A0A061I1F9_CRIGR Loading...

Ankyrin repeat and EF-hand domain containing 1

AlphaFold DB , UniProt , Accession A0A061I1F9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ankef1, Length 775 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	69.8	Low	224 Å²	224	112.7 Å²	112.7	100%	1.103	59%	0.591	S	S	*	*				0	-3.4	0	-84.5	-177.5	-108.2	0	0	114.7
2	A	53.2	Low	71.2	Confident	82 Å²	82	106.8 Å²	106.8	68%	0.678	56%	0.558	S	S	*	*	H	α-helix	trans	-92.2	-13.9	-173.2	0	0	0	0	0	117.4
3	L	54.8	Low	72.5	Confident	156 Å²	156	99 Å²	99	82%	0.817	52%	0.517	S	S	*	.	H	α-helix	trans	-91.4	-32.6	-175.2	-103.8	131.3	0	0	0	113.9	R7	L3-R7 WeakPolarHBondContact O-CB 3.33Å; L3-R7 PolarHBondContact O-N 3.24Å
4	A	54.7	Low	73.8	Confident	72 Å²	72	97.9 Å²	97.9	60%	0.595	50%	0.503	S	S	*	.	H	α-helix	trans	-72.5	-40.2	-179.5	0	0	0	0	0	111.6	R7 L8	A4-R7 WeakPolarHBondContact O-CB 3.48Å; A4-R7 PolarHBondContact O-N 3.39Å; A4-L8 PolarHBondContact O-N 3.42Å
5	D	66.6	Low	74.9	Confident	102 Å²	102	99.1 Å²	99.1	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-45.1	177.8	-67.4	-19.9	0	0	0	111.5	R7 L8 E9	D5-R7 PolarHBondContact O-N 3.2Å; D5-L8 PolarHBondContact O-N 3.28Å; D5-L8 VanDerWaalsContact O-N 3.15Å; D5-E9 WeakPolarHBondContact O-CB 3.29Å; D5-E9 PolarHBondContact O-N 3.26Å
6	K	75.8	Confident	75.9	Confident	138 Å²	138	93.1 Å²	93.1	60%	0.6	47%	0.469	S	S	*	.	H	α-helix	trans	-58.2	-35.4	171.9	-91.1	-176.1	172.7	-179.2	0	113.1	N10	K6-N10 WeakPolarHBondContact O-CB 3.16Å; K6-N10 PolarHBondContact O-N 3.41Å; K6-N10 PolarHBondContact O-ND2 3.03Å; K6-N10 VanDerWaalsContact O-ND2 3.1Å
7	R	79.9	Confident	76.8	Confident	184 Å²	184	88.1 Å²	88.1	69%	0.694	44%	0.444	S	S	*	.	H	α-helix	trans	-69.7	-42.5	177.4	-173.7	177.3	178.2	-179.3	-0.3	111.1	L3 A4 D5 L11	L3-R7 WeakPolarHBondContact O-CB 3.33Å; L3-R7 PolarHBondContact O-N 3.24Å; A4-R7 WeakPolarHBondContact O-CB 3.48Å; A4-R7 PolarHBondContact O-N 3.39Å; D5-R7 PolarHBondContact O-N 3.2Å; R7-L11 HydrophobicContact CG-CD1 4.34Å; R7-L11 WeakPolarHBondContact O-CB 3.27Å; R7-L11 VanDerWaalsContact O-CG 3.25Å; R7-L11 WeakPolarHBondContact O-CG 3.45Å; R7-L11 PolarHBondContact O-N 3.46Å
8	L	81.8	Confident	77.7	Confident	94 Å²	94	88.2 Å²	88.2	49%	0.492	44%	0.443	S	S	.	.	H	α-helix	trans	-65.2	-44.6	176.8	-178.2	63.6	0	0	0	111.3	A4 D5 L11 Q12	A4-L8 PolarHBondContact O-N 3.42Å; D5-L8 PolarHBondContact O-N 3.28Å; D5-L8 VanDerWaalsContact O-N 3.15Å; L8-L11 PolarHBondContact O-N 3.46Å; L8-Q12 WeakPolarHBondContact O-CG 3.32Å; L8-Q12 PolarHBondContact O-N 3.48Å
9	E	82.3	Confident	78.4	Confident	33 Å²	33	83.8 Å²	83.8	15%	0.154	42%	0.421	C	S	.	.	H	α-helix	trans	-53.9	-55.3	173.5	-177.2	-170.6	164.1	0	0	110.8	D5 L11 Q12 I13 Y36 F42	D5-E9 WeakPolarHBondContact O-CB 3.29Å; D5-E9 PolarHBondContact O-N 3.26Å; E9-L11 VanDerWaalsContact C-N 3.31Å; E9-L11 PolarHBondContact O-N 3.01Å; E9-Q12 PolarHBondContact O-N 3.49Å; E9-I13 HydrophobicContact CG-CD1 4.05Å; E9-I13 WeakPolarHBondContact O-CG1 3.34Å; E9-I13 PolarHBondContact O-N 2.86Å; E9-Y36 HydrophobicContact CG-CD1 4.5Å; E9-Y36 HydrophobicContact CG-CE1 4.44Å; E9-F42 WeakPolarHBondContact OE1-CD1 3.5Å; E9-F42 WeakPolarHBondContact OE1-CE1 3.45Å
10	N	87.1	Confident	79.1	Confident	50 Å²	50	80 Å²	80	27%	0.267	40%	0.402	S	S	.	.	H	α-helix	trans	-57	-42.4	177.9	-73.7	-26.2	0	0	0	112.6	K6 Q12 I13 Y14	K6-N10 WeakPolarHBondContact O-CB 3.16Å; K6-N10 PolarHBondContact O-N 3.41Å; K6-N10 PolarHBondContact O-ND2 3.03Å; K6-N10 VanDerWaalsContact O-ND2 3.1Å; N10-Q12 VanDerWaalsContact C-N 3.33Å; N10-Q12 PolarHBondContact O-N 3.06Å; N10-I13 PolarHBondContact O-N 3.03Å; N10-Y14 WeakPolarHBondContact O-CD2 3.33Å; N10-Y14 PolarHBondContact O-N 3.19Å
11	L	87.1	Confident	79.7	Confident	105 Å²	105	84.2 Å²	84.2	55%	0.55	41%	0.413	S	S	.	.	H	α-helix	trans	-63.9	-38.9	177.2	-73.8	170.7	0	0	0	112	R7 L8 E9 R15	R7-L11 HydrophobicContact CG-CD1 4.34Å; R7-L11 WeakPolarHBondContact O-CB 3.27Å; R7-L11 VanDerWaalsContact O-CG 3.25Å; R7-L11 WeakPolarHBondContact O-CG 3.45Å; R7-L11 PolarHBondContact O-N 3.46Å; L8-L11 PolarHBondContact O-N 3.46Å; E9-L11 VanDerWaalsContact C-N 3.31Å; E9-L11 PolarHBondContact O-N 3.01Å; L11-R15 WeakPolarHBondContact O-CB 3.22Å; L11-R15 PolarHBondContact O-N 3.42Å
12	Q	86.6	Confident	82	Confident	42 Å²	42	78.9 Å²	78.9	20%	0.196	39%	0.389	C	S	.	.	H	α-helix	trans	-69.3	-39	176.3	-71.6	-171.4	5	0	0	111.8	L8 E9 N10 R15 V16 L39	L8-Q12 WeakPolarHBondContact O-CG 3.32Å; L8-Q12 PolarHBondContact O-N 3.48Å; E9-Q12 PolarHBondContact O-N 3.49Å; N10-Q12 VanDerWaalsContact C-N 3.33Å; N10-Q12 PolarHBondContact O-N 3.06Å; Q12-R15 PolarHBondContact O-N 2.68Å; Q12-V16 WeakPolarHBondContact O-CG2 3.41Å; Q12-V16 PolarHBondContact O-N 3.44Å; Q12-L39 HydrophobicContact CB-CD1 3.96Å; Q12-L39 HydrophobicContact CB-CD2 3.9Å
13	I	88.4	Confident	83.9	Confident	5 Å²	5	81.2 Å²	81.2	3%	0.026	38%	0.384	C	S	.	.	H	α-helix	trans	-58.1	-54.8	173.3	-66.2	165.2	0	0	0	109.6	E9 N10 R15 V16 L17 L39 F42 E44	E9-I13 HydrophobicContact CG-CD1 4.05Å; E9-I13 WeakPolarHBondContact O-CG1 3.34Å; E9-I13 PolarHBondContact O-N 2.86Å; N10-I13 PolarHBondContact O-N 3.03Å; I13-R15 PolarHBondContact O-N 3Å; I13-V16 PolarHBondContact O-N 2.77Å; I13-L17 HydrophobicContact CG2-CD1 4.02Å; I13-L17 HydrophobicContact CG2-CG 4.38Å; I13-L17 WeakPolarHBondContact O-CG 3.32Å; I13-L17 PolarHBondContact O-N 3.22Å; I13-L39 HydrophobicContact CG1-CD1 3.73Å; I13-F42 HydrophobicContact CD1-CB 3.61Å; I13-F42 HydrophobicContact CD1-CG 4.31Å; I13-F42 HydrophobicContact CG1-CB 3.86Å; I13-E44 HydrophobicContact CG2-CB 4.29Å
14	Y	90.8	Very high	85.7	Confident	83 Å²	83	77.1 Å²	77.1	33%	0.325	36%	0.363	S	S	.	.	H	α-helix	trans	-59	-35.4	178.3	-74.8	-59	0	0	0	112.7	N10 L17 Q18 E44 P45 I46	N10-Y14 WeakPolarHBondContact O-CD2 3.33Å; N10-Y14 PolarHBondContact O-N 3.19Å; Y14-L17 HydrophobicContact CD1-CD1 4.49Å; Y14-L17 PolarHBondContact O-N 3.27Å; Y14-Q18 WeakPolarHBondContact O-CB 3.39Å; Y14-Q18 PolarHBondContact O-N 3.16Å; Y14-E44 HydrophobicContact CE1-CB 4.08Å; Y14-E44 WeakPolarHBondContact CE1-OE2 3.31Å; Y14-P45 HydrophobicContact CE2-CG 4.18Å; Y14-P45 WeakPolarHBondContact OH-CD 3.31Å; Y14-P45 WeakPolarHBondContact OH-CG 3.38Å; Y14-I46 WeakPolarHBondContact OH-CD1 3.36Å
15	R	90	Very high	87.4	Confident	116 Å²	116	77.4 Å²	77.4	44%	0.438	35%	0.351	S	S	.	.	H	α-helix	trans	-65.9	-42.3	175.9	-173.3	59.4	175	-178.4	-1.5	111.9	L11 Q12 I13 Q18 C19 L31	L11-R15 WeakPolarHBondContact O-CB 3.22Å; L11-R15 PolarHBondContact O-N 3.42Å; Q12-R15 PolarHBondContact O-N 2.68Å; I13-R15 PolarHBondContact O-N 3Å; R15-Q18 PolarHBondContact O-N 3.2Å; R15-C19 PolarHBondContact O-N 3.47Å; R15-C19 PolarHBondContact O-SG 3.29Å; R15-L31 HydrophobicContact CG-CD1 3.96Å
16	V	90.8	Very high	88.6	Confident	4 Å²	4	80.9 Å²	80.9	2%	0.024	36%	0.361	C	S	.	.	H	α-helix	trans	-62	-47.5	174.8	170.8	0	0	0	0	110.3	Q12 I13 Q18 C19 V20 L31 L39 A51	Q12-V16 WeakPolarHBondContact O-CG2 3.41Å; Q12-V16 PolarHBondContact O-N 3.44Å; I13-V16 PolarHBondContact O-N 2.77Å; V16-Q18 VanDerWaalsContact C-N 3.3Å; V16-Q18 PolarHBondContact O-N 3.07Å; V16-C19 WeakPolarHBondContact O-CA 3.29Å; V16-C19 WeakPolarHBondContact O-CB 3.3Å; V16-C19 PolarHBondContact O-N 3.23Å; V16-V20 HydrophobicContact CG1-CG2 4.5Å; V16-V20 WeakPolarHBondContact O-CG2 3.34Å; V16-V20 PolarHBondContact O-N 3.45Å; V16-L31 HydrophobicContact CG2-CB 4.13Å; V16-L31 HydrophobicContact CG2-CD1 3.86Å; V16-L39 HydrophobicContact CG2-CD2 3.54Å; V16-L39 HydrophobicContact CG2-CG 4Å; V16-A51 HydrophobicContact CG1-CB 4.21Å
17	L	92.1	Very high	89.1	Confident	8 Å²	8	77 Å²	77	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-40.2	177.9	-62.5	177.4	0	0	0	112.1	I13 Y14 V20 R21 E44 A51 L54	I13-L17 HydrophobicContact CG2-CD1 4.02Å; I13-L17 HydrophobicContact CG2-CG 4.38Å; I13-L17 WeakPolarHBondContact O-CG 3.32Å; I13-L17 PolarHBondContact O-N 3.22Å; Y14-L17 HydrophobicContact CD1-CD1 4.49Å; Y14-L17 PolarHBondContact O-N 3.27Å; L17-V20 PolarHBondContact O-N 2.92Å; L17-R21 WeakPolarHBondContact O-CG 3.14Å; L17-R21 PolarHBondContact O-N 2.89Å; L17-E44 HydrophobicContact CD1-CB 3.82Å; L17-E44 HydrophobicContact CD1-CG 4.47Å; L17-A51 HydrophobicContact CD2-CB 4.38Å; L17-L54 HydrophobicContact CB-CD1 3.74Å; L17-L54 HydrophobicContact CD2-CD1 3.6Å; L17-L54 HydrophobicContact CD2-CG 4.26Å; L17-L54 HydrophobicContact CG-CD1 4.11Å
18	Q	92.3	Very high	89.6	Confident	90 Å²	90	68.2 Å²	68.2	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-63.5	-40.8	173.5	-170.8	-178.1	25.4	0	0	111.9	Y14 R15 V16 V20 R21 N22	Y14-Q18 WeakPolarHBondContact O-CB 3.39Å; Y14-Q18 PolarHBondContact O-N 3.16Å; R15-Q18 PolarHBondContact O-N 3.2Å; V16-Q18 VanDerWaalsContact C-N 3.3Å; V16-Q18 PolarHBondContact O-N 3.07Å; Q18-V20 VanDerWaalsContact C-N 3.34Å; Q18-R21 PolarHBondContact O-N 2.93Å; Q18-N22 WeakPolarHBondContact O-CB 3.36Å; Q18-N22 VanDerWaalsContact O-CG 3.28Å; Q18-N22 PolarHBondContact O-N 2.95Å
19	C	92	Very high	89.9	Confident	4 Å²	4	66.9 Å²	66.9	3%	0.027	30%	0.303	C	S	.	.	H	α-helix	trans	-66.1	-36.9	177.1	-63.5	0	0	0	0	111.8	R15 V16 N22 K23 D24 Q27 I28	R15-C19 PolarHBondContact O-N 3.47Å; R15-C19 PolarHBondContact O-SG 3.29Å; V16-C19 WeakPolarHBondContact O-CA 3.29Å; V16-C19 WeakPolarHBondContact O-CB 3.3Å; V16-C19 PolarHBondContact O-N 3.23Å; C19-N22 CarbonylContact O-C 3.56Å; C19-N22 PolarHBondContact O-N 2.85Å; C19-K23 PolarHBondContact O-N 3.45Å; C19-D24 PolarHBondContact O-N 3.14Å; C19-Q27 VanDerWaalsContact SG-CG 3.59Å; C19-I28 HydrophobicContact CB-CD1 4.22Å; C19-I28 HydrophobicContact CB-CG1 3.64Å
20	V	92	Very high	90.1	Very high	7 Å²	7	71.1 Å²	71.1	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-47.8	173.1	172	0	0	0	0	110.4	V16 L17 Q18 N22 K23 I28 A51 L54 A55 M63 L67	V16-V20 HydrophobicContact CG1-CG2 4.5Å; V16-V20 WeakPolarHBondContact O-CG2 3.34Å; V16-V20 PolarHBondContact O-N 3.45Å; L17-V20 PolarHBondContact O-N 2.92Å; Q18-V20 VanDerWaalsContact C-N 3.34Å; V20-N22 VanDerWaalsContact C-N 3.29Å; V20-N22 PolarHBondContact O-N 3Å; V20-K23 PolarHBondContact O-N 3.07Å; V20-I28 HydrophobicContact CG2-CD1 3.8Å; V20-A51 HydrophobicContact CG2-CB 4.03Å; V20-L54 HydrophobicContact CG1-CB 4.21Å; V20-A55 HydrophobicContact CG1-CB 4.46Å; V20-M63 HydrophobicContact CG1-CG 4.13Å; V20-L67 HydrophobicContact CG2-CD1 4.39Å; V20-L67 HydrophobicContact CG2-CD2 4.46Å
21	R	91.4	Very high	90	Very high	170 Å²	170	69.9 Å²	69.9	64%	0.642	31%	0.314	S	S	*	.	H	α-helix	trans	-59.5	-38.6	175.6	-70.5	179.1	179.9	176.5	2.7	112.7	L17 Q18 K23 L54	L17-R21 WeakPolarHBondContact O-CG 3.14Å; L17-R21 PolarHBondContact O-N 2.89Å; Q18-R21 PolarHBondContact O-N 2.93Å; R21-K23 VanDerWaalsContact C-N 3.28Å; R21-K23 PolarHBondContact O-N 3.42Å; R21-L54 HydrophobicContact CG-CD1 4.38Å
22	N	92.9	Very high	89.9	Confident	112 Å²	112	66.7 Å²	66.7	60%	0.599	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-3	178.1	-67.1	-7.8	0	0	0	113.8	Q18 C19 V20 D24	Q18-N22 WeakPolarHBondContact O-CB 3.36Å; Q18-N22 VanDerWaalsContact O-CG 3.28Å; Q18-N22 PolarHBondContact O-N 2.95Å; C19-N22 CarbonylContact O-C 3.56Å; C19-N22 PolarHBondContact O-N 2.85Å; V20-N22 VanDerWaalsContact C-N 3.29Å; V20-N22 PolarHBondContact O-N 3Å; N22-D24 PolarHBondContact O-N 3.42Å
23	K	92.3	Very high	89.8	Confident	130 Å²	130	73.9 Å²	73.9	57%	0.565	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	27.8	-176.6	-50.1	-172.7	-177.6	-139.6	0	115	C19 V20 R21 K25 D60 M63	C19-K23 PolarHBondContact O-N 3.45Å; V20-K23 PolarHBondContact O-N 3.07Å; R21-K23 VanDerWaalsContact C-N 3.28Å; R21-K23 PolarHBondContact O-N 3.42Å; K23-K25 PolarHBondContact O-N 3.47Å; K23-K25 VanDerWaalsContact O-N 3.14Å; K23-D60 WeakPolarHBondContact CD-OD2 3.48Å; K23-D60 WeakPolarHBondContact CE-OD2 3.5Å; K23-D60 IonicContact NZ-OD2 3.78Å; K23-D60 PolarHBondContact NZ-OD2 3.06Å; K23-M63 HydrophobicContact CB-CE 4.23Å
24	D	92.3	Very high	89.5	Confident	70 Å²	70	80.2 Å²	80.2	37%	0.374	36%	0.358	S	S	.	.			trans	-86.5	84.1	-178.5	-170.1	-9.6	0	0	0	112	C19 N22 K26 Q27 I28	C19-D24 PolarHBondContact O-N 3.14Å; N22-D24 PolarHBondContact O-N 3.42Å; D24-K26 VanDerWaalsContact C-N 3.32Å; D24-K26 PolarHBondContact O-N 3.4Å; D24-K26 PolarHBondContact OD1-N 3.27Å; D24-Q27 HydrophobicContact CB-CB 4.23Å; D24-Q27 VanDerWaalsContact CG-CB 3.5Å; D24-Q27 PolarHBondContact O-N 3.19Å; D24-Q27 PolarHBondContact OD1-N 2.95Å; D24-Q27 WeakPolarHBondContact OD2-CB 3.32Å; D24-I28 WeakPolarHBondContact O-CG1 3.19Å; D24-I28 PolarHBondContact O-N 2.97Å
25	K	91.8	Very high	88.9	Confident	78 Å²	78	77.5 Å²	77.5	34%	0.339	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-36.9	-178.7	-64.1	-173.2	-178.2	-173.3	0	113.4	K23 I28 E29 M63 F66	K23-K25 PolarHBondContact O-N 3.47Å; K23-K25 VanDerWaalsContact O-N 3.14Å; K25-I28 PolarHBondContact O-N 3.31Å; K25-E29 PolarHBondContact O-N 2.86Å; K25-M63 HydrophobicContact CG-CE 3.99Å; K25-F66 HydrophobicContact CB-CD1 4.44Å; K25-F66 HydrophobicContact CB-CE1 3.84Å; K25-F66 HydrophobicContact CB-CE2 4.11Å; K25-F66 HydrophobicContact CB-CZ 3.64Å; K25-F66 HydrophobicContact CD-CD1 4.32Å; K25-F66 HydrophobicContact CD-CD2 4.12Å; K25-F66 HydrophobicContact CD-CE2 4.34Å; K25-F66 HydrophobicContact CD-CG 4.09Å; K25-F66 HydrophobicContact CG-CD1 4.07Å; K25-F66 HydrophobicContact CG-CE1 3.96Å; K25-F66 HydrophobicContact CG-CE2 4.46Å; K25-F66 HydrophobicContact CG-CG 4.34Å; K25-F66 HydrophobicContact CG-CZ 4.15Å; K25-F66 WeakPolarHBondContact O-CZ 3.45Å
26	K	90.2	Very high	88.3	Confident	175 Å²	175	76.4 Å²	76.4	76%	0.761	35%	0.351	S	S	*	.	H	α-helix	trans	-66.9	-41.9	-177.4	-66.8	-177.6	-179.2	178.8	0	111.2	D24 K30	D24-K26 VanDerWaalsContact C-N 3.32Å; D24-K26 PolarHBondContact O-N 3.4Å; D24-K26 PolarHBondContact OD1-N 3.27Å; K26-K30 PolarHBondContact O-N 3.37Å; K26-K30 VanDerWaalsContact O-N 3.11Å
27	Q	88.1	Confident	87.6	Confident	56 Å²	56	80.7 Å²	80.7	26%	0.262	38%	0.379	S	S	.	.	H	α-helix	trans	-69.5	-35.6	178.6	-170.5	66.4	15.4	0	0	111.6	C19 D24 K30 L31	C19-Q27 VanDerWaalsContact SG-CG 3.59Å; D24-Q27 HydrophobicContact CB-CB 4.23Å; D24-Q27 VanDerWaalsContact CG-CB 3.5Å; D24-Q27 PolarHBondContact O-N 3.19Å; D24-Q27 PolarHBondContact OD1-N 2.95Å; D24-Q27 WeakPolarHBondContact OD2-CB 3.32Å; Q27-K30 PolarHBondContact O-N 3.2Å; Q27-L31 HydrophobicContact CG-CD1 4.22Å; Q27-L31 WeakPolarHBondContact O-CB 3.38Å; Q27-L31 VanDerWaalsContact O-CG 3.27Å; Q27-L31 WeakPolarHBondContact O-CG 3.4Å; Q27-L31 PolarHBondContact O-N 3.07Å
28	I	88.8	Confident	87.1	Confident	0 Å²	0	87.6 Å²	87.6	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-62	-50	174.5	-64.6	165	0	0	0	110.5	C19 V20 D24 K25 K30 L31 T32 M63 F66 L67 L70	C19-I28 HydrophobicContact CB-CD1 4.22Å; C19-I28 HydrophobicContact CB-CG1 3.64Å; V20-I28 HydrophobicContact CG2-CD1 3.8Å; D24-I28 WeakPolarHBondContact O-CG1 3.19Å; D24-I28 PolarHBondContact O-N 2.97Å; K25-I28 PolarHBondContact O-N 3.31Å; I28-K30 VanDerWaalsContact C-N 3.26Å; I28-K30 PolarHBondContact O-N 2.87Å; I28-L31 PolarHBondContact O-N 3.43Å; I28-L31 VanDerWaalsContact O-N 3.11Å; I28-T32 HydrophobicContact CG2-CG2 4.26Å; I28-T32 WeakPolarHBondContact O-CG2 3.45Å; I28-T32 PolarHBondContact O-N 2.93Å; I28-T32 PolarHBondContact O-OG1 3.09Å; I28-M63 HydrophobicContact CD1-CE 4.26Å; I28-M63 HydrophobicContact CD1-SD 3.97Å; I28-F66 HydrophobicContact CB-CE1 4.18Å; I28-F66 HydrophobicContact CD1-CE1 4.42Å; I28-F66 HydrophobicContact CG2-CE1 4.06Å; I28-L67 HydrophobicContact CG2-CD2 4.2Å; I28-L70 HydrophobicContact CG2-CD1 3.89Å
29	E	88.8	Confident	86.8	Confident	67 Å²	67	83.5 Å²	83.5	31%	0.313	39%	0.392	S	S	.	.	H	α-helix	trans	-56.1	-39.9	175.6	-94.7	173.3	-148.9	0	0	113.1	K25 T32 R33 F66 L70	K25-E29 PolarHBondContact O-N 2.86Å; E29-T32 WeakPolarHBondContact CA-OG1 3.44Å; E29-T32 PolarHBondContact O-OG1 3.26Å; E29-T32 VanDerWaalsContact O-OG1 3.06Å; E29-R33 WeakPolarHBondContact O-CB 3.2Å; E29-R33 WeakPolarHBondContact O-CG 3.37Å; E29-R33 PolarHBondContact O-N 3.45Å; E29-R33 VanDerWaalsContact O-N 3.13Å; E29-F66 HydrophobicContact CG-CE2 4.3Å; E29-F66 HydrophobicContact CG-CZ 3.87Å; E29-F66 VanDerWaalsContact OE1-CE2 3.3Å; E29-F66 WeakPolarHBondContact OE1-CE2 3.27Å; E29-L70 HydrophobicContact CG-CD1 4.42Å; E29-L70 HydrophobicContact CG-CD2 3.97Å
30	K	86.9	Confident	86.6	Confident	121 Å²	121	83.8 Å²	83.8	53%	0.526	39%	0.393	S	S	.	.	H	α-helix	trans	-65.6	-43.7	177.5	-172.6	178.7	179.4	178.8	0	111.2	K26 Q27 I28 L34	K26-K30 PolarHBondContact O-N 3.37Å; K26-K30 VanDerWaalsContact O-N 3.11Å; Q27-K30 PolarHBondContact O-N 3.2Å; I28-K30 VanDerWaalsContact C-N 3.26Å; I28-K30 PolarHBondContact O-N 2.87Å; K30-L34 HydrophobicContact CG-CD1 3.91Å; K30-L34 WeakPolarHBondContact O-CB 3.45Å; K30-L34 PolarHBondContact O-N 3.44Å
31	L	85.3	Confident	86.5	Confident	25 Å²	25	85.6 Å²	85.6	13%	0.131	40%	0.403	C	S	.	.	H	α-helix	trans	-68.2	-35.3	179.5	-72.1	169.2	0	0	0	112.1	R15 V16 Q27 I28 G35	R15-L31 HydrophobicContact CG-CD1 3.96Å; V16-L31 HydrophobicContact CG2-CB 4.13Å; V16-L31 HydrophobicContact CG2-CD1 3.86Å; Q27-L31 HydrophobicContact CG-CD1 4.22Å; Q27-L31 WeakPolarHBondContact O-CB 3.38Å; Q27-L31 VanDerWaalsContact O-CG 3.27Å; Q27-L31 WeakPolarHBondContact O-CG 3.4Å; Q27-L31 PolarHBondContact O-N 3.07Å; I28-L31 PolarHBondContact O-N 3.43Å; I28-L31 VanDerWaalsContact O-N 3.11Å; L31-G35 WeakPolarHBondContact O-CA 3.49Å; L31-G35 PolarHBondContact O-N 3.04Å
32	T	84.2	Confident	86.4	Confident	38 Å²	38	80.6 Å²	80.6	23%	0.233	39%	0.386	C	S	.	.	H	α-helix	trans	-76.1	-29.7	179.5	55.8	0	0	0	0	112.9	I28 E29 I40	I28-T32 HydrophobicContact CG2-CG2 4.26Å; I28-T32 WeakPolarHBondContact O-CG2 3.45Å; I28-T32 PolarHBondContact O-N 2.93Å; I28-T32 PolarHBondContact O-OG1 3.09Å; E29-T32 WeakPolarHBondContact CA-OG1 3.44Å; E29-T32 PolarHBondContact O-OG1 3.26Å; E29-T32 VanDerWaalsContact O-OG1 3.06Å; T32-I40 HydrophobicContact CG2-CB 4.41Å; T32-I40 HydrophobicContact CG2-CD1 3.35Å; T32-I40 HydrophobicContact CG2-CG1 3.62Å
33	R	85	Confident	86.3	Confident	193 Å²	193	77.7 Å²	77.7	73%	0.728	37%	0.372	S	S	*	.	H	α-helix	trans	-82.9	-37.6	176.9	-70.8	-179.3	-176.1	173.9	6.8	114.1	E29	E29-R33 WeakPolarHBondContact O-CB 3.2Å; E29-R33 WeakPolarHBondContact O-CG 3.37Å; E29-R33 PolarHBondContact O-N 3.45Å; E29-R33 VanDerWaalsContact O-N 3.13Å
34	L	82.4	Confident	86.2	Confident	138 Å²	138	72.2 Å²	72.2	72%	0.723	35%	0.349	S	S	*	.	H	α-helix	trans	-110.8	-11.5	-171.8	-59.6	175.3	0	0	0	113.6	K30	K30-L34 HydrophobicContact CG-CD1 3.91Å; K30-L34 WeakPolarHBondContact O-CB 3.45Å; K30-L34 PolarHBondContact O-N 3.44Å
35	G	77.4	Confident	85.8	Confident	25 Å²	25	71.1 Å²	71.1	26%	0.258	35%	0.346	S	S	.	.	S	Bend	trans	-89.4	-160.7	-179.2	0	0	0	0	0	112.8	L31	L31-G35 WeakPolarHBondContact O-CA 3.49Å; L31-G35 PolarHBondContact O-N 3.04Å
36	Y	76.6	Confident	85.6	Confident	93 Å²	93	72.2 Å²	72.2	37%	0.365	35%	0.354	S	S	.	.	S	Bend	trans	-58.7	139.8	177.6	-160.5	-97.8	0	0	0	111.3	E9 L39 F42	E9-Y36 HydrophobicContact CG-CD1 4.5Å; E9-Y36 HydrophobicContact CG-CE1 4.44Å; Y36-L39 VanDerWaalsContact O-CB 3.27Å; Y36-L39 WeakPolarHBondContact O-CB 3.24Å; Y36-L39 PolarHBondContact O-N 3.14Å; Y36-F42 AromaticContact CD1-CE2 3.83Å; Y36-F42 HydrophobicContact CD1-CE2 3.83Å; Y36-F42 HydrophobicContact CD1-CZ 4.24Å; Y36-F42 AromaticContact CE1-CE2 3.85Å; Y36-F42 HydrophobicContact CE1-CE2 3.85Å; Y36-F42 AromaticContact CE1-CZ 3.76Å; Y36-F42 HydrophobicContact CE1-CZ 3.76Å
37	P	77.8	Confident	85.4	Confident	95 Å²	95	68.4 Å²	68.4	62%	0.617	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	140.7	180	25.3	-33.9	0	0	0	110.9	L39 F42	P37-L39 PolarHBondContact O-N 3.07Å; P37-L39 VanDerWaalsContact O-N 3.08Å; P37-F42 WeakPolarHBondContact O-CE2 3.35Å
38	E	81.4	Confident	85.4	Confident	152 Å²	152	65.8 Å²	65.8	71%	0.71	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	20.6	-178.9	-60.1	-176.7	176.8	0	0	115.3	I40 N41 F42	E38-I40 PolarHBondContact O-N 3Å; E38-N41 PolarHBondContact O-N 3.31Å; E38-F42 HydrophobicContact CB-CE2 4.4Å; E38-F42 WeakPolarHBondContact O-CD2 3.27Å
39	L	85.6	Confident	85.6	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-47.5	-32.5	-177.9	-175.7	61.7	0	0	0	114.1	Q12 I13 V16 Y36 P37 N41 F42	Q12-L39 HydrophobicContact CB-CD1 3.96Å; Q12-L39 HydrophobicContact CB-CD2 3.9Å; I13-L39 HydrophobicContact CG1-CD1 3.73Å; V16-L39 HydrophobicContact CG2-CD2 3.54Å; V16-L39 HydrophobicContact CG2-CG 4Å; Y36-L39 VanDerWaalsContact O-CB 3.27Å; Y36-L39 WeakPolarHBondContact O-CB 3.24Å; Y36-L39 PolarHBondContact O-N 3.14Å; P37-L39 PolarHBondContact O-N 3.07Å; P37-L39 VanDerWaalsContact O-N 3.08Å; L39-N41 VanDerWaalsContact C-N 3.27Å; L39-N41 PolarHBondContact O-N 2.87Å; L39-F42 PolarHBondContact O-N 3.03Å
40	I	87.6	Confident	85.8	Confident	9 Å²	9	63.8 Å²	63.8	5%	0.046	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-63.2	-29.5	-177.7	-109.7	173.4	0	0	0	113.5	T32 E38 L67 L70 A72	T32-I40 HydrophobicContact CG2-CB 4.41Å; T32-I40 HydrophobicContact CG2-CD1 3.35Å; T32-I40 HydrophobicContact CG2-CG1 3.62Å; E38-I40 PolarHBondContact O-N 3Å; I40-L67 HydrophobicContact CD1-CD2 4.2Å; I40-L67 HydrophobicContact CG1-CD2 4.42Å; I40-L70 HydrophobicContact CD1-CB 3.48Å; I40-L70 VanDerWaalsContact CD1-CB 3.48Å; I40-L70 HydrophobicContact CD1-CD1 3.82Å; I40-L70 HydrophobicContact CD1-CG 4.32Å; I40-A72 HydrophobicContact CG2-CB 3.53Å
41	N	89.8	Confident	86.1	Confident	45 Å²	45	58.1 Å²	58.1	24%	0.241	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-93.4	-8.4	-175.8	-68.2	-34.6	0	0	0	113	E38 L39 G71 A72 H73 V76	E38-N41 PolarHBondContact O-N 3.31Å; L39-N41 VanDerWaalsContact C-N 3.27Å; L39-N41 PolarHBondContact O-N 2.87Å; N41-G71 PolarHBondContact ND2-O 3.31Å; N41-A72 WeakPolarHBondContact OD1-CA 3.34Å; N41-H73 PolarHBondContact OD1-N 3.12Å; N41-V76 HydrophobicContact CB-CG2 4.35Å
42	F	90.1	Very high	86.5	Confident	65 Å²	65	57 Å²	57	29%	0.285	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-72.9	146.5	176.7	-73.8	-83.2	0	0	0	111.8	E9 I13 Y36 P37 E38 L39	E9-F42 WeakPolarHBondContact OE1-CD1 3.5Å; E9-F42 WeakPolarHBondContact OE1-CE1 3.45Å; I13-F42 HydrophobicContact CD1-CB 3.61Å; I13-F42 HydrophobicContact CD1-CG 4.31Å; I13-F42 HydrophobicContact CG1-CB 3.86Å; Y36-F42 AromaticContact CD1-CE2 3.83Å; Y36-F42 HydrophobicContact CD1-CE2 3.83Å; Y36-F42 HydrophobicContact CD1-CZ 4.24Å; Y36-F42 AromaticContact CE1-CE2 3.85Å; Y36-F42 HydrophobicContact CE1-CE2 3.85Å; Y36-F42 AromaticContact CE1-CZ 3.76Å; Y36-F42 HydrophobicContact CE1-CZ 3.76Å; P37-F42 WeakPolarHBondContact O-CE2 3.35Å; E38-F42 HydrophobicContact CB-CE2 4.4Å; E38-F42 WeakPolarHBondContact O-CD2 3.27Å; L39-F42 PolarHBondContact O-N 3.03Å
43	T	90.3	Very high	87	Confident	51 Å²	51	55.2 Å²	55.2	31%	0.313	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-103.1	143.9	-179.8	55.2	0	0	0	0	110.4	G48 V76	T43-G48 WeakPolarHBondContact CB-O 3.29Å; T43-G48 WeakPolarHBondContact CG2-O 3.27Å; T43-V76 HydrophobicContact CG2-CG1 3.41Å; T43-V76 VanDerWaalsContact CG2-CG1 3.41Å
44	E	89.1	Confident	87.5	Confident	15 Å²	15	46.9 Å²	46.9	7%	0.07	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-65	149.5	176	76.8	-174	160.9	0	0	112.5	I13 Y14 L17 I46 G48 L49	I13-E44 HydrophobicContact CG2-CB 4.29Å; Y14-E44 HydrophobicContact CE1-CB 4.08Å; Y14-E44 WeakPolarHBondContact CE1-OE2 3.31Å; L17-E44 HydrophobicContact CD1-CB 3.82Å; L17-E44 HydrophobicContact CD1-CG 4.47Å; E44-I46 VanDerWaalsContact C-N 3.27Å; E44-I46 PolarHBondContact O-N 3.13Å; E44-G48 WeakPolarHBondContact O-CA 3.45Å; E44-G48 PolarHBondContact O-N 3.26Å; E44-L49 HydrophobicContact CG-CB 4.34Å; E44-L49 PolarHBondContact N-O 3.49Å; E44-L49 WeakPolarHBondContact OE1-CB 3.27Å; E44-L49 WeakPolarHBondContact OE1-CD1 3.43Å; E44-L49 WeakPolarHBondContact OE1-CG 3.01Å
45	P	85	Confident	88	Confident	48 Å²	48	40.3 Å²	40.3	31%	0.312	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-1.4	-173	30.4	-37.4	0	0	0	114.9	Y14 R79	Y14-P45 HydrophobicContact CE2-CG 4.18Å; Y14-P45 WeakPolarHBondContact OH-CD 3.31Å; Y14-P45 WeakPolarHBondContact OH-CG 3.38Å; P45-R79 PolarHBondContact O-NH1 2.85Å; P45-R79 PolarHBondContact O-NH2 3.01Å
46	I	86.8	Confident	88.8	Confident	100 Å²	100	39.1 Å²	39.1	51%	0.513	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-58.1	-178.3	-59.9	174.4	0	0	0	111.1	Y14 E44 R79	Y14-I46 WeakPolarHBondContact OH-CD1 3.36Å; E44-I46 VanDerWaalsContact C-N 3.27Å; E44-I46 PolarHBondContact O-N 3.13Å; I46-R79 WeakPolarHBondContact O-CD 3.36Å; I46-R79 PolarHBondContact O-NE 3.37Å; I46-R79 PolarHBondContact O-NH1 3.17Å
47	D	85.8	Confident	89.6	Confident	96 Å²	96	37.6 Å²	37.6	51%	0.513	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-14	-177.3	-60.6	-35.7	0	0	0	112.4	L49 R79	D47-L49 HydrophobicContact CB-CD1 4.36Å; D47-L49 HydrophobicContact CB-CG 4.04Å; D47-R79 WeakPolarHBondContact O-CB 3.38Å; D47-R79 PolarHBondContact O-N 3.45Å
48	G	89.9	Confident	90.3	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.01	20%	0.198	C	C	.	.			trans	80.6	13.3	-176.1	0	0	0	0	0	113.9	T43 E44 S50 D78	T43-G48 WeakPolarHBondContact CB-O 3.29Å; T43-G48 WeakPolarHBondContact CG2-O 3.27Å; E44-G48 WeakPolarHBondContact O-CA 3.45Å; E44-G48 PolarHBondContact O-N 3.26Å; G48-S50 PolarHBondContact O-N 3.47Å; G48-D78 WeakPolarHBondContact O-CA 3.32Å
49	L	91.5	Very high	90.9	Very high	23 Å²	23	32.4 Å²	32.4	12%	0.12	18%	0.179	C	C	.	.			trans	-68.8	132.7	178.6	-58.2	175.7	0	0	0	111.3	E44 D47 H53 L54 I57	E44-L49 HydrophobicContact CG-CB 4.34Å; E44-L49 PolarHBondContact N-O 3.49Å; E44-L49 WeakPolarHBondContact OE1-CB 3.27Å; E44-L49 WeakPolarHBondContact OE1-CD1 3.43Å; E44-L49 WeakPolarHBondContact OE1-CG 3.01Å; D47-L49 HydrophobicContact CB-CD1 4.36Å; D47-L49 HydrophobicContact CB-CG 4.04Å; L49-H53 HydrophobicContact CB-CB 4.32Å; L49-H53 HydrophobicContact CD2-CB 3.99Å; L49-L54 HydrophobicContact CD1-CD2 3.92Å; L49-I57 HydrophobicContact CD2-CD1 4.24Å
50	S	93.6	Very high	91.3	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	18%	0.183	C	C	.	.			trans	-94.1	170.6	169.3	77.7	0	0	0	0	111.2	G48 L52 H53 L54	G48-S50 PolarHBondContact O-N 3.47Å; S50-L52 PolarHBondContact O-N 3.2Å; S50-L52 PolarHBondContact OG-N 2.91Å; S50-H53 WeakPolarHBondContact CB-ND1 3.37Å; S50-H53 PolarHBondContact N-ND1 3.5Å; S50-H53 VanDerWaalsContact N-ND1 3.16Å; S50-H53 WeakPolarHBondContact O-CB 3.2Å; S50-H53 PolarHBondContact O-N 3.42Å; S50-H53 PolarHBondContact OG-N 3.35Å; S50-H53 PolarHBondContact OG-ND1 3.11Å; S50-L54 PolarHBondContact O-N 3.45Å
51	A	93.2	Very high	91.7	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	19%	0.193	C	C	.	.	H	α-helix	trans	-55.4	-38.3	173.2	0	0	0	0	0	112	V16 L17 V20 L54 A55 L67	V16-A51 HydrophobicContact CG1-CB 4.21Å; L17-A51 HydrophobicContact CD2-CB 4.38Å; V20-A51 HydrophobicContact CG2-CB 4.03Å; A51-L54 PolarHBondContact O-N 2.85Å; A51-A55 PolarHBondContact O-N 3.41Å; A51-A55 VanDerWaalsContact O-N 3.13Å; A51-L67 HydrophobicContact CB-CD1 4.03Å; A51-L67 HydrophobicContact CB-CD2 4.28Å; A51-L67 WeakPolarHBondContact O-CD1 3.3Å
52	L	94.4	Very high	91.9	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-71.6	-37.9	179.9	-160	63.8	0	0	0	111.9	S50 L54 A55 S56 V64 L67 L68 A72 P84 L100	S50-L52 PolarHBondContact O-N 3.2Å; S50-L52 PolarHBondContact OG-N 2.91Å; L52-L54 PolarHBondContact O-N 3.14Å; L52-A55 PolarHBondContact O-N 3.36Å; L52-S56 WeakPolarHBondContact O-CB 3.29Å; L52-S56 PolarHBondContact O-N 3.2Å; L52-S56 PolarHBondContact O-OG 3.03Å; L52-S56 VanDerWaalsContact O-OG 3.1Å; L52-V64 HydrophobicContact CD1-CG1 4.17Å; L52-L67 HydrophobicContact CD1-CB 4.11Å; L52-L67 HydrophobicContact CD1-CD1 4.38Å; L52-L68 HydrophobicContact CD1-CD2 4.42Å; L52-L68 HydrophobicContact CD1-CG 4.26Å; L52-L68 HydrophobicContact CD2-CD2 4.08Å; L52-A72 HydrophobicContact CD2-CB 4.49Å; L52-P84 HydrophobicContact CB-CB 4.38Å; L52-P84 HydrophobicContact CB-CG 4.06Å; L52-P84 HydrophobicContact CD2-CB 4.2Å; L52-P84 HydrophobicContact CD2-CG 4.04Å; L52-P84 HydrophobicContact CG-CB 4.04Å; L52-P84 HydrophobicContact CG-CG 4.11Å; L52-L100 HydrophobicContact CD1-CD2 4.19Å; L52-L100 HydrophobicContact CD2-CD2 3.68Å; L52-L100 HydrophobicContact CG-CD2 4.02Å
53	H	94.8	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.2	-48.1	172.6	-72.4	97.1	0	0	0	111.8	L49 S50 A55 S56 I57 V76 C82 P84	L49-H53 HydrophobicContact CB-CB 4.32Å; L49-H53 HydrophobicContact CD2-CB 3.99Å; S50-H53 WeakPolarHBondContact CB-ND1 3.37Å; S50-H53 PolarHBondContact N-ND1 3.5Å; S50-H53 VanDerWaalsContact N-ND1 3.16Å; S50-H53 WeakPolarHBondContact O-CB 3.2Å; S50-H53 PolarHBondContact O-N 3.42Å; S50-H53 PolarHBondContact OG-N 3.35Å; S50-H53 PolarHBondContact OG-ND1 3.11Å; H53-A55 VanDerWaalsContact C-N 3.35Å; H53-A55 PolarHBondContact O-N 3.4Å; H53-S56 PolarHBondContact O-N 2.99Å; H53-I57 WeakPolarHBondContact O-CB 3.35Å; H53-I57 WeakPolarHBondContact O-CD1 3.26Å; H53-I57 VanDerWaalsContact O-CG1 3.23Å; H53-I57 WeakPolarHBondContact O-CG1 3.2Å; H53-I57 PolarHBondContact O-N 3.45Å; H53-V76 PolarHBondContact CE1-O 3.4Å; H53-C82 PolarHBondContact NE2-O 3.48Å; H53-P84 VanDerWaalsContact NE2-CD 3.34Å; H53-P84 WeakPolarHBondContact NE2-CD 3.43Å
54	L	94	Very high	92.3	Very high	18 Å²	18	32.9 Å²	32.9	9%	0.094	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-40.3	179	-71	-174.8	0	0	0	112.4	L17 V20 R21 L49 S50 A51 L52 I57 S58	L17-L54 HydrophobicContact CB-CD1 3.74Å; L17-L54 HydrophobicContact CD2-CD1 3.6Å; L17-L54 HydrophobicContact CD2-CG 4.26Å; L17-L54 HydrophobicContact CG-CD1 4.11Å; V20-L54 HydrophobicContact CG1-CB 4.21Å; R21-L54 HydrophobicContact CG-CD1 4.38Å; L49-L54 HydrophobicContact CD1-CD2 3.92Å; S50-L54 PolarHBondContact O-N 3.45Å; A51-L54 PolarHBondContact O-N 2.85Å; L52-L54 PolarHBondContact O-N 3.14Å; L54-I57 PolarHBondContact O-N 3.05Å; L54-S58 WeakPolarHBondContact O-CB 3.42Å; L54-S58 PolarHBondContact O-N 3.44Å; L54-S58 PolarHBondContact O-OG 2.9Å
55	A	94.4	Very high	92.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-42	176.9	0	0	0	0	0	111.5	V20 A51 L52 H53 S58 N59 D60 M63 V64 L67	V20-A55 HydrophobicContact CG1-CB 4.46Å; A51-A55 PolarHBondContact O-N 3.41Å; A51-A55 VanDerWaalsContact O-N 3.13Å; L52-A55 PolarHBondContact O-N 3.36Å; H53-A55 VanDerWaalsContact C-N 3.35Å; H53-A55 PolarHBondContact O-N 3.4Å; A55-S58 PolarHBondContact O-OG 3.09Å; A55-S58 VanDerWaalsContact O-OG 3.14Å; A55-N59 PolarHBondContact O-N 3.11Å; A55-D60 PolarHBondContact O-N 3.28Å; A55-M63 HydrophobicContact CB-CB 4.2Å; A55-M63 HydrophobicContact CB-CG 3.96Å; A55-V64 HydrophobicContact CB-CG2 3.69Å; A55-L67 HydrophobicContact CB-CD1 3.85Å
56	S	93.9	Very high	93	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-48.5	173.9	-66.9	0	0	0	0	112.4	L52 H53 S58 N59 P84 H93	L52-S56 WeakPolarHBondContact O-CB 3.29Å; L52-S56 PolarHBondContact O-N 3.2Å; L52-S56 PolarHBondContact O-OG 3.03Å; L52-S56 VanDerWaalsContact O-OG 3.1Å; H53-S56 PolarHBondContact O-N 2.99Å; S56-S58 VanDerWaalsContact C-N 3.3Å; S56-S58 PolarHBondContact O-N 3.05Å; S56-N59 PolarHBondContact O-N 3.33Å; S56-N59 VanDerWaalsContact O-N 3.07Å; S56-P84 WeakPolarHBondContact CB-O 3.32Å; S56-P84 PolarHBondContact OG-O 3.19Å; S56-H93 PolarHBondContact O-CD2 3.22Å
57	I	93.8	Very high	93.4	Very high	62 Å²	62	29.5 Å²	29.5	32%	0.318	17%	0.166	S	C	.	.	H	α-helix	trans	-60.9	-40.4	-179	-70.8	164.1	0	0	0	111.4	L49 H53 L54 N59 R87 L91 H93	L49-I57 HydrophobicContact CD2-CD1 4.24Å; H53-I57 WeakPolarHBondContact O-CB 3.35Å; H53-I57 WeakPolarHBondContact O-CD1 3.26Å; H53-I57 VanDerWaalsContact O-CG1 3.23Å; H53-I57 WeakPolarHBondContact O-CG1 3.2Å; H53-I57 PolarHBondContact O-N 3.45Å; L54-I57 PolarHBondContact O-N 3.05Å; I57-N59 PolarHBondContact O-N 3.46Å; I57-R87 HydrophobicContact CG1-CB 4.05Å; I57-L91 HydrophobicContact CB-CD1 4.23Å; I57-L91 HydrophobicContact CG1-CD1 4.37Å; I57-L91 HydrophobicContact CG2-CD1 3.95Å; I57-L91 WeakPolarHBondContact O-CD1 3.4Å; I57-H93 PolarHBondContact O-NE2 2.99Å; I57-H93 VanDerWaalsContact O-NE2 3.1Å
58	S	92.6	Very high	93.7	Very high	78 Å²	78	26.5 Å²	26.5	55%	0.545	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-1.4	178.7	59.2	0	0	0	0	114.5	L54 A55 S56 D60	L54-S58 WeakPolarHBondContact O-CB 3.42Å; L54-S58 PolarHBondContact O-N 3.44Å; L54-S58 PolarHBondContact O-OG 2.9Å; A55-S58 PolarHBondContact O-OG 3.09Å; A55-S58 VanDerWaalsContact O-OG 3.14Å; S56-S58 VanDerWaalsContact C-N 3.3Å; S56-S58 PolarHBondContact O-N 3.05Å; S58-D60 PolarHBondContact O-N 3.42Å
59	N	93.4	Very high	93.8	Very high	60 Å²	60	29.8 Å²	29.8	32%	0.321	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	35.5	-175.3	-163.5	28.3	0	0	0	113	A55 S56 I57 I61 H93 S96	A55-N59 PolarHBondContact O-N 3.11Å; S56-N59 PolarHBondContact O-N 3.33Å; S56-N59 VanDerWaalsContact O-N 3.07Å; I57-N59 PolarHBondContact O-N 3.46Å; N59-I61 PolarHBondContact O-N 3.43Å; N59-H93 HydrophobicContact CB-CB 4.48Å; N59-S96 PolarHBondContact OD1-OG 3.49Å
60	D	94.1	Very high	93.8	Very high	19 Å²	19	31.3 Å²	31.3	10%	0.102	19%	0.191	C	C	.	.			trans	-90.1	86.4	179.6	-164.2	-31.3	0	0	0	110.4	K23 A55 S58 D62 M63 V64	K23-D60 WeakPolarHBondContact CD-OD2 3.48Å; K23-D60 WeakPolarHBondContact CE-OD2 3.5Å; K23-D60 IonicContact NZ-OD2 3.78Å; K23-D60 PolarHBondContact NZ-OD2 3.06Å; A55-D60 PolarHBondContact O-N 3.28Å; S58-D60 PolarHBondContact O-N 3.42Å; D60-D62 VanDerWaalsContact C-N 3.3Å; D60-D62 PolarHBondContact O-N 3.13Å; D60-D62 PolarHBondContact OD1-N 2.93Å; D60-M63 HydrophobicContact CB-CB 3.86Å; D60-M63 VanDerWaalsContact CG-CB 3.5Å; D60-M63 PolarHBondContact O-N 3.37Å; D60-M63 VanDerWaalsContact O-N 3.14Å; D60-M63 WeakPolarHBondContact OD1-CB 2.98Å; D60-M63 PolarHBondContact OD1-N 3.24Å; D60-M63 VanDerWaalsContact OD1-N 3.07Å; D60-V64 WeakPolarHBondContact O-CG2 3.45Å; D60-V64 PolarHBondContact O-N 3.09Å
61	I	94.8	Very high	93.6	Very high	53 Å²	53	33.7 Å²	33.7	27%	0.272	22%	0.216	S	C	.	.	H	α-helix	trans	-53.9	-46.6	-177.6	-56.3	173.3	0	0	0	111.2	N59 M63 V64 S65 L95 I99	N59-I61 PolarHBondContact O-N 3.43Å; I61-M63 VanDerWaalsContact C-N 3.29Å; I61-M63 PolarHBondContact O-N 3.33Å; I61-V64 PolarHBondContact O-N 2.99Å; I61-S65 PolarHBondContact O-N 3.23Å; I61-S65 PolarHBondContact O-OG 3.46Å; I61-L95 HydrophobicContact CD1-CB 3.77Å; I61-L95 HydrophobicContact CD1-CD1 3.52Å; I61-L95 HydrophobicContact CD1-CG 4.29Å; I61-L95 HydrophobicContact CG1-CB 4.21Å; I61-I99 HydrophobicContact CB-CD1 4.41Å; I61-I99 HydrophobicContact CG2-CD1 3.24Å
62	D	94.4	Very high	93.6	Very high	111 Å²	111	34 Å²	34	59%	0.594	22%	0.219	S	C	*	.	H	α-helix	trans	-67.2	-33.8	-177.6	-69.2	-19.9	0	0	0	111.8	D60 F66	D60-D62 VanDerWaalsContact C-N 3.3Å; D60-D62 PolarHBondContact O-N 3.13Å; D60-D62 PolarHBondContact OD1-N 2.93Å; D62-F66 WeakPolarHBondContact O-CB 3.34Å; D62-F66 PolarHBondContact O-N 3.19Å; D62-F66 VanDerWaalsContact O-N 3.15Å
63	M	94.3	Very high	93.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-74.5	-40	175.9	-169.7	60.1	68.6	0	0	111.5	V20 K23 K25 I28 A55 D60 I61 F66 L67	V20-M63 HydrophobicContact CG1-CG 4.13Å; K23-M63 HydrophobicContact CB-CE 4.23Å; K25-M63 HydrophobicContact CG-CE 3.99Å; I28-M63 HydrophobicContact CD1-CE 4.26Å; I28-M63 HydrophobicContact CD1-SD 3.97Å; A55-M63 HydrophobicContact CB-CB 4.2Å; A55-M63 HydrophobicContact CB-CG 3.96Å; D60-M63 HydrophobicContact CB-CB 3.86Å; D60-M63 VanDerWaalsContact CG-CB 3.5Å; D60-M63 PolarHBondContact O-N 3.37Å; D60-M63 VanDerWaalsContact O-N 3.14Å; D60-M63 WeakPolarHBondContact OD1-CB 2.98Å; D60-M63 PolarHBondContact OD1-N 3.24Å; D60-M63 VanDerWaalsContact OD1-N 3.07Å; I61-M63 VanDerWaalsContact C-N 3.29Å; I61-M63 PolarHBondContact O-N 3.33Å; M63-F66 PolarHBondContact O-N 3.47Å; M63-F66 HydrophobicContact SD-CD1 3.8Å; M63-F66 HydrophobicContact SD-CE1 4.5Å; M63-L67 HydrophobicContact CG-CD1 3.94Å; M63-L67 HydrophobicContact CG-CG 4.19Å; M63-L67 WeakPolarHBondContact O-CB 3.09Å; M63-L67 VanDerWaalsContact O-CG 3.26Å; M63-L67 WeakPolarHBondContact O-CG 3.47Å; M63-L67 PolarHBondContact O-N 3.17Å; M63-L67 HydrophobicContact SD-CD1 4.46Å; M63-L67 HydrophobicContact SD-CG 4.18Å
64	V	94.5	Very high	93.5	Very high	0 Å²	0	39 Å²	39	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-51.2	175	171.5	0	0	0	0	110.3	L52 A55 D60 I61 F66 L67 L68 I99 L100	L52-V64 HydrophobicContact CD1-CG1 4.17Å; A55-V64 HydrophobicContact CB-CG2 3.69Å; D60-V64 WeakPolarHBondContact O-CG2 3.45Å; D60-V64 PolarHBondContact O-N 3.09Å; I61-V64 PolarHBondContact O-N 2.99Å; V64-F66 VanDerWaalsContact C-N 3.3Å; V64-F66 PolarHBondContact O-N 2.91Å; V64-L67 PolarHBondContact O-N 3.39Å; V64-L68 HydrophobicContact CG1-CD1 3.89Å; V64-L68 WeakPolarHBondContact O-CB 3.4Å; V64-L68 VanDerWaalsContact O-CG 3.27Å; V64-L68 WeakPolarHBondContact O-CG 3.28Å; V64-L68 PolarHBondContact O-N 2.89Å; V64-I99 HydrophobicContact CG1-CB 4.43Å; V64-I99 HydrophobicContact CG1-CG2 3.88Å; V64-L100 HydrophobicContact CG1-CD2 3.99Å; V64-L100 HydrophobicContact CG1-CG 4.09Å
65	S	95	Very high	93.5	Very high	58 Å²	58	39.7 Å²	39.7	41%	0.406	25%	0.247	S	C	.	.	H	α-helix	trans	-61.3	-38.7	177	-63.2	0	0	0	0	112.9	I61 G69	I61-S65 PolarHBondContact O-N 3.23Å; I61-S65 PolarHBondContact O-OG 3.46Å; S65-G69 PolarHBondContact O-N 3.24Å
66	F	94.4	Very high	93.4	Very high	35 Å²	35	40.7 Å²	40.7	15%	0.154	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-46.5	178.4	174.8	-105.3	0	0	0	112.4	K25 I28 E29 D62 M63 V64 G69 L70	K25-F66 HydrophobicContact CB-CD1 4.44Å; K25-F66 HydrophobicContact CB-CE1 3.84Å; K25-F66 HydrophobicContact CB-CE2 4.11Å; K25-F66 HydrophobicContact CB-CZ 3.64Å; K25-F66 HydrophobicContact CD-CD1 4.32Å; K25-F66 HydrophobicContact CD-CD2 4.12Å; K25-F66 HydrophobicContact CD-CE2 4.34Å; K25-F66 HydrophobicContact CD-CG 4.09Å; K25-F66 HydrophobicContact CG-CD1 4.07Å; K25-F66 HydrophobicContact CG-CE1 3.96Å; K25-F66 HydrophobicContact CG-CE2 4.46Å; K25-F66 HydrophobicContact CG-CG 4.34Å; K25-F66 HydrophobicContact CG-CZ 4.15Å; K25-F66 WeakPolarHBondContact O-CZ 3.45Å; I28-F66 HydrophobicContact CB-CE1 4.18Å; I28-F66 HydrophobicContact CD1-CE1 4.42Å; I28-F66 HydrophobicContact CG2-CE1 4.06Å; E29-F66 HydrophobicContact CG-CE2 4.3Å; E29-F66 HydrophobicContact CG-CZ 3.87Å; E29-F66 VanDerWaalsContact OE1-CE2 3.3Å; E29-F66 WeakPolarHBondContact OE1-CE2 3.27Å; D62-F66 WeakPolarHBondContact O-CB 3.34Å; D62-F66 PolarHBondContact O-N 3.19Å; D62-F66 VanDerWaalsContact O-N 3.15Å; M63-F66 PolarHBondContact O-N 3.47Å; M63-F66 HydrophobicContact SD-CD1 3.8Å; M63-F66 HydrophobicContact SD-CE1 4.5Å; V64-F66 VanDerWaalsContact C-N 3.3Å; V64-F66 PolarHBondContact O-N 2.91Å; F66-G69 PolarHBondContact O-N 3.46Å; F66-L70 HydrophobicContact CD1-CD1 4.11Å; F66-L70 HydrophobicContact CE1-CD1 3.53Å; F66-L70 HydrophobicContact CE1-CG 4.5Å; F66-L70 HydrophobicContact CE2-CD1 4.29Å; F66-L70 HydrophobicContact CZ-CD1 3.65Å; F66-L70 HydrophobicContact CZ-CG 4.38Å; F66-L70 PolarHBondContact O-N 3.38Å; F66-L70 VanDerWaalsContact O-N 3.13Å
67	L	93.9	Very high	93.4	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-41.6	178.9	-69.7	173.2	0	0	0	111.6	V20 I28 I40 A51 L52 A55 M63 V64 G69 L70 G71 A72	V20-L67 HydrophobicContact CG2-CD1 4.39Å; V20-L67 HydrophobicContact CG2-CD2 4.46Å; I28-L67 HydrophobicContact CG2-CD2 4.2Å; I40-L67 HydrophobicContact CD1-CD2 4.2Å; I40-L67 HydrophobicContact CG1-CD2 4.42Å; A51-L67 HydrophobicContact CB-CD1 4.03Å; A51-L67 HydrophobicContact CB-CD2 4.28Å; A51-L67 WeakPolarHBondContact O-CD1 3.3Å; L52-L67 HydrophobicContact CD1-CB 4.11Å; L52-L67 HydrophobicContact CD1-CD1 4.38Å; A55-L67 HydrophobicContact CB-CD1 3.85Å; M63-L67 HydrophobicContact CG-CD1 3.94Å; M63-L67 HydrophobicContact CG-CG 4.19Å; M63-L67 WeakPolarHBondContact O-CB 3.09Å; M63-L67 VanDerWaalsContact O-CG 3.26Å; M63-L67 WeakPolarHBondContact O-CG 3.47Å; M63-L67 PolarHBondContact O-N 3.17Å; M63-L67 HydrophobicContact SD-CD1 4.46Å; M63-L67 HydrophobicContact SD-CG 4.18Å; V64-L67 PolarHBondContact O-N 3.39Å; L67-G69 VanDerWaalsContact C-N 3.31Å; L67-G69 PolarHBondContact O-N 2.96Å; L67-L70 PolarHBondContact O-N 3.28Å; L67-L70 VanDerWaalsContact O-N 3.1Å; L67-G71 PolarHBondContact O-N 3.43Å; L67-A72 HydrophobicContact CB-CB 4.09Å; L67-A72 WeakPolarHBondContact O-CB 3.39Å; L67-A72 PolarHBondContact O-N 3.32Å
68	L	93.7	Very high	93.4	Very high	33 Å²	33	42.5 Å²	42.5	17%	0.173	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-41	173.2	-69.9	167.8	0	0	0	111.5	L52 V64 L70 G71 A72 I99 L100 A103	L52-L68 HydrophobicContact CD1-CD2 4.42Å; L52-L68 HydrophobicContact CD1-CG 4.26Å; L52-L68 HydrophobicContact CD2-CD2 4.08Å; V64-L68 HydrophobicContact CG1-CD1 3.89Å; V64-L68 WeakPolarHBondContact O-CB 3.4Å; V64-L68 VanDerWaalsContact O-CG 3.27Å; V64-L68 WeakPolarHBondContact O-CG 3.28Å; V64-L68 PolarHBondContact O-N 2.89Å; L68-L70 PolarHBondContact O-N 3.06Å; L68-G71 PolarHBondContact O-N 3.26Å; L68-A72 WeakPolarHBondContact CD2-O 3.37Å; L68-I99 HydrophobicContact CD1-CG2 3.71Å; L68-L100 HydrophobicContact CD1-CD2 4.26Å; L68-L100 HydrophobicContact CD2-CD2 4.38Å; L68-A103 HydrophobicContact CD1-CB 3.81Å; L68-A103 HydrophobicContact CD2-CB 3.92Å; L68-A103 HydrophobicContact CG-CB 4.41Å
69	G	92	Very high	93.4	Very high	70 Å²	70	46.2 Å²	46.2	72%	0.722	26%	0.262	S	S	*	.	H	α-helix	trans	-63.2	-23.4	174.7	0	0	0	0	0	114.4	S65 F66 L67 G71	S65-G69 PolarHBondContact O-N 3.24Å; F66-G69 PolarHBondContact O-N 3.46Å; L67-G69 VanDerWaalsContact C-N 3.31Å; L67-G69 PolarHBondContact O-N 2.96Å; G69-G71 VanDerWaalsContact C-N 3.34Å
70	L	90.8	Very high	93.2	Very high	54 Å²	54	47.8 Å²	47.8	28%	0.283	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	0.5	173.8	-68.4	176.8	0	0	0	113.7	I28 E29 I40 F66 L67 L68	I28-L70 HydrophobicContact CG2-CD1 3.89Å; E29-L70 HydrophobicContact CG-CD1 4.42Å; E29-L70 HydrophobicContact CG-CD2 3.97Å; I40-L70 HydrophobicContact CD1-CB 3.48Å; I40-L70 VanDerWaalsContact CD1-CB 3.48Å; I40-L70 HydrophobicContact CD1-CD1 3.82Å; I40-L70 HydrophobicContact CD1-CG 4.32Å; F66-L70 HydrophobicContact CD1-CD1 4.11Å; F66-L70 HydrophobicContact CE1-CD1 3.53Å; F66-L70 HydrophobicContact CE1-CG 4.5Å; F66-L70 HydrophobicContact CE2-CD1 4.29Å; F66-L70 HydrophobicContact CZ-CD1 3.65Å; F66-L70 HydrophobicContact CZ-CG 4.38Å; F66-L70 PolarHBondContact O-N 3.38Å; F66-L70 VanDerWaalsContact O-N 3.13Å; L67-L70 PolarHBondContact O-N 3.28Å; L67-L70 VanDerWaalsContact O-N 3.1Å; L68-L70 PolarHBondContact O-N 3.06Å
71	G	89.9	Confident	93.1	Very high	51 Å²	51	47 Å²	47	53%	0.526	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	23.1	-180	0	0	0	0	0	114.7	N41 L67 L68 G69 H73	N41-G71 PolarHBondContact ND2-O 3.31Å; L67-G71 PolarHBondContact O-N 3.43Å; L68-G71 PolarHBondContact O-N 3.26Å; G69-G71 VanDerWaalsContact C-N 3.34Å; G71-H73 PolarHBondContact O-N 3.46Å
72	A	93.1	Very high	93.1	Very high	8 Å²	8	44.5 Å²	44.5	7%	0.066	25%	0.252	C	S	.	.			trans	-65.5	129.8	170	0	0	0	0	0	110.9	I40 N41 L52 L67 L68	I40-A72 HydrophobicContact CG2-CB 3.53Å; N41-A72 WeakPolarHBondContact OD1-CA 3.34Å; L52-A72 HydrophobicContact CD2-CB 4.49Å; L67-A72 HydrophobicContact CB-CB 4.09Å; L67-A72 WeakPolarHBondContact O-CB 3.39Å; L67-A72 PolarHBondContact O-N 3.32Å; L68-A72 WeakPolarHBondContact CD2-O 3.37Å
73	H	93.3	Very high	93.1	Very high	98 Å²	98	39.2 Å²	39.2	45%	0.454	22%	0.224	S	C	.	.			trans	-81	129.3	177.7	-161.6	-78.8	0	0	0	109.8	N41 G71 D75 V76	N41-H73 PolarHBondContact OD1-N 3.12Å; G71-H73 PolarHBondContact O-N 3.46Å; H73-D75 VanDerWaalsContact C-N 3.27Å; H73-D75 IonicContact CE1-OD2 3.13Å; H73-D75 PolarHBondContact CE1-OD2 3.21Å; H73-D75 PolarHBondContact ND1-N 2.99Å; H73-D75 VanDerWaalsContact ND1-N 3.17Å; H73-D75 IonicContact ND1-OD2 3.17Å; H73-D75 PolarHBondContact O-N 3.32Å; H73-V76 HydrophobicContact CB-CG2 4.05Å; H73-V76 WeakPolarHBondContact O-CG2 3.29Å
74	P	93.3	Very high	93.1	Very high	11 Å²	11	39.2 Å²	39.2	7%	0.071	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.1	-177	27.2	-34.2	0	0	0	113.8	P84 L100 A105	P74-P84 VanDerWaalsContact O-CD 3.25Å; P74-P84 WeakPolarHBondContact O-CD 3.15Å; P74-L100 HydrophobicContact CB-CD2 4.37Å; P74-A105 HydrophobicContact CB-CB 3.67Å; P74-A105 HydrophobicContact CG-CB 4.12Å
75	D	93.9	Very high	93.2	Very high	32 Å²	32	39.2 Å²	39.2	17%	0.171	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	17.5	-172	-50.2	-40.8	0	0	0	114.3	H73 Q77 A105 D106 I109	H73-D75 VanDerWaalsContact C-N 3.27Å; H73-D75 IonicContact CE1-OD2 3.13Å; H73-D75 PolarHBondContact CE1-OD2 3.21Å; H73-D75 PolarHBondContact ND1-N 2.99Å; H73-D75 VanDerWaalsContact ND1-N 3.17Å; H73-D75 IonicContact ND1-OD2 3.17Å; H73-D75 PolarHBondContact O-N 3.32Å; D75-Q77 PolarHBondContact O-N 3.36Å; D75-A105 WeakPolarHBondContact OD1-CA 3.39Å; D75-D106 PolarHBondContact OD1-N 3.47Å; D75-I109 HydrophobicContact CB-CD1 3.57Å
76	V	93.4	Very high	93.2	Very high	20 Å²	20	36.5 Å²	36.5	12%	0.121	21%	0.205	C	C	.	.			trans	-61	129	173.1	177.8	0	0	0	0	108.5	N41 T43 H53 H73 P84	N41-V76 HydrophobicContact CB-CG2 4.35Å; T43-V76 HydrophobicContact CG2-CG1 3.41Å; T43-V76 VanDerWaalsContact CG2-CG1 3.41Å; H53-V76 PolarHBondContact CE1-O 3.4Å; H73-V76 HydrophobicContact CB-CG2 4.05Å; H73-V76 WeakPolarHBondContact O-CG2 3.29Å; V76-P84 WeakPolarHBondContact O-CD 3.3Å
77	Q	93.7	Very high	93.2	Very high	90 Å²	90	36.5 Å²	36.5	42%	0.421	20%	0.204	S	C	.	.			trans	-98.2	139.4	179.5	-67.9	-178.6	-54.8	0	0	111.5	D75 G81 C82 T83 I109 V110	D75-Q77 PolarHBondContact O-N 3.36Å; Q77-G81 PolarHBondContact NE2-O 3.14Å; Q77-C82 WeakPolarHBondContact CA-O 3.4Å; Q77-T83 HydrophobicContact CG-CG2 4.15Å; Q77-I109 HydrophobicContact CG-CG2 4.43Å; Q77-V110 PolarHBondContact NE2-O 3.14Å
78	D	93.4	Very high	93.3	Very high	11 Å²	11	36.5 Å²	36.5	6%	0.059	20%	0.204	C	C	.	.			trans	-74.2	-177.3	167.8	73	14.2	0	0	0	111.9	G48 M80 G81 C82 R87	G48-D78 WeakPolarHBondContact O-CA 3.32Å; D78-M80 PolarHBondContact O-N 3.26Å; D78-M80 VanDerWaalsContact OD1-CA 3.3Å; D78-M80 WeakPolarHBondContact OD1-CA 3.5Å; D78-M80 WeakPolarHBondContact OD1-CB 3.35Å; D78-M80 PolarHBondContact OD1-N 3.3Å; D78-G81 PolarHBondContact O-N 3.34Å; D78-G81 PolarHBondContact OD1-N 3.36Å; D78-G81 VanDerWaalsContact OD1-N 3.11Å; D78-C82 PolarHBondContact N-O 2.81Å; D78-C82 WeakPolarHBondContact OD1-CB 3.27Å; D78-C82 PolarHBondContact OD1-N 2.73Å; D78-C82 WeakPolarHBondContact OD2-CB 3.45Å; D78-R87 IonicContact OD2-CZ 2.78Å; D78-R87 IonicContact OD2-NE 3.99Å; D78-R87 PolarHBondContact OD2-NE 3.38Å; D78-R87 IonicContact OD2-NH2 3.39Å; D78-R87 PolarHBondContact OD2-NH2 2.94Å
79	R	91.5	Very high	93.4	Very high	156 Å²	156	35 Å²	35	59%	0.589	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-21	179.6	-80.5	179	167.5	-154.5	-15	114.1	P45 I46 D47 G81 N112	P45-R79 PolarHBondContact O-NH1 2.85Å; P45-R79 PolarHBondContact O-NH2 3.01Å; I46-R79 WeakPolarHBondContact O-CD 3.36Å; I46-R79 PolarHBondContact O-NE 3.37Å; I46-R79 PolarHBondContact O-NH1 3.17Å; D47-R79 WeakPolarHBondContact O-CB 3.38Å; D47-R79 PolarHBondContact O-N 3.45Å; R79-G81 VanDerWaalsContact C-N 3.27Å; R79-N112 PolarHBondContact O-ND2 3.23Å
80	M	89.2	Confident	93.5	Very high	93 Å²	93	35.4 Å²	35.4	46%	0.458	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3	174.3	-62.4	-177.6	62.1	0	0	112	D78 C82 R87 D111 N112	D78-M80 PolarHBondContact O-N 3.26Å; D78-M80 VanDerWaalsContact OD1-CA 3.3Å; D78-M80 WeakPolarHBondContact OD1-CA 3.5Å; D78-M80 WeakPolarHBondContact OD1-CB 3.35Å; D78-M80 PolarHBondContact OD1-N 3.3Å; M80-C82 VanDerWaalsContact C-N 3.27Å; M80-R87 PolarHBondContact SD-NH2 3.49Å; M80-D111 WeakPolarHBondContact O-CB 3.47Å; M80-N112 VanDerWaalsContact C-CG 3.44Å; M80-N112 VanDerWaalsContact C-ND2 3.32Å; M80-N112 WeakPolarHBondContact O-CB 3.42Å; M80-N112 PolarHBondContact O-N 3.18Å; M80-N112 PolarHBondContact O-ND2 3.05Å
81	G	92.6	Very high	93.7	Very high	2 Å²	2	36.5 Å²	36.5	2%	0.021	19%	0.185	C	C	.	.	S	Bend	trans	81.8	5.8	-173.7	0	0	0	0	0	113.1	Q77 D78 R79	Q77-G81 PolarHBondContact NE2-O 3.14Å; D78-G81 PolarHBondContact O-N 3.34Å; D78-G81 PolarHBondContact OD1-N 3.36Å; D78-G81 VanDerWaalsContact OD1-N 3.11Å; R79-G81 VanDerWaalsContact C-N 3.27Å
82	C	94.5	Very high	93.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.16	C	C	.	.			trans	-80.1	139.7	-178.4	-64.1	0	0	0	0	110.5	H53 Q77 D78 M80 M86 Y120	H53-C82 PolarHBondContact NE2-O 3.48Å; Q77-C82 WeakPolarHBondContact CA-O 3.4Å; D78-C82 PolarHBondContact N-O 2.81Å; D78-C82 WeakPolarHBondContact OD1-CB 3.27Å; D78-C82 PolarHBondContact OD1-N 2.73Å; D78-C82 WeakPolarHBondContact OD2-CB 3.45Å; M80-C82 VanDerWaalsContact C-N 3.27Å; C82-M86 HydrophobicContact CB-CB 4.33Å; C82-M86 HydrophobicContact CB-SD 4.25Å; C82-Y120 PolarHBondContact SG-OH 3.48Å; C82-Y120 VanDerWaalsContact SG-OH 3.38Å
83	T	95.3	Very high	94	Very high	1 Å²	1	35 Å²	35	1%	0.006	16%	0.163	C	C	.	.			trans	-89.5	164.1	173.6	61.1	0	0	0	0	111.4	Q77 T85 M86 R87 I109	Q77-T83 HydrophobicContact CG-CG2 4.15Å; T83-T85 PolarHBondContact O-N 3.05Å; T83-T85 PolarHBondContact OG1-OG1 3.3Å; T83-M86 WeakPolarHBondContact O-CB 3.48Å; T83-M86 PolarHBondContact O-N 3.02Å; T83-M86 WeakPolarHBondContact OG1-CG 3.17Å; T83-M86 PolarHBondContact OG1-N 3.4Å; T83-R87 PolarHBondContact O-N 3.44Å; T83-I109 HydrophobicContact CG2-CB 4.26Å; T83-I109 HydrophobicContact CG2-CD1 4.12Å; T83-I109 HydrophobicContact CG2-CG2 3.82Å
84	P	94.9	Very high	94	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-54.6	-32.2	170.5	-28.2	32.8	0	0	0	113.3	L52 H53 S56 P74 V76 A88 L100	L52-P84 HydrophobicContact CB-CB 4.38Å; L52-P84 HydrophobicContact CB-CG 4.06Å; L52-P84 HydrophobicContact CD2-CB 4.2Å; L52-P84 HydrophobicContact CD2-CG 4.04Å; L52-P84 HydrophobicContact CG-CB 4.04Å; L52-P84 HydrophobicContact CG-CG 4.11Å; H53-P84 VanDerWaalsContact NE2-CD 3.34Å; H53-P84 WeakPolarHBondContact NE2-CD 3.43Å; S56-P84 WeakPolarHBondContact CB-O 3.32Å; S56-P84 PolarHBondContact OG-O 3.19Å; P74-P84 VanDerWaalsContact O-CD 3.25Å; P74-P84 WeakPolarHBondContact O-CD 3.15Å; V76-P84 WeakPolarHBondContact O-CD 3.3Å; P84-A88 WeakPolarHBondContact O-CB 3.38Å; P84-A88 PolarHBondContact O-N 2.96Å; P84-L100 HydrophobicContact CB-CD1 4.33Å
85	T	95.3	Very high	94	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.5	-41.2	174.8	47.5	0	0	0	0	111.8	T83 A88 A89 L100 A105 M107	T83-T85 PolarHBondContact O-N 3.05Å; T83-T85 PolarHBondContact OG1-OG1 3.3Å; T85-A88 PolarHBondContact O-N 3.42Å; T85-A89 WeakPolarHBondContact O-CB 3.48Å; T85-A89 PolarHBondContact O-N 2.82Å; T85-L100 HydrophobicContact CG2-CB 3.43Å; T85-L100 VanDerWaalsContact CG2-CB 3.43Å; T85-L100 HydrophobicContact CG2-CD1 3.69Å; T85-L100 HydrophobicContact CG2-CG 4.12Å; T85-A105 HydrophobicContact CG2-CB 3.61Å; T85-M107 HydrophobicContact CG2-CE 4.04Å; T85-M107 HydrophobicContact CG2-SD 4.39Å
86	M	95.6	Very high	94	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-62.9	-43.4	174.1	-68.9	173.2	-178.5	0	0	112.1	C82 T83 A88 A89 E90 I109 I117 Y120	C82-M86 HydrophobicContact CB-CB 4.33Å; C82-M86 HydrophobicContact CB-SD 4.25Å; T83-M86 WeakPolarHBondContact O-CB 3.48Å; T83-M86 PolarHBondContact O-N 3.02Å; T83-M86 WeakPolarHBondContact OG1-CG 3.17Å; T83-M86 PolarHBondContact OG1-N 3.4Å; M86-A88 VanDerWaalsContact C-N 3.33Å; M86-A88 PolarHBondContact O-N 3.31Å; M86-A89 WeakPolarHBondContact O-CB 3.41Å; M86-A89 PolarHBondContact O-N 3.17Å; M86-A89 VanDerWaalsContact O-N 3.14Å; M86-E90 WeakPolarHBondContact O-CB 3.35Å; M86-E90 PolarHBondContact O-N 3.24Å; M86-I109 HydrophobicContact CE-CB 4.45Å; M86-I109 HydrophobicContact CE-CG2 4.29Å; M86-I109 WeakPolarHBondContact CE-O 3.39Å; M86-I117 HydrophobicContact CG-CB 4.21Å; M86-I117 HydrophobicContact CG-CD1 4.4Å; M86-I117 HydrophobicContact CG-CG1 4.07Å; M86-Y120 HydrophobicContact CB-CD2 4.17Å; M86-Y120 HydrophobicContact CB-CE2 4.42Å; M86-Y120 HydrophobicContact CG-CD2 4.23Å; M86-Y120 HydrophobicContact CG-CE2 4.44Å; M86-Y120 HydrophobicContact SD-CE2 4.2Å
87	R	94.8	Very high	94.1	Very high	35 Å²	35	32.9 Å²	32.9	13%	0.132	15%	0.152	C	C	.	.	H	α-helix	trans	-65.3	-35.8	175.9	-65.4	-56.5	-172.9	-178.9	-2.3	112.8	I57 D78 M80 T83 E90	I57-R87 HydrophobicContact CG1-CB 4.05Å; D78-R87 IonicContact OD2-CZ 2.78Å; D78-R87 IonicContact OD2-NE 3.99Å; D78-R87 PolarHBondContact OD2-NE 3.38Å; D78-R87 IonicContact OD2-NH2 3.39Å; D78-R87 PolarHBondContact OD2-NH2 2.94Å; M80-R87 PolarHBondContact SD-NH2 3.49Å; T83-R87 PolarHBondContact O-N 3.44Å; R87-E90 WeakPolarHBondContact CD-OE2 3.3Å; R87-E90 IonicContact CZ-OE2 2.72Å; R87-E90 IonicContact NH1-OE1 3.67Å; R87-E90 IonicContact NH1-OE2 2.83Å; R87-E90 PolarHBondContact NH1-OE2 2.63Å
88	A	95.1	Very high	94.1	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.8	-39.8	171.8	0	0	0	0	0	111.6	P84 T85 M86 L91 G92 H93 M97	P84-A88 WeakPolarHBondContact O-CB 3.38Å; P84-A88 PolarHBondContact O-N 2.96Å; T85-A88 PolarHBondContact O-N 3.42Å; M86-A88 VanDerWaalsContact C-N 3.33Å; M86-A88 PolarHBondContact O-N 3.31Å; A88-L91 PolarHBondContact O-N 3.13Å; A88-G92 PolarHBondContact O-N 3.06Å; A88-G92 VanDerWaalsContact O-N 3.16Å; A88-H93 HydrophobicContact CB-CB 4.32Å; A88-H93 PolarHBondContact O-N 2.99Å; A88-M97 HydrophobicContact CB-CB 4.48Å
89	A	95.3	Very high	94.2	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-45.8	177.6	0	0	0	0	0	112.2	T85 M86 L91 G92 M97 I117 H128	T85-A89 WeakPolarHBondContact O-CB 3.48Å; T85-A89 PolarHBondContact O-N 2.82Å; M86-A89 WeakPolarHBondContact O-CB 3.41Å; M86-A89 PolarHBondContact O-N 3.17Å; M86-A89 VanDerWaalsContact O-N 3.14Å; A89-L91 PolarHBondContact O-N 3.26Å; A89-G92 PolarHBondContact O-N 3.46Å; A89-M97 HydrophobicContact CB-CE 3.72Å; A89-M97 HydrophobicContact CB-SD 4.48Å; A89-I117 HydrophobicContact CB-CD1 4.5Å; A89-I117 HydrophobicContact CB-CG1 4Å; A89-H128 PolarHBondContact O-CD2 3.14Å; A89-H128 PolarHBondContact O-NE2 3.34Å
90	E	94.6	Very high	94.3	Very high	79 Å²	79	25.6 Å²	25.6	37%	0.369	13%	0.125	S	C	.	.	H	α-helix	trans	-56.5	-31.8	179	-175.3	-179.5	-172.3	0	0	113.1	M86 R87 Y120 H128	M86-E90 WeakPolarHBondContact O-CB 3.35Å; M86-E90 PolarHBondContact O-N 3.24Å; R87-E90 WeakPolarHBondContact CD-OE2 3.3Å; R87-E90 IonicContact CZ-OE2 2.72Å; R87-E90 IonicContact NH1-OE1 3.67Å; R87-E90 IonicContact NH1-OE2 2.83Å; R87-E90 PolarHBondContact NH1-OE2 2.63Å; E90-Y120 HydrophobicContact CB-CD1 4.01Å; E90-Y120 HydrophobicContact CG-CD1 4.17Å; E90-H128 PolarHBondContact O-NE2 3.12Å
91	L	94.6	Very high	94.5	Very high	78 Å²	78	21.4 Å²	21.4	41%	0.408	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-4.5	179.5	-61.4	174.3	0	0	0	113.3	I57 A88 A89 H93	I57-L91 HydrophobicContact CB-CD1 4.23Å; I57-L91 HydrophobicContact CG1-CD1 4.37Å; I57-L91 HydrophobicContact CG2-CD1 3.95Å; I57-L91 WeakPolarHBondContact O-CD1 3.4Å; A88-L91 PolarHBondContact O-N 3.13Å; A89-L91 PolarHBondContact O-N 3.26Å; L91-H93 VanDerWaalsContact CB-NE2 3.34Å; L91-H93 WeakPolarHBondContact CB-NE2 3.16Å; L91-H93 WeakPolarHBondContact CD1-NE2 3.32Å
92	G	94	Very high	94.6	Very high	1 Å²	1	28 Å²	28	1%	0.01	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	33.9	-177.7	0	0	0	0	0	114	A88 A89 E94 R127 H128	A88-G92 PolarHBondContact O-N 3.06Å; A88-G92 VanDerWaalsContact O-N 3.16Å; A89-G92 PolarHBondContact O-N 3.46Å; G92-E94 PolarHBondContact O-N 3.41Å; G92-E94 VanDerWaalsContact O-N 3.15Å; G92-R127 WeakPolarHBondContact O-CB 3.44Å; G92-R127 WeakPolarHBondContact O-CD 3.48Å; G92-H128 PolarHBondContact N-CE1 2.67Å; G92-H128 PolarHBondContact N-NE2 3.44Å
93	H	95.3	Very high	94.5	Very high	26 Å²	26	29.9 Å²	29.9	12%	0.12	15%	0.149	C	C	.	.			trans	-86.6	76.8	179.3	-62.8	-31.6	0	0	0	111.4	S56 I57 N59 A88 L91 L95 S96 M97	S56-H93 PolarHBondContact O-CD2 3.22Å; I57-H93 PolarHBondContact O-NE2 2.99Å; I57-H93 VanDerWaalsContact O-NE2 3.1Å; N59-H93 HydrophobicContact CB-CB 4.48Å; A88-H93 HydrophobicContact CB-CB 4.32Å; A88-H93 PolarHBondContact O-N 2.99Å; L91-H93 VanDerWaalsContact CB-NE2 3.34Å; L91-H93 WeakPolarHBondContact CB-NE2 3.16Å; L91-H93 WeakPolarHBondContact CD1-NE2 3.32Å; H93-L95 VanDerWaalsContact C-N 3.34Å; H93-L95 PolarHBondContact O-N 3.28Å; H93-S96 PolarHBondContact O-N 2.91Å; H93-M97 PolarHBondContact O-N 3.08Å; H93-M97 VanDerWaalsContact O-N 3.07Å
94	E	93.9	Very high	94.4	Very high	38 Å²	38	38.6 Å²	38.6	18%	0.178	19%	0.187	C	C	.	.	H	α-helix	trans	-56.7	-40.5	-173.8	67.2	-170.3	-151.1	0	0	113.9	G92 M97 E98 R130 I134	G92-E94 PolarHBondContact O-N 3.41Å; G92-E94 VanDerWaalsContact O-N 3.15Å; E94-M97 PolarHBondContact O-N 3.5Å; E94-E98 WeakPolarHBondContact O-CB 3.44Å; E94-E98 PolarHBondContact O-N 3.13Å; E94-R130 HydrophobicContact CB-CB 4.4Å; E94-R130 IonicContact OE1-CZ 3.12Å; E94-R130 IonicContact OE1-NH1 2.85Å; E94-R130 PolarHBondContact OE1-NH1 3.39Å; E94-R130 WeakPolarHBondContact OE2-CD 3.33Å; E94-R130 IonicContact OE2-NE 3.84Å; E94-R130 IonicContact OE2-NH1 3.64Å; E94-R130 PolarHBondContact OE2-NH1 3.2Å; E94-I134 HydrophobicContact CB-CD1 4.31Å
95	L	93.8	Very high	94.3	Very high	79 Å²	79	39 Å²	39	41%	0.414	19%	0.19	S	C	.	.	H	α-helix	trans	-72.2	-41.9	-176.7	-63.7	174.5	0	0	0	112.1	I61 H93 M97 E98 I99	I61-L95 HydrophobicContact CD1-CB 3.77Å; I61-L95 HydrophobicContact CD1-CD1 3.52Å; I61-L95 HydrophobicContact CD1-CG 4.29Å; I61-L95 HydrophobicContact CG1-CB 4.21Å; H93-L95 VanDerWaalsContact C-N 3.34Å; H93-L95 PolarHBondContact O-N 3.28Å; L95-M97 VanDerWaalsContact C-N 3.3Å; L95-M97 PolarHBondContact O-N 2.94Å; L95-E98 PolarHBondContact O-N 3.38Å; L95-I99 WeakPolarHBondContact O-CG1 3.46Å; L95-I99 PolarHBondContact O-N 2.96Å; L95-I99 VanDerWaalsContact O-N 3.14Å
96	S	93.6	Very high	94.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-42.3	174.1	-63.3	0	0	0	0	110.8	N59 H93 I99 L100	N59-S96 PolarHBondContact OD1-OG 3.49Å; H93-S96 PolarHBondContact O-N 2.91Å; S96-I99 PolarHBondContact O-N 3.42Å; S96-L100 WeakPolarHBondContact O-CD1 3.47Å; S96-L100 VanDerWaalsContact O-CG 3.26Å; S96-L100 WeakPolarHBondContact O-CG 3.35Å; S96-L100 PolarHBondContact O-N 3.36Å; S96-L100 VanDerWaalsContact O-N 3.08Å
97	M	94.3	Very high	94.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-42.8	176.7	-166.5	-177.4	-149.8	0	0	112.2	A88 A89 H93 E94 L95 I99 L100 A101 I117 C131 I134 A135	A88-M97 HydrophobicContact CB-CB 4.48Å; A89-M97 HydrophobicContact CB-CE 3.72Å; A89-M97 HydrophobicContact CB-SD 4.48Å; H93-M97 PolarHBondContact O-N 3.08Å; H93-M97 VanDerWaalsContact O-N 3.07Å; E94-M97 PolarHBondContact O-N 3.5Å; L95-M97 VanDerWaalsContact C-N 3.3Å; L95-M97 PolarHBondContact O-N 2.94Å; M97-I99 VanDerWaalsContact C-N 3.33Å; M97-I99 PolarHBondContact O-N 3.34Å; M97-L100 PolarHBondContact O-N 2.85Å; M97-A101 WeakPolarHBondContact O-CB 3.43Å; M97-A101 PolarHBondContact O-N 3.44Å; M97-I117 HydrophobicContact CE-CD1 3.24Å; M97-I117 HydrophobicContact CE-CG1 3.72Å; M97-C131 HydrophobicContact CE-CB 4.41Å; M97-C131 HydrophobicContact SD-CB 3.54Å; M97-C131 VanDerWaalsContact SD-CB 3.54Å; M97-I134 HydrophobicContact CG-CG2 4.22Å; M97-I134 HydrophobicContact SD-CB 4.43Å; M97-I134 HydrophobicContact SD-CG2 4.38Å; M97-A135 HydrophobicContact CE-CB 4.05Å
98	E	94.4	Very high	94	Very high	71 Å²	71	44.4 Å²	44.4	33%	0.332	23%	0.225	S	C	.	.	H	α-helix	trans	-61.2	-40.3	177.8	-167	-171.9	161	0	0	112.1	E94 L95 A101 K102 I134	E94-E98 WeakPolarHBondContact O-CB 3.44Å; E94-E98 PolarHBondContact O-N 3.13Å; L95-E98 PolarHBondContact O-N 3.38Å; E98-A101 PolarHBondContact O-N 3.31Å; E98-K102 WeakPolarHBondContact O-CB 3.35Å; E98-K102 WeakPolarHBondContact O-CG 3.37Å; E98-K102 PolarHBondContact O-N 3.35Å; E98-K102 VanDerWaalsContact OE1-CE 3.3Å; E98-K102 WeakPolarHBondContact OE1-CE 3.45Å; E98-K102 IonicContact OE1-NZ 3.46Å; E98-K102 PolarHBondContact OE1-NZ 3.49Å; E98-I134 HydrophobicContact CB-CD1 4.28Å
99	I	95.3	Very high	94	Very high	33 Å²	33	46 Å²	46	17%	0.169	23%	0.232	C	C	.	.	H	α-helix	trans	-67.3	-43.9	177.3	-69.4	168.2	0	0	0	111.1	I61 V64 L68 L95 S96 M97 A101 K102 A103	I61-I99 HydrophobicContact CB-CD1 4.41Å; I61-I99 HydrophobicContact CG2-CD1 3.24Å; V64-I99 HydrophobicContact CG1-CB 4.43Å; V64-I99 HydrophobicContact CG1-CG2 3.88Å; L68-I99 HydrophobicContact CD1-CG2 3.71Å; L95-I99 WeakPolarHBondContact O-CG1 3.46Å; L95-I99 PolarHBondContact O-N 2.96Å; L95-I99 VanDerWaalsContact O-N 3.14Å; S96-I99 PolarHBondContact O-N 3.42Å; M97-I99 VanDerWaalsContact C-N 3.33Å; M97-I99 PolarHBondContact O-N 3.34Å; I99-A101 VanDerWaalsContact C-N 3.32Å; I99-A101 PolarHBondContact O-N 2.8Å; I99-K102 PolarHBondContact O-N 3.5Å; I99-A103 PolarHBondContact O-N 2.84Å
100	L	94.4	Very high	93.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-40.4	177	-68.7	165.3	0	0	0	111.2	L52 V64 L68 P74 P84 T85 S96 M97 A103 K104 A105	L52-L100 HydrophobicContact CD1-CD2 4.19Å; L52-L100 HydrophobicContact CD2-CD2 3.68Å; L52-L100 HydrophobicContact CG-CD2 4.02Å; V64-L100 HydrophobicContact CG1-CD2 3.99Å; V64-L100 HydrophobicContact CG1-CG 4.09Å; L68-L100 HydrophobicContact CD1-CD2 4.26Å; L68-L100 HydrophobicContact CD2-CD2 4.38Å; P74-L100 HydrophobicContact CB-CD2 4.37Å; P84-L100 HydrophobicContact CB-CD1 4.33Å; T85-L100 HydrophobicContact CG2-CB 3.43Å; T85-L100 VanDerWaalsContact CG2-CB 3.43Å; T85-L100 HydrophobicContact CG2-CD1 3.69Å; T85-L100 HydrophobicContact CG2-CG 4.12Å; S96-L100 WeakPolarHBondContact O-CD1 3.47Å; S96-L100 VanDerWaalsContact O-CG 3.26Å; S96-L100 WeakPolarHBondContact O-CG 3.35Å; S96-L100 PolarHBondContact O-N 3.36Å; S96-L100 VanDerWaalsContact O-N 3.08Å; M97-L100 PolarHBondContact O-N 2.85Å; L100-A103 CarbonylContact O-C 3.54Å; L100-A103 WeakPolarHBondContact O-CA 3.34Å; L100-A103 WeakPolarHBondContact O-CB 3.37Å; L100-A103 PolarHBondContact O-N 3.24Å; L100-A103 VanDerWaalsContact O-N 3.09Å; L100-K104 PolarHBondContact O-N 3Å; L100-A105 HydrophobicContact CB-CB 4.38Å; L100-A105 VanDerWaalsContact O-CB 3.28Å; L100-A105 WeakPolarHBondContact O-CB 3.45Å; L100-A105 PolarHBondContact O-N 3.13Å; L100-A105 VanDerWaalsContact O-N 3.17Å
101	A	93.4	Very high	93.9	Very high	5 Å²	5	44.4 Å²	44.4	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-41	176.1	0	0	0	0	0	112.2	M97 E98 I99 A103 K104 M107 I134 H138	M97-A101 WeakPolarHBondContact O-CB 3.43Å; M97-A101 PolarHBondContact O-N 3.44Å; E98-A101 PolarHBondContact O-N 3.31Å; I99-A101 VanDerWaalsContact C-N 3.32Å; I99-A101 PolarHBondContact O-N 2.8Å; A101-A103 PolarHBondContact O-N 2.84Å; A101-K104 WeakPolarHBondContact O-CA 3.4Å; A101-K104 PolarHBondContact O-N 2.9Å; A101-M107 HydrophobicContact CB-CE 3.51Å; A101-I134 HydrophobicContact CB-CG2 4.22Å; A101-H138 HydrophobicContact CB-CB 4.38Å; A101-H138 WeakPolarHBondContact CB-CD2 3.49Å
102	K	93.6	Very high	93.9	Very high	139 Å²	139	45.7 Å²	45.7	60%	0.604	24%	0.235	S	C	*	.	H	α-helix	trans	-61	-30.2	170.8	-76.3	171.6	-175	165.7	0	112.7	E98 I99 K104	E98-K102 WeakPolarHBondContact O-CB 3.35Å; E98-K102 WeakPolarHBondContact O-CG 3.37Å; E98-K102 PolarHBondContact O-N 3.35Å; E98-K102 VanDerWaalsContact OE1-CE 3.3Å; E98-K102 WeakPolarHBondContact OE1-CE 3.45Å; E98-K102 IonicContact OE1-NZ 3.46Å; E98-K102 PolarHBondContact OE1-NZ 3.49Å; I99-K102 PolarHBondContact O-N 3.5Å; K102-K104 PolarHBondContact O-N 3.47Å
103	A	93.6	Very high	93.8	Very high	40 Å²	40	50.3 Å²	50.3	33%	0.331	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	11.7	173.4	0	0	0	0	0	113.9	L68 I99 L100 A101	L68-A103 HydrophobicContact CD1-CB 3.81Å; L68-A103 HydrophobicContact CD2-CB 3.92Å; L68-A103 HydrophobicContact CG-CB 4.41Å; I99-A103 PolarHBondContact O-N 2.84Å; L100-A103 CarbonylContact O-C 3.54Å; L100-A103 WeakPolarHBondContact O-CA 3.34Å; L100-A103 WeakPolarHBondContact O-CB 3.37Å; L100-A103 PolarHBondContact O-N 3.24Å; L100-A103 VanDerWaalsContact O-N 3.09Å; A101-A103 PolarHBondContact O-N 2.84Å
104	K	92.6	Very high	93.7	Very high	184 Å²	184	49.1 Å²	49.1	80%	0.8	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	36.7	179.4	-54.3	-178.7	176.5	-178.5	0	114	L100 A101 K102 D106	L100-K104 PolarHBondContact O-N 3Å; A101-K104 WeakPolarHBondContact O-CA 3.4Å; A101-K104 PolarHBondContact O-N 2.9Å; K102-K104 PolarHBondContact O-N 3.47Å; K104-D106 PolarHBondContact O-N 3.42Å
105	A	93.1	Very high	93.6	Very high	8 Å²	8	50.1 Å²	50.1	7%	0.066	26%	0.255	C	S	.	.			trans	-56.8	135.1	166.9	0	0	0	0	0	110.9	P74 D75 T85 L100 M107	P74-A105 HydrophobicContact CB-CB 3.67Å; P74-A105 HydrophobicContact CG-CB 4.12Å; D75-A105 WeakPolarHBondContact OD1-CA 3.39Å; T85-A105 HydrophobicContact CG2-CB 3.61Å; L100-A105 HydrophobicContact CB-CB 4.38Å; L100-A105 VanDerWaalsContact O-CB 3.28Å; L100-A105 WeakPolarHBondContact O-CB 3.45Å; L100-A105 PolarHBondContact O-N 3.13Å; L100-A105 VanDerWaalsContact O-N 3.17Å; A105-M107 HydrophobicContact CB-CE 4.26Å; A105-M107 PolarHBondContact O-N 3.5Å
106	D	93.3	Very high	93.6	Very high	69 Å²	69	46.6 Å²	46.6	37%	0.369	24%	0.238	S	C	.	.			trans	-79.6	113.8	177.6	-172.4	-6.4	0	0	0	110.3	D75 K104 T108 I109	D75-D106 PolarHBondContact OD1-N 3.47Å; K104-D106 PolarHBondContact O-N 3.42Å; D106-T108 VanDerWaalsContact C-N 3.3Å; D106-T108 VanDerWaalsContact CG-OG1 3.32Å; D106-T108 WeakPolarHBondContact OD1-CB 3.38Å; D106-T108 PolarHBondContact OD1-N 2.97Å; D106-T108 PolarHBondContact OD1-OG1 3.23Å; D106-T108 PolarHBondContact OD2-OG1 3.32Å; D106-I109 HydrophobicContact CB-CD1 3.86Å; D106-I109 HydrophobicContact CB-CG1 4.03Å
107	M	92.8	Very high	93.7	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.025	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-1.4	-179.2	-59.2	-61.3	-179.6	0	0	113.3	T85 A101 A105 I117 H138 A140	T85-M107 HydrophobicContact CG2-CE 4.04Å; T85-M107 HydrophobicContact CG2-SD 4.39Å; A101-M107 HydrophobicContact CB-CE 3.51Å; A105-M107 HydrophobicContact CB-CE 4.26Å; A105-M107 PolarHBondContact O-N 3.5Å; M107-I117 HydrophobicContact CB-CG2 4.44Å; M107-I117 HydrophobicContact SD-CD1 3.56Å; M107-I117 VanDerWaalsContact SD-CD1 3.56Å; M107-H138 HydrophobicContact CG-CB 4.06Å; M107-A140 HydrophobicContact CB-CB 4.03Å
108	T	93.2	Very high	93.8	Very high	78 Å²	78	46.8 Å²	46.8	48%	0.479	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-11.8	179.8	70.3	0	0	0	0	113.5	D106	D106-T108 VanDerWaalsContact C-N 3.3Å; D106-T108 VanDerWaalsContact CG-OG1 3.32Å; D106-T108 WeakPolarHBondContact OD1-CB 3.38Å; D106-T108 PolarHBondContact OD1-N 2.97Å; D106-T108 PolarHBondContact OD1-OG1 3.23Å; D106-T108 PolarHBondContact OD2-OG1 3.32Å
109	I	94.1	Very high	93.8	Very high	32 Å²	32	44.7 Å²	44.7	16%	0.164	23%	0.229	C	C	.	.			trans	-59	143.5	177.2	-65.1	174.6	0	0	0	109.7	D75 Q77 T83 M86 D106	D75-I109 HydrophobicContact CB-CD1 3.57Å; Q77-I109 HydrophobicContact CG-CG2 4.43Å; T83-I109 HydrophobicContact CG2-CB 4.26Å; T83-I109 HydrophobicContact CG2-CD1 4.12Å; T83-I109 HydrophobicContact CG2-CG2 3.82Å; M86-I109 HydrophobicContact CE-CB 4.45Å; M86-I109 HydrophobicContact CE-CG2 4.29Å; M86-I109 WeakPolarHBondContact CE-O 3.39Å; D106-I109 HydrophobicContact CB-CD1 3.86Å; D106-I109 HydrophobicContact CB-CG1 4.03Å
110	V	94.8	Very high	93.7	Very high	42 Å²	42	44.6 Å²	44.6	26%	0.255	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-118.5	152.2	176.6	-62.4	0	0	0	0	110.3	Q77 K115 N144	Q77-V110 PolarHBondContact NE2-O 3.14Å; V110-K115 WeakPolarHBondContact CA-O 3.49Å; V110-N144 WeakPolarHBondContact CG1-ND2 3.37Å
111	D	94.5	Very high	93.7	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.027	23%	0.227	C	C	.	.			trans	-77.1	-177.1	173	75.2	5.3	0	0	0	112.4	M80 E113 G114 K115 Y120	M80-D111 WeakPolarHBondContact O-CB 3.47Å; D111-E113 PolarHBondContact O-N 3.09Å; D111-E113 VanDerWaalsContact O-N 3.16Å; D111-E113 WeakPolarHBondContact OD1-CA 3.47Å; D111-E113 WeakPolarHBondContact OD1-CB 3.22Å; D111-E113 PolarHBondContact OD1-N 3.11Å; D111-G114 PolarHBondContact O-N 3.09Å; D111-G114 PolarHBondContact OD1-N 3.27Å; D111-K115 PolarHBondContact N-O 2.97Å; D111-K115 WeakPolarHBondContact OD1-CB 3.3Å; D111-K115 PolarHBondContact OD1-N 2.97Å; D111-K115 WeakPolarHBondContact OD2-CB 3.46Å; D111-Y120 PolarHBondContact OD2-OH 3.48Å
112	N	93.3	Very high	93.7	Very high	104 Å²	104	44.8 Å²	44.8	56%	0.556	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.2	179.7	-67.5	-12.9	0	0	0	114.2	R79 M80 Y147	R79-N112 PolarHBondContact O-ND2 3.23Å; M80-N112 VanDerWaalsContact C-CG 3.44Å; M80-N112 VanDerWaalsContact C-ND2 3.32Å; M80-N112 WeakPolarHBondContact O-CB 3.42Å; M80-N112 PolarHBondContact O-N 3.18Å; M80-N112 PolarHBondContact O-ND2 3.05Å; N112-Y147 WeakPolarHBondContact O-CD2 3.12Å; N112-Y147 VanDerWaalsContact O-CE2 3.28Å; N112-Y147 WeakPolarHBondContact O-CE2 3.4Å
113	E	92.1	Very high	93.6	Very high	98 Å²	98	41.7 Å²	41.7	46%	0.458	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-1.3	175.4	-63	-179.6	-170.1	0	0	111.9	D111 K115 Y147	D111-E113 PolarHBondContact O-N 3.09Å; D111-E113 VanDerWaalsContact O-N 3.16Å; D111-E113 WeakPolarHBondContact OD1-CA 3.47Å; D111-E113 WeakPolarHBondContact OD1-CB 3.22Å; D111-E113 PolarHBondContact OD1-N 3.11Å; E113-K115 HydrophobicContact CB-CG 4.34Å; E113-K115 WeakPolarHBondContact OE2-CE 3.25Å; E113-K115 IonicContact OE2-NZ 3.8Å; E113-K115 PolarHBondContact OE2-NZ 3.32Å; E113-Y147 PolarHBondContact O-N 3Å
114	G	92.7	Very high	93.5	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.01	22%	0.223	C	C	.	.			trans	81.3	13.1	-176.4	0	0	0	0	0	113.7	D111 N144	D111-G114 PolarHBondContact O-N 3.09Å; D111-G114 PolarHBondContact OD1-N 3.27Å; G114-N144 PolarHBondContact O-OD1 3.35Å
115	K	93.3	Very high	93.4	Very high	59 Å²	59	37.6 Å²	37.6	26%	0.257	20%	0.204	S	C	.	.			trans	-79.7	120.8	176.9	-59.9	173.2	-174.4	159.7	0	110.1	V110 D111 E113 F119 Y120 T146	V110-K115 WeakPolarHBondContact CA-O 3.49Å; D111-K115 PolarHBondContact N-O 2.97Å; D111-K115 WeakPolarHBondContact OD1-CB 3.3Å; D111-K115 PolarHBondContact OD1-N 2.97Å; D111-K115 WeakPolarHBondContact OD2-CB 3.46Å; E113-K115 HydrophobicContact CB-CG 4.34Å; E113-K115 WeakPolarHBondContact OE2-CE 3.25Å; E113-K115 IonicContact OE2-NZ 3.8Å; E113-K115 PolarHBondContact OE2-NZ 3.32Å; K115-F119 HydrophobicContact CB-CB 3.98Å; K115-F119 HydrophobicContact CB-CD2 3.61Å; K115-F119 HydrophobicContact CB-CE2 4.33Å; K115-F119 HydrophobicContact CB-CG 3.94Å; K115-F119 HydrophobicContact CD-CB 4.39Å; K115-F119 HydrophobicContact CG-CB 4.32Å; K115-F119 HydrophobicContact CG-CD2 3.98Å; K115-F119 HydrophobicContact CG-CE2 4.43Å; K115-F119 HydrophobicContact CG-CG 4.05Å; K115-Y120 HydrophobicContact CB-CE2 4.19Å; K115-T146 HydrophobicContact CG-CG2 3.74Å
116	G	94.3	Very high	93.3	Very high	6 Å²	6	45.9 Å²	45.9	6%	0.062	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-74.5	174.1	164.9	0	0	0	0	0	112.7	L118 F119 N144	G116-L118 PolarHBondContact O-N 3.06Å; G116-L118 VanDerWaalsContact O-N 3.16Å; G116-F119 WeakPolarHBondContact O-CB 3.13Å; G116-F119 PolarHBondContact O-N 3.07Å; G116-F119 VanDerWaalsContact O-N 3.14Å; G116-N144 PolarHBondContact N-OD1 3.36Å
117	I	94.8	Very high	93.4	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-31.6	-174.6	-163.3	160.5	0	0	0	114.3	M86 A89 M97 M107 F119 Y120 C121 A135 A140	M86-I117 HydrophobicContact CG-CB 4.21Å; M86-I117 HydrophobicContact CG-CD1 4.4Å; M86-I117 HydrophobicContact CG-CG1 4.07Å; A89-I117 HydrophobicContact CB-CD1 4.5Å; A89-I117 HydrophobicContact CB-CG1 4Å; M97-I117 HydrophobicContact CE-CD1 3.24Å; M97-I117 HydrophobicContact CE-CG1 3.72Å; M107-I117 HydrophobicContact CB-CG2 4.44Å; M107-I117 HydrophobicContact SD-CD1 3.56Å; M107-I117 VanDerWaalsContact SD-CD1 3.56Å; I117-F119 PolarHBondContact O-N 3.41Å; I117-Y120 PolarHBondContact O-N 3.4Å; I117-Y120 VanDerWaalsContact O-N 3.1Å; I117-C121 PolarHBondContact O-N 3.38Å; I117-A135 HydrophobicContact CG2-CB 3.88Å; I117-A140 HydrophobicContact CG2-CB 3.83Å
118	L	95.3	Very high	93.4	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-64.7	-27.6	-178.8	-66.1	177.5	0	0	0	112.6	G116 Y120 C121 I122 A135 L136 A140 V152 F170	G116-L118 PolarHBondContact O-N 3.06Å; G116-L118 VanDerWaalsContact O-N 3.16Å; L118-Y120 VanDerWaalsContact C-N 3.26Å; L118-Y120 PolarHBondContact O-N 2.94Å; L118-C121 WeakPolarHBondContact O-CB 3.38Å; L118-C121 PolarHBondContact O-N 3.18Å; L118-C121 VanDerWaalsContact O-N 3.12Å; L118-I122 WeakPolarHBondContact O-CG1 3.29Å; L118-I122 PolarHBondContact O-N 3.05Å; L118-A135 HydrophobicContact CD2-CB 3.89Å; L118-L136 HydrophobicContact CD1-CD2 3.93Å; L118-L136 HydrophobicContact CD2-CD2 4.26Å; L118-L136 HydrophobicContact CD2-CG 4.16Å; L118-A140 HydrophobicContact CD1-CB 4.25Å; L118-A140 HydrophobicContact CD2-CB 4.25Å; L118-A140 HydrophobicContact CG-CB 4.05Å; L118-V152 HydrophobicContact CB-CG1 3.68Å; L118-V152 HydrophobicContact CB-CG2 4.39Å; L118-V152 HydrophobicContact CD1-CG1 4.37Å; L118-F170 HydrophobicContact CB-CZ 4.32Å; L118-F170 HydrophobicContact CD1-CE1 4.47Å; L118-F170 HydrophobicContact CD1-CZ 4.41Å; L118-F170 HydrophobicContact CD2-CE1 4.13Å; L118-F170 HydrophobicContact CD2-CZ 4.15Å
119	F	95.1	Very high	93.5	Very high	27 Å²	27	49.5 Å²	49.5	12%	0.118	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-37.6	173.8	-81.1	-76.8	0	0	0	112.3	K115 G116 I117 C121 I122 N144 T146 K150 V152 K155	K115-F119 HydrophobicContact CB-CB 3.98Å; K115-F119 HydrophobicContact CB-CD2 3.61Å; K115-F119 HydrophobicContact CB-CE2 4.33Å; K115-F119 HydrophobicContact CB-CG 3.94Å; K115-F119 HydrophobicContact CD-CB 4.39Å; K115-F119 HydrophobicContact CG-CB 4.32Å; K115-F119 HydrophobicContact CG-CD2 3.98Å; K115-F119 HydrophobicContact CG-CE2 4.43Å; K115-F119 HydrophobicContact CG-CG 4.05Å; G116-F119 WeakPolarHBondContact O-CB 3.13Å; G116-F119 PolarHBondContact O-N 3.07Å; G116-F119 VanDerWaalsContact O-N 3.14Å; I117-F119 PolarHBondContact O-N 3.41Å; F119-C121 VanDerWaalsContact C-N 3.26Å; F119-C121 PolarHBondContact O-N 2.96Å; F119-I122 HydrophobicContact CD1-CD1 4.47Å; F119-I122 PolarHBondContact O-N 3.46Å; F119-N144 VanDerWaalsContact CE2-OD1 3.25Å; F119-N144 WeakPolarHBondContact CE2-OD1 3.41Å; F119-T146 HydrophobicContact CD2-CG2 4.46Å; F119-T146 HydrophobicContact CE1-CG2 3.93Å; F119-T146 HydrophobicContact CE2-CG2 3.67Å; F119-T146 HydrophobicContact CZ-CG2 3.39Å; F119-K150 WeakPolarHBondContact CZ-O 3.46Å; F119-V152 HydrophobicContact CD1-CG2 4.48Å; F119-V152 HydrophobicContact CD2-CG2 3.49Å; F119-V152 VanDerWaalsContact CD2-CG2 3.49Å; F119-V152 HydrophobicContact CE1-CG2 4.19Å; F119-V152 HydrophobicContact CE2-CB 4.24Å; F119-V152 HydrophobicContact CE2-CG2 3.15Å; F119-V152 HydrophobicContact CG-CG2 4.15Å; F119-V152 HydrophobicContact CZ-CB 4.15Å; F119-V152 HydrophobicContact CZ-CG2 3.52Å; F119-K155 HydrophobicContact CD1-CB 4.25Å; F119-K155 HydrophobicContact CD1-CG 4.1Å; F119-K155 HydrophobicContact CE1-CB 3.84Å; F119-K155 HydrophobicContact CE1-CG 4.14Å
120	Y	94.1	Very high	93.5	Very high	31 Å²	31	54.5 Å²	54.5	12%	0.122	26%	0.256	C	S	.	.	H	α-helix	trans	-75.5	-15.8	178.5	-65.5	-81	0	0	0	112.8	C82 M86 E90 D111 K115 I117 L118	C82-Y120 PolarHBondContact SG-OH 3.48Å; C82-Y120 VanDerWaalsContact SG-OH 3.38Å; M86-Y120 HydrophobicContact CB-CD2 4.17Å; M86-Y120 HydrophobicContact CB-CE2 4.42Å; M86-Y120 HydrophobicContact CG-CD2 4.23Å; M86-Y120 HydrophobicContact CG-CE2 4.44Å; M86-Y120 HydrophobicContact SD-CE2 4.2Å; E90-Y120 HydrophobicContact CB-CD1 4.01Å; E90-Y120 HydrophobicContact CG-CD1 4.17Å; D111-Y120 PolarHBondContact OD2-OH 3.48Å; K115-Y120 HydrophobicContact CB-CE2 4.19Å; I117-Y120 PolarHBondContact O-N 3.4Å; I117-Y120 VanDerWaalsContact O-N 3.1Å; L118-Y120 VanDerWaalsContact C-N 3.26Å; L118-Y120 PolarHBondContact O-N 2.94Å
121	C	94.3	Very high	93.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-11.4	175.4	-64.5	0	0	0	0	113.7	I117 L118 F119 L123 H128 M166	I117-C121 PolarHBondContact O-N 3.38Å; L118-C121 WeakPolarHBondContact O-CB 3.38Å; L118-C121 PolarHBondContact O-N 3.18Å; L118-C121 VanDerWaalsContact O-N 3.12Å; F119-C121 VanDerWaalsContact C-N 3.26Å; F119-C121 PolarHBondContact O-N 2.96Å; C121-L123 VanDerWaalsContact C-N 3.27Å; C121-L123 PolarHBondContact O-N 2.75Å; C121-H128 WeakPolarHBondContact O-CB 3.18Å; C121-M166 VanDerWaalsContact O-CE 3.29Å; C121-M166 WeakPolarHBondContact O-CE 3.49Å
122	I	93.1	Very high	93.5	Very high	8 Å²	8	52.2 Å²	52.2	4%	0.041	24%	0.243	C	C	.	.			trans	-78.1	78.8	-176.3	-58.6	165.8	0	0	0	109.5	L118 F119 V152 K155 A156	L118-I122 WeakPolarHBondContact O-CG1 3.29Å; L118-I122 PolarHBondContact O-N 3.05Å; F119-I122 HydrophobicContact CD1-CD1 4.47Å; F119-I122 PolarHBondContact O-N 3.46Å; I122-V152 HydrophobicContact CD1-CG1 4.25Å; I122-K155 HydrophobicContact CD1-CB 3.98Å; I122-K155 HydrophobicContact CD1-CG 3.69Å; I122-A156 HydrophobicContact CD1-CB 4.01Å; I122-A156 HydrophobicContact CG1-CB 4.23Å; I122-A156 HydrophobicContact CG2-CB 4.41Å
123	L	91.5	Very high	93.6	Very high	75 Å²	75	49.6 Å²	49.6	39%	0.393	23%	0.228	S	C	.	.	S	Bend	trans	-142.8	147.7	172.4	-76.6	175.1	0	0	0	110.2	C121 T125 H128	C121-L123 VanDerWaalsContact C-N 3.27Å; C121-L123 PolarHBondContact O-N 2.75Å; L123-T125 PolarHBondContact O-N 3.34Å; L123-H128 HydrophobicContact CB-CB 4.21Å; L123-H128 WeakPolarHBondContact CD1-NE2 3.46Å
124	P	90.3	Very high	93.7	Very high	72 Å²	72	46.3 Å²	46.3	47%	0.468	21%	0.213	S	C	.	.	S	Bend	trans	-81.3	56.1	-170.3	35.6	-39.7	0	0	0	113	D162 V163	P124-D162 HydrophobicContact CB-CB 3.43Å; P124-D162 VanDerWaalsContact CB-CB 3.43Å; P124-D162 HydrophobicContact CG-CB 4.31Å; P124-V163 HydrophobicContact CB-CG2 4.26Å
125	T	92	Very high	93.9	Very high	66 Å²	66	46.2 Å²	46.2	41%	0.405	21%	0.213	S	C	.	.	S	Bend	trans	-133.6	150.5	178.3	75.8	0	0	0	0	111.4	L123 R127 H128 Y129	L123-T125 PolarHBondContact O-N 3.34Å; T125-R127 PolarHBondContact O-N 3.41Å; T125-H128 PolarHBondContact O-N 3.17Å; T125-H128 WeakPolarHBondContact OG1-CB 3.36Å; T125-H128 PolarHBondContact OG1-N 3.36Å; T125-H128 PolarHBondContact OG1-ND1 3.38Å; T125-Y129 PolarHBondContact O-N 2.96Å
126	K	91.3	Very high	93.9	Very high	182 Å²	182	44.1 Å²	44.1	79%	0.791	20%	0.204	S	C	*	.	H	α-helix	trans	-60.5	-31.9	177.5	-66.7	-175.9	177.7	-176.5	0	113.3	R130	K126-R130 WeakPolarHBondContact O-CG 3.41Å; K126-R130 PolarHBondContact O-N 3Å; K126-R130 VanDerWaalsContact O-N 3.09Å
127	R	94	Very high	93.9	Very high	150 Å²	150	48.8 Å²	48.8	57%	0.566	23%	0.228	S	C	*	.	H	α-helix	trans	-68.9	-46.8	178.2	-67.1	-174.8	-176.5	179.6	0.1	111.2	G92 T125 Y129 R130 C131	G92-R127 WeakPolarHBondContact O-CB 3.44Å; G92-R127 WeakPolarHBondContact O-CD 3.48Å; T125-R127 PolarHBondContact O-N 3.41Å; R127-Y129 VanDerWaalsContact C-N 3.32Å; R127-Y129 PolarHBondContact O-N 3.2Å; R127-R130 CarbonylContact O-C 3.19Å; R127-R130 WeakPolarHBondContact O-CB 3.39Å; R127-R130 PolarHBondContact O-N 3.03Å; R127-R130 VanDerWaalsContact O-N 3.1Å; R127-C131 PolarHBondContact O-N 3.24Å; R127-C131 PolarHBondContact O-SG 3.08Å
128	H	94.2	Very high	93.8	Very high	13 Å²	13	53 Å²	53	6%	0.06	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-35.1	177.6	-71.3	82.9	0	0	0	112	A89 E90 G92 C121 L123 T125 R130 C131 S132	A89-H128 PolarHBondContact O-CD2 3.14Å; A89-H128 PolarHBondContact O-NE2 3.34Å; E90-H128 PolarHBondContact O-NE2 3.12Å; G92-H128 PolarHBondContact N-CE1 2.67Å; G92-H128 PolarHBondContact N-NE2 3.44Å; C121-H128 WeakPolarHBondContact O-CB 3.18Å; L123-H128 HydrophobicContact CB-CB 4.21Å; L123-H128 WeakPolarHBondContact CD1-NE2 3.46Å; T125-H128 PolarHBondContact O-N 3.17Å; T125-H128 WeakPolarHBondContact OG1-CB 3.36Å; T125-H128 PolarHBondContact OG1-N 3.36Å; T125-H128 PolarHBondContact OG1-ND1 3.38Å; H128-R130 PolarHBondContact O-N 3.19Å; H128-C131 WeakPolarHBondContact O-CB 3.35Å; H128-C131 PolarHBondContact O-N 3.37Å; H128-S132 PolarHBondContact O-N 2.88Å
129	Y	94.3	Very high	93.7	Very high	65 Å²	65	55.1 Å²	55.1	26%	0.255	27%	0.27	S	S	.	.	H	α-helix	trans	-59	-45.3	168.7	178.1	-112.6	0	0	0	112.3	T125 R127 S132 L133 E165 M166 T169	T125-Y129 PolarHBondContact O-N 2.96Å; R127-Y129 VanDerWaalsContact C-N 3.32Å; R127-Y129 PolarHBondContact O-N 3.2Å; Y129-S132 WeakPolarHBondContact O-CB 3.2Å; Y129-S132 PolarHBondContact O-N 3.41Å; Y129-S132 PolarHBondContact O-OG 3.23Å; Y129-L133 HydrophobicContact CD1-CD1 4.14Å; Y129-L133 HydrophobicContact CE1-CD1 3.68Å; Y129-L133 HydrophobicContact CE1-CG 4.44Å; Y129-L133 PolarHBondContact O-N 3.34Å; Y129-E165 HydrophobicContact CD2-CB 4.5Å; Y129-E165 HydrophobicContact CE2-CB 4.05Å; Y129-M166 HydrophobicContact CD2-CB 3.94Å; Y129-M166 HydrophobicContact CD2-CG 4.35Å; Y129-M166 HydrophobicContact CE2-CB 4.39Å; Y129-T169 PolarHBondContact OH-OG1 2.97Å
130	R	94.6	Very high	93.7	Very high	136 Å²	136	54.2 Å²	54.2	51%	0.513	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-41.6	173.9	-72.7	170.8	172.8	-170.6	-0.9	112.8	E94 K126 R127 H128 S132 L133 I134	E94-R130 HydrophobicContact CB-CB 4.4Å; E94-R130 IonicContact OE1-CZ 3.12Å; E94-R130 IonicContact OE1-NH1 2.85Å; E94-R130 PolarHBondContact OE1-NH1 3.39Å; E94-R130 WeakPolarHBondContact OE2-CD 3.33Å; E94-R130 IonicContact OE2-NE 3.84Å; E94-R130 IonicContact OE2-NH1 3.64Å; E94-R130 PolarHBondContact OE2-NH1 3.2Å; K126-R130 WeakPolarHBondContact O-CG 3.41Å; K126-R130 PolarHBondContact O-N 3Å; K126-R130 VanDerWaalsContact O-N 3.09Å; R127-R130 CarbonylContact O-C 3.19Å; R127-R130 WeakPolarHBondContact O-CB 3.39Å; R127-R130 PolarHBondContact O-N 3.03Å; R127-R130 VanDerWaalsContact O-N 3.1Å; H128-R130 PolarHBondContact O-N 3.19Å; R130-S132 VanDerWaalsContact C-N 3.27Å; R130-S132 PolarHBondContact O-N 2.94Å; R130-L133 WeakPolarHBondContact O-CB 3.34Å; R130-L133 PolarHBondContact O-N 2.88Å; R130-L133 VanDerWaalsContact O-N 3.16Å; R130-I134 WeakPolarHBondContact O-CG1 3.42Å; R130-I134 PolarHBondContact O-N 3.44Å
131	C	94.9	Very high	93.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.5	-41.3	173	-66.3	0	0	0	0	111.6	M97 R127 H128 I134 A135	M97-C131 HydrophobicContact CE-CB 4.41Å; M97-C131 HydrophobicContact SD-CB 3.54Å; M97-C131 VanDerWaalsContact SD-CB 3.54Å; R127-C131 PolarHBondContact O-N 3.24Å; R127-C131 PolarHBondContact O-SG 3.08Å; H128-C131 WeakPolarHBondContact O-CB 3.35Å; H128-C131 PolarHBondContact O-N 3.37Å; C131-I134 PolarHBondContact O-N 2.99Å; C131-A135 WeakPolarHBondContact O-CB 3.22Å; C131-A135 PolarHBondContact O-N 2.96Å
132	S	95	Very high	93.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-41.8	176	80.3	0	0	0	0	112.1	H128 Y129 R130 A135 L136	H128-S132 PolarHBondContact O-N 2.88Å; Y129-S132 WeakPolarHBondContact O-CB 3.2Å; Y129-S132 PolarHBondContact O-N 3.41Å; Y129-S132 PolarHBondContact O-OG 3.23Å; R130-S132 VanDerWaalsContact C-N 3.27Å; R130-S132 PolarHBondContact O-N 2.94Å; S132-A135 PolarHBondContact O-N 3.47Å; S132-L136 WeakPolarHBondContact O-CB 3.39Å; S132-L136 WeakPolarHBondContact O-CD1 3.46Å; S132-L136 WeakPolarHBondContact O-CG 3.46Å; S132-L136 PolarHBondContact O-N 3.19Å
133	L	95.1	Very high	93.7	Very high	48 Å²	48	59.7 Å²	59.7	25%	0.251	30%	0.299	S	S	.	.	H	α-helix	trans	-62.7	-47.2	175.7	-69.1	171.2	0	0	0	111.7	Y129 R130 A135 L136 D137 T169	Y129-L133 HydrophobicContact CD1-CD1 4.14Å; Y129-L133 HydrophobicContact CE1-CD1 3.68Å; Y129-L133 HydrophobicContact CE1-CG 4.44Å; Y129-L133 PolarHBondContact O-N 3.34Å; R130-L133 WeakPolarHBondContact O-CB 3.34Å; R130-L133 PolarHBondContact O-N 2.88Å; R130-L133 VanDerWaalsContact O-N 3.16Å; L133-A135 VanDerWaalsContact C-N 3.32Å; L133-A135 PolarHBondContact O-N 3.31Å; L133-L136 PolarHBondContact O-N 3.47Å; L133-D137 WeakPolarHBondContact O-CB 3.36Å; L133-D137 PolarHBondContact O-N 3.26Å; L133-T169 HydrophobicContact CD2-CG2 3.58Å
134	I	94.5	Very high	93.8	Very high	29 Å²	29	57 Å²	57	15%	0.149	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-46.5	177.5	-66.2	165.3	0	0	0	110.2	E94 M97 E98 A101 R130 C131 L136 D137 H138	E94-I134 HydrophobicContact CB-CD1 4.31Å; M97-I134 HydrophobicContact CG-CG2 4.22Å; M97-I134 HydrophobicContact SD-CB 4.43Å; M97-I134 HydrophobicContact SD-CG2 4.38Å; E98-I134 HydrophobicContact CB-CD1 4.28Å; A101-I134 HydrophobicContact CB-CG2 4.22Å; R130-I134 WeakPolarHBondContact O-CG1 3.42Å; R130-I134 PolarHBondContact O-N 3.44Å; C131-I134 PolarHBondContact O-N 2.99Å; I134-L136 PolarHBondContact O-N 3.45Å; I134-D137 PolarHBondContact O-N 2.96Å; I134-H138 PolarHBondContact O-CD2 3.3Å; I134-H138 PolarHBondContact O-N 3.14Å; I134-H138 VanDerWaalsContact O-N 3.15Å
135	A	95.3	Very high	94	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-45.3	178.4	0	0	0	0	0	111.9	M97 I117 L118 C131 S132 L133 H138 G139 A140	M97-A135 HydrophobicContact CE-CB 4.05Å; I117-A135 HydrophobicContact CG2-CB 3.88Å; L118-A135 HydrophobicContact CD2-CB 3.89Å; C131-A135 WeakPolarHBondContact O-CB 3.22Å; C131-A135 PolarHBondContact O-N 2.96Å; S132-A135 PolarHBondContact O-N 3.47Å; L133-A135 VanDerWaalsContact C-N 3.32Å; L133-A135 PolarHBondContact O-N 3.31Å; A135-H138 CarbonylContact O-C 3.52Å; A135-H138 PolarHBondContact O-N 2.99Å; A135-G139 PolarHBondContact O-N 3.26Å; A135-A140 HydrophobicContact CB-CB 3.91Å; A135-A140 WeakPolarHBondContact O-CB 3.49Å; A135-A140 PolarHBondContact O-N 3.44Å
136	L	94.5	Very high	94.1	Very high	14 Å²	14	55.4 Å²	55.4	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-41.1	179	-69.4	165.3	0	0	0	112.8	L118 S132 L133 I134 H138 G139 V142 T169 F170 K173	L118-L136 HydrophobicContact CD1-CD2 3.93Å; L118-L136 HydrophobicContact CD2-CD2 4.26Å; L118-L136 HydrophobicContact CD2-CG 4.16Å; S132-L136 WeakPolarHBondContact O-CB 3.39Å; S132-L136 WeakPolarHBondContact O-CD1 3.46Å; S132-L136 WeakPolarHBondContact O-CG 3.46Å; S132-L136 PolarHBondContact O-N 3.19Å; L133-L136 PolarHBondContact O-N 3.47Å; I134-L136 PolarHBondContact O-N 3.45Å; L136-H138 PolarHBondContact O-N 3.13Å; L136-G139 PolarHBondContact O-N 3.31Å; L136-V142 HydrophobicContact CD2-CB 4.44Å; L136-V142 HydrophobicContact CD2-CG1 4.47Å; L136-V142 HydrophobicContact CD2-CG2 3.36Å; L136-T169 HydrophobicContact CD1-CG2 3.88Å; L136-F170 HydrophobicContact CD1-CD1 3.82Å; L136-F170 HydrophobicContact CD1-CE1 3.85Å; L136-F170 HydrophobicContact CD2-CD1 4.45Å; L136-F170 HydrophobicContact CG-CE1 4.49Å; L136-K173 HydrophobicContact CD1-CG 4.23Å; L136-K173 HydrophobicContact CD2-CB 4.32Å; L136-K173 HydrophobicContact CD2-CG 4.48Å
137	D	93.9	Very high	94.1	Very high	105 Å²	105	54.8 Å²	54.8	56%	0.561	26%	0.264	S	S	*	.	H	α-helix	trans	-68.7	-23.4	178.9	-71.1	-18.4	0	0	0	112.3	L133 I134 K173	L133-D137 WeakPolarHBondContact O-CB 3.36Å; L133-D137 PolarHBondContact O-N 3.26Å; I134-D137 PolarHBondContact O-N 2.96Å; D137-K173 IonicContact OD1-NZ 3.93Å; D137-K173 PolarHBondContact OD1-NZ 2.98Å
138	H	93.8	Very high	93.9	Very high	89 Å²	89	54.9 Å²	54.9	41%	0.412	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	19.6	176	-70.1	-64.5	0	0	0	114.2	A101 M107 I134 A135 L136	A101-H138 HydrophobicContact CB-CB 4.38Å; A101-H138 WeakPolarHBondContact CB-CD2 3.49Å; M107-H138 HydrophobicContact CG-CB 4.06Å; I134-H138 PolarHBondContact O-CD2 3.3Å; I134-H138 PolarHBondContact O-N 3.14Å; I134-H138 VanDerWaalsContact O-N 3.15Å; A135-H138 CarbonylContact O-C 3.52Å; A135-H138 PolarHBondContact O-N 2.99Å; L136-H138 PolarHBondContact O-N 3.13Å
139	G	91.1	Very high	93.7	Very high	47 Å²	47	54.7 Å²	54.7	49%	0.485	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	21.2	167.1	0	0	0	0	0	115.8	A135 L136	A135-G139 PolarHBondContact O-N 3.26Å; L136-G139 PolarHBondContact O-N 3.31Å
140	A	95.1	Very high	93.7	Very high	8 Å²	8	53.5 Å²	53.5	7%	0.066	27%	0.268	C	S	.	.			trans	-60.4	137.6	170.6	0	0	0	0	0	111.7	M107 I117 L118 A135 V142	M107-A140 HydrophobicContact CB-CB 4.03Å; I117-A140 HydrophobicContact CG2-CB 3.83Å; L118-A140 HydrophobicContact CD1-CB 4.25Å; L118-A140 HydrophobicContact CD2-CB 4.25Å; L118-A140 HydrophobicContact CG-CB 4.05Å; A135-A140 HydrophobicContact CB-CB 3.91Å; A135-A140 WeakPolarHBondContact O-CB 3.49Å; A135-A140 PolarHBondContact O-N 3.44Å; A140-V142 PolarHBondContact O-N 3.47Å
141	D	93.9	Very high	93.7	Very high	80 Å²	80	47.2 Å²	47.2	43%	0.428	25%	0.245	S	C	.	.			trans	-76.3	110.5	178.7	-179.9	15.9	0	0	0	111.6	N143 N144	D141-N143 PolarHBondContact O-N 2.97Å; D141-N143 PolarHBondContact OD1-N 2.97Å; D141-N144 HydrophobicContact CB-CB 4.23Å; D141-N144 WeakPolarHBondContact O-CB 3.46Å; D141-N144 PolarHBondContact O-N 2.94Å; D141-N144 PolarHBondContact OD2-N 3.33Å
142	V	94.3	Very high	93.7	Very high	12 Å²	12	47.2 Å²	47.2	7%	0.073	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.2	178.7	-160.7	0	0	0	0	112.3	L136 A140 F170 K173 A175	L136-V142 HydrophobicContact CD2-CB 4.44Å; L136-V142 HydrophobicContact CD2-CG1 4.47Å; L136-V142 HydrophobicContact CD2-CG2 3.36Å; A140-V142 PolarHBondContact O-N 3.47Å; V142-F170 HydrophobicContact CG1-CB 3.86Å; V142-F170 HydrophobicContact CG1-CD1 4.44Å; V142-F170 HydrophobicContact CG1-CG 4.09Å; V142-K173 HydrophobicContact CG2-CB 4.15Å; V142-A175 HydrophobicContact CG1-CB 3.72Å
143	N	94.1	Very high	93.7	Very high	62 Å²	62	47.2 Å²	47.2	33%	0.332	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	16.3	-177.4	-66.8	-57.5	0	0	0	112.5	D141 I145 G174 A175 N176	D141-N143 PolarHBondContact O-N 2.97Å; D141-N143 PolarHBondContact OD1-N 2.97Å; N143-I145 VanDerWaalsContact O-CG1 3.28Å; N143-I145 WeakPolarHBondContact O-CG1 3.15Å; N143-G174 PolarHBondContact ND2-O 3.27Å; N143-A175 WeakPolarHBondContact OD1-CA 3.35Å; N143-N176 WeakPolarHBondContact OD1-CB 3.19Å; N143-N176 PolarHBondContact OD1-N 2.89Å
144	N	94.1	Very high	93.6	Very high	19 Å²	19	45 Å²	45	10%	0.102	23%	0.233	C	C	.	.			trans	-57	142.4	176.5	176.7	-104.8	0	0	0	111.4	V110 G114 G116 F119 D141 V152	V110-N144 WeakPolarHBondContact CG1-ND2 3.37Å; G114-N144 PolarHBondContact O-OD1 3.35Å; G116-N144 PolarHBondContact N-OD1 3.36Å; F119-N144 VanDerWaalsContact CE2-OD1 3.25Å; F119-N144 WeakPolarHBondContact CE2-OD1 3.41Å; D141-N144 HydrophobicContact CB-CB 4.23Å; D141-N144 WeakPolarHBondContact O-CB 3.46Å; D141-N144 PolarHBondContact O-N 2.94Å; D141-N144 PolarHBondContact OD2-N 3.33Å; N144-V152 HydrophobicContact CB-CG2 3.85Å; N144-V152 WeakPolarHBondContact O-CG2 3.37Å; N144-V152 PolarHBondContact O-N 3.48Å
145	I	93.9	Very high	93.6	Very high	92 Å²	92	46.1 Å²	46.1	47%	0.472	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-128.9	131.5	-175.5	-47.6	-179.1	0	0	0	107.8	N143 G149 K150	N143-I145 VanDerWaalsContact O-CG1 3.28Å; N143-I145 WeakPolarHBondContact O-CG1 3.15Å; I145-G149 VanDerWaalsContact CG2-C 3.44Å; I145-K150 WeakPolarHBondContact CA-O 3.33Å
146	T	94.5	Very high	93.5	Very high	12 Å²	12	46.1 Å²	46.1	7%	0.074	24%	0.237	C	C	.	.			trans	-65.5	164.3	172.9	66.6	0	0	0	0	111.4	K115 F119 E148 G149 K150	K115-T146 HydrophobicContact CG-CG2 3.74Å; F119-T146 HydrophobicContact CD2-CG2 4.46Å; F119-T146 HydrophobicContact CE1-CG2 3.93Å; F119-T146 HydrophobicContact CE2-CG2 3.67Å; F119-T146 HydrophobicContact CZ-CG2 3.39Å; T146-E148 PolarHBondContact O-N 2.97Å; T146-E148 PolarHBondContact OG1-N 3.04Å; T146-G149 WeakPolarHBondContact O-CA 3.32Å; T146-G149 PolarHBondContact O-N 3.11Å; T146-K150 HydrophobicContact CG2-CB 4.46Å; T146-K150 PolarHBondContact N-O 3.34Å; T146-K150 WeakPolarHBondContact OG1-CB 3.43Å; T146-K150 PolarHBondContact OG1-N 3.43Å; T146-K150 VanDerWaalsContact OG1-N 3.1Å
147	Y	91.8	Very high	93.4	Very high	169 Å²	169	45.5 Å²	45.5	66%	0.663	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.8	174.2	-62.1	-37.8	0	0	0	113.5	N112 E113 G149	N112-Y147 WeakPolarHBondContact O-CD2 3.12Å; N112-Y147 VanDerWaalsContact O-CE2 3.28Å; N112-Y147 WeakPolarHBondContact O-CE2 3.4Å; E113-Y147 PolarHBondContact O-N 3Å; Y147-G149 PolarHBondContact O-N 3.11Å
148	E	89.3	Confident	93.3	Very high	153 Å²	153	43 Å²	43	72%	0.715	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-8.4	169.9	-60	-175.2	158.3	0	0	113.2	T146	T146-E148 PolarHBondContact O-N 2.97Å; T146-E148 PolarHBondContact OG1-N 3.04Å
149	G	90.9	Very high	93.1	Very high	8 Å²	8	41.5 Å²	41.5	8%	0.082	21%	0.212	C	C	.	.	S	Bend	trans	84	26.2	-178.6	0	0	0	0	0	113.8	I145 T146 Y147 P151 N181 S182	I145-G149 VanDerWaalsContact CG2-C 3.44Å; T146-G149 WeakPolarHBondContact O-CA 3.32Å; T146-G149 PolarHBondContact O-N 3.11Å; Y147-G149 PolarHBondContact O-N 3.11Å; G149-P151 WeakPolarHBondContact O-CD 3.34Å; G149-N181 WeakPolarHBondContact O-CA 3.49Å; G149-S182 PolarHBondContact O-N 3.49Å
150	K	93.1	Very high	92.9	Very high	40 Å²	40	39.3 Å²	39.3	17%	0.174	19%	0.189	C	C	.	.			trans	-96.4	119.1	177	-170.7	172.6	-176.1	169.4	0	110.7	F119 I145 T146 L154 E158	F119-K150 WeakPolarHBondContact CZ-O 3.46Å; I145-K150 WeakPolarHBondContact CA-O 3.33Å; T146-K150 HydrophobicContact CG2-CB 4.46Å; T146-K150 PolarHBondContact N-O 3.34Å; T146-K150 WeakPolarHBondContact OG1-CB 3.43Å; T146-K150 PolarHBondContact OG1-N 3.43Å; T146-K150 VanDerWaalsContact OG1-N 3.1Å; K150-L154 HydrophobicContact CG-CD2 4.29Å; K150-E158 WeakPolarHBondContact CE-OE1 3.39Å; K150-E158 IonicContact NZ-OE1 2.79Å; K150-E158 PolarHBondContact NZ-OE1 2.78Å; K150-E158 IonicContact NZ-OE2 2.96Å; K150-E158 PolarHBondContact NZ-OE2 3.43Å
151	P	95	Very high	92.4	Very high	4 Å²	4	45.9 Å²	45.9	3%	0.026	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-72.7	146.1	175.1	-18.4	31.6	0	0	0	113	G149 F153 L154 K155 A179	G149-P151 WeakPolarHBondContact O-CD 3.34Å; P151-F153 PolarHBondContact O-N 3.04Å; P151-L154 HydrophobicContact CB-CB 4.22Å; P151-L154 HydrophobicContact CG-CB 4.37Å; P151-L154 PolarHBondContact O-N 3.09Å; P151-K155 PolarHBondContact O-N 3.12Å; P151-K155 VanDerWaalsContact O-N 3.08Å; P151-A179 HydrophobicContact CB-CB 3.9Å; P151-A179 HydrophobicContact CG-CB 3.74Å
152	V	94.7	Very high	92.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-53.5	-50.6	174.4	172.6	0	0	0	0	111.4	L118 F119 I122 N144 L154 K155 A156 F170	L118-V152 HydrophobicContact CB-CG1 3.68Å; L118-V152 HydrophobicContact CB-CG2 4.39Å; L118-V152 HydrophobicContact CD1-CG1 4.37Å; F119-V152 HydrophobicContact CD1-CG2 4.48Å; F119-V152 HydrophobicContact CD2-CG2 3.49Å; F119-V152 VanDerWaalsContact CD2-CG2 3.49Å; F119-V152 HydrophobicContact CE1-CG2 4.19Å; F119-V152 HydrophobicContact CE2-CB 4.24Å; F119-V152 HydrophobicContact CE2-CG2 3.15Å; F119-V152 HydrophobicContact CG-CG2 4.15Å; F119-V152 HydrophobicContact CZ-CB 4.15Å; F119-V152 HydrophobicContact CZ-CG2 3.52Å; I122-V152 HydrophobicContact CD1-CG1 4.25Å; N144-V152 HydrophobicContact CB-CG2 3.85Å; N144-V152 WeakPolarHBondContact O-CG2 3.37Å; N144-V152 PolarHBondContact O-N 3.48Å; V152-L154 VanDerWaalsContact C-N 3.27Å; V152-L154 PolarHBondContact O-N 3.31Å; V152-K155 WeakPolarHBondContact O-CB 3.45Å; V152-K155 PolarHBondContact O-N 3.37Å; V152-K155 VanDerWaalsContact O-N 3.08Å; V152-A156 PolarHBondContact O-N 3.07Å; V152-F170 HydrophobicContact CG1-CD2 4.43Å; V152-F170 HydrophobicContact CG1-CE2 3.83Å; V152-F170 HydrophobicContact CG1-CZ 4.49Å
153	F	94.6	Very high	91.9	Very high	1 Å²	1	46.8 Å²	46.8	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-37.3	-176	-178.1	-120.4	0	0	0	112.3	P151 A156 C157 C167 F170 L171 A175 A188 L200 I204	P151-F153 PolarHBondContact O-N 3.04Å; F153-A156 PolarHBondContact O-N 3.12Å; F153-C157 PolarHBondContact O-N 2.87Å; F153-C157 PolarHBondContact O-SG 2.79Å; F153-C167 HydrophobicContact CE2-CB 4.29Å; F153-F170 HydrophobicContact CD2-CB 3.86Å; F153-F170 HydrophobicContact CD2-CD2 4.21Å; F153-F170 HydrophobicContact CE2-CB 4.26Å; F153-L171 HydrophobicContact CE1-CD2 3.7Å; F153-L171 HydrophobicContact CE1-CG 4.31Å; F153-L171 HydrophobicContact CE2-CD1 4.37Å; F153-L171 HydrophobicContact CE2-CD2 3.95Å; F153-L171 HydrophobicContact CE2-CG 3.69Å; F153-L171 HydrophobicContact CZ-CD1 3.9Å; F153-L171 HydrophobicContact CZ-CD2 3.33Å; F153-L171 HydrophobicContact CZ-CG 3.44Å; F153-L171 VanDerWaalsContact CZ-CG 3.44Å; F153-A175 HydrophobicContact CB-CB 4.06Å; F153-A175 HydrophobicContact CD1-CB 4.18Å; F153-A175 HydrophobicContact CD2-CB 3.86Å; F153-A175 HydrophobicContact CE2-CB 4.42Å; F153-A175 HydrophobicContact CG-CB 3.76Å; F153-A188 HydrophobicContact CD1-CB 3.58Å; F153-A188 HydrophobicContact CE1-CB 3.42Å; F153-A188 VanDerWaalsContact CE1-CB 3.42Å; F153-A188 HydrophobicContact CZ-CB 4.41Å; F153-L200 HydrophobicContact CZ-CD1 4.41Å; F153-I204 HydrophobicContact CE1-CD1 4.2Å; F153-I204 HydrophobicContact CE1-CG1 4.23Å; F153-I204 HydrophobicContact CZ-CD1 4.05Å; F153-I204 HydrophobicContact CZ-CG1 4Å
154	L	93.8	Very high	91.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.6	-43	175	-175.1	149	0	0	0	111.2	K150 P151 V152 A156 C157 E158 N181 R186 E191	K150-L154 HydrophobicContact CG-CD2 4.29Å; P151-L154 HydrophobicContact CB-CB 4.22Å; P151-L154 HydrophobicContact CG-CB 4.37Å; P151-L154 PolarHBondContact O-N 3.09Å; V152-L154 VanDerWaalsContact C-N 3.27Å; V152-L154 PolarHBondContact O-N 3.31Å; L154-A156 VanDerWaalsContact C-N 3.27Å; L154-A156 PolarHBondContact O-N 2.9Å; L154-C157 WeakPolarHBondContact O-CB 3.16Å; L154-C157 PolarHBondContact O-N 3.48Å; L154-C157 VanDerWaalsContact O-N 3.09Å; L154-E158 PolarHBondContact O-N 3.04Å; L154-E158 VanDerWaalsContact O-N 3.12Å; L154-N181 HydrophobicContact CD1-CB 3.74Å; L154-N181 HydrophobicContact CD2-CB 4.23Å; L154-R186 WeakPolarHBondContact CD1-O 3.45Å; L154-E191 HydrophobicContact CG-CG 4.5Å
155	K	93.4	Very high	91.6	Very high	54 Å²	54	52.7 Å²	52.7	24%	0.235	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-40.2	174.9	177.2	57.3	-165.6	151.9	0	111.6	F119 I122 P151 V152 C157 E158 E159	F119-K155 HydrophobicContact CD1-CB 4.25Å; F119-K155 HydrophobicContact CD1-CG 4.1Å; F119-K155 HydrophobicContact CE1-CB 3.84Å; F119-K155 HydrophobicContact CE1-CG 4.14Å; I122-K155 HydrophobicContact CD1-CB 3.98Å; I122-K155 HydrophobicContact CD1-CG 3.69Å; P151-K155 PolarHBondContact O-N 3.12Å; P151-K155 VanDerWaalsContact O-N 3.08Å; V152-K155 WeakPolarHBondContact O-CB 3.45Å; V152-K155 PolarHBondContact O-N 3.37Å; V152-K155 VanDerWaalsContact O-N 3.08Å; K155-C157 VanDerWaalsContact C-N 3.33Å; K155-E158 VanDerWaalsContact CD-OE2 3.3Å; K155-E158 WeakPolarHBondContact CD-OE2 3.34Å; K155-E158 IonicContact NZ-OE2 2.75Å; K155-E158 PolarHBondContact NZ-OE2 3.33Å; K155-E158 WeakPolarHBondContact O-CB 3.36Å; K155-E158 PolarHBondContact O-N 2.86Å; K155-E159 IonicContact NZ-OE1 3.08Å; K155-E159 PolarHBondContact NZ-OE1 2.85Å
156	A	93.8	Very high	91.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.2	-35.9	175.6	0	0	0	0	0	112	I122 V152 F153 L154 E158 E159 A160 C167 F170	I122-A156 HydrophobicContact CD1-CB 4.01Å; I122-A156 HydrophobicContact CG1-CB 4.23Å; I122-A156 HydrophobicContact CG2-CB 4.41Å; V152-A156 PolarHBondContact O-N 3.07Å; F153-A156 PolarHBondContact O-N 3.12Å; L154-A156 VanDerWaalsContact C-N 3.27Å; L154-A156 PolarHBondContact O-N 2.9Å; A156-E158 VanDerWaalsContact C-N 3.32Å; A156-E158 PolarHBondContact O-N 3.34Å; A156-E159 CarbonylContact O-C 3.5Å; A156-E159 PolarHBondContact O-N 2.82Å; A156-E159 VanDerWaalsContact O-N 3.17Å; A156-A160 PolarHBondContact O-N 2.91Å; A156-C167 PolarHBondContact O-SG 3.07Å; A156-F170 HydrophobicContact CB-CD2 4.22Å; A156-F170 HydrophobicContact CB-CE2 4.06Å
157	C	92.8	Very high	91.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-24.7	176.6	-67.8	0	0	0	0	114.1	F153 L154 K155 E159 A160 E191	F153-C157 PolarHBondContact O-N 2.87Å; F153-C157 PolarHBondContact O-SG 2.79Å; L154-C157 WeakPolarHBondContact O-CB 3.16Å; L154-C157 PolarHBondContact O-N 3.48Å; L154-C157 VanDerWaalsContact O-N 3.09Å; K155-C157 VanDerWaalsContact C-N 3.33Å; C157-E159 PolarHBondContact O-N 2.89Å; C157-A160 WeakPolarHBondContact O-CB 3.37Å; C157-A160 PolarHBondContact O-N 2.92Å; C157-E191 HydrophobicContact CB-CB 4.23Å
158	E	91.2	Very high	91.6	Very high	52 Å²	52	42.1 Å²	42.1	24%	0.243	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-27.5	171.5	-67.5	176	172.9	0	0	112.1	K150 L154 K155 A156 E191 E195	K150-E158 WeakPolarHBondContact CE-OE1 3.39Å; K150-E158 IonicContact NZ-OE1 2.79Å; K150-E158 PolarHBondContact NZ-OE1 2.78Å; K150-E158 IonicContact NZ-OE2 2.96Å; K150-E158 PolarHBondContact NZ-OE2 3.43Å; L154-E158 PolarHBondContact O-N 3.04Å; L154-E158 VanDerWaalsContact O-N 3.12Å; K155-E158 VanDerWaalsContact CD-OE2 3.3Å; K155-E158 WeakPolarHBondContact CD-OE2 3.34Å; K155-E158 IonicContact NZ-OE2 2.75Å; K155-E158 PolarHBondContact NZ-OE2 3.33Å; K155-E158 WeakPolarHBondContact O-CB 3.36Å; K155-E158 PolarHBondContact O-N 2.86Å; A156-E158 VanDerWaalsContact C-N 3.32Å; A156-E158 PolarHBondContact O-N 3.34Å; E158-E191 HydrophobicContact CG-CG 4.27Å; E158-E195 WeakPolarHBondContact O-CG 3.41Å
159	E	89.6	Confident	91.8	Very high	58 Å²	58	35.2 Å²	35.2	27%	0.271	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	26.2	179.7	-65.2	174.8	-149.8	0	0	111	K155 A156 C157 H161 D162 V163	K155-E159 IonicContact NZ-OE1 3.08Å; K155-E159 PolarHBondContact NZ-OE1 2.85Å; A156-E159 CarbonylContact O-C 3.5Å; A156-E159 PolarHBondContact O-N 2.82Å; A156-E159 VanDerWaalsContact O-N 3.17Å; C157-E159 PolarHBondContact O-N 2.89Å; E159-H161 PolarHBondContact O-N 3.09Å; E159-D162 PolarHBondContact O-N 2.87Å; E159-V163 HydrophobicContact CB-CG2 4.17Å; E159-V163 PolarHBondContact O-N 3.12Å
160	A	86.8	Confident	91.9	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.9	-171.7	0	0	0	0	0	114.7	A156 C157 E195 A197 L200	A156-A160 PolarHBondContact O-N 2.91Å; C157-A160 WeakPolarHBondContact O-CB 3.37Å; C157-A160 PolarHBondContact O-N 2.92Å; A160-E195 HydrophobicContact CB-CB 4.3Å; A160-A197 HydrophobicContact CB-CB 3.76Å; A160-L200 HydrophobicContact CB-CD2 3.66Å
161	H	85.3	Confident	92	Very high	147 Å²	147	33.1 Å²	33.1	68%	0.681	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-43	175.9	-168.3	68.7	0	0	0	111.7	E159	E159-H161 PolarHBondContact O-N 3.09Å
162	D	87.6	Confident	91.9	Very high	105 Å²	105	39.2 Å²	39.2	56%	0.561	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-24.3	-172.8	-55.9	-46.2	0	0	0	112.6	P124 E159	P124-D162 HydrophobicContact CB-CB 3.43Å; P124-D162 VanDerWaalsContact CB-CB 3.43Å; P124-D162 HydrophobicContact CG-CB 4.31Å; E159-D162 PolarHBondContact O-N 2.87Å
163	V	90.6	Very high	91.8	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.036	21%	0.206	C	C	.	.			trans	-112.9	22.4	-170.4	-170.9	0	0	0	0	112.7	P124 E159 E165 M166 C167	P124-V163 HydrophobicContact CB-CG2 4.26Å; E159-V163 HydrophobicContact CB-CG2 4.17Å; E159-V163 PolarHBondContact O-N 3.12Å; V163-E165 PolarHBondContact O-N 2.92Å; V163-M166 HydrophobicContact CG1-CB 3.45Å; V163-M166 VanDerWaalsContact CG1-CB 3.45Å; V163-M166 HydrophobicContact CG1-CE 3.62Å; V163-M166 HydrophobicContact CG1-CG 4.05Å; V163-M166 HydrophobicContact CG1-SD 3.59Å; V163-M166 VanDerWaalsContact CG1-SD 3.59Å; V163-M166 WeakPolarHBondContact O-CB 3.43Å; V163-M166 PolarHBondContact O-N 3.41Å; V163-C167 PolarHBondContact O-N 3.12Å; V163-C167 VanDerWaalsContact O-N 3.1Å; V163-C167 PolarHBondContact O-SG 2.9Å; V163-C167 VanDerWaalsContact O-SG 3.38Å
164	K	90.6	Very high	91.6	Very high	68 Å²	68	46 Å²	46	30%	0.296	23%	0.229	S	C	.	.	H	α-helix	trans	-52.1	-47.4	-174.8	-178.7	-172.6	170.9	-163.3	0	115.2	M166 C167 M168 E199	K164-M166 VanDerWaalsContact C-N 3.33Å; K164-M166 PolarHBondContact O-N 2.61Å; K164-C167 PolarHBondContact O-N 3.09Å; K164-M168 WeakPolarHBondContact O-CG 3.4Å; K164-M168 PolarHBondContact O-N 3.31Å; K164-M168 VanDerWaalsContact O-N 3.08Å; K164-E199 VanDerWaalsContact CE-CD 3.42Å; K164-E199 WeakPolarHBondContact CE-OE2 3.36Å; K164-E199 IonicContact NZ-OE1 3.11Å; K164-E199 PolarHBondContact NZ-OE1 3.25Å; K164-E199 IonicContact NZ-OE2 2.89Å; K164-E199 PolarHBondContact NZ-OE2 3.19Å
165	E	90.7	Very high	91.6	Very high	136 Å²	136	46.3 Å²	46.3	64%	0.636	23%	0.231	S	C	*	.	H	α-helix	trans	-61.8	-43	-178.5	-68	-178.9	175.2	0	0	111	Y129 V163 C167 M168 T169	Y129-E165 HydrophobicContact CD2-CB 4.5Å; Y129-E165 HydrophobicContact CE2-CB 4.05Å; V163-E165 PolarHBondContact O-N 2.92Å; E165-C167 PolarHBondContact O-N 3.3Å; E165-M168 PolarHBondContact O-N 2.87Å; E165-T169 PolarHBondContact O-N 2.84Å; E165-T169 PolarHBondContact O-OG1 2.94Å; E165-T169 VanDerWaalsContact O-OG1 3.05Å
166	M	92.9	Very high	91.6	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.02	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-43.2	177.3	-165.5	-178.8	-53.5	0	0	111.9	C121 Y129 V163 K164 M168 T169 F170	C121-M166 VanDerWaalsContact O-CE 3.29Å; C121-M166 WeakPolarHBondContact O-CE 3.49Å; Y129-M166 HydrophobicContact CD2-CB 3.94Å; Y129-M166 HydrophobicContact CD2-CG 4.35Å; Y129-M166 HydrophobicContact CE2-CB 4.39Å; V163-M166 HydrophobicContact CG1-CB 3.45Å; V163-M166 VanDerWaalsContact CG1-CB 3.45Å; V163-M166 HydrophobicContact CG1-CE 3.62Å; V163-M166 HydrophobicContact CG1-CG 4.05Å; V163-M166 HydrophobicContact CG1-SD 3.59Å; V163-M166 VanDerWaalsContact CG1-SD 3.59Å; V163-M166 WeakPolarHBondContact O-CB 3.43Å; V163-M166 PolarHBondContact O-N 3.41Å; K164-M166 VanDerWaalsContact C-N 3.33Å; K164-M166 PolarHBondContact O-N 2.61Å; M166-M168 VanDerWaalsContact C-N 3.3Å; M166-M168 PolarHBondContact O-N 2.9Å; M166-T169 WeakPolarHBondContact O-CB 3.48Å; M166-T169 PolarHBondContact O-N 2.99Å; M166-F170 HydrophobicContact CG-CD1 4.35Å; M166-F170 HydrophobicContact CG-CE1 3.76Å; M166-F170 HydrophobicContact CG-CE2 4.28Å; M166-F170 HydrophobicContact CG-CZ 3.72Å; M166-F170 WeakPolarHBondContact O-CD1 3.43Å; M166-F170 WeakPolarHBondContact O-CG 3.42Å; M166-F170 PolarHBondContact O-N 3.09Å; M166-F170 HydrophobicContact SD-CE1 4.48Å; M166-F170 HydrophobicContact SD-CE2 4.49Å; M166-F170 HydrophobicContact SD-CZ 3.93Å
167	C	93.5	Very high	91.4	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-39.5	176.4	-63.6	0	0	0	0	111.8	F153 A156 V163 K164 E165 F170 L171 L200	F153-C167 HydrophobicContact CE2-CB 4.29Å; A156-C167 PolarHBondContact O-SG 3.07Å; V163-C167 PolarHBondContact O-N 3.12Å; V163-C167 VanDerWaalsContact O-N 3.1Å; V163-C167 PolarHBondContact O-SG 2.9Å; V163-C167 VanDerWaalsContact O-SG 3.38Å; K164-C167 PolarHBondContact O-N 3.09Å; E165-C167 PolarHBondContact O-N 3.3Å; C167-F170 PolarHBondContact O-N 3Å; C167-L171 WeakPolarHBondContact O-CG 3.48Å; C167-L171 PolarHBondContact O-N 2.88Å; C167-L171 VanDerWaalsContact O-N 3.09Å; C167-L200 HydrophobicContact CB-CD1 3.56Å; C167-L200 HydrophobicContact CB-CD2 3.76Å; C167-L200 HydrophobicContact CB-CG 4.31Å
168	M	93.2	Very high	91.4	Very high	47 Å²	47	50.1 Å²	50.1	23%	0.232	26%	0.255	C	S	.	.	H	α-helix	trans	-65	-42.6	175	-68.8	-59.8	-65.2	0	0	111.6	K164 E165 M166 F170 L171 E172 L200	K164-M168 WeakPolarHBondContact O-CG 3.4Å; K164-M168 PolarHBondContact O-N 3.31Å; K164-M168 VanDerWaalsContact O-N 3.08Å; E165-M168 PolarHBondContact O-N 2.87Å; M166-M168 VanDerWaalsContact C-N 3.3Å; M166-M168 PolarHBondContact O-N 2.9Å; M168-F170 VanDerWaalsContact C-N 3.34Å; M168-F170 PolarHBondContact O-N 3.18Å; M168-L171 WeakPolarHBondContact O-CB 3.09Å; M168-L171 PolarHBondContact O-N 2.95Å; M168-L171 HydrophobicContact SD-CD1 4.31Å; M168-E172 WeakPolarHBondContact O-CG 3.36Å; M168-E172 PolarHBondContact O-N 2.75Å; M168-L200 HydrophobicContact SD-CD1 4.01Å
169	T	93.6	Very high	91.3	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.049	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-41.6	174.1	-51.3	0	0	0	0	112	Y129 L133 L136 E165 M166 L171 E172 K173	Y129-T169 PolarHBondContact OH-OG1 2.97Å; L133-T169 HydrophobicContact CD2-CG2 3.58Å; L136-T169 HydrophobicContact CD1-CG2 3.88Å; E165-T169 PolarHBondContact O-N 2.84Å; E165-T169 PolarHBondContact O-OG1 2.94Å; E165-T169 VanDerWaalsContact O-OG1 3.05Å; M166-T169 WeakPolarHBondContact O-CB 3.48Å; M166-T169 PolarHBondContact O-N 2.99Å; T169-L171 VanDerWaalsContact C-N 3.3Å; T169-L171 PolarHBondContact O-N 3.45Å; T169-E172 WeakPolarHBondContact O-CB 3.41Å; T169-E172 PolarHBondContact O-N 3.4Å; T169-E172 VanDerWaalsContact O-N 3.17Å; T169-K173 HydrophobicContact CG2-CG 4.39Å; T169-K173 WeakPolarHBondContact O-CB 3.31Å; T169-K173 WeakPolarHBondContact O-CG 3.48Å; T169-K173 PolarHBondContact O-N 2.96Å
170	F	94.4	Very high	91.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-42.9	176.6	-72.2	1.8	0	0	0	111	L118 L136 V142 V152 F153 A156 M166 C167 M168 E172 K173 G174 A175	L118-F170 HydrophobicContact CB-CZ 4.32Å; L118-F170 HydrophobicContact CD1-CE1 4.47Å; L118-F170 HydrophobicContact CD1-CZ 4.41Å; L118-F170 HydrophobicContact CD2-CE1 4.13Å; L118-F170 HydrophobicContact CD2-CZ 4.15Å; L136-F170 HydrophobicContact CD1-CD1 3.82Å; L136-F170 HydrophobicContact CD1-CE1 3.85Å; L136-F170 HydrophobicContact CD2-CD1 4.45Å; L136-F170 HydrophobicContact CG-CE1 4.49Å; V142-F170 HydrophobicContact CG1-CB 3.86Å; V142-F170 HydrophobicContact CG1-CD1 4.44Å; V142-F170 HydrophobicContact CG1-CG 4.09Å; V152-F170 HydrophobicContact CG1-CD2 4.43Å; V152-F170 HydrophobicContact CG1-CE2 3.83Å; V152-F170 HydrophobicContact CG1-CZ 4.49Å; F153-F170 HydrophobicContact CD2-CB 3.86Å; F153-F170 HydrophobicContact CD2-CD2 4.21Å; F153-F170 HydrophobicContact CE2-CB 4.26Å; A156-F170 HydrophobicContact CB-CD2 4.22Å; A156-F170 HydrophobicContact CB-CE2 4.06Å; M166-F170 HydrophobicContact CG-CD1 4.35Å; M166-F170 HydrophobicContact CG-CE1 3.76Å; M166-F170 HydrophobicContact CG-CE2 4.28Å; M166-F170 HydrophobicContact CG-CZ 3.72Å; M166-F170 WeakPolarHBondContact O-CD1 3.43Å; M166-F170 WeakPolarHBondContact O-CG 3.42Å; M166-F170 PolarHBondContact O-N 3.09Å; M166-F170 HydrophobicContact SD-CE1 4.48Å; M166-F170 HydrophobicContact SD-CE2 4.49Å; M166-F170 HydrophobicContact SD-CZ 3.93Å; C167-F170 PolarHBondContact O-N 3Å; M168-F170 VanDerWaalsContact C-N 3.34Å; M168-F170 PolarHBondContact O-N 3.18Å; F170-E172 PolarHBondContact O-N 2.95Å; F170-K173 CarbonylContact O-C 3.54Å; F170-K173 PolarHBondContact O-N 3.28Å; F170-G174 PolarHBondContact O-N 3.31Å; F170-A175 HydrophobicContact CB-CB 4.11Å; F170-A175 WeakPolarHBondContact O-CB 3.49Å; F170-A175 PolarHBondContact O-N 3.28Å
171	L	93.4	Very high	91.6	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-37.3	174.3	-75.7	175.7	0	0	0	113.5	F153 C167 M168 T169 K173 G174 A175 L200 I204 R207	F153-L171 HydrophobicContact CE1-CD2 3.7Å; F153-L171 HydrophobicContact CE1-CG 4.31Å; F153-L171 HydrophobicContact CE2-CD1 4.37Å; F153-L171 HydrophobicContact CE2-CD2 3.95Å; F153-L171 HydrophobicContact CE2-CG 3.69Å; F153-L171 HydrophobicContact CZ-CD1 3.9Å; F153-L171 HydrophobicContact CZ-CD2 3.33Å; F153-L171 HydrophobicContact CZ-CG 3.44Å; F153-L171 VanDerWaalsContact CZ-CG 3.44Å; C167-L171 WeakPolarHBondContact O-CG 3.48Å; C167-L171 PolarHBondContact O-N 2.88Å; C167-L171 VanDerWaalsContact O-N 3.09Å; M168-L171 WeakPolarHBondContact O-CB 3.09Å; M168-L171 PolarHBondContact O-N 2.95Å; M168-L171 HydrophobicContact SD-CD1 4.31Å; T169-L171 VanDerWaalsContact C-N 3.3Å; T169-L171 PolarHBondContact O-N 3.45Å; L171-K173 VanDerWaalsContact C-N 3.32Å; L171-G174 PolarHBondContact O-N 3.31Å; L171-A175 HydrophobicContact CD2-CB 4.43Å; L171-L200 HydrophobicContact CD1-CD1 3.69Å; L171-I204 HydrophobicContact CD1-CG1 3.78Å; L171-I204 HydrophobicContact CD2-CG1 4.24Å; L171-R207 PolarHBondContact O-NE 3.34Å
172	E	92.9	Very high	91.9	Very high	131 Å²	131	48 Å²	48	61%	0.612	26%	0.26	S	S	*	.	H	α-helix	trans	-66.7	-34.3	174	-71.7	170.2	-176.5	0	0	112.3	M168 T169 F170 G174	M168-E172 WeakPolarHBondContact O-CG 3.36Å; M168-E172 PolarHBondContact O-N 2.75Å; T169-E172 WeakPolarHBondContact O-CB 3.41Å; T169-E172 PolarHBondContact O-N 3.4Å; T169-E172 VanDerWaalsContact O-N 3.17Å; F170-E172 PolarHBondContact O-N 2.95Å; E172-G174 VanDerWaalsContact C-N 3.28Å; E172-G174 PolarHBondContact O-N 2.83Å
173	K	93	Very high	92	Very high	98 Å²	98	46.5 Å²	46.5	43%	0.426	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	10.2	179.5	-65.8	-77.8	-168.4	161.2	0	113.8	L136 D137 V142 T169 F170 L171	L136-K173 HydrophobicContact CD1-CG 4.23Å; L136-K173 HydrophobicContact CD2-CB 4.32Å; L136-K173 HydrophobicContact CD2-CG 4.48Å; D137-K173 IonicContact OD1-NZ 3.93Å; D137-K173 PolarHBondContact OD1-NZ 2.98Å; V142-K173 HydrophobicContact CG2-CB 4.15Å; T169-K173 HydrophobicContact CG2-CG 4.39Å; T169-K173 WeakPolarHBondContact O-CB 3.31Å; T169-K173 WeakPolarHBondContact O-CG 3.48Å; T169-K173 PolarHBondContact O-N 2.96Å; F170-K173 CarbonylContact O-C 3.54Å; F170-K173 PolarHBondContact O-N 3.28Å; L171-K173 VanDerWaalsContact C-N 3.32Å
174	G	91.6	Very high	92	Very high	47 Å²	47	48.3 Å²	48.3	49%	0.485	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	26.2	171.9	0	0	0	0	0	115.5	N143 F170 L171 E172 N176	N143-G174 PolarHBondContact ND2-O 3.27Å; F170-G174 PolarHBondContact O-N 3.31Å; L171-G174 PolarHBondContact O-N 3.31Å; E172-G174 VanDerWaalsContact C-N 3.28Å; E172-G174 PolarHBondContact O-N 2.83Å; G174-N176 PolarHBondContact O-N 3.04Å
175	A	93.9	Very high	92	Very high	5 Å²	5	45.5 Å²	45.5	4%	0.041	26%	0.26	C	S	.	.			trans	-58.5	133.4	168	0	0	0	0	0	111	V142 N143 F153 F170 L171 P177	V142-A175 HydrophobicContact CG1-CB 3.72Å; N143-A175 WeakPolarHBondContact OD1-CA 3.35Å; F153-A175 HydrophobicContact CB-CB 4.06Å; F153-A175 HydrophobicContact CD1-CB 4.18Å; F153-A175 HydrophobicContact CD2-CB 3.86Å; F153-A175 HydrophobicContact CE2-CB 4.42Å; F153-A175 HydrophobicContact CG-CB 3.76Å; F170-A175 HydrophobicContact CB-CB 4.11Å; F170-A175 WeakPolarHBondContact O-CB 3.49Å; F170-A175 PolarHBondContact O-N 3.28Å; L171-A175 HydrophobicContact CD2-CB 4.43Å; A175-P177 VanDerWaalsContact O-CD 3.26Å; A175-P177 WeakPolarHBondContact O-CD 3.26Å
176	N	92.1	Very high	92.1	Very high	77 Å²	77	41.1 Å²	41.1	41%	0.412	24%	0.238	S	C	.	.			trans	-72.2	113.8	177.7	-178	-1.1	0	0	0	110	N143 G174 N178 A179	N143-N176 WeakPolarHBondContact OD1-CB 3.19Å; N143-N176 PolarHBondContact OD1-N 2.89Å; G174-N176 PolarHBondContact O-N 3.04Å; N176-N178 PolarHBondContact O-N 3.18Å; N176-N178 PolarHBondContact OD1-N 3.04Å; N176-A179 HydrophobicContact CB-CB 4.35Å; N176-A179 WeakPolarHBondContact O-CB 2.79Å; N176-A179 PolarHBondContact O-N 3.36Å
177	P	90.8	Very high	92.2	Very high	14 Å²	14	41.2 Å²	41.2	9%	0.091	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.9	-179.3	28.1	-34.5	0	0	0	112.8	A175 I204 R207	A175-P177 VanDerWaalsContact O-CD 3.26Å; A175-P177 WeakPolarHBondContact O-CD 3.26Å; P177-I204 HydrophobicContact CB-CG2 3.77Å; P177-R207 HydrophobicContact CG-CB 4.46Å
178	N	91.3	Very high	92.2	Very high	44 Å²	44	41.2 Å²	41.2	24%	0.235	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	16.1	-177.1	-61.4	-34.1	0	0	0	112.4	N176 I180 G208 G209 E210	N176-N178 PolarHBondContact O-N 3.18Å; N176-N178 PolarHBondContact OD1-N 3.04Å; N178-I180 PolarHBondContact O-N 3.16Å; N178-G208 PolarHBondContact ND2-O 3.15Å; N178-G209 VanDerWaalsContact OD1-CA 3.3Å; N178-G209 WeakPolarHBondContact OD1-CA 3.36Å; N178-E210 PolarHBondContact OD1-N 2.79Å
179	A	89.6	Confident	92.3	Very high	14 Å²	14	39 Å²	39	12%	0.116	23%	0.227	C	C	.	.			trans	-62.1	131.8	173.2	0	0	0	0	0	110.2	P151 N176	P151-A179 HydrophobicContact CB-CB 3.9Å; P151-A179 HydrophobicContact CG-CB 3.74Å; N176-A179 HydrophobicContact CB-CB 4.35Å; N176-A179 WeakPolarHBondContact O-CB 2.79Å; N176-A179 PolarHBondContact O-N 3.36Å
180	I	91.6	Very high	92.3	Very high	97 Å²	97	38.7 Å²	38.7	50%	0.497	23%	0.225	S	C	.	.	B	Isolated β-bridge	trans	-109.4	137.4	-177.4	-62	166.7	0	0	0	108.7	N178 S182 R186 T187	N178-I180 PolarHBondContact O-N 3.16Å; I180-S182 PolarHBondContact O-N 3.48Å; I180-R186 WeakPolarHBondContact CA-O 3.49Å; I180-T187 HydrophobicContact CG1-CG2 4.02Å
181	N	92.2	Very high	92.3	Very high	9 Å²	9	38.8 Å²	38.8	5%	0.048	23%	0.226	C	C	.	.			trans	-77	116.4	166.5	178.1	-4.8	0	0	0	109.8	G149 L154 S183 T184 G185 R186	G149-N181 WeakPolarHBondContact O-CA 3.49Å; L154-N181 HydrophobicContact CD1-CB 3.74Å; L154-N181 HydrophobicContact CD2-CB 4.23Å; N181-S183 VanDerWaalsContact CG-OG 3.28Å; N181-S183 PolarHBondContact ND2-OG 3.33Å; N181-S183 PolarHBondContact O-N 3.27Å; N181-S183 VanDerWaalsContact O-N 3.13Å; N181-S183 PolarHBondContact OD1-N 2.92Å; N181-S183 VanDerWaalsContact OD1-N 3.09Å; N181-S183 PolarHBondContact OD1-OG 3.11Å; N181-T184 WeakPolarHBondContact CB-OG1 3.49Å; N181-T184 PolarHBondContact ND2-OG1 3.11Å; N181-T184 PolarHBondContact O-N 2.96Å; N181-G185 WeakPolarHBondContact O-CA 3.45Å; N181-G185 PolarHBondContact O-N 2.68Å; N181-R186 PolarHBondContact N-O 2.93Å
182	S	90.6	Very high	92.3	Very high	92 Å²	92	38.6 Å²	38.6	64%	0.643	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-30.9	-177.1	-58.8	0	0	0	0	113.9	G149 I180	G149-S182 PolarHBondContact O-N 3.49Å; I180-S182 PolarHBondContact O-N 3.48Å
183	S	89.8	Confident	92.4	Very high	75 Å²	75	32.3 Å²	32.3	52%	0.524	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-37.5	-178.1	62.2	0	0	0	0	113.6	N181 N216	N181-S183 VanDerWaalsContact CG-OG 3.28Å; N181-S183 PolarHBondContact ND2-OG 3.33Å; N181-S183 PolarHBondContact O-N 3.27Å; N181-S183 VanDerWaalsContact O-N 3.13Å; N181-S183 PolarHBondContact OD1-N 2.92Å; N181-S183 VanDerWaalsContact OD1-N 3.09Å; N181-S183 PolarHBondContact OD1-OG 3.11Å; S183-N216 PolarHBondContact O-ND2 3.45Å; S183-N216 VanDerWaalsContact O-ND2 3.13Å
184	T	89.9	Confident	92.4	Very high	43 Å²	43	32.2 Å²	32.2	26%	0.264	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-18.5	-172.1	55.4	0	0	0	0	113.5	N181 R186 N216	N181-T184 WeakPolarHBondContact CB-OG1 3.49Å; N181-T184 PolarHBondContact ND2-OG1 3.11Å; N181-T184 PolarHBondContact O-N 2.96Å; T184-R186 PolarHBondContact O-N 3.3Å; T184-R186 PolarHBondContact OG1-N 2.97Å; T184-N216 VanDerWaalsContact C-ND2 3.3Å; T184-N216 WeakPolarHBondContact O-CB 3.42Å; T184-N216 VanDerWaalsContact O-CG 3.24Å; T184-N216 PolarHBondContact O-N 2.57Å; T184-N216 PolarHBondContact O-ND2 2.82Å
185	G	91.6	Very high	92.4	Very high	10 Å²	10	33.4 Å²	33.4	10%	0.103	19%	0.185	C	C	.	.			trans	73.8	6.3	-170.9	0	0	0	0	0	113.8	N181 D215	N181-G185 WeakPolarHBondContact O-CA 3.45Å; N181-G185 PolarHBondContact O-N 2.68Å; G185-D215 WeakPolarHBondContact O-CA 3.38Å
186	R	93.1	Very high	92.4	Very high	44 Å²	44	34 Å²	34	17%	0.166	19%	0.192	C	C	.	.			trans	-79.3	146.7	-176	-68.7	-174.8	-175.2	154.6	11.7	112.7	L154 I180 N181 T184 M190 E191 D215	L154-R186 WeakPolarHBondContact CD1-O 3.45Å; I180-R186 WeakPolarHBondContact CA-O 3.49Å; N181-R186 PolarHBondContact N-O 2.93Å; T184-R186 PolarHBondContact O-N 3.3Å; T184-R186 PolarHBondContact OG1-N 2.97Å; R186-M190 HydrophobicContact CB-SD 4.17Å; R186-M190 HydrophobicContact CG-SD 4.19Å; R186-E191 WeakPolarHBondContact CD-OE1 3.38Å; R186-E191 IonicContact CZ-OE1 3.44Å; R186-E191 IonicContact NE-OE1 3.34Å; R186-E191 IonicContact NH1-OE1 2.78Å; R186-E191 PolarHBondContact NH1-OE1 3.14Å; R186-D215 HydrophobicContact CG-CB 3.64Å; R186-D215 IonicContact NE-OD2 2.81Å; R186-D215 PolarHBondContact NE-OD2 3.09Å
187	T	93.9	Very high	92.5	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.031	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-100.4	161.8	173.2	64.6	0	0	0	0	111.7	I180 L189 M190 E191 A213	I180-T187 HydrophobicContact CG1-CG2 4.02Å; T187-L189 PolarHBondContact O-N 2.88Å; T187-M190 HydrophobicContact CG2-CE 4.24Å; T187-M190 WeakPolarHBondContact O-CB 3.32Å; T187-M190 PolarHBondContact O-N 2.84Å; T187-M190 VanDerWaalsContact O-N 3.08Å; T187-M190 WeakPolarHBondContact OG1-CG 3.21Å; T187-M190 PolarHBondContact OG1-N 3.09Å; T187-E191 PolarHBondContact O-N 2.94Å; T187-A213 HydrophobicContact CG2-CB 3.9Å
188	A	93.4	Very high	92.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.6	-36.6	173.7	0	0	0	0	0	112.5	F153 M190 E191 A192 I204	F153-A188 HydrophobicContact CD1-CB 3.58Å; F153-A188 HydrophobicContact CE1-CB 3.42Å; F153-A188 VanDerWaalsContact CE1-CB 3.42Å; F153-A188 HydrophobicContact CZ-CB 4.41Å; A188-M190 VanDerWaalsContact C-N 3.31Å; A188-M190 PolarHBondContact O-N 3.47Å; A188-E191 PolarHBondContact O-N 3.22Å; A188-A192 WeakPolarHBondContact O-CB 3.35Å; A188-A192 PolarHBondContact O-N 2.8Å; A188-I204 HydrophobicContact CB-CD1 4.36Å
189	L	94.9	Very high	92.6	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-37.6	176.4	-175.3	64.1	0	0	0	112.6	T187 S193 V201 I204 L205 A221 L237	T187-L189 PolarHBondContact O-N 2.88Å; L189-S193 VanDerWaalsContact O-CB 3.25Å; L189-S193 WeakPolarHBondContact O-CB 3.46Å; L189-S193 PolarHBondContact O-N 2.93Å; L189-S193 PolarHBondContact O-OG 3.24Å; L189-V201 HydrophobicContact CD1-CB 4.49Å; L189-V201 HydrophobicContact CD1-CG1 3.9Å; L189-V201 HydrophobicContact CD1-CG2 4.47Å; L189-I204 HydrophobicContact CB-CG2 4.09Å; L189-I204 HydrophobicContact CD1-CB 4.34Å; L189-I204 HydrophobicContact CD1-CG2 3.98Å; L189-L205 HydrophobicContact CD1-CD2 4.02Å; L189-L205 HydrophobicContact CD1-CG 4.05Å; L189-L205 HydrophobicContact CD2-CD2 3.85Å; L189-A221 HydrophobicContact CD2-CB 4.22Å; L189-A221 HydrophobicContact CG-CB 4.04Å; L189-L237 HydrophobicContact CD1-CD2 4.36Å; L189-L237 HydrophobicContact CD2-CD2 4.23Å; L189-L237 HydrophobicContact CG-CD2 4.44Å
190	M	94.6	Very high	92.8	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-67.8	-46.4	178.2	-67.8	170.9	-168.3	0	0	111.8	R186 T187 A188 S193 R194 A213 F214 D215 F224	R186-M190 HydrophobicContact CB-SD 4.17Å; R186-M190 HydrophobicContact CG-SD 4.19Å; T187-M190 HydrophobicContact CG2-CE 4.24Å; T187-M190 WeakPolarHBondContact O-CB 3.32Å; T187-M190 PolarHBondContact O-N 2.84Å; T187-M190 VanDerWaalsContact O-N 3.08Å; T187-M190 WeakPolarHBondContact OG1-CG 3.21Å; T187-M190 PolarHBondContact OG1-N 3.09Å; A188-M190 VanDerWaalsContact C-N 3.31Å; A188-M190 PolarHBondContact O-N 3.47Å; M190-S193 PolarHBondContact O-N 2.78Å; M190-R194 WeakPolarHBondContact O-CB 3.48Å; M190-R194 PolarHBondContact O-N 2.78Å; M190-A213 HydrophobicContact CE-CB 4.05Å; M190-A213 WeakPolarHBondContact CE-O 3.41Å; M190-F214 VanDerWaalsContact CE-C 3.49Å; M190-F214 VanDerWaalsContact CE-CA 3.41Å; M190-D215 HydrophobicContact SD-CB 4.04Å; M190-F224 HydrophobicContact CB-CD2 3.89Å; M190-F224 HydrophobicContact CB-CE2 3.94Å; M190-F224 HydrophobicContact CG-CD2 4.21Å; M190-F224 HydrophobicContact CG-CE2 4.14Å; M190-F224 HydrophobicContact SD-CE2 4.21Å
191	E	93.3	Very high	93	Very high	3 Å²	3	30.6 Å²	30.6	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-67.9	-42.1	178.9	-65.6	-63.3	168.7	0	0	111	L154 C157 E158 R186 T187 A188 S193 R194 E195	L154-E191 HydrophobicContact CG-CG 4.5Å; C157-E191 HydrophobicContact CB-CB 4.23Å; E158-E191 HydrophobicContact CG-CG 4.27Å; R186-E191 WeakPolarHBondContact CD-OE1 3.38Å; R186-E191 IonicContact CZ-OE1 3.44Å; R186-E191 IonicContact NE-OE1 3.34Å; R186-E191 IonicContact NH1-OE1 2.78Å; R186-E191 PolarHBondContact NH1-OE1 3.14Å; T187-E191 PolarHBondContact O-N 2.94Å; A188-E191 PolarHBondContact O-N 3.22Å; E191-S193 VanDerWaalsContact C-N 3.25Å; E191-S193 PolarHBondContact O-N 3.25Å; E191-R194 VanDerWaalsContact O-CB 3.31Å; E191-R194 WeakPolarHBondContact O-CB 3.4Å; E191-R194 PolarHBondContact O-N 3.39Å; E191-R194 WeakPolarHBondContact OE2-CD 2.98Å; E191-R194 IonicContact OE2-NH1 3.95Å; E191-E195 PolarHBondContact O-N 3.15Å
192	A	94.5	Very high	93	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-36.5	173.2	0	0	0	0	0	112.6	A188 G196 A197 L200 V201 I204	A188-A192 WeakPolarHBondContact O-CB 3.35Å; A188-A192 PolarHBondContact O-N 2.8Å; A192-G196 PolarHBondContact O-N 3.33Å; A192-G196 VanDerWaalsContact O-N 3.12Å; A192-A197 PolarHBondContact O-N 3.36Å; A192-A197 VanDerWaalsContact O-N 3.15Å; A192-L200 HydrophobicContact CB-CD2 4.03Å; A192-L200 HydrophobicContact CB-CG 4.24Å; A192-V201 HydrophobicContact CB-CG2 3.81Å; A192-I204 HydrophobicContact CB-CD1 3.98Å
193	S	94.1	Very high	93.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-72.3	-27.7	175.2	-62.9	0	0	0	0	113.4	L189 M190 E191 F230	L189-S193 VanDerWaalsContact O-CB 3.25Å; L189-S193 WeakPolarHBondContact O-CB 3.46Å; L189-S193 PolarHBondContact O-N 2.93Å; L189-S193 PolarHBondContact O-OG 3.24Å; M190-S193 PolarHBondContact O-N 2.78Å; E191-S193 VanDerWaalsContact C-N 3.25Å; E191-S193 PolarHBondContact O-N 3.25Å; S193-F230 VanDerWaalsContact O-CD2 3.29Å; S193-F230 WeakPolarHBondContact O-CD2 3.46Å
194	R	93.6	Very high	93.3	Very high	96 Å²	96	25.8 Å²	25.8	36%	0.362	13%	0.128	S	C	.	.	H	α-helix	trans	-74.6	-38.4	177.3	-174.6	-171.8	-136.8	-154.8	-0.6	112.1	M190 E191 F224 F230	M190-R194 WeakPolarHBondContact O-CB 3.48Å; M190-R194 PolarHBondContact O-N 2.78Å; E191-R194 VanDerWaalsContact O-CB 3.31Å; E191-R194 WeakPolarHBondContact O-CB 3.4Å; E191-R194 PolarHBondContact O-N 3.39Å; E191-R194 WeakPolarHBondContact OE2-CD 2.98Å; E191-R194 IonicContact OE2-NH1 3.95Å; R194-F224 HydrophobicContact CB-CB 4.05Å; R194-F224 HydrophobicContact CB-CD1 4.29Å; R194-F224 HydrophobicContact CB-CG 4.34Å; R194-F224 HydrophobicContact CG-CD1 4.18Å; R194-F230 VanDerWaalsContact O-CE2 3.3Å; R194-F230 WeakPolarHBondContact O-CE2 3.5Å
195	E	92.7	Very high	93.4	Very high	72 Å²	72	24.1 Å²	24.1	34%	0.336	12%	0.118	S	C	.	.	H	α-helix	trans	-81.2	-21.6	177.6	-66	-50.3	124.9	0	0	113	E158 A160 E191	E158-E195 WeakPolarHBondContact O-CG 3.41Å; A160-E195 HydrophobicContact CB-CB 4.3Å; E191-E195 PolarHBondContact O-N 3.15Å
196	G	92.4	Very high	93.4	Very high	18 Å²	18	29 Å²	29	19%	0.186	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	20.6	176.7	0	0	0	0	0	114.5	A192 V198 F230 I233	A192-G196 PolarHBondContact O-N 3.33Å; A192-G196 VanDerWaalsContact O-N 3.12Å; G196-V198 PolarHBondContact O-N 3.32Å; G196-F230 VanDerWaalsContact CA-CE2 3.49Å; G196-F230 VanDerWaalsContact CA-CZ 3.48Å; G196-I233 VanDerWaalsContact CA-CD1 3.49Å
197	A	93.8	Very high	93.3	Very high	15 Å²	15	31.3 Å²	31.3	12%	0.124	15%	0.147	C	C	.	.			trans	-80.2	83	-178	0	0	0	0	0	112.1	A160 A192 E199 L200 V201	A160-A197 HydrophobicContact CB-CB 3.76Å; A192-A197 PolarHBondContact O-N 3.36Å; A192-A197 VanDerWaalsContact O-N 3.15Å; A197-E199 PolarHBondContact O-N 2.7Å; A197-L200 HydrophobicContact CB-CB 3.9Å; A197-L200 HydrophobicContact CB-CD2 4.43Å; A197-L200 PolarHBondContact O-N 3.1Å; A197-V201 WeakPolarHBondContact O-CG2 3.49Å; A197-V201 PolarHBondContact O-N 3.42Å
198	V	93.4	Very high	93.1	Very high	49 Å²	49	33.4 Å²	33.4	30%	0.297	17%	0.169	S	C	.	.	H	α-helix	trans	-53.3	-47.8	-174.3	-179.6	0	0	0	0	113.5	G196 V201 R202 D232 I233 L236	G196-V198 PolarHBondContact O-N 3.32Å; V198-V201 PolarHBondContact O-N 3.08Å; V198-R202 PolarHBondContact O-N 2.87Å; V198-D232 HydrophobicContact CG1-CB 4.36Å; V198-D232 HydrophobicContact CG2-CB 4.25Å; V198-I233 HydrophobicContact CG2-CD1 4.42Å; V198-I233 HydrophobicContact CG2-CG1 3.92Å; V198-L236 HydrophobicContact CG1-CD1 3.62Å
199	E	92.2	Very high	93	Very high	110 Å²	110	33.8 Å²	33.8	51%	0.514	17%	0.173	S	C	.	.	H	α-helix	trans	-70.6	-35.4	-178	-70.3	171.6	-130.8	0	0	112.4	K164 A197 R202 G203	K164-E199 VanDerWaalsContact CE-CD 3.42Å; K164-E199 WeakPolarHBondContact CE-OE2 3.36Å; K164-E199 IonicContact NZ-OE1 3.11Å; K164-E199 PolarHBondContact NZ-OE1 3.25Å; K164-E199 IonicContact NZ-OE2 2.89Å; K164-E199 PolarHBondContact NZ-OE2 3.19Å; A197-E199 PolarHBondContact O-N 2.7Å; E199-R202 WeakPolarHBondContact O-CB 3.3Å; E199-R202 PolarHBondContact O-N 3.06Å; E199-G203 PolarHBondContact O-N 3.26Å
200	L	93.6	Very high	92.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-43.8	175.1	-179.2	60.1	0	0	0	110.5	F153 A160 C167 M168 L171 A192 A197 R202 G203 I204	F153-L200 HydrophobicContact CZ-CD1 4.41Å; A160-L200 HydrophobicContact CB-CD2 3.66Å; C167-L200 HydrophobicContact CB-CD1 3.56Å; C167-L200 HydrophobicContact CB-CD2 3.76Å; C167-L200 HydrophobicContact CB-CG 4.31Å; M168-L200 HydrophobicContact SD-CD1 4.01Å; L171-L200 HydrophobicContact CD1-CD1 3.69Å; A192-L200 HydrophobicContact CB-CD2 4.03Å; A192-L200 HydrophobicContact CB-CG 4.24Å; A197-L200 HydrophobicContact CB-CB 3.9Å; A197-L200 HydrophobicContact CB-CD2 4.43Å; A197-L200 PolarHBondContact O-N 3.1Å; L200-R202 VanDerWaalsContact C-N 3.3Å; L200-R202 PolarHBondContact O-N 3.32Å; L200-G203 PolarHBondContact O-N 3.37Å; L200-G203 VanDerWaalsContact O-N 3.16Å; L200-I204 HydrophobicContact CD1-CD1 4.28Å; L200-I204 HydrophobicContact CD1-CG1 4.31Å; L200-I204 HydrophobicContact CG-CD1 3.98Å; L200-I204 HydrophobicContact CG-CG1 4.43Å; L200-I204 VanDerWaalsContact O-CG1 3.27Å; L200-I204 WeakPolarHBondContact O-CG1 3.29Å; L200-I204 PolarHBondContact O-N 3.3Å
201	V	94.8	Very high	92.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.1	-46.4	173.7	167.9	0	0	0	0	110.8	L189 A192 A197 V198 I204 L205 I233 L236	L189-V201 HydrophobicContact CD1-CB 4.49Å; L189-V201 HydrophobicContact CD1-CG1 3.9Å; L189-V201 HydrophobicContact CD1-CG2 4.47Å; A192-V201 HydrophobicContact CB-CG2 3.81Å; A197-V201 WeakPolarHBondContact O-CG2 3.49Å; A197-V201 PolarHBondContact O-N 3.42Å; V198-V201 PolarHBondContact O-N 3.08Å; V201-I204 PolarHBondContact O-N 3.49Å; V201-L205 HydrophobicContact CG1-CD1 3.77Å; V201-L205 HydrophobicContact CG1-CG 4.36Å; V201-L205 WeakPolarHBondContact O-CB 3.39Å; V201-L205 WeakPolarHBondContact O-CG 3.44Å; V201-L205 PolarHBondContact O-N 2.97Å; V201-I233 HydrophobicContact CG1-CG2 4.27Å; V201-I233 HydrophobicContact CG2-CD1 4.23Å; V201-I233 HydrophobicContact CG2-CG2 4.4Å; V201-L236 HydrophobicContact CG1-CB 4.48Å; V201-L236 HydrophobicContact CG1-CD1 4.32Å
202	R	93.2	Very high	92.6	Very high	73 Å²	73	43.4 Å²	43.4	28%	0.275	22%	0.221	S	C	.	.	H	α-helix	trans	-57.6	-50	174.5	-177.7	-170.3	-57.9	-87.9	-12.8	111.5	V198 E199 L200 I204 L205 E206 L236 E335	V198-R202 PolarHBondContact O-N 2.87Å; E199-R202 WeakPolarHBondContact O-CB 3.3Å; E199-R202 PolarHBondContact O-N 3.06Å; L200-R202 VanDerWaalsContact C-N 3.3Å; L200-R202 PolarHBondContact O-N 3.32Å; R202-I204 VanDerWaalsContact C-N 3.3Å; R202-I204 PolarHBondContact O-N 3.47Å; R202-L205 PolarHBondContact O-N 2.78Å; R202-L205 VanDerWaalsContact O-N 3.17Å; R202-E206 HydrophobicContact CG-CG 4.43Å; R202-E206 WeakPolarHBondContact CG-OE1 3.4Å; R202-E206 WeakPolarHBondContact O-CG 3.49Å; R202-E206 PolarHBondContact O-N 2.97Å; R202-L236 HydrophobicContact CB-CD1 4.38Å; R202-L236 HydrophobicContact CB-CD2 3.98Å; R202-L236 HydrophobicContact CG-CD2 4.19Å; R202-E335 VanDerWaalsContact CZ-CD 3.49Å; R202-E335 IonicContact CZ-OE1 3.98Å; R202-E335 IonicContact CZ-OE2 2.76Å; R202-E335 IonicContact NH1-OE1 3.47Å; R202-E335 PolarHBondContact NH1-OE1 3.29Å; R202-E335 IonicContact NH1-OE2 2.85Å; R202-E335 PolarHBondContact NH1-OE2 3.29Å; R202-E335 VanDerWaalsContact NH2-CD 3.28Å; R202-E335 IonicContact NH2-OE1 3.98Å; R202-E335 PolarHBondContact NH2-OE1 3.29Å; R202-E335 IonicContact NH2-OE2 3.82Å; R202-E335 PolarHBondContact NH2-OE2 3.37Å; R202-E335 VanDerWaalsContact NH2-OE2 3.08Å
203	G	92.4	Very high	92.5	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-33.3	-179.4	0	0	0	0	0	114.1	E199 L200 R207	E199-G203 PolarHBondContact O-N 3.26Å; L200-G203 PolarHBondContact O-N 3.37Å; L200-G203 VanDerWaalsContact O-N 3.16Å; G203-R207 WeakPolarHBondContact O-CG 3.47Å; G203-R207 PolarHBondContact O-N 2.96Å; G203-R207 PolarHBondContact O-NH1 3.35Å
204	I	93.9	Very high	92.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.1	-46	173.7	-68.1	170.9	0	0	0	110.4	F153 L171 P177 A188 L189 A192 L200 V201 R202 R207 G208 G209	F153-I204 HydrophobicContact CE1-CD1 4.2Å; F153-I204 HydrophobicContact CE1-CG1 4.23Å; F153-I204 HydrophobicContact CZ-CD1 4.05Å; F153-I204 HydrophobicContact CZ-CG1 4Å; L171-I204 HydrophobicContact CD1-CG1 3.78Å; L171-I204 HydrophobicContact CD2-CG1 4.24Å; P177-I204 HydrophobicContact CB-CG2 3.77Å; A188-I204 HydrophobicContact CB-CD1 4.36Å; L189-I204 HydrophobicContact CB-CG2 4.09Å; L189-I204 HydrophobicContact CD1-CB 4.34Å; L189-I204 HydrophobicContact CD1-CG2 3.98Å; A192-I204 HydrophobicContact CB-CD1 3.98Å; L200-I204 HydrophobicContact CD1-CD1 4.28Å; L200-I204 HydrophobicContact CD1-CG1 4.31Å; L200-I204 HydrophobicContact CG-CD1 3.98Å; L200-I204 HydrophobicContact CG-CG1 4.43Å; L200-I204 VanDerWaalsContact O-CG1 3.27Å; L200-I204 WeakPolarHBondContact O-CG1 3.29Å; L200-I204 PolarHBondContact O-N 3.3Å; V201-I204 PolarHBondContact O-N 3.49Å; R202-I204 VanDerWaalsContact C-N 3.3Å; R202-I204 PolarHBondContact O-N 3.47Å; I204-R207 PolarHBondContact O-N 3.32Å; I204-G208 PolarHBondContact O-N 3.33Å; I204-G209 PolarHBondContact O-N 2.98Å
205	L	93	Very high	92.4	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-65	-41.8	-179.2	-69.8	171.9	0	0	0	112.1	L189 V201 R202 R207 G208 V211 L236 L237 Y240	L189-L205 HydrophobicContact CD1-CD2 4.02Å; L189-L205 HydrophobicContact CD1-CG 4.05Å; L189-L205 HydrophobicContact CD2-CD2 3.85Å; V201-L205 HydrophobicContact CG1-CD1 3.77Å; V201-L205 HydrophobicContact CG1-CG 4.36Å; V201-L205 WeakPolarHBondContact O-CB 3.39Å; V201-L205 WeakPolarHBondContact O-CG 3.44Å; V201-L205 PolarHBondContact O-N 2.97Å; R202-L205 PolarHBondContact O-N 2.78Å; R202-L205 VanDerWaalsContact O-N 3.17Å; L205-R207 PolarHBondContact O-N 2.77Å; L205-G208 PolarHBondContact O-N 2.88Å; L205-G208 VanDerWaalsContact O-N 3.09Å; L205-V211 HydrophobicContact CD2-CB 4.48Å; L205-V211 HydrophobicContact CD2-CG2 3.41Å; L205-V211 VanDerWaalsContact CD2-CG2 3.41Å; L205-L236 HydrophobicContact CD1-CB 4.29Å; L205-L236 HydrophobicContact CD1-CD2 4.38Å; L205-L237 HydrophobicContact CD1-CD2 4.43Å; L205-Y240 HydrophobicContact CB-CD1 3.82Å; L205-Y240 HydrophobicContact CB-CD2 4.02Å; L205-Y240 HydrophobicContact CB-CE1 3.9Å; L205-Y240 HydrophobicContact CB-CE2 4.08Å; L205-Y240 HydrophobicContact CB-CG 3.88Å; L205-Y240 HydrophobicContact CD1-CD2 3.67Å; L205-Y240 HydrophobicContact CD1-CE2 4.17Å; L205-Y240 HydrophobicContact CD1-CG 4Å; L205-Y240 HydrophobicContact CD2-CG 4.33Å; L205-Y240 HydrophobicContact CG-CD2 4.37Å; L205-Y240 HydrophobicContact CG-CG 4.3Å
206	E	90.6	Very high	92.4	Very high	114 Å²	114	47 Å²	47	53%	0.533	25%	0.246	S	C	.	.	H	α-helix	trans	-60	-27.8	174.6	-73.2	171.8	178.7	0	0	112.9	R202 G208 Y240	R202-E206 HydrophobicContact CG-CG 4.43Å; R202-E206 WeakPolarHBondContact CG-OE1 3.4Å; R202-E206 WeakPolarHBondContact O-CG 3.49Å; R202-E206 PolarHBondContact O-N 2.97Å; E206-G208 VanDerWaalsContact C-N 3.34Å; E206-Y240 WeakPolarHBondContact CG-OH 3.46Å
207	R	91.7	Very high	92.3	Very high	92 Å²	92	50.1 Å²	50.1	35%	0.347	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	12.5	178.5	-71.8	171.2	177.2	74.5	-3.9	113.7	L171 P177 G203 I204 L205	L171-R207 PolarHBondContact O-NE 3.34Å; P177-R207 HydrophobicContact CG-CB 4.46Å; G203-R207 WeakPolarHBondContact O-CG 3.47Å; G203-R207 PolarHBondContact O-N 2.96Å; G203-R207 PolarHBondContact O-NH1 3.35Å; I204-R207 PolarHBondContact O-N 3.32Å; L205-R207 PolarHBondContact O-N 2.77Å
208	G	89.1	Confident	92.3	Very high	48 Å²	48	55.4 Å²	55.4	50%	0.495	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	27.7	176.1	0	0	0	0	0	114.5	N178 I204 L205 E206 E210	N178-G208 PolarHBondContact ND2-O 3.15Å; I204-G208 PolarHBondContact O-N 3.33Å; L205-G208 PolarHBondContact O-N 2.88Å; L205-G208 VanDerWaalsContact O-N 3.09Å; E206-G208 VanDerWaalsContact C-N 3.34Å; G208-E210 PolarHBondContact O-N 3.31Å
209	G	91.6	Very high	92.3	Very high	8 Å²	8	54.1 Å²	54.1	8%	0.082	27%	0.266	C	S	.	.			trans	-60.6	128.2	171.9	0	0	0	0	0	113	N178 I204 V211	N178-G209 VanDerWaalsContact OD1-CA 3.3Å; N178-G209 WeakPolarHBondContact OD1-CA 3.36Å; I204-G209 PolarHBondContact O-N 2.98Å; G209-V211 PolarHBondContact O-N 3.28Å
210	E	91.6	Very high	92.3	Very high	120 Å²	120	49.5 Å²	49.5	56%	0.561	25%	0.245	S	C	*	.			trans	-72.3	108	179.4	-73.7	-177.8	-165.8	0	0	111.6	N178 G208 N212 A213	N178-E210 PolarHBondContact OD1-N 2.79Å; G208-E210 PolarHBondContact O-N 3.31Å; E210-N212 PolarHBondContact O-N 2.98Å; E210-A213 HydrophobicContact CB-CB 4.07Å
211	V	91.5	Very high	92.4	Very high	18 Å²	18	49.6 Å²	49.6	11%	0.109	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-34.9	-174.3	-165.1	0	0	0	0	113.1	L205 G209 L237 Y240 G242	L205-V211 HydrophobicContact CD2-CB 4.48Å; L205-V211 HydrophobicContact CD2-CG2 3.41Å; L205-V211 VanDerWaalsContact CD2-CG2 3.41Å; G209-V211 PolarHBondContact O-N 3.28Å; V211-L237 HydrophobicContact CG1-CB 4.07Å; V211-L237 HydrophobicContact CG1-CD2 3.71Å; V211-L237 HydrophobicContact CG1-CG 4.48Å; V211-Y240 VanDerWaalsContact CG2-O 3.24Å; V211-Y240 WeakPolarHBondContact CG2-O 3.38Å; V211-G242 VanDerWaalsContact CG1-CA 3.46Å
212	N	91.4	Very high	92.4	Very high	70 Å²	70	49.9 Å²	49.9	37%	0.374	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	14.2	-174.8	-61.2	-42.4	0	0	0	112.6	E210 H220 S241 G242 D243 L246	E210-N212 PolarHBondContact O-N 2.98Å; N212-H220 PolarHBondContact O-CD2 3.09Å; N212-H220 VanDerWaalsContact O-CD2 3.28Å; N212-S241 PolarHBondContact ND2-O 3.31Å; N212-G242 WeakPolarHBondContact OD1-CA 3.37Å; N212-D243 PolarHBondContact OD1-N 3.07Å; N212-L246 HydrophobicContact CB-CD1 4.31Å
213	A	92.6	Very high	92.5	Very high	15 Å²	15	46.5 Å²	46.5	12%	0.124	24%	0.235	C	C	.	.			trans	-60.9	151.7	168.2	0	0	0	0	0	110.1	T187 M190 E210 H220	T187-A213 HydrophobicContact CG2-CB 3.9Å; M190-A213 HydrophobicContact CE-CB 4.05Å; M190-A213 WeakPolarHBondContact CE-O 3.41Å; E210-A213 HydrophobicContact CB-CB 4.07Å; A213-H220 PolarHBondContact O-CD2 2.9Å
214	F	92.8	Very high	92.6	Very high	123 Å²	123	47 Å²	47	54%	0.539	24%	0.237	S	C	.	.			trans	-132.9	147.6	-178.5	60.7	-99.2	0	0	0	112.2	M190 R218 H219	M190-F214 VanDerWaalsContact CE-C 3.49Å; M190-F214 VanDerWaalsContact CE-CA 3.41Å; F214-R218 HydrophobicContact CD2-CG 4.21Å; F214-H219 VanDerWaalsContact CA-O 3.3Å; F214-H219 WeakPolarHBondContact CA-O 3.35Å
215	D	93.1	Very high	92.6	Very high	3 Å²	3	47 Å²	47	2%	0.016	24%	0.237	C	C	.	.			trans	-85.2	-178	175.4	76.2	-2.1	0	0	0	112.3	G185 R186 M190 D217 R218 H219	G185-D215 WeakPolarHBondContact O-CA 3.38Å; R186-D215 HydrophobicContact CG-CB 3.64Å; R186-D215 IonicContact NE-OD2 2.81Å; R186-D215 PolarHBondContact NE-OD2 3.09Å; M190-D215 HydrophobicContact SD-CB 4.04Å; D215-D217 PolarHBondContact O-N 3.46Å; D215-D217 VanDerWaalsContact O-N 3.09Å; D215-D217 WeakPolarHBondContact OD1-CA 3.19Å; D215-D217 PolarHBondContact OD1-N 2.93Å; D215-R218 WeakPolarHBondContact O-CA 3.22Å; D215-R218 PolarHBondContact O-N 3.49Å; D215-R218 PolarHBondContact OD1-N 2.88Å; D215-R218 VanDerWaalsContact OD1-N 3.14Å; D215-H219 PolarHBondContact N-O 2.87Å; D215-H219 WeakPolarHBondContact OD1-CA 3.38Å; D215-H219 WeakPolarHBondContact OD1-CB 3.19Å; D215-H219 IonicContact OD1-CG 2.81Å; D215-H219 PolarHBondContact OD1-N 3.14Å; D215-H219 IonicContact OD2-ND1 2.66Å
216	N	91.8	Very high	92.7	Very high	101 Å²	101	46.6 Å²	46.6	54%	0.54	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.5	-179.4	-68.8	-13.7	0	0	0	113	S183 T184	S183-N216 PolarHBondContact O-ND2 3.45Å; S183-N216 VanDerWaalsContact O-ND2 3.13Å; T184-N216 VanDerWaalsContact C-ND2 3.3Å; T184-N216 WeakPolarHBondContact O-CB 3.42Å; T184-N216 VanDerWaalsContact O-CG 3.24Å; T184-N216 PolarHBondContact O-N 2.57Å; T184-N216 PolarHBondContact O-ND2 2.82Å
217	D	91.1	Very high	92.9	Very high	85 Å²	85	47 Å²	47	46%	0.455	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	10	176.9	-68.1	-34.8	0	0	0	113.2	D215 H219 M249	D215-D217 PolarHBondContact O-N 3.46Å; D215-D217 VanDerWaalsContact O-N 3.09Å; D215-D217 WeakPolarHBondContact OD1-CA 3.19Å; D215-D217 PolarHBondContact OD1-N 2.93Å; D217-H219 VanDerWaalsContact CB-CE1 3.44Å; D217-H219 WeakPolarHBondContact CB-CE1 3.31Å; D217-H219 PolarHBondContact O-N 3Å; D217-M249 VanDerWaalsContact C-CG 3.43Å; D217-M249 WeakPolarHBondContact O-CB 3.5Å; D217-M249 VanDerWaalsContact O-CG 3.26Å; D217-M249 WeakPolarHBondContact O-CG 3.43Å; D217-M249 PolarHBondContact O-N 3.4Å
218	R	92.8	Very high	92.9	Very high	125 Å²	125	44.1 Å²	44.1	47%	0.472	23%	0.234	S	C	.	.			trans	56.7	24.8	-172.7	-69	-178.1	176.2	-144	-0.2	114.1	F214 D215 H220 G248 M249	F214-R218 HydrophobicContact CD2-CG 4.21Å; D215-R218 WeakPolarHBondContact O-CA 3.22Å; D215-R218 PolarHBondContact O-N 3.49Å; D215-R218 PolarHBondContact OD1-N 2.88Å; D215-R218 VanDerWaalsContact OD1-N 3.14Å; R218-H220 PolarHBondContact O-CE1 2.91Å; R218-H220 VanDerWaalsContact O-CE1 3.23Å; R218-H220 PolarHBondContact O-ND1 3.37Å; R218-G248 WeakPolarHBondContact O-CA 3.46Å; R218-M249 HydrophobicContact CB-CG 4.13Å; R218-M249 HydrophobicContact CG-CE 3.87Å; R218-M249 HydrophobicContact CG-CG 4.13Å; R218-M249 HydrophobicContact CG-SD 4.14Å
219	H	93.5	Very high	93.2	Very high	22 Å²	22	42.7 Å²	42.7	10%	0.102	22%	0.219	C	C	.	.			trans	-77.9	143	168.6	-60.1	133.8	0	0	0	109.9	F214 D215 D217 H223 F224 Y257	F214-H219 VanDerWaalsContact CA-O 3.3Å; F214-H219 WeakPolarHBondContact CA-O 3.35Å; D215-H219 PolarHBondContact N-O 2.87Å; D215-H219 WeakPolarHBondContact OD1-CA 3.38Å; D215-H219 WeakPolarHBondContact OD1-CB 3.19Å; D215-H219 IonicContact OD1-CG 2.81Å; D215-H219 PolarHBondContact OD1-N 3.14Å; D215-H219 IonicContact OD2-ND1 2.66Å; D217-H219 VanDerWaalsContact CB-CE1 3.44Å; D217-H219 WeakPolarHBondContact CB-CE1 3.31Å; D217-H219 PolarHBondContact O-N 3Å; H219-H223 HydrophobicContact CB-CB 4.27Å; H219-F224 HydrophobicContact CB-CE2 3.67Å; H219-F224 HydrophobicContact CB-CZ 3.7Å; H219-Y257 PolarHBondContact NE2-OH 3.4Å
220	H	93.3	Very high	93.3	Very high	13 Å²	13	45.2 Å²	45.2	6%	0.06	23%	0.228	C	C	.	.			trans	-118.3	166.8	-178.9	-58.5	69.4	0	0	0	108.3	N212 A213 R218 A222 H223 F224 L246	N212-H220 PolarHBondContact O-CD2 3.09Å; N212-H220 VanDerWaalsContact O-CD2 3.28Å; A213-H220 PolarHBondContact O-CD2 2.9Å; R218-H220 PolarHBondContact O-CE1 2.91Å; R218-H220 VanDerWaalsContact O-CE1 3.23Å; R218-H220 PolarHBondContact O-ND1 3.37Å; H220-A222 PolarHBondContact O-N 3.46Å; H220-A222 VanDerWaalsContact O-N 3.09Å; H220-H223 AromaticContact CG-ND1 3.92Å; H220-H223 PolarHBondContact N-ND1 2.92Å; H220-H223 AromaticContact ND1-CE1 3.48Å; H220-H223 PolarHBondContact ND1-CE1 3.36Å; H220-H223 AromaticContact ND1-ND1 3.55Å; H220-H223 WeakPolarHBondContact O-CB 3.33Å; H220-H223 PolarHBondContact O-N 2.99Å; H220-F224 WeakPolarHBondContact O-CD2 3.46Å; H220-F224 PolarHBondContact O-N 2.95Å; H220-L246 WeakPolarHBondContact CD2-CD1 3.39Å; H220-L246 WeakPolarHBondContact NE2-CD1 3.39Å
221	A	94.4	Very high	93.4	Very high	2 Å²	2	41.1 Å²	41.1	2%	0.017	21%	0.208	C	C	.	.	H	α-helix	trans	-50.9	-38.2	176.9	0	0	0	0	0	112.8	L189 H223 F224 A225 L237	L189-A221 HydrophobicContact CD2-CB 4.22Å; L189-A221 HydrophobicContact CG-CB 4.04Å; A221-H223 VanDerWaalsContact C-N 3.33Å; A221-H223 PolarHBondContact O-N 2.75Å; A221-F224 PolarHBondContact O-N 3.02Å; A221-A225 WeakPolarHBondContact O-CB 3.44Å; A221-A225 PolarHBondContact O-N 2.86Å; A221-L237 HydrophobicContact CB-CD1 3.89Å; A221-L237 HydrophobicContact CB-CD2 3.78Å
222	A	94.8	Very high	93.4	Very high	6 Å²	6	44.2 Å²	44.2	5%	0.05	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-32.9	176.9	0	0	0	0	0	113.7	H220 A226 L234 L237 M244 P254	H220-A222 PolarHBondContact O-N 3.46Å; H220-A222 VanDerWaalsContact O-N 3.09Å; A222-A226 WeakPolarHBondContact O-CB 3.35Å; A222-A226 PolarHBondContact O-N 3.34Å; A222-L234 HydrophobicContact CB-CD2 4.42Å; A222-L237 HydrophobicContact CB-CD1 4.24Å; A222-M244 HydrophobicContact CB-CE 4.05Å; A222-M244 HydrophobicContact CB-SD 4.24Å; A222-P254 HydrophobicContact CB-CB 4.47Å; A222-P254 HydrophobicContact CB-CG 4.06Å
223	H	94.7	Very high	93.6	Very high	3 Å²	3	40.9 Å²	40.9	1%	0.014	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-45.5	176.6	-67.7	93.2	0	0	0	110.9	H219 H220 A221 A226 K227 L246 N252 P254 Y257	H219-H223 HydrophobicContact CB-CB 4.27Å; H220-H223 AromaticContact CG-ND1 3.92Å; H220-H223 PolarHBondContact N-ND1 2.92Å; H220-H223 AromaticContact ND1-CE1 3.48Å; H220-H223 PolarHBondContact ND1-CE1 3.36Å; H220-H223 AromaticContact ND1-ND1 3.55Å; H220-H223 WeakPolarHBondContact O-CB 3.33Å; H220-H223 PolarHBondContact O-N 2.99Å; A221-H223 VanDerWaalsContact C-N 3.33Å; A221-H223 PolarHBondContact O-N 2.75Å; H223-A226 PolarHBondContact O-N 2.95Å; H223-K227 WeakPolarHBondContact O-CB 3.34Å; H223-K227 PolarHBondContact O-N 2.8Å; H223-L246 PolarHBondContact CE1-O 3.04Å; H223-L246 VanDerWaalsContact CE1-O 3.24Å; H223-L246 PolarHBondContact NE2-O 2.91Å; H223-L246 VanDerWaalsContact NE2-O 3.1Å; H223-N252 PolarHBondContact NE2-O 3.29Å; H223-P254 WeakPolarHBondContact NE2-CD 3.18Å; H223-Y257 HydrophobicContact CB-CD2 4.17Å; H223-Y257 HydrophobicContact CB-CE2 4.17Å; H223-Y257 AromaticContact CD2-CD2 3.72Å; H223-Y257 AromaticContact CD2-CE2 3.58Å
224	F	94.7	Very high	93.6	Very high	11 Å²	11	40.2 Å²	40.2	5%	0.048	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-45.9	177.4	-65.6	-70	0	0	0	111.6	M190 R194 H219 H220 A221 A226 K227 G228	M190-F224 HydrophobicContact CB-CD2 3.89Å; M190-F224 HydrophobicContact CB-CE2 3.94Å; M190-F224 HydrophobicContact CG-CD2 4.21Å; M190-F224 HydrophobicContact CG-CE2 4.14Å; M190-F224 HydrophobicContact SD-CE2 4.21Å; R194-F224 HydrophobicContact CB-CB 4.05Å; R194-F224 HydrophobicContact CB-CD1 4.29Å; R194-F224 HydrophobicContact CB-CG 4.34Å; R194-F224 HydrophobicContact CG-CD1 4.18Å; H219-F224 HydrophobicContact CB-CE2 3.67Å; H219-F224 HydrophobicContact CB-CZ 3.7Å; H220-F224 WeakPolarHBondContact O-CD2 3.46Å; H220-F224 PolarHBondContact O-N 2.95Å; A221-F224 PolarHBondContact O-N 3.02Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 3.21Å; F224-K227 WeakPolarHBondContact O-CB 3.47Å; F224-K227 PolarHBondContact O-N 3.37Å; F224-K227 VanDerWaalsContact O-N 3.15Å; F224-G228 PolarHBondContact O-N 2.55Å
225	A	95.4	Very high	93.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-41.3	176.2	0	0	0	0	0	112.4	A221 G228 G229 F230 I233 L234 L237	A221-A225 WeakPolarHBondContact O-CB 3.44Å; A221-A225 PolarHBondContact O-N 2.86Å; A225-G228 PolarHBondContact O-N 3.03Å; A225-G229 PolarHBondContact O-N 3.23Å; A225-F230 PolarHBondContact O-N 3.03Å; A225-I233 HydrophobicContact CB-CB 4.14Å; A225-I233 HydrophobicContact CB-CG2 3.63Å; A225-L234 HydrophobicContact CB-CD2 3.67Å; A225-L234 HydrophobicContact CB-CG 4.05Å; A225-L237 HydrophobicContact CB-CD1 4.19Å
226	A	95	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.4	-35.2	176.5	0	0	0	0	0	112.8	A222 H223 F224 G229 L234 P254 A258 L270	A222-A226 WeakPolarHBondContact O-CB 3.35Å; A222-A226 PolarHBondContact O-N 3.34Å; H223-A226 PolarHBondContact O-N 2.95Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 3.21Å; A226-G229 PolarHBondContact O-N 3.2Å; A226-L234 HydrophobicContact CB-CD2 4.38Å; A226-P254 HydrophobicContact CB-CB 3.97Å; A226-P254 VanDerWaalsContact CB-O 3.24Å; A226-P254 WeakPolarHBondContact CB-O 3.27Å; A226-A258 HydrophobicContact CB-CB 4.18Å; A226-A258 WeakPolarHBondContact O-CA 3.43Å; A226-L270 HydrophobicContact CB-CD1 4Å
227	K	94.1	Very high	93.7	Very high	122 Å²	122	31.8 Å²	31.8	53%	0.53	16%	0.159	S	C	.	.	H	α-helix	trans	-68	-37.6	175.6	-172.3	-178.8	179.3	-176.6	0	112.2	H223 F224 Y257 F263	H223-K227 WeakPolarHBondContact O-CB 3.34Å; H223-K227 PolarHBondContact O-N 2.8Å; F224-K227 WeakPolarHBondContact O-CB 3.47Å; F224-K227 PolarHBondContact O-N 3.37Å; F224-K227 VanDerWaalsContact O-N 3.15Å; K227-Y257 HydrophobicContact CB-CD1 4.42Å; K227-Y257 HydrophobicContact CB-CG 4.44Å; K227-Y257 HydrophobicContact CD-CD1 4.45Å; K227-Y257 HydrophobicContact CG-CD1 4.39Å; K227-F263 WeakPolarHBondContact O-CE2 3.34Å
228	G	92.1	Very high	93.8	Very high	31 Å²	31	27.8 Å²	27.8	32%	0.32	14%	0.138	S	C	.	.	H	α-helix	trans	-81.2	-13.3	174.5	0	0	0	0	0	114.4	F224 A225	F224-G228 PolarHBondContact O-N 2.55Å; A225-G228 PolarHBondContact O-N 3.03Å
229	G	94	Very high	93.7	Very high	18 Å²	18	22 Å²	22	19%	0.186	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	20.9	-178.5	0	0	0	0	0	113.9	A225 A226 F231 F263 C266	A225-G229 PolarHBondContact O-N 3.23Å; A226-G229 PolarHBondContact O-N 3.2Å; G229-F231 PolarHBondContact O-N 3.22Å; G229-F263 VanDerWaalsContact CA-CE2 3.44Å; G229-C266 PolarHBondContact O-SG 3.27Å
230	F	94.8	Very high	93.6	Very high	61 Å²	61	23.1 Å²	23.1	27%	0.268	12%	0.12	S	C	.	.			trans	-79.5	87.1	-176.6	-55.4	-59.1	0	0	0	111.5	S193 R194 G196 A225 D232 I233 L234	S193-F230 VanDerWaalsContact O-CD2 3.29Å; S193-F230 WeakPolarHBondContact O-CD2 3.46Å; R194-F230 VanDerWaalsContact O-CE2 3.3Å; R194-F230 WeakPolarHBondContact O-CE2 3.5Å; G196-F230 VanDerWaalsContact CA-CE2 3.49Å; G196-F230 VanDerWaalsContact CA-CZ 3.48Å; A225-F230 PolarHBondContact O-N 3.03Å; F230-D232 VanDerWaalsContact C-N 3.34Å; F230-D232 PolarHBondContact O-N 3.44Å; F230-I233 HydrophobicContact CB-CB 3.96Å; F230-I233 HydrophobicContact CB-CD1 3.76Å; F230-I233 HydrophobicContact CB-CG1 3.93Å; F230-I233 HydrophobicContact CD2-CD1 4.24Å; F230-I233 HydrophobicContact CG-CD1 4.07Å; F230-I233 PolarHBondContact O-N 3.38Å; F230-L234 PolarHBondContact O-N 3.19Å; F230-L234 VanDerWaalsContact O-N 3.16Å
231	F	93	Very high	93.3	Very high	34 Å²	34	25.1 Å²	25.1	15%	0.149	14%	0.135	C	C	.	.	H	α-helix	trans	-59	-41.3	-177.3	178	-128.5	0	0	0	113.3	G229 I233 L234 K235 Y269 F411	G229-F231 PolarHBondContact O-N 3.22Å; F231-I233 VanDerWaalsContact C-N 3.35Å; F231-L234 PolarHBondContact O-N 3.5Å; F231-K235 VanDerWaalsContact CD1-CE 3.45Å; F231-K235 HydrophobicContact CE1-CD 4.36Å; F231-K235 HydrophobicContact CE2-CG 4.35Å; F231-K235 HydrophobicContact CZ-CD 4.34Å; F231-K235 HydrophobicContact CZ-CG 4.41Å; F231-K235 PolarHBondContact O-N 2.91Å; F231-K235 VanDerWaalsContact O-N 3.17Å; F231-Y269 HydrophobicContact CD2-CG 4.35Å; F231-Y269 HydrophobicContact CE2-CD1 4.35Å; F231-Y269 AromaticContact CE2-CD2 3.73Å; F231-Y269 HydrophobicContact CE2-CD2 3.73Å; F231-Y269 HydrophobicContact CE2-CE2 4.46Å; F231-Y269 AromaticContact CE2-CG 3.67Å; F231-Y269 HydrophobicContact CE2-CG 3.67Å; F231-Y269 HydrophobicContact CZ-CD2 4.35Å; F231-F411 HydrophobicContact CE1-CB 3.68Å; F231-F411 HydrophobicContact CE1-CG 4.28Å; F231-F411 HydrophobicContact CE2-CB 4.5Å; F231-F411 HydrophobicContact CE2-CD1 4.01Å; F231-F411 HydrophobicContact CE2-CE1 4.44Å; F231-F411 HydrophobicContact CE2-CG 4.25Å; F231-F411 HydrophobicContact CZ-CB 3.42Å; F231-F411 VanDerWaalsContact CZ-CB 3.42Å; F231-F411 AromaticContact CZ-CD1 3.69Å; F231-F411 HydrophobicContact CZ-CD1 3.69Å; F231-F411 HydrophobicContact CZ-CD2 4.16Å; F231-F411 HydrophobicContact CZ-CE1 4.46Å; F231-F411 AromaticContact CZ-CG 3.5Å; F231-F411 HydrophobicContact CZ-CG 3.5Å
232	D	92.9	Very high	93.1	Very high	84 Å²	84	25.1 Å²	25.1	45%	0.449	14%	0.135	S	C	.	.	H	α-helix	trans	-70.2	-32.8	-177.7	-62.2	-42.7	0	0	0	112.3	V198 F230 K235 L236	V198-D232 HydrophobicContact CG1-CB 4.36Å; V198-D232 HydrophobicContact CG2-CB 4.25Å; F230-D232 VanDerWaalsContact C-N 3.34Å; F230-D232 PolarHBondContact O-N 3.44Å; D232-K235 WeakPolarHBondContact O-CB 3.48Å; D232-K235 PolarHBondContact O-N 2.94Å; D232-K235 IonicContact OD1-NZ 3.23Å; D232-K235 PolarHBondContact OD1-NZ 3.36Å; D232-L236 PolarHBondContact O-N 3.01Å
233	I	94.3	Very high	92.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-41.5	172.6	-62.2	-177.2	0	0	0	110.6	G196 V198 V201 A225 F230 F231 K235 L236 L237	G196-I233 VanDerWaalsContact CA-CD1 3.49Å; V198-I233 HydrophobicContact CG2-CD1 4.42Å; V198-I233 HydrophobicContact CG2-CG1 3.92Å; V201-I233 HydrophobicContact CG1-CG2 4.27Å; V201-I233 HydrophobicContact CG2-CD1 4.23Å; V201-I233 HydrophobicContact CG2-CG2 4.4Å; A225-I233 HydrophobicContact CB-CB 4.14Å; A225-I233 HydrophobicContact CB-CG2 3.63Å; F230-I233 HydrophobicContact CB-CB 3.96Å; F230-I233 HydrophobicContact CB-CD1 3.76Å; F230-I233 HydrophobicContact CB-CG1 3.93Å; F230-I233 HydrophobicContact CD2-CD1 4.24Å; F230-I233 HydrophobicContact CG-CD1 4.07Å; F230-I233 PolarHBondContact O-N 3.38Å; F231-I233 VanDerWaalsContact C-N 3.35Å; I233-K235 PolarHBondContact O-N 3.25Å; I233-L236 WeakPolarHBondContact O-CB 3.48Å; I233-L236 PolarHBondContact O-N 3.07Å; I233-L237 HydrophobicContact CG2-CD1 3.86Å; I233-L237 HydrophobicContact CG2-CG 4.09Å; I233-L237 VanDerWaalsContact O-CG 3.27Å; I233-L237 WeakPolarHBondContact O-CG 3.37Å; I233-L237 PolarHBondContact O-N 2.94Å
234	L	93.8	Very high	92.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-30.5	175.8	-66	173.2	0	0	0	112.7	A222 A225 A226 F230 F231 F238 M244 C266 Y269 L270	A222-L234 HydrophobicContact CB-CD2 4.42Å; A225-L234 HydrophobicContact CB-CD2 3.67Å; A225-L234 HydrophobicContact CB-CG 4.05Å; A226-L234 HydrophobicContact CB-CD2 4.38Å; F230-L234 PolarHBondContact O-N 3.19Å; F230-L234 VanDerWaalsContact O-N 3.16Å; F231-L234 PolarHBondContact O-N 3.5Å; L234-F238 WeakPolarHBondContact O-CB 3.44Å; L234-F238 PolarHBondContact O-N 2.84Å; L234-M244 HydrophobicContact CB-CE 4.06Å; L234-M244 HydrophobicContact CD2-CE 3.52Å; L234-M244 HydrophobicContact CG-CE 4.35Å; L234-C266 HydrophobicContact CD1-CB 3.87Å; L234-Y269 HydrophobicContact CB-CD1 4.17Å; L234-Y269 HydrophobicContact CB-CE1 4.13Å; L234-L270 HydrophobicContact CD1-CD1 4.22Å; L234-L270 HydrophobicContact CD1-CD2 4.43Å; L234-L270 HydrophobicContact CD1-CG 4.26Å; L234-L270 HydrophobicContact CD2-CD2 4.28Å
235	K	92.9	Very high	92.1	Very high	47 Å²	47	28.8 Å²	28.8	20%	0.204	16%	0.161	C	C	.	.	H	α-helix	trans	-68.3	-50	172.3	-64.8	174.3	-166.4	155.7	0	111.3	F231 D232 I233 F238 A239 Y269 L408	F231-K235 VanDerWaalsContact CD1-CE 3.45Å; F231-K235 HydrophobicContact CE1-CD 4.36Å; F231-K235 HydrophobicContact CE2-CG 4.35Å; F231-K235 HydrophobicContact CZ-CD 4.34Å; F231-K235 HydrophobicContact CZ-CG 4.41Å; F231-K235 PolarHBondContact O-N 2.91Å; F231-K235 VanDerWaalsContact O-N 3.17Å; D232-K235 WeakPolarHBondContact O-CB 3.48Å; D232-K235 PolarHBondContact O-N 2.94Å; D232-K235 IonicContact OD1-NZ 3.23Å; D232-K235 PolarHBondContact OD1-NZ 3.36Å; I233-K235 PolarHBondContact O-N 3.25Å; K235-F238 PolarHBondContact O-N 3.46Å; K235-A239 WeakPolarHBondContact O-CB 3.16Å; K235-A239 PolarHBondContact O-N 2.56Å; K235-Y269 WeakPolarHBondContact CA-OH 3.37Å; K235-Y269 HydrophobicContact CG-CE2 4.27Å; K235-L408 HydrophobicContact CD-CD1 4.47Å; K235-L408 HydrophobicContact CD-CD2 4.15Å; K235-L408 HydrophobicContact CG-CD2 4.22Å
236	L	93.3	Very high	91.9	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-52.9	-55.8	176.6	-91.9	162.1	0	0	0	111	V198 V201 R202 L205 D232 I233 F238 A239 Y240 E335	V198-L236 HydrophobicContact CG1-CD1 3.62Å; V201-L236 HydrophobicContact CG1-CB 4.48Å; V201-L236 HydrophobicContact CG1-CD1 4.32Å; R202-L236 HydrophobicContact CB-CD1 4.38Å; R202-L236 HydrophobicContact CB-CD2 3.98Å; R202-L236 HydrophobicContact CG-CD2 4.19Å; L205-L236 HydrophobicContact CD1-CB 4.29Å; L205-L236 HydrophobicContact CD1-CD2 4.38Å; D232-L236 PolarHBondContact O-N 3.01Å; I233-L236 WeakPolarHBondContact O-CB 3.48Å; I233-L236 PolarHBondContact O-N 3.07Å; L236-F238 VanDerWaalsContact C-N 3.27Å; L236-F238 PolarHBondContact O-N 3.39Å; L236-A239 WeakPolarHBondContact O-CB 3.4Å; L236-A239 PolarHBondContact O-N 3.04Å; L236-Y240 HydrophobicContact CD2-CD2 4.47Å; L236-Y240 HydrophobicContact CD2-CE2 4.04Å; L236-Y240 WeakPolarHBondContact O-CD2 3.32Å; L236-Y240 PolarHBondContact O-N 3.5Å; L236-E335 HydrophobicContact CD2-CG 4.41Å; L236-E335 WeakPolarHBondContact CD2-OE1 3.16Å; L236-E335 VanDerWaalsContact CG-OE1 3.25Å; L236-E335 WeakPolarHBondContact CG-OE1 3.43Å
237	L	93.8	Very high	91.7	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-56.7	-42.5	-179.1	-65.1	172.3	0	0	0	111.6	L189 L205 V211 A221 A222 A225 I233 Y240 G242	L189-L237 HydrophobicContact CD1-CD2 4.36Å; L189-L237 HydrophobicContact CD2-CD2 4.23Å; L189-L237 HydrophobicContact CG-CD2 4.44Å; L205-L237 HydrophobicContact CD1-CD2 4.43Å; V211-L237 HydrophobicContact CG1-CB 4.07Å; V211-L237 HydrophobicContact CG1-CD2 3.71Å; V211-L237 HydrophobicContact CG1-CG 4.48Å; A221-L237 HydrophobicContact CB-CD1 3.89Å; A221-L237 HydrophobicContact CB-CD2 3.78Å; A222-L237 HydrophobicContact CB-CD1 4.24Å; A225-L237 HydrophobicContact CB-CD1 4.19Å; I233-L237 HydrophobicContact CG2-CD1 3.86Å; I233-L237 HydrophobicContact CG2-CG 4.09Å; I233-L237 VanDerWaalsContact O-CG 3.27Å; I233-L237 WeakPolarHBondContact O-CG 3.37Å; I233-L237 PolarHBondContact O-N 2.94Å; L237-Y240 CarbonylContact O-C 3.56Å; L237-Y240 PolarHBondContact O-N 2.97Å; L237-G242 VanDerWaalsContact O-CA 3.23Å; L237-G242 WeakPolarHBondContact O-CA 3.35Å; L237-G242 PolarHBondContact O-N 3.05Å
238	F	92.3	Very high	91.6	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.009	17%	0.165	C	C	.	.	H	α-helix	trans	-68.8	-35.5	178.4	-174.5	-103.5	0	0	0	113.3	L234 K235 L236 Y240 S241 M244 R273 I324 L327 R328 D331	L234-F238 WeakPolarHBondContact O-CB 3.44Å; L234-F238 PolarHBondContact O-N 2.84Å; K235-F238 PolarHBondContact O-N 3.46Å; L236-F238 VanDerWaalsContact C-N 3.27Å; L236-F238 PolarHBondContact O-N 3.39Å; F238-Y240 VanDerWaalsContact C-N 3.32Å; F238-S241 PolarHBondContact O-N 2.92Å; F238-M244 HydrophobicContact CB-SD 4.19Å; F238-M244 HydrophobicContact CD2-CG 3.79Å; F238-M244 HydrophobicContact CD2-SD 4.32Å; F238-R273 HydrophobicContact CD1-CG 4.35Å; F238-R273 HydrophobicContact CD2-CB 4.11Å; F238-R273 HydrophobicContact CD2-CG 4.4Å; F238-R273 VanDerWaalsContact CE1-CD 3.45Å; F238-R273 HydrophobicContact CE1-CG 4.29Å; F238-R273 HydrophobicContact CE2-CB 3.93Å; F238-R273 HydrophobicContact CE2-CG 4.34Å; F238-R273 HydrophobicContact CG-CG 4.41Å; F238-R273 HydrophobicContact CZ-CB 4.27Å; F238-R273 HydrophobicContact CZ-CG 4.3Å; F238-I324 HydrophobicContact CE2-CG2 4.34Å; F238-I324 HydrophobicContact CZ-CG2 4.16Å; F238-L327 HydrophobicContact CE1-CB 4.27Å; F238-L327 HydrophobicContact CZ-CB 4.39Å; F238-R328 HydrophobicContact CE1-CB 3.91Å; F238-R328 HydrophobicContact CE1-CG 4.44Å; F238-R328 HydrophobicContact CZ-CB 4Å; F238-D331 HydrophobicContact CD1-CB 4.13Å; F238-D331 WeakPolarHBondContact CD1-OD2 3.03Å
239	A	90.7	Very high	91.5	Very high	3 Å²	3	32.3 Å²	32.3	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-36.4	175.9	0	0	0	0	0	111.9	K235 L236 S241 E335	K235-A239 WeakPolarHBondContact O-CB 3.16Å; K235-A239 PolarHBondContact O-N 2.56Å; L236-A239 WeakPolarHBondContact O-CB 3.4Å; L236-A239 PolarHBondContact O-N 3.04Å; A239-S241 VanDerWaalsContact C-N 3.26Å; A239-S241 PolarHBondContact O-N 3.49Å; A239-E335 HydrophobicContact CB-CB 4.4Å
240	Y	90.5	Very high	91.3	Very high	46 Å²	46	33.9 Å²	33.9	18%	0.18	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	33.8	174.7	-72.4	-96.3	0	0	0	113.1	L205 E206 V211 L236 L237 F238 G242	L205-Y240 HydrophobicContact CB-CD1 3.82Å; L205-Y240 HydrophobicContact CB-CD2 4.02Å; L205-Y240 HydrophobicContact CB-CE1 3.9Å; L205-Y240 HydrophobicContact CB-CE2 4.08Å; L205-Y240 HydrophobicContact CB-CG 3.88Å; L205-Y240 HydrophobicContact CD1-CD2 3.67Å; L205-Y240 HydrophobicContact CD1-CE2 4.17Å; L205-Y240 HydrophobicContact CD1-CG 4Å; L205-Y240 HydrophobicContact CD2-CG 4.33Å; L205-Y240 HydrophobicContact CG-CD2 4.37Å; L205-Y240 HydrophobicContact CG-CG 4.3Å; E206-Y240 WeakPolarHBondContact CG-OH 3.46Å; V211-Y240 VanDerWaalsContact CG2-O 3.24Å; V211-Y240 WeakPolarHBondContact CG2-O 3.38Å; L236-Y240 HydrophobicContact CD2-CD2 4.47Å; L236-Y240 HydrophobicContact CD2-CE2 4.04Å; L236-Y240 WeakPolarHBondContact O-CD2 3.32Å; L236-Y240 PolarHBondContact O-N 3.5Å; L237-Y240 CarbonylContact O-C 3.56Å; L237-Y240 PolarHBondContact O-N 2.97Å; F238-Y240 VanDerWaalsContact C-N 3.32Å; Y240-G242 VanDerWaalsContact C-N 3.31Å; Y240-G242 PolarHBondContact O-N 2.7Å
241	S	88.4	Confident	91.1	Very high	54 Å²	54	31.4 Å²	31.4	38%	0.378	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	25	174.9	-60.4	0	0	0	0	116.2	N212 F238 A239	N212-S241 PolarHBondContact ND2-O 3.31Å; F238-S241 PolarHBondContact O-N 2.92Å; A239-S241 VanDerWaalsContact C-N 3.26Å; A239-S241 PolarHBondContact O-N 3.49Å
242	G	88.9	Confident	91.1	Very high	2 Å²	2	30.4 Å²	30.4	2%	0.021	17%	0.168	C	C	.	.			trans	-64.1	134.6	169.4	0	0	0	0	0	112.6	V211 N212 L237 Y240	V211-G242 VanDerWaalsContact CG1-CA 3.46Å; N212-G242 WeakPolarHBondContact OD1-CA 3.37Å; L237-G242 VanDerWaalsContact O-CA 3.23Å; L237-G242 WeakPolarHBondContact O-CA 3.35Å; L237-G242 PolarHBondContact O-N 3.05Å; Y240-G242 VanDerWaalsContact C-N 3.31Å; Y240-G242 PolarHBondContact O-N 2.7Å
243	D	89	Confident	91.2	Very high	74 Å²	74	26.4 Å²	26.4	40%	0.396	15%	0.147	S	C	.	.			trans	-89.7	114.9	172.3	-176.3	6.2	0	0	0	110.4	N212 G245 L246	N212-D243 PolarHBondContact OD1-N 3.07Å; D243-G245 VanDerWaalsContact C-N 3.27Å; D243-G245 PolarHBondContact O-N 3.2Å; D243-G245 PolarHBondContact OD1-N 3.48Å; D243-L246 HydrophobicContact CB-CD1 3.93Å; D243-L246 HydrophobicContact CB-CD2 4.32Å; D243-L246 HydrophobicContact CB-CG 3.86Å; D243-L246 WeakPolarHBondContact OD2-CD2 3.41Å
244	M	89	Confident	91.2	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-8.9	-178.5	-46.2	-53.1	-77.1	0	0	112.2	A222 L234 F238 P254 L270 R273 C275	A222-M244 HydrophobicContact CB-CE 4.05Å; A222-M244 HydrophobicContact CB-SD 4.24Å; L234-M244 HydrophobicContact CB-CE 4.06Å; L234-M244 HydrophobicContact CD2-CE 3.52Å; L234-M244 HydrophobicContact CG-CE 4.35Å; F238-M244 HydrophobicContact CB-SD 4.19Å; F238-M244 HydrophobicContact CD2-CG 3.79Å; F238-M244 HydrophobicContact CD2-SD 4.32Å; M244-P254 WeakPolarHBondContact O-CD 3.43Å; M244-P254 WeakPolarHBondContact O-CG 3.49Å; M244-L270 HydrophobicContact CB-CD2 3.96Å; M244-L270 HydrophobicContact CE-CD2 3.35Å; M244-L270 HydrophobicContact CG-CD2 4.36Å; M244-R273 HydrophobicContact CG-CB 4.3Å; M244-C275 PolarHBondContact O-SG 2.98Å
245	G	86.9	Confident	91.3	Very high	23 Å²	23	26.4 Å²	26.4	24%	0.237	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-8.3	-176.4	0	0	0	0	0	115.2	D243	D243-G245 VanDerWaalsContact C-N 3.27Å; D243-G245 PolarHBondContact O-N 3.2Å; D243-G245 PolarHBondContact OD1-N 3.48Å
246	L	90.1	Very high	91.4	Very high	43 Å²	43	24.2 Å²	24.2	23%	0.225	14%	0.137	C	C	.	.			trans	-60.7	146.9	-174.1	-60.9	174	0	0	0	111.9	N212 H220 H223 D243 P254	N212-L246 HydrophobicContact CB-CD1 4.31Å; H220-L246 WeakPolarHBondContact CD2-CD1 3.39Å; H220-L246 WeakPolarHBondContact NE2-CD1 3.39Å; H223-L246 PolarHBondContact CE1-O 3.04Å; H223-L246 VanDerWaalsContact CE1-O 3.24Å; H223-L246 PolarHBondContact NE2-O 2.91Å; H223-L246 VanDerWaalsContact NE2-O 3.1Å; D243-L246 HydrophobicContact CB-CD1 3.93Å; D243-L246 HydrophobicContact CB-CD2 4.32Å; D243-L246 HydrophobicContact CB-CG 3.86Å; D243-L246 WeakPolarHBondContact OD2-CD2 3.41Å; L246-P254 VanDerWaalsContact O-CD 3.28Å; L246-P254 WeakPolarHBondContact O-CD 3.3Å
247	I	92	Very high	91.4	Very high	69 Å²	69	25.2 Å²	25.2	35%	0.354	14%	0.141	S	C	.	.			trans	-108.9	132.8	-176.9	56.7	176.9	0	0	0	110.5	T253 W279	I247-T253 HydrophobicContact CG2-CG2 3.76Å; I247-W279 HydrophobicContact CD1-CZ2 4.02Å; I247-W279 HydrophobicContact CG2-CZ2 4.43Å
248	G	91.2	Very high	91.5	Very high	4 Å²	4	25.2 Å²	25.2	4%	0.041	14%	0.141	C	C	.	.			trans	-74.1	168.9	167.1	0	0	0	0	0	112.2	R218 N250 G251 N252	R218-G248 WeakPolarHBondContact O-CA 3.46Å; G248-N250 PolarHBondContact O-N 3.49Å; G248-N250 VanDerWaalsContact O-N 3.17Å; G248-G251 WeakPolarHBondContact O-CA 3.5Å; G248-G251 PolarHBondContact O-N 2.84Å; G248-N252 PolarHBondContact N-O 3.35Å
249	M	89.8	Confident	91.6	Very high	110 Å²	110	25.1 Å²	25.1	54%	0.542	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.3	178.3	-75.3	-62.9	-163	0	0	113.2	D217 R218 G251	D217-M249 VanDerWaalsContact C-CG 3.43Å; D217-M249 WeakPolarHBondContact O-CB 3.5Å; D217-M249 VanDerWaalsContact O-CG 3.26Å; D217-M249 WeakPolarHBondContact O-CG 3.43Å; D217-M249 PolarHBondContact O-N 3.4Å; R218-M249 HydrophobicContact CB-CG 4.13Å; R218-M249 HydrophobicContact CG-CE 3.87Å; R218-M249 HydrophobicContact CG-CG 4.13Å; R218-M249 HydrophobicContact CG-SD 4.14Å; M249-G251 PolarHBondContact O-N 2.91Å
250	N	90.3	Very high	91.8	Very high	51 Å²	51	29.7 Å²	29.7	27%	0.273	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	5.2	174.9	60.1	3.7	0	0	0	114.3	G248 N252 Y257 L282	G248-N250 PolarHBondContact O-N 3.49Å; G248-N250 VanDerWaalsContact O-N 3.17Å; N250-N252 PolarHBondContact ND2-ND2 3.31Å; N250-N252 PolarHBondContact O-N 3.26Å; N250-N252 VanDerWaalsContact OD1-CB 3.29Å; N250-N252 WeakPolarHBondContact OD1-CB 3.33Å; N250-N252 PolarHBondContact OD1-N 3.37Å; N250-N252 VanDerWaalsContact OD1-N 3.16Å; N250-N252 PolarHBondContact OD1-ND2 2.96Å; N250-Y257 PolarHBondContact ND2-OH 2.91Å; N250-L282 WeakPolarHBondContact O-CG 2.91Å; N250-L282 PolarHBondContact O-N 3.48Å
251	G	90.5	Very high	91.8	Very high	10 Å²	10	28.9 Å²	28.9	10%	0.103	17%	0.168	C	C	.	.	S	Bend	trans	71.3	7.1	-177	0	0	0	0	0	114	G248 M249 W279 N281	G248-G251 WeakPolarHBondContact O-CA 3.5Å; G248-G251 PolarHBondContact O-N 2.84Å; M249-G251 PolarHBondContact O-N 2.91Å; G251-W279 PolarHBondContact O-NE1 3.34Å; G251-W279 VanDerWaalsContact O-NE1 3.1Å; G251-N281 WeakPolarHBondContact O-CA 3.12Å
252	N	93.2	Very high	92.1	Very high	12 Å²	12	27.2 Å²	27.2	6%	0.064	16%	0.159	C	C	.	.			trans	-82.1	132.3	176.6	-70.6	-42.6	0	0	0	110.2	H223 G248 N250 H256 Y257 N281	H223-N252 PolarHBondContact NE2-O 3.29Å; G248-N252 PolarHBondContact N-O 3.35Å; N250-N252 PolarHBondContact ND2-ND2 3.31Å; N250-N252 PolarHBondContact O-N 3.26Å; N250-N252 VanDerWaalsContact OD1-CB 3.29Å; N250-N252 WeakPolarHBondContact OD1-CB 3.33Å; N250-N252 PolarHBondContact OD1-N 3.37Å; N250-N252 VanDerWaalsContact OD1-N 3.16Å; N250-N252 PolarHBondContact OD1-ND2 2.96Å; N252-H256 HydrophobicContact CB-CB 3.87Å; N252-Y257 HydrophobicContact CB-CD2 4.34Å; N252-Y257 HydrophobicContact CB-CE2 3.85Å; N252-N281 WeakPolarHBondContact OD1-CB 3.37Å; N252-N281 PolarHBondContact OD1-ND2 2.87Å
253	T	93.9	Very high	92.3	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	17%	0.173	C	C	.	.			trans	-84.5	165.9	165.1	59.5	0	0	0	0	110.5	I247 L255 H256 Y257 W279	I247-T253 HydrophobicContact CG2-CG2 3.76Å; T253-L255 PolarHBondContact O-N 3.48Å; T253-L255 VanDerWaalsContact O-N 3.08Å; T253-H256 PolarHBondContact N-ND1 3.21Å; T253-H256 WeakPolarHBondContact O-CB 3.44Å; T253-H256 PolarHBondContact O-N 2.71Å; T253-H256 PolarHBondContact OG1-ND1 3.48Å; T253-Y257 PolarHBondContact O-N 3.36Å; T253-W279 HydrophobicContact CG2-CG 4.48Å
254	P	95	Very high	92.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-52.8	-33.2	171.5	-28.5	36.8	0	0	0	112.5	A222 H223 A226 M244 L246 H256 Y257 A258 L270	A222-P254 HydrophobicContact CB-CB 4.47Å; A222-P254 HydrophobicContact CB-CG 4.06Å; H223-P254 WeakPolarHBondContact NE2-CD 3.18Å; A226-P254 HydrophobicContact CB-CB 3.97Å; A226-P254 VanDerWaalsContact CB-O 3.24Å; A226-P254 WeakPolarHBondContact CB-O 3.27Å; M244-P254 WeakPolarHBondContact O-CD 3.43Å; M244-P254 WeakPolarHBondContact O-CG 3.49Å; L246-P254 VanDerWaalsContact O-CD 3.28Å; L246-P254 WeakPolarHBondContact O-CD 3.3Å; P254-H256 VanDerWaalsContact C-N 3.33Å; P254-H256 PolarHBondContact O-N 3.14Å; P254-Y257 PolarHBondContact O-N 3.4Å; P254-A258 PolarHBondContact O-N 3.35Å; P254-L270 HydrophobicContact CB-CD1 4.17Å; P254-L270 HydrophobicContact CB-CD2 4.11Å
255	L	95.1	Very high	92.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-33.6	176.3	-175.5	61.3	0	0	0	113	T253 A259 C267 L270 A271 C275 L277 P287 I303	T253-L255 PolarHBondContact O-N 3.48Å; T253-L255 VanDerWaalsContact O-N 3.08Å; L255-A259 WeakPolarHBondContact O-CB 3.05Å; L255-A259 PolarHBondContact O-N 3.4Å; L255-C267 HydrophobicContact CD1-CB 4.04Å; L255-C267 WeakPolarHBondContact CD1-O 3.48Å; L255-L270 HydrophobicContact CB-CB 4.44Å; L255-L270 HydrophobicContact CD1-CB 4.03Å; L255-A271 HydrophobicContact CD2-CB 4.49Å; L255-C275 HydrophobicContact CB-CB 4.14Å; L255-C275 HydrophobicContact CD2-CB 4.2Å; L255-L277 HydrophobicContact CD2-CD2 3.56Å; L255-P287 HydrophobicContact CB-CG 4.48Å; L255-P287 HydrophobicContact CD2-CB 4.05Å; L255-P287 HydrophobicContact CD2-CG 3.94Å; L255-P287 HydrophobicContact CG-CB 3.8Å; L255-P287 HydrophobicContact CG-CG 4.04Å; L255-I303 HydrophobicContact CD1-CG1 4.41Å
256	H	94.6	Very high	92.9	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-65.1	-42.6	173.5	-72.3	84.3	0	0	0	111.1	N252 T253 P254 A259 M260 K285 P287	N252-H256 HydrophobicContact CB-CB 3.87Å; T253-H256 PolarHBondContact N-ND1 3.21Å; T253-H256 WeakPolarHBondContact O-CB 3.44Å; T253-H256 PolarHBondContact O-N 2.71Å; T253-H256 PolarHBondContact OG1-ND1 3.48Å; P254-H256 VanDerWaalsContact C-N 3.33Å; P254-H256 PolarHBondContact O-N 3.14Å; H256-A259 WeakPolarHBondContact O-CB 3.25Å; H256-A259 PolarHBondContact O-N 3.36Å; H256-M260 WeakPolarHBondContact O-CB 3.36Å; H256-M260 PolarHBondContact O-N 3.29Å; H256-K285 PolarHBondContact NE2-O 3.07Å; H256-P287 VanDerWaalsContact CE1-CG 3.49Å; H256-P287 WeakPolarHBondContact CE1-CG 3.43Å; H256-P287 VanDerWaalsContact NE2-CD 3.32Å; H256-P287 WeakPolarHBondContact NE2-CD 3.47Å
257	Y	94.8	Very high	93.1	Very high	23 Å²	23	28.8 Å²	28.8	9%	0.09	16%	0.163	C	C	.	.	H	α-helix	trans	-67.4	-43	177.4	-71.7	-66.7	0	0	0	112.6	H219 H223 K227 N250 N252 T253 P254 A259 M260 G261	H219-Y257 PolarHBondContact NE2-OH 3.4Å; H223-Y257 HydrophobicContact CB-CD2 4.17Å; H223-Y257 HydrophobicContact CB-CE2 4.17Å; H223-Y257 AromaticContact CD2-CD2 3.72Å; H223-Y257 AromaticContact CD2-CE2 3.58Å; K227-Y257 HydrophobicContact CB-CD1 4.42Å; K227-Y257 HydrophobicContact CB-CG 4.44Å; K227-Y257 HydrophobicContact CD-CD1 4.45Å; K227-Y257 HydrophobicContact CG-CD1 4.39Å; N250-Y257 PolarHBondContact ND2-OH 2.91Å; N252-Y257 HydrophobicContact CB-CD2 4.34Å; N252-Y257 HydrophobicContact CB-CE2 3.85Å; T253-Y257 PolarHBondContact O-N 3.36Å; P254-Y257 PolarHBondContact O-N 3.4Å; Y257-A259 VanDerWaalsContact C-N 3.26Å; Y257-A259 PolarHBondContact O-N 3.45Å; Y257-M260 WeakPolarHBondContact O-CB 3.4Å; Y257-M260 PolarHBondContact O-N 2.79Å; Y257-G261 PolarHBondContact O-N 3.14Å
258	A	95.3	Very high	93.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-37.4	173.7	0	0	0	0	0	112.1	A226 P254 G261 G262 F263 C266 C267 L270	A226-A258 HydrophobicContact CB-CB 4.18Å; A226-A258 WeakPolarHBondContact O-CA 3.43Å; P254-A258 PolarHBondContact O-N 3.35Å; A258-G261 PolarHBondContact O-N 3.04Å; A258-G262 PolarHBondContact O-N 3.34Å; A258-G262 VanDerWaalsContact O-N 3.08Å; A258-F263 PolarHBondContact O-N 3.34Å; A258-F263 VanDerWaalsContact O-N 3.07Å; A258-C266 HydrophobicContact CB-CB 4.06Å; A258-C267 VanDerWaalsContact C-SG 3.5Å; A258-L270 HydrophobicContact CB-CD1 3.78Å
259	A	94.8	Very high	93.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.8	-37.7	175.7	0	0	0	0	0	112.6	L255 H256 Y257 G262 P287 A291 I303	L255-A259 WeakPolarHBondContact O-CB 3.05Å; L255-A259 PolarHBondContact O-N 3.4Å; H256-A259 WeakPolarHBondContact O-CB 3.25Å; H256-A259 PolarHBondContact O-N 3.36Å; Y257-A259 VanDerWaalsContact C-N 3.26Å; Y257-A259 PolarHBondContact O-N 3.45Å; A259-G262 PolarHBondContact O-N 3.05Å; A259-P287 HydrophobicContact CB-CB 4.36Å; A259-P287 VanDerWaalsContact CB-O 3.26Å; A259-P287 WeakPolarHBondContact CB-O 3.23Å; A259-A291 HydrophobicContact CB-CB 4.01Å; A259-I303 HydrophobicContact CB-CD1 4.01Å
260	M	93.6	Very high	93.2	Very high	99 Å²	99	21.5 Å²	21.5	49%	0.488	12%	0.124	S	C	.	.	H	α-helix	trans	-66.1	-36.4	175.3	-173.8	-176.3	-70.2	0	0	112.1	H256 Y257 V290 F296	H256-M260 WeakPolarHBondContact O-CB 3.36Å; H256-M260 PolarHBondContact O-N 3.29Å; Y257-M260 WeakPolarHBondContact O-CB 3.4Å; Y257-M260 PolarHBondContact O-N 2.79Å; M260-V290 HydrophobicContact CB-CG1 3.93Å; M260-F296 WeakPolarHBondContact O-CE2 3.35Å
261	G	92.3	Very high	93.2	Very high	30 Å²	30	19.8 Å²	19.8	31%	0.309	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.3	173.8	0	0	0	0	0	114.7	Y257 A258 F263	Y257-G261 PolarHBondContact O-N 3.14Å; A258-G261 PolarHBondContact O-N 3.04Å; G261-F263 VanDerWaalsContact C-N 3.29Å; G261-F263 PolarHBondContact O-N 2.9Å
262	G	93.4	Very high	93.1	Very high	18 Å²	18	20.6 Å²	20.6	19%	0.186	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	15.5	179.6	0	0	0	0	0	115.4	A258 A259 A264	A258-G262 PolarHBondContact O-N 3.34Å; A258-G262 VanDerWaalsContact O-N 3.08Å; A259-G262 PolarHBondContact O-N 3.05Å; G262-A264 PolarHBondContact O-N 3.03Å
263	F	94.6	Very high	92.9	Very high	72 Å²	72	20.2 Å²	20.2	32%	0.316	12%	0.116	S	C	.	.			trans	-76.8	88.8	-175.3	-55.3	-63.7	0	0	0	111.9	K227 G229 A258 G261 D265 C266 C267	K227-F263 WeakPolarHBondContact O-CE2 3.34Å; G229-F263 VanDerWaalsContact CA-CE2 3.44Å; A258-F263 PolarHBondContact O-N 3.34Å; A258-F263 VanDerWaalsContact O-N 3.07Å; G261-F263 VanDerWaalsContact C-N 3.29Å; G261-F263 PolarHBondContact O-N 2.9Å; F263-D265 PolarHBondContact O-N 3.09Å; F263-C266 HydrophobicContact CB-CB 3.85Å; F263-C266 PolarHBondContact O-N 2.97Å; F263-C267 PolarHBondContact O-N 2.93Å; F263-C267 PolarHBondContact O-SG 3.07Å
264	A	92.3	Very high	92.2	Very high	26 Å²	26	22.1 Å²	22.1	22%	0.215	14%	0.136	C	C	.	.	H	α-helix	trans	-59.3	-39.1	-172.1	0	0	0	0	0	114.5	G262 C267 K268 A298 E302	G262-A264 PolarHBondContact O-N 3.03Å; A264-C267 PolarHBondContact O-N 2.98Å; A264-K268 WeakPolarHBondContact O-CB 3.44Å; A264-K268 PolarHBondContact O-N 3.42Å; A264-A298 HydrophobicContact CB-CB 4.11Å; A264-E302 HydrophobicContact CB-CG 4.46Å
265	D	91.9	Very high	91.7	Very high	74 Å²	74	22.5 Å²	22.5	40%	0.396	14%	0.138	S	C	.	.	H	α-helix	trans	-70.3	-41.9	178.9	-74.6	-27.7	0	0	0	111.6	F263 K268 Y269	F263-D265 PolarHBondContact O-N 3.09Å; D265-K268 PolarHBondContact O-N 3.37Å; D265-Y269 WeakPolarHBondContact O-CB 3.49Å; D265-Y269 PolarHBondContact O-N 3.4Å
266	C	93.1	Very high	91.1	Very high	4 Å²	4	28 Å²	28	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-44	173	-59.8	0	0	0	0	111.2	G229 L234 A258 F263 K268 Y269 L270	G229-C266 PolarHBondContact O-SG 3.27Å; L234-C266 HydrophobicContact CD1-CB 3.87Å; A258-C266 HydrophobicContact CB-CB 4.06Å; F263-C266 HydrophobicContact CB-CB 3.85Å; F263-C266 PolarHBondContact O-N 2.97Å; C266-K268 PolarHBondContact O-N 3.23Å; C266-Y269 PolarHBondContact O-N 2.98Å; C266-L270 VanDerWaalsContact O-CB 3.32Å; C266-L270 WeakPolarHBondContact O-CB 3.46Å; C266-L270 VanDerWaalsContact O-CG 3.27Å; C266-L270 WeakPolarHBondContact O-CG 3.45Å; C266-L270 PolarHBondContact O-N 3.07Å
267	C	92.9	Very high	90.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-43.9	175	-68.5	0	0	0	0	112.2	L255 A258 F263 A264 Y269 A271 I303	L255-C267 HydrophobicContact CD1-CB 4.04Å; L255-C267 WeakPolarHBondContact CD1-O 3.48Å; A258-C267 VanDerWaalsContact C-SG 3.5Å; F263-C267 PolarHBondContact O-N 2.93Å; F263-C267 PolarHBondContact O-SG 3.07Å; A264-C267 PolarHBondContact O-N 2.98Å; C267-Y269 VanDerWaalsContact C-N 3.34Å; C267-A271 WeakPolarHBondContact O-CB 3.39Å; C267-A271 PolarHBondContact O-N 3.25Å; C267-A271 VanDerWaalsContact O-N 3.09Å; C267-I303 HydrophobicContact CB-CD1 4.33Å; C267-I303 HydrophobicContact CB-CG1 4.02Å
268	K	91.7	Very high	90.4	Very high	30 Å²	30	36 Å²	36	13%	0.13	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-43.9	176.4	179.8	-172.3	166.7	-129	0	110.8	A264 D265 C266 Q272 E302 S410 F411	A264-K268 WeakPolarHBondContact O-CB 3.44Å; A264-K268 PolarHBondContact O-N 3.42Å; D265-K268 PolarHBondContact O-N 3.37Å; C266-K268 PolarHBondContact O-N 3.23Å; K268-Q272 VanDerWaalsContact O-CG 3.28Å; K268-Q272 WeakPolarHBondContact O-CG 3.43Å; K268-Q272 PolarHBondContact O-N 3.41Å; K268-E302 HydrophobicContact CB-CB 4.3Å; K268-S410 PolarHBondContact NZ-O 3.01Å; K268-S410 VanDerWaalsContact NZ-O 3.08Å; K268-S410 PolarHBondContact NZ-OG 3.48Å; K268-F411 HydrophobicContact CB-CE1 4.07Å; K268-F411 HydrophobicContact CD-CD1 4.06Å; K268-F411 HydrophobicContact CD-CE1 3.63Å; K268-F411 HydrophobicContact CD-CZ 4.33Å; K268-F411 HydrophobicContact CG-CE1 3.72Å; K268-F411 HydrophobicContact CG-CZ 4.31Å
269	Y	92.3	Very high	90.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-53.7	-177.1	-176.9	-102.6	0	0	0	112.1	F231 L234 K235 D265 C266 C267 A271 Q272 R273 D331 L408 F411	F231-Y269 HydrophobicContact CD2-CG 4.35Å; F231-Y269 HydrophobicContact CE2-CD1 4.35Å; F231-Y269 AromaticContact CE2-CD2 3.73Å; F231-Y269 HydrophobicContact CE2-CD2 3.73Å; F231-Y269 HydrophobicContact CE2-CE2 4.46Å; F231-Y269 AromaticContact CE2-CG 3.67Å; F231-Y269 HydrophobicContact CE2-CG 3.67Å; F231-Y269 HydrophobicContact CZ-CD2 4.35Å; L234-Y269 HydrophobicContact CB-CD1 4.17Å; L234-Y269 HydrophobicContact CB-CE1 4.13Å; K235-Y269 WeakPolarHBondContact CA-OH 3.37Å; K235-Y269 HydrophobicContact CG-CE2 4.27Å; D265-Y269 WeakPolarHBondContact O-CB 3.49Å; D265-Y269 PolarHBondContact O-N 3.4Å; C266-Y269 PolarHBondContact O-N 2.98Å; C267-Y269 VanDerWaalsContact C-N 3.34Å; Y269-A271 VanDerWaalsContact C-N 3.3Å; Y269-A271 PolarHBondContact O-N 3.35Å; Y269-Q272 WeakPolarHBondContact O-CB 3.26Å; Y269-Q272 PolarHBondContact O-N 3.15Å; Y269-R273 HydrophobicContact CD1-CG 4.39Å; Y269-R273 HydrophobicContact CD2-CG 4.41Å; Y269-R273 HydrophobicContact CE1-CG 4.03Å; Y269-R273 HydrophobicContact CE2-CG 4.05Å; Y269-R273 WeakPolarHBondContact O-CG 3.41Å; Y269-R273 PolarHBondContact O-N 3.11Å; Y269-R273 VanDerWaalsContact O-N 3.12Å; Y269-D331 PolarHBondContact OH-OD2 3.34Å; Y269-D331 VanDerWaalsContact OH-OD2 3.09Å; Y269-L408 HydrophobicContact CE2-CD2 3.91Å; Y269-F411 HydrophobicContact CD2-CE1 4.14Å; Y269-F411 HydrophobicContact CD2-CE2 4.11Å; Y269-F411 AromaticContact CD2-CZ 3.76Å; Y269-F411 HydrophobicContact CD2-CZ 3.76Å; Y269-F411 HydrophobicContact CG-CE1 4.48Å; Y269-F411 HydrophobicContact CG-CZ 4.44Å
270	L	92.3	Very high	90.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56	-44.6	177.4	-72.5	170.5	0	0	0	111.7	A226 L234 M244 P254 L255 A258 C266 Q272 R273 C275	A226-L270 HydrophobicContact CB-CD1 4Å; L234-L270 HydrophobicContact CD1-CD1 4.22Å; L234-L270 HydrophobicContact CD1-CD2 4.43Å; L234-L270 HydrophobicContact CD1-CG 4.26Å; L234-L270 HydrophobicContact CD2-CD2 4.28Å; M244-L270 HydrophobicContact CB-CD2 3.96Å; M244-L270 HydrophobicContact CE-CD2 3.35Å; M244-L270 HydrophobicContact CG-CD2 4.36Å; P254-L270 HydrophobicContact CB-CD1 4.17Å; P254-L270 HydrophobicContact CB-CD2 4.11Å; L255-L270 HydrophobicContact CB-CB 4.44Å; L255-L270 HydrophobicContact CD1-CB 4.03Å; A258-L270 HydrophobicContact CB-CD1 3.78Å; C266-L270 VanDerWaalsContact O-CB 3.32Å; C266-L270 WeakPolarHBondContact O-CB 3.46Å; C266-L270 VanDerWaalsContact O-CG 3.27Å; C266-L270 WeakPolarHBondContact O-CG 3.45Å; C266-L270 PolarHBondContact O-N 3.07Å; L270-Q272 PolarHBondContact O-N 3.06Å; L270-R273 PolarHBondContact O-N 3.11Å; L270-R273 VanDerWaalsContact O-N 3.14Å; L270-C275 WeakPolarHBondContact O-CB 3.32Å; L270-C275 PolarHBondContact O-N 3.21Å; L270-C275 PolarHBondContact O-SG 3.23Å
271	A	90.3	Very high	90	Very high	15 Å²	15	42.2 Å²	42.2	12%	0.124	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-24.9	177.3	0	0	0	0	0	114.1	L255 C267 Y269 L277 A306	L255-A271 HydrophobicContact CD2-CB 4.49Å; C267-A271 WeakPolarHBondContact O-CB 3.39Å; C267-A271 PolarHBondContact O-N 3.25Å; C267-A271 VanDerWaalsContact O-N 3.09Å; Y269-A271 VanDerWaalsContact C-N 3.3Å; Y269-A271 PolarHBondContact O-N 3.35Å; A271-L277 HydrophobicContact CB-CD2 3.43Å; A271-L277 VanDerWaalsContact CB-CD2 3.43Å; A271-A306 HydrophobicContact CB-CB 3.59Å
272	Q	88.3	Confident	89.9	Confident	28 Å²	28	46.8 Å²	46.8	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-88	-22.9	177.2	-73.8	-179.4	-2.6	0	0	113.4	K268 Y269 L270 L327 S405 F406 F411	K268-Q272 VanDerWaalsContact O-CG 3.28Å; K268-Q272 WeakPolarHBondContact O-CG 3.43Å; K268-Q272 PolarHBondContact O-N 3.41Å; Y269-Q272 WeakPolarHBondContact O-CB 3.26Å; Y269-Q272 PolarHBondContact O-N 3.15Å; L270-Q272 PolarHBondContact O-N 3.06Å; Q272-L327 WeakPolarHBondContact O-CD1 3.3Å; Q272-S405 PolarHBondContact NE2-O 3.1Å; Q272-S405 PolarHBondContact OE1-O 3.01Å; Q272-F406 HydrophobicContact CB-CD1 3.68Å; Q272-F406 HydrophobicContact CB-CE1 3.63Å; Q272-F406 HydrophobicContact CG-CD1 3.79Å; Q272-F406 HydrophobicContact CG-CE1 3.55Å; Q272-F406 HydrophobicContact CG-CG 4.45Å; Q272-F406 HydrophobicContact CG-CZ 4.05Å; Q272-F411 VanDerWaalsContact OE1-CZ 3.25Å
273	R	87.7	Confident	89.8	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.015	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	20	-173.5	-63.9	-58.2	-171.8	-97	7.3	114.2	F238 M244 Y269 L270 D331 F406	F238-R273 HydrophobicContact CD1-CG 4.35Å; F238-R273 HydrophobicContact CD2-CB 4.11Å; F238-R273 HydrophobicContact CD2-CG 4.4Å; F238-R273 VanDerWaalsContact CE1-CD 3.45Å; F238-R273 HydrophobicContact CE1-CG 4.29Å; F238-R273 HydrophobicContact CE2-CB 3.93Å; F238-R273 HydrophobicContact CE2-CG 4.34Å; F238-R273 HydrophobicContact CG-CG 4.41Å; F238-R273 HydrophobicContact CZ-CB 4.27Å; F238-R273 HydrophobicContact CZ-CG 4.3Å; M244-R273 HydrophobicContact CG-CB 4.3Å; Y269-R273 HydrophobicContact CD1-CG 4.39Å; Y269-R273 HydrophobicContact CD2-CG 4.41Å; Y269-R273 HydrophobicContact CE1-CG 4.03Å; Y269-R273 HydrophobicContact CE2-CG 4.05Å; Y269-R273 WeakPolarHBondContact O-CG 3.41Å; Y269-R273 PolarHBondContact O-N 3.11Å; Y269-R273 VanDerWaalsContact O-N 3.12Å; L270-R273 PolarHBondContact O-N 3.11Å; L270-R273 VanDerWaalsContact O-N 3.14Å; R273-D331 IonicContact CZ-OD2 2.74Å; R273-D331 IonicContact NE-OD2 2.64Å; R273-D331 PolarHBondContact NE-OD2 2.95Å; R273-D331 VanDerWaalsContact NH2-CG 3.32Å; R273-D331 IonicContact NH2-OD1 2.82Å; R273-D331 PolarHBondContact NH2-OD1 3.26Å; R273-D331 IonicContact NH2-OD2 2.97Å; R273-D331 PolarHBondContact NH2-OD2 3.37Å; R273-F406 PolarHBondContact NH1-O 3.05Å; R273-F406 PolarHBondContact NH2-O 3.07Å
274	G	79.1	Confident	89.6	Confident	41 Å²	41	55.6 Å²	55.6	42%	0.423	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.5	2.6	168.4	0	0	0	0	0	115.8	E276	G274-E276 PolarHBondContact O-N 2.99Å
275	C	84.7	Confident	89.6	Confident	7 Å²	7	57.6 Å²	57.6	5%	0.047	28%	0.28	C	S	.	.			trans	-65.5	135.2	175.2	-60.7	0	0	0	0	112	M244 L255 L270 L277	M244-C275 PolarHBondContact O-SG 2.98Å; L255-C275 HydrophobicContact CB-CB 4.14Å; L255-C275 HydrophobicContact CD2-CB 4.2Å; L270-C275 WeakPolarHBondContact O-CB 3.32Å; L270-C275 PolarHBondContact O-N 3.21Å; L270-C275 PolarHBondContact O-SG 3.23Å; C275-L277 PolarHBondContact O-N 3.35Å
276	E	84	Confident	89.7	Confident	115 Å²	115	55.8 Å²	55.8	54%	0.537	27%	0.271	S	S	.	.			trans	-67.5	117.7	173.8	-68.4	-160.7	180	0	0	112.1	G274 W279	G274-E276 PolarHBondContact O-N 2.99Å; E276-W279 HydrophobicContact CB-CB 3.9Å; E276-W279 VanDerWaalsContact OE2-CE3 3.27Å
277	L	87.5	Confident	89.8	Confident	18 Å²	18	55.6 Å²	55.6	9%	0.094	27%	0.27	C	S	.	.	S	Bend	trans	-78.4	-23.8	-175.7	-59.3	172.3	0	0	0	113.5	L255 A271 C275 A306 E307 A310	L255-L277 HydrophobicContact CD2-CD2 3.56Å; A271-L277 HydrophobicContact CB-CD2 3.43Å; A271-L277 VanDerWaalsContact CB-CD2 3.43Å; C275-L277 PolarHBondContact O-N 3.35Å; L277-A306 HydrophobicContact CD1-CB 4.01Å; L277-A306 HydrophobicContact CD2-CB 4.32Å; L277-E307 HydrophobicContact CB-CG 4.12Å; L277-E307 HydrophobicContact CD1-CG 4.21Å; L277-A310 HydrophobicContact CD1-CB 4.12Å
278	K	86.9	Confident	89.8	Confident	174 Å²	174	58.6 Å²	58.6	76%	0.757	28%	0.281	S	S	*	.	S	Bend	trans	-104	-2.5	-175.7	-65.4	-174.6	-178.7	177.8	0	113.3
279	W	90.4	Very high	89.9	Confident	98 Å²	98	58.5 Å²	58.5	37%	0.371	29%	0.286	S	S	.	.			trans	-58.2	143.1	176.7	-171.2	-97.6	0	0	0	110.1	I247 G251 T253 E276 P287	I247-W279 HydrophobicContact CD1-CZ2 4.02Å; I247-W279 HydrophobicContact CG2-CZ2 4.43Å; G251-W279 PolarHBondContact O-NE1 3.34Å; G251-W279 VanDerWaalsContact O-NE1 3.1Å; T253-W279 HydrophobicContact CG2-CG 4.48Å; E276-W279 HydrophobicContact CB-CB 3.9Å; E276-W279 VanDerWaalsContact OE2-CE3 3.27Å; W279-P287 WeakPolarHBondContact O-CD 3.4Å
280	K	92.5	Very high	89.9	Confident	122 Å²	122	59.1 Å²	59.1	53%	0.53	29%	0.29	S	S	.	.			trans	-113.9	132.8	178.6	-68.5	-179	179.8	-176.7	0	108.7	K285 T286	K280-K285 WeakPolarHBondContact CA-O 3.5Å; K280-T286 HydrophobicContact CG-CG2 3.9Å
281	N	91.3	Very high	90	Very high	10 Å²	10	59.1 Å²	59.1	5%	0.053	29%	0.29	C	S	.	.			trans	-72.7	-178.5	171.4	68.8	0.4	0	0	0	111.7	G251 N252 E283 H284 K285	G251-N281 WeakPolarHBondContact O-CA 3.12Å; N252-N281 WeakPolarHBondContact OD1-CB 3.37Å; N252-N281 PolarHBondContact OD1-ND2 2.87Å; N281-E283 PolarHBondContact O-N 3.05Å; N281-E283 WeakPolarHBondContact OD1-CB 3.43Å; N281-E283 PolarHBondContact OD1-N 2.93Å; N281-E283 VanDerWaalsContact OD1-N 3.17Å; N281-H284 WeakPolarHBondContact O-CA 3.27Å; N281-H284 PolarHBondContact O-N 3.27Å; N281-H284 PolarHBondContact OD1-N 3.1Å; N281-K285 PolarHBondContact N-O 3.28Å; N281-K285 PolarHBondContact OD1-N 3.36Å; N281-K285 PolarHBondContact OD1-O 3.36Å
282	L	91.5	Very high	90.2	Very high	127 Å²	127	64.3 Å²	64.3	67%	0.665	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.5	178.4	-69.2	-179.7	0	0	0	113.7	N250 H284	N250-L282 WeakPolarHBondContact O-CG 2.91Å; N250-L282 PolarHBondContact O-N 3.48Å; L282-H284 PolarHBondContact O-N 3.1Å
283	E	90.1	Very high	90.4	Very high	125 Å²	125	68 Å²	68	58%	0.584	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	7.5	172.5	-59.8	-177.8	-175.3	0	0	113.2	N281 K285	N281-E283 PolarHBondContact O-N 3.05Å; N281-E283 WeakPolarHBondContact OD1-CB 3.43Å; N281-E283 PolarHBondContact OD1-N 2.93Å; N281-E283 VanDerWaalsContact OD1-N 3.17Å; E283-K285 HydrophobicContact CB-CD 4.23Å; E283-K285 HydrophobicContact CB-CG 4.16Å; E283-K285 PolarHBondContact O-N 3.29Å; E283-K285 WeakPolarHBondContact OE2-CD 3.33Å; E283-K285 VanDerWaalsContact OE2-CE 3.3Å; E283-K285 WeakPolarHBondContact OE2-CE 3.45Å; E283-K285 IonicContact OE2-NZ 2.86Å; E283-K285 PolarHBondContact OE2-NZ 3.06Å
284	H	90.9	Very high	90.5	Very high	149 Å²	149	69.8 Å²	69.8	69%	0.69	35%	0.35	S	S	*	.	S	Bend	trans	59.4	20.3	-174.5	-57	-57.8	0	0	0	115	N281 L282	N281-H284 WeakPolarHBondContact O-CA 3.27Å; N281-H284 PolarHBondContact O-N 3.27Å; N281-H284 PolarHBondContact OD1-N 3.1Å; L282-H284 PolarHBondContact O-N 3.1Å
285	K	92.9	Very high	91.1	Very high	69 Å²	69	70.4 Å²	70.4	30%	0.3	36%	0.357	S	S	.	.			trans	-94.4	139.5	178.7	-63.3	178.6	-174.7	162.4	0	110.3	H256 K280 N281 E283 A289 V290 D293	H256-K285 PolarHBondContact NE2-O 3.07Å; K280-K285 WeakPolarHBondContact CA-O 3.5Å; N281-K285 PolarHBondContact N-O 3.28Å; N281-K285 PolarHBondContact OD1-N 3.36Å; N281-K285 PolarHBondContact OD1-O 3.36Å; E283-K285 HydrophobicContact CB-CD 4.23Å; E283-K285 HydrophobicContact CB-CG 4.16Å; E283-K285 PolarHBondContact O-N 3.29Å; E283-K285 WeakPolarHBondContact OE2-CD 3.33Å; E283-K285 VanDerWaalsContact OE2-CE 3.3Å; E283-K285 WeakPolarHBondContact OE2-CE 3.45Å; E283-K285 IonicContact OE2-NZ 2.86Å; E283-K285 PolarHBondContact OE2-NZ 3.06Å; K285-A289 HydrophobicContact CB-CB 4.27Å; K285-V290 HydrophobicContact CB-CG2 3.86Å; K285-V290 HydrophobicContact CD-CG2 4.38Å; K285-D293 WeakPolarHBondContact CD-OD2 3.49Å; K285-D293 WeakPolarHBondContact CE-OD2 3.42Å; K285-D293 IonicContact NZ-OD2 2.72Å
286	T	94	Very high	91.6	Very high	36 Å²	36	74 Å²	74	22%	0.221	37%	0.371	C	S	.	.			trans	-84.8	161.9	169.4	63.7	0	0	0	0	110.2	K280 R288 A289 V290	K280-T286 HydrophobicContact CG-CG2 3.9Å; T286-R288 PolarHBondContact O-N 3.48Å; T286-R288 VanDerWaalsContact O-N 3.09Å; T286-A289 WeakPolarHBondContact O-CA 3.49Å; T286-A289 WeakPolarHBondContact O-CB 3.42Å; T286-A289 PolarHBondContact O-N 3.46Å; T286-A289 PolarHBondContact OG1-N 3.3Å; T286-V290 PolarHBondContact O-N 3.13Å
287	P	93.9	Very high	92	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-55.8	-34.7	177.9	-21.4	28.5	0	0	0	112.5	L255 H256 A259 W279 V290 A291 I303	L255-P287 HydrophobicContact CB-CG 4.48Å; L255-P287 HydrophobicContact CD2-CB 4.05Å; L255-P287 HydrophobicContact CD2-CG 3.94Å; L255-P287 HydrophobicContact CG-CB 3.8Å; L255-P287 HydrophobicContact CG-CG 4.04Å; H256-P287 VanDerWaalsContact CE1-CG 3.49Å; H256-P287 WeakPolarHBondContact CE1-CG 3.43Å; H256-P287 VanDerWaalsContact NE2-CD 3.32Å; H256-P287 WeakPolarHBondContact NE2-CD 3.47Å; A259-P287 HydrophobicContact CB-CB 4.36Å; A259-P287 VanDerWaalsContact CB-O 3.26Å; A259-P287 WeakPolarHBondContact CB-O 3.23Å; W279-P287 WeakPolarHBondContact O-CD 3.4Å; P287-V290 PolarHBondContact O-N 3.45Å; P287-A291 PolarHBondContact O-N 3.19Å; P287-I303 HydrophobicContact CB-CD1 4.29Å
288	R	93.9	Very high	92.2	Very high	62 Å²	62	79.5 Å²	79.5	23%	0.234	40%	0.404	C	S	.	.	H	α-helix	trans	-68.3	-35.9	176.3	-176.1	174.6	165.1	-153.8	-15.8	113.1	T286 K292 I303 E307	T286-R288 PolarHBondContact O-N 3.48Å; T286-R288 VanDerWaalsContact O-N 3.09Å; R288-K292 WeakPolarHBondContact O-CG 3.48Å; R288-K292 PolarHBondContact O-N 3.31Å; R288-I303 HydrophobicContact CB-CG2 3.87Å; R288-E307 WeakPolarHBondContact CD-OE1 3.44Å; R288-E307 WeakPolarHBondContact CD-OE2 3.44Å; R288-E307 IonicContact CZ-OE2 3.86Å; R288-E307 IonicContact NH1-OE2 3.03Å; R288-E307 PolarHBondContact NH1-OE2 2.87Å
289	A	93.2	Very high	92.5	Very high	28 Å²	28	71.2 Å²	71.2	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-68	-46.5	174.5	0	0	0	0	0	109.9	K285 T286 A291 K292 D293	K285-A289 HydrophobicContact CB-CB 4.27Å; T286-A289 WeakPolarHBondContact O-CA 3.49Å; T286-A289 WeakPolarHBondContact O-CB 3.42Å; T286-A289 PolarHBondContact O-N 3.46Å; T286-A289 PolarHBondContact OG1-N 3.3Å; A289-A291 VanDerWaalsContact C-N 3.32Å; A289-A291 PolarHBondContact O-N 3.49Å; A289-K292 WeakPolarHBondContact O-CA 3.33Å; A289-K292 WeakPolarHBondContact O-CB 3.5Å; A289-K292 PolarHBondContact O-N 2.92Å; A289-D293 PolarHBondContact O-N 2.91Å
290	V	93.4	Very high	92.6	Very high	14 Å²	14	67.1 Å²	67.1	9%	0.085	36%	0.355	C	S	.	.	H	α-helix	trans	-55.1	-45.8	174.5	176.6	0	0	0	0	111.7	M260 K285 T286 P287 K292 D293 G294	M260-V290 HydrophobicContact CB-CG1 3.93Å; K285-V290 HydrophobicContact CB-CG2 3.86Å; K285-V290 HydrophobicContact CD-CG2 4.38Å; T286-V290 PolarHBondContact O-N 3.13Å; P287-V290 PolarHBondContact O-N 3.45Å; V290-K292 VanDerWaalsContact C-N 3.27Å; V290-K292 PolarHBondContact O-N 3.25Å; V290-D293 PolarHBondContact O-N 3.14Å; V290-G294 PolarHBondContact O-N 2.9Å
291	A	93.9	Very high	92.7	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-29.6	175.6	0	0	0	0	0	113.8	A259 P287 A289 F296 A299 I303	A259-A291 HydrophobicContact CB-CB 4.01Å; P287-A291 PolarHBondContact O-N 3.19Å; A289-A291 VanDerWaalsContact C-N 3.32Å; A289-A291 PolarHBondContact O-N 3.49Å; A291-F296 WeakPolarHBondContact O-CA 3.19Å; A291-F296 PolarHBondContact O-N 3.29Å; A291-A299 HydrophobicContact CB-CB 4.36Å; A291-I303 HydrophobicContact CB-CD1 4.32Å
292	K	93.7	Very high	92.7	Very high	123 Å²	123	68.5 Å²	68.5	54%	0.535	36%	0.361	S	S	.	.	H	α-helix	trans	-76.7	-42.9	176.8	-77.8	176.3	169.7	-171	0	111.5	R288 A289 V290 G294 G295	R288-K292 WeakPolarHBondContact O-CG 3.48Å; R288-K292 PolarHBondContact O-N 3.31Å; A289-K292 WeakPolarHBondContact O-CA 3.33Å; A289-K292 WeakPolarHBondContact O-CB 3.5Å; A289-K292 PolarHBondContact O-N 2.92Å; V290-K292 VanDerWaalsContact C-N 3.27Å; V290-K292 PolarHBondContact O-N 3.25Å; K292-G294 VanDerWaalsContact C-N 3.27Å; K292-G294 PolarHBondContact O-N 3.15Å; K292-G295 PolarHBondContact O-N 3.22Å
293	D	92.6	Very high	92.7	Very high	107 Å²	107	62.4 Å²	62.4	57%	0.572	33%	0.329	S	S	*	.	H	α-helix	trans	-61.7	-39.8	179	-65.2	-2.8	0	0	0	110.1	K285 A289 V290 G295	K285-D293 WeakPolarHBondContact CD-OD2 3.49Å; K285-D293 WeakPolarHBondContact CE-OD2 3.42Å; K285-D293 IonicContact NZ-OD2 2.72Å; A289-D293 PolarHBondContact O-N 2.91Å; V290-D293 PolarHBondContact O-N 3.14Å; D293-G295 PolarHBondContact O-N 3.35Å
294	G	89.8	Confident	92.8	Very high	41 Å²	41	62.1 Å²	62.1	42%	0.423	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	0	172	0	0	0	0	0	115.5	V290 K292 F296	V290-G294 PolarHBondContact O-N 2.9Å; K292-G294 VanDerWaalsContact C-N 3.27Å; K292-G294 PolarHBondContact O-N 3.15Å; G294-F296 VanDerWaalsContact C-N 3.28Å; G294-F296 WeakPolarHBondContact O-CD2 3.5Å; G294-F296 VanDerWaalsContact O-CE2 3.28Å; G294-F296 WeakPolarHBondContact O-CE2 3.44Å; G294-F296 PolarHBondContact O-N 2.87Å
295	G	92.3	Very high	92.7	Very high	54 Å²	54	60.5 Å²	60.5	56%	0.557	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	6.3	179.9	0	0	0	0	0	115.7	K292 D293 K297	K292-G295 PolarHBondContact O-N 3.22Å; D293-G295 PolarHBondContact O-N 3.35Å; G295-K297 PolarHBondContact O-N 3.2Å
296	F	95.4	Very high	92.5	Very high	81 Å²	81	57.8 Å²	57.8	36%	0.355	30%	0.301	S	S	.	.			trans	-83.2	80.6	-174.5	-55.3	-65.7	0	0	0	113.1	M260 A291 G294 A298 A299 S300	M260-F296 WeakPolarHBondContact O-CE2 3.35Å; A291-F296 WeakPolarHBondContact O-CA 3.19Å; A291-F296 PolarHBondContact O-N 3.29Å; G294-F296 VanDerWaalsContact C-N 3.28Å; G294-F296 WeakPolarHBondContact O-CD2 3.5Å; G294-F296 VanDerWaalsContact O-CE2 3.28Å; G294-F296 WeakPolarHBondContact O-CE2 3.44Å; G294-F296 PolarHBondContact O-N 2.87Å; F296-A298 VanDerWaalsContact C-N 3.3Å; F296-A298 PolarHBondContact O-N 2.78Å; F296-A299 HydrophobicContact CB-CB 4.23Å; F296-A299 PolarHBondContact O-N 3.36Å; F296-S300 WeakPolarHBondContact O-CB 3.48Å; F296-S300 PolarHBondContact O-N 3.02Å; F296-S300 VanDerWaalsContact O-N 3.09Å
297	K	92.6	Very high	92.3	Very high	186 Å²	186	58 Å²	58	81%	0.809	30%	0.3	S	S	*	.	H	α-helix	trans	-58.9	-34.6	-178.6	-65.9	179	-177.1	173.1	0	114.1	G295 K301	G295-K297 PolarHBondContact O-N 3.2Å; K297-K301 WeakPolarHBondContact O-CB 3.34Å; K297-K301 PolarHBondContact O-N 3.44Å; K297-K301 VanDerWaalsContact O-N 3.11Å
298	A	91.6	Very high	92	Very high	63 Å²	63	64.4 Å²	64.4	52%	0.521	32%	0.324	S	S	.	.	H	α-helix	trans	-69.4	-51.8	-178.7	0	0	0	0	0	111.9	A264 F296 S300 K301 E302	A264-A298 HydrophobicContact CB-CB 4.11Å; F296-A298 VanDerWaalsContact C-N 3.3Å; F296-A298 PolarHBondContact O-N 2.78Å; A298-S300 PolarHBondContact O-N 3.42Å; A298-K301 WeakPolarHBondContact O-CB 3.41Å; A298-K301 PolarHBondContact O-N 2.86Å; A298-K301 VanDerWaalsContact O-N 3.16Å; A298-E302 PolarHBondContact O-N 3.14Å; A298-E302 VanDerWaalsContact O-N 3.1Å
299	A	92.6	Very high	91.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-58.9	-46.6	175.7	0	0	0	0	0	111.6	A291 F296 K301 E302 I303	A291-A299 HydrophobicContact CB-CB 4.36Å; F296-A299 HydrophobicContact CB-CB 4.23Å; F296-A299 PolarHBondContact O-N 3.36Å; A299-K301 PolarHBondContact O-N 3.21Å; A299-E302 PolarHBondContact O-N 3.04Å; A299-E302 VanDerWaalsContact O-N 3.16Å; A299-I303 WeakPolarHBondContact O-CG1 3.42Å; A299-I303 PolarHBondContact O-N 3.29Å
300	S	93.4	Very high	91.1	Very high	12 Å²	12	65.2 Å²	65.2	8%	0.084	34%	0.337	C	S	.	.	H	α-helix	trans	-58.6	-35.5	176.7	-168.9	0	0	0	0	112.9	F296 A298 R304	F296-S300 WeakPolarHBondContact O-CB 3.48Å; F296-S300 PolarHBondContact O-N 3.02Å; F296-S300 VanDerWaalsContact O-N 3.09Å; A298-S300 PolarHBondContact O-N 3.42Å; S300-R304 WeakPolarHBondContact O-CB 3.44Å; S300-R304 PolarHBondContact O-N 3.37Å
301	K	93.2	Very high	90.6	Very high	120 Å²	120	67.4 Å²	67.4	52%	0.522	36%	0.357	S	S	.	.	H	α-helix	trans	-70.1	-40.9	177.6	-174.9	179.5	-178.5	179.2	0	112.2	K297 A298 A299 R304 R305	K297-K301 WeakPolarHBondContact O-CB 3.34Å; K297-K301 PolarHBondContact O-N 3.44Å; K297-K301 VanDerWaalsContact O-N 3.11Å; A298-K301 WeakPolarHBondContact O-CB 3.41Å; A298-K301 PolarHBondContact O-N 2.86Å; A298-K301 VanDerWaalsContact O-N 3.16Å; A299-K301 PolarHBondContact O-N 3.21Å; K301-R304 PolarHBondContact O-N 3.26Å; K301-R305 WeakPolarHBondContact O-CG 3.42Å; K301-R305 PolarHBondContact O-N 3.13Å
302	E	91.3	Very high	90.1	Very high	41 Å²	41	74.3 Å²	74.3	19%	0.192	39%	0.387	C	S	.	.	H	α-helix	trans	-68.7	-42.6	177	-66.9	-52.5	142.8	0	0	111.7	A264 K268 A298 A299 R304 R305 A306	A264-E302 HydrophobicContact CB-CG 4.46Å; K268-E302 HydrophobicContact CB-CB 4.3Å; A298-E302 PolarHBondContact O-N 3.14Å; A298-E302 VanDerWaalsContact O-N 3.1Å; A299-E302 PolarHBondContact O-N 3.04Å; A299-E302 VanDerWaalsContact O-N 3.16Å; E302-R304 VanDerWaalsContact C-N 3.33Å; E302-R304 PolarHBondContact O-N 3.03Å; E302-R305 WeakPolarHBondContact O-CB 3.47Å; E302-R305 PolarHBondContact O-N 3.13Å; E302-R305 IonicContact OE1-CZ 3.71Å; E302-R305 IonicContact OE1-NH1 3.92Å; E302-R305 PolarHBondContact OE1-NH1 3Å; E302-R305 WeakPolarHBondContact OE2-CD 3.46Å; E302-R305 IonicContact OE2-NH1 2.71Å; E302-A306 PolarHBondContact O-N 3.03Å
303	I	91.4	Very high	89.5	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-59.3	-45.7	173.9	-61.6	166	0	0	0	110.2	L255 A259 C267 P287 R288 A291 A299 R305 A306 E307	L255-I303 HydrophobicContact CD1-CG1 4.41Å; A259-I303 HydrophobicContact CB-CD1 4.01Å; C267-I303 HydrophobicContact CB-CD1 4.33Å; C267-I303 HydrophobicContact CB-CG1 4.02Å; P287-I303 HydrophobicContact CB-CD1 4.29Å; R288-I303 HydrophobicContact CB-CG2 3.87Å; A291-I303 HydrophobicContact CB-CD1 4.32Å; A299-I303 WeakPolarHBondContact O-CG1 3.42Å; A299-I303 PolarHBondContact O-N 3.29Å; I303-R305 VanDerWaalsContact C-N 3.26Å; I303-R305 PolarHBondContact O-N 3Å; I303-A306 WeakPolarHBondContact O-CB 3.27Å; I303-A306 PolarHBondContact O-N 3.27Å; I303-A306 VanDerWaalsContact O-N 3.16Å; I303-E307 WeakPolarHBondContact O-CG 3.49Å; I303-E307 PolarHBondContact O-N 3.37Å
304	R	92	Very high	88.8	Confident	118 Å²	118	69.7 Å²	69.7	45%	0.445	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-32.7	175.7	-174.4	179.2	-177.6	-168.9	0.3	112.9	S300 K301 E302 R308	S300-R304 WeakPolarHBondContact O-CB 3.44Å; S300-R304 PolarHBondContact O-N 3.37Å; K301-R304 PolarHBondContact O-N 3.26Å; E302-R304 VanDerWaalsContact C-N 3.33Å; E302-R304 PolarHBondContact O-N 3.03Å; R304-R308 WeakPolarHBondContact O-CG 3.48Å; R304-R308 PolarHBondContact O-N 3.06Å
305	R	89.9	Confident	88.4	Confident	115 Å²	115	74.1 Å²	74.1	43%	0.434	39%	0.387	S	S	.	.	H	α-helix	trans	-69.2	-45.5	175.4	-77.5	168.8	169.1	179.7	-5.6	110.4	K301 E302 I303 E307 R308 T309	K301-R305 WeakPolarHBondContact O-CG 3.42Å; K301-R305 PolarHBondContact O-N 3.13Å; E302-R305 WeakPolarHBondContact O-CB 3.47Å; E302-R305 PolarHBondContact O-N 3.13Å; E302-R305 IonicContact OE1-CZ 3.71Å; E302-R305 IonicContact OE1-NH1 3.92Å; E302-R305 PolarHBondContact OE1-NH1 3Å; E302-R305 WeakPolarHBondContact OE2-CD 3.46Å; E302-R305 IonicContact OE2-NH1 2.71Å; I303-R305 VanDerWaalsContact C-N 3.26Å; I303-R305 PolarHBondContact O-N 3Å; R305-E307 VanDerWaalsContact C-N 3.34Å; R305-E307 PolarHBondContact O-N 3.21Å; R305-R308 PolarHBondContact O-N 3.05Å; R305-T309 PolarHBondContact O-N 3.1Å; R305-T309 PolarHBondContact O-OG1 3.15Å
306	A	88.1	Confident	87.2	Confident	13 Å²	13	78 Å²	78	11%	0.107	40%	0.402	C	S	.	.	H	α-helix	trans	-60	-42.1	175.9	0	0	0	0	0	112.2	A271 L277 E302 I303 R308 T309 A310	A271-A306 HydrophobicContact CB-CB 3.59Å; L277-A306 HydrophobicContact CD1-CB 4.01Å; L277-A306 HydrophobicContact CD2-CB 4.32Å; E302-A306 PolarHBondContact O-N 3.03Å; I303-A306 WeakPolarHBondContact O-CB 3.27Å; I303-A306 PolarHBondContact O-N 3.27Å; I303-A306 VanDerWaalsContact O-N 3.16Å; A306-R308 VanDerWaalsContact C-N 3.32Å; A306-R308 PolarHBondContact O-N 3Å; A306-T309 VanDerWaalsContact CA-OG1 3.27Å; A306-T309 WeakPolarHBondContact CA-OG1 3.48Å; A306-T309 PolarHBondContact O-N 3.04Å; A306-T309 PolarHBondContact O-OG1 3.22Å; A306-A310 WeakPolarHBondContact O-CB 3.17Å; A306-A310 PolarHBondContact O-N 2.77Å
307	E	89.3	Confident	85.9	Confident	41 Å²	41	78.1 Å²	78.1	19%	0.192	43%	0.427	C	S	.	.	H	α-helix	trans	-57.1	-44.1	174.5	-74.6	171	176.1	0	0	111.7	L277 R288 I303 R305 A311	L277-E307 HydrophobicContact CB-CG 4.12Å; L277-E307 HydrophobicContact CD1-CG 4.21Å; R288-E307 WeakPolarHBondContact CD-OE1 3.44Å; R288-E307 WeakPolarHBondContact CD-OE2 3.44Å; R288-E307 IonicContact CZ-OE2 3.86Å; R288-E307 IonicContact NH1-OE2 3.03Å; R288-E307 PolarHBondContact NH1-OE2 2.87Å; I303-E307 WeakPolarHBondContact O-CG 3.49Å; I303-E307 PolarHBondContact O-N 3.37Å; R305-E307 VanDerWaalsContact C-N 3.34Å; R305-E307 PolarHBondContact O-N 3.21Å; E307-A311 WeakPolarHBondContact O-CB 3.43Å; E307-A311 PolarHBondContact O-N 3.19Å
308	R	87.8	Confident	85.1	Confident	133 Å²	133	72.7 Å²	72.7	50%	0.502	41%	0.409	S	S	.	.	H	α-helix	trans	-68.2	-38.1	179	-69.8	-179.9	-148.6	179.9	3.4	112.2	R304 R305 A306 K312	R304-R308 WeakPolarHBondContact O-CG 3.48Å; R304-R308 PolarHBondContact O-N 3.06Å; R305-R308 PolarHBondContact O-N 3.05Å; A306-R308 VanDerWaalsContact C-N 3.32Å; A306-R308 PolarHBondContact O-N 3Å; R308-K312 WeakPolarHBondContact O-CG 3.33Å; R308-K312 PolarHBondContact O-N 2.86Å; R308-K312 VanDerWaalsContact O-N 3.15Å
309	T	84.9	Confident	84.2	Confident	64 Å²	64	79 Å²	79	39%	0.393	42%	0.424	S	S	.	.	H	α-helix	trans	-68.4	-43.3	176.9	43.3	0	0	0	0	110.9	R305 A306 A311 K312 L313	R305-T309 PolarHBondContact O-N 3.1Å; R305-T309 PolarHBondContact O-OG1 3.15Å; A306-T309 VanDerWaalsContact CA-OG1 3.27Å; A306-T309 WeakPolarHBondContact CA-OG1 3.48Å; A306-T309 PolarHBondContact O-N 3.04Å; A306-T309 PolarHBondContact O-OG1 3.22Å; T309-A311 PolarHBondContact O-N 2.86Å; T309-K312 PolarHBondContact O-N 3.03Å; T309-L313 WeakPolarHBondContact O-CG 3.26Å; T309-L313 PolarHBondContact O-N 2.95Å; T309-L313 VanDerWaalsContact O-N 3.12Å
310	A	83.5	Confident	83.5	Confident	43 Å²	43	83 Å²	83	36%	0.355	45%	0.446	S	S	.	.	H	α-helix	trans	-60.4	-44	174.6	0	0	0	0	0	111.6	L277 A306 K312 L313 A314	L277-A310 HydrophobicContact CD1-CB 4.12Å; A306-A310 WeakPolarHBondContact O-CB 3.17Å; A306-A310 PolarHBondContact O-N 2.77Å; A310-K312 VanDerWaalsContact C-N 3.28Å; A310-K312 PolarHBondContact O-N 2.97Å; A310-L313 PolarHBondContact O-N 3.18Å; A310-L313 VanDerWaalsContact O-N 3.15Å; A310-A314 WeakPolarHBondContact O-CB 3.47Å; A310-A314 PolarHBondContact O-N 2.86Å
311	A	84	Confident	82.6	Confident	60 Å²	60	85.7 Å²	85.7	50%	0.496	46%	0.463	S	S	.	.	H	α-helix	trans	-64	-29.3	177.1	0	0	0	0	0	113.9	E307 T309	E307-A311 WeakPolarHBondContact O-CB 3.43Å; E307-A311 PolarHBondContact O-N 3.19Å; T309-A311 PolarHBondContact O-N 2.86Å
312	K	83.3	Confident	82.1	Confident	145 Å²	145	80.3 Å²	80.3	63%	0.63	44%	0.44	S	S	*	.	H	α-helix	trans	-71.9	-38.9	173.4	-74.7	175.9	179.9	-170.8	0	111.9	R308 T309 A310	R308-K312 WeakPolarHBondContact O-CG 3.33Å; R308-K312 PolarHBondContact O-N 2.86Å; R308-K312 VanDerWaalsContact O-N 3.15Å; T309-K312 PolarHBondContact O-N 3.03Å; A310-K312 VanDerWaalsContact C-N 3.28Å; A310-K312 PolarHBondContact O-N 2.97Å
313	L	79.9	Confident	81.8	Confident	51 Å²	51	80.1 Å²	80.1	27%	0.267	44%	0.442	S	S	.	.	H	α-helix	trans	-77.5	-25.8	-179.3	-66.2	172.2	0	0	0	112.7	T309 A310 K315 V318 P321	T309-L313 WeakPolarHBondContact O-CG 3.26Å; T309-L313 PolarHBondContact O-N 2.95Å; T309-L313 VanDerWaalsContact O-N 3.12Å; A310-L313 PolarHBondContact O-N 3.18Å; A310-L313 VanDerWaalsContact O-N 3.15Å; L313-K315 PolarHBondContact O-N 3.21Å; L313-V318 HydrophobicContact CD2-CG1 4.12Å; L313-P321 HydrophobicContact CD2-CG 4.42Å
314	A	78.6	Confident	81.5	Confident	82 Å²	82	84.2 Å²	84.2	68%	0.678	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-0.6	176.3	0	0	0	0	0	114.3	A310	A310-A314 WeakPolarHBondContact O-CB 3.47Å; A310-A314 PolarHBondContact O-N 2.86Å
315	K	81.6	Confident	81.3	Confident	134 Å²	134	81.4 Å²	81.4	58%	0.583	45%	0.453	S	S	*	.	S	Bend	trans	-73	133.1	177.4	-69.8	-174.5	176.5	-170	0	110.2	L313 G317 V318	L313-K315 PolarHBondContact O-N 3.21Å; K315-G317 PolarHBondContact O-N 2.68Å; K315-V318 HydrophobicContact CB-CG2 4.05Å; K315-V318 PolarHBondContact O-N 2.82Å
316	P	66.4	Low	81.2	Confident	136 Å²	136	76 Å²	76	88%	0.883	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	130.2	-179.7	20.4	-29.7	0	0	0	111
317	G	68.4	Low	81.2	Confident	84 Å²	84	75.5 Å²	75.5	87%	0.866	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	-8.1	-178.6	0	0	0	0	0	116	K315	K315-G317 PolarHBondContact O-N 2.68Å
318	V	76.2	Confident	81.2	Confident	72 Å²	72	75.8 Å²	75.8	44%	0.436	43%	0.428	S	S	.	.			trans	-89.4	112	177.2	-177.1	0	0	0	0	110	L313 K315 N320	L313-V318 HydrophobicContact CD2-CG1 4.12Å; K315-V318 HydrophