27Å; T324-E326 PolarHBondContact O-N 2.86Å; T324-E326 VanDerWaalsContact O-N 3.12Å
327	I	40.2	Very low	35.6	Very low	65 Å²	65	87.9 Å²	87.9	33%	0.333	54%	0.537	S	S	.	.	S	Bend	trans	-110.8	-26.2	-169.7	-64.7	-179.7	0	0	0	114.7	F249 P289 N329 C330	F249-I327 HydrophobicContact CD2-CD1 4.28Å; F249-I327 HydrophobicContact CE2-CD1 3.82Å; P289-I327 HydrophobicContact CG-CB 4.22Å; P289-I327 HydrophobicContact CG-CD1 3.38Å; P289-I327 HydrophobicContact CG-CG1 4.35Å; P289-I327 HydrophobicContact CG-CG2 3.79Å; I327-N329 PolarHBondContact O-N 3.14Å; I327-C330 PolarHBondContact O-N 3.27Å
328	L	41.3	Very low	35.4	Very low	50 Å²	50	86.3 Å²	86.3	26%	0.262	53%	0.53	S	S	.	.	H	α-helix	trans	-61.4	-29.7	172.9	-83.6	104.1	0	0	0	112.2	C330 L332 F343	L328-C330 VanDerWaalsContact C-N 3.29Å; L328-C330 PolarHBondContact O-N 3.4Å; L328-L332 HydrophobicContact CB-CD1 4.21Å; L328-L332 HydrophobicContact CD2-CD1 3.65Å; L328-L332 HydrophobicContact CG-CD1 4.18Å; L328-L332 WeakPolarHBondContact O-CB 3.46Å; L328-L332 PolarHBondContact O-N 3.2Å; L328-F343 HydrophobicContact CD2-CD1 3.53Å; L328-F343 HydrophobicContact CD2-CD2 4.45Å; L328-F343 HydrophobicContact CD2-CE1 3.08Å; L328-F343 HydrophobicContact CD2-CE2 4.08Å; L328-F343 HydrophobicContact CD2-CG 4.2Å; L328-F343 HydrophobicContact CD2-CZ 3.39Å
329	N	37.4	Very low	35.1	Very low	115 Å²	115	91.2 Å²	91.2	62%	0.615	55%	0.554	S	S	*	*	H	α-helix	trans	-69.1	-20.9	179.5	-115	8.2	0	0	0	114.1	I327 C333	I327-N329 PolarHBondContact O-N 3.14Å; N329-C333 WeakPolarHBondContact O-CB 3.35Å; N329-C333 PolarHBondContact O-SG 3.2Å; N329-C333 PolarHBondContact OD1-SG 3.19Å
330	C	38.8	Very low	35.1	Very low	94 Å²	94	88.4 Å²	88.4	64%	0.635	54%	0.537	S	S	*	.	H	α-helix	trans	-94.4	-34.2	-176.1	-141.5	0	0	0	0	112.8	I327 L328 S334	I327-C330 PolarHBondContact O-N 3.27Å; L328-C330 VanDerWaalsContact C-N 3.29Å; L328-C330 PolarHBondContact O-N 3.4Å; C330-S334 PolarHBondContact O-OG 3.23Å
331	V	40.1	Very low	34.9	Very low	55 Å²	55	91.1 Å²	91.1	33%	0.333	56%	0.558	S	S	.	*	H	α-helix	trans	-88.3	-33.3	-179.5	180	0	0	0	0	112	A267 L335	A267-V331 HydrophobicContact CB-CG1 4.25Å; V331-L335 WeakPolarHBondContact O-CD1 3.1Å
332	L	40.7	Very low	35.1	Very low	55 Å²	55	87.5 Å²	87.5	29%	0.288	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-31.5	-175.7	-63.6	165.5	0	0	0	113.9	L328 S334 L335 F343	L328-L332 HydrophobicContact CB-CD1 4.21Å; L328-L332 HydrophobicContact CD2-CD1 3.65Å; L328-L332 HydrophobicContact CG-CD1 4.18Å; L328-L332 WeakPolarHBondContact O-CB 3.46Å; L328-L332 PolarHBondContact O-N 3.2Å; L332-S334 VanDerWaalsContact C-N 3.27Å; L332-S334 PolarHBondContact O-N 3.34Å; L332-L335 PolarHBondContact O-N 3.09Å; L332-F343 HydrophobicContact CD1-CD2 4.45Å; L332-F343 HydrophobicContact CD1-CE2 3.94Å; L332-F343 HydrophobicContact CD1-CZ 4.3Å
333	C	37.7	Very low	35.2	Very low	66 Å²	66	90.5 Å²	90.5	45%	0.446	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-66.1	-30.9	175.9	-73.2	0	0	0	0	112.4	N329 L335 G336	N329-C333 WeakPolarHBondContact O-CB 3.35Å; N329-C333 PolarHBondContact O-SG 3.2Å; N329-C333 PolarHBondContact OD1-SG 3.19Å; C333-L335 PolarHBondContact O-N 3.47Å; C333-G336 PolarHBondContact O-N 2.72Å
334	S	36.1	Very low	35	Very low	87 Å²	87	92.6 Å²	92.6	61%	0.608	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-69.6	-13.3	176.7	-55.3	0	0	0	0	113.8	C330 L332	C330-S334 PolarHBondContact O-OG 3.23Å; L332-S334 VanDerWaalsContact C-N 3.27Å; L332-S334 PolarHBondContact O-N 3.34Å
335	L	34.8	Very low	35	Very low	61 Å²	61	93.2 Å²	93.2	32%	0.319	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-102.1	4.4	-177.5	-68.7	168.8	0	0	0	113.7	R264 A267 V331 L332 C333 C337	R264-L335 HydrophobicContact CG-CD2 4.37Å; A267-L335 HydrophobicContact CB-CD1 3.45Å; A267-L335 VanDerWaalsContact CB-CD1 3.45Å; V331-L335 WeakPolarHBondContact O-CD1 3.1Å; L332-L335 PolarHBondContact O-N 3.09Å; C333-L335 PolarHBondContact O-N 3.47Å; L335-C337 PolarHBondContact O-N 3.38Å; L335-C337 VanDerWaalsContact O-N 3.14Å
336	G	29.1	Very low	34.5	Very low	65 Å²	65	93 Å²	93	67%	0.67	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.2	14.6	-179	0	0	0	0	0	114.1	C333 C338	C333-G336 PolarHBondContact O-N 2.72Å; G336-C338 PolarHBondContact O-N 3.49Å
337	C	34.2	Very low	34.2	Very low	62 Å²	62	91.3 Å²	91.3	42%	0.419	56%	0.56	S	S	.	*			trans	-78.8	29.4	-179.5	-64.9	0	0	0	0	113.5	L335 N339 V340	L335-C337 PolarHBondContact O-N 3.38Å; L335-C337 VanDerWaalsContact O-N 3.14Å; C337-N339 PolarHBondContact O-N 3.13Å; C337-N339 VanDerWaalsContact O-N 3.09Å; C337-V340 PolarHBondContact O-N 3.14Å
338	C	31.5	Very low	33.4	Very low	101 Å²	101	93.4 Å²	93.4	68%	0.682	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-5.6	178	-65.3	0	0	0	0	113.9	G336	G336-C338 PolarHBondContact O-N 3.49Å
339	N	28.8	Very low	33	Very low	155 Å²	155	101.4 Å²	101.4	83%	0.829	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	9.9	-178.4	-82.4	-13.6	0	0	0	115.3	C337 S341	C337-N339 PolarHBondContact O-N 3.13Å; C337-N339 VanDerWaalsContact O-N 3.09Å; N339-S341 PolarHBondContact O-N 3.32Å
340	V	32.3	Very low	32.8	Very low	85 Å²	85	100.8 Å²	100.8	52%	0.515	63%	0.631	S	S	.	*			trans	-90.4	99.7	168.5	-172.8	0	0	0	0	108.1	C337 I342	C337-V340 PolarHBondContact O-N 3.14Å; V340-I342 HydrophobicContact CG1-CB 4.2Å; V340-I342 HydrophobicContact CG1-CD1 3.96Å; V340-I342 HydrophobicContact CG1-CG1 4.07Å; V340-I342 PolarHBondContact O-N 3.01Å
341	S	29.6	Very low	32.5	Very low	113 Å²	113	101.1 Å²	101.1	79%	0.79	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	35.3	-179.2	-46.9	0	0	0	0	115.6	N339	N339-S341 PolarHBondContact O-N 3.32Å
342	I	33.7	Very low	32.1	Very low	108 Å²	108	103.7 Å²	103.7	55%	0.554	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	-7.5	-177.7	-64.7	176.2	0	0	0	112	V340	V340-I342 HydrophobicContact CG1-CB 4.2Å; V340-I342 HydrophobicContact CG1-CD1 3.96Å; V340-I342 HydrophobicContact CG1-CG1 4.07Å; V340-I342 PolarHBondContact O-N 3.01Å
343	F	34.5	Very low	31.6	Very low	127 Å²	127	106.5 Å²	106.5	56%	0.557	67%	0.669	S	S	*	*			trans	-112.3	64.7	172.4	-66.3	-72.2	0	0	0	111.3	L328 L332 V345	L328-F343 HydrophobicContact CD2-CD1 3.53Å; L328-F343 HydrophobicContact CD2-CD2 4.45Å; L328-F343 HydrophobicContact CD2-CE1 3.08Å; L328-F343 HydrophobicContact CD2-CE2 4.08Å; L328-F343 HydrophobicContact CD2-CG 4.2Å; L328-F343 HydrophobicContact CD2-CZ 3.39Å; L332-F343 HydrophobicContact CD1-CD2 4.45Å; L332-F343 HydrophobicContact CD1-CE2 3.94Å; L332-F343 HydrophobicContact CD1-CZ 4.3Å; F343-V345 PolarHBondContact O-N 3.27Å; F343-V345 VanDerWaalsContact O-N 3.13Å
344	S	29.5	Very low	31.2	Very low	104 Å²	104	109.1 Å²	109.1	73%	0.727	68%	0.683	S	S	*	*			trans	-81.5	90	170.8	-63.8	0	0	0	0	110.4
345	V	32.5	Very low	30.8	Very low	119 Å²	119	110.5 Å²	110.5	72%	0.721	69%	0.687	S	S	*	*			trans	-104.5	83.6	139.2	-176.5	0	0	0	0	106.4	F343	F343-V345 PolarHBondContact O-N 3.27Å; F343-V345 VanDerWaalsContact O-N 3.13Å
346	V	24.8	Very low	30.6	Very low	106 Å²	106	114.1 Å²	114.1	64%	0.642	71%	0.714	S	S	*	*			trans	-144.2	124	158.1	-175	0	0	0	0	107.5
347	P	30.7	Very low	30.7	Very low	125 Å²	125	117.8 Å²	117.8	81%	0.812	72%	0.717	S	S	*	*			trans	-76.8	122.9	162.9	31.1	-26.3	0	0	0	107.9
348	C	23.6	Very low	30.4	Very low	108 Å²	108	122.5 Å²	122.5	73%	0.73	74%	0.742	S	S	*	*			trans	-114.8	109.7	166.9	-80.4	0	0	0	0	109.2
349	T	32.9	Very low	30.3	Very low	219 Å²	219	124.5 Å²	124.5	100%	1.344	75%	0.747	S	S	*	*			trans	57.2	0	170.9	55.8	0	0	0	0	118.4

Retrieved 349 of 349 residues in 369.6 ms (Link to these results)

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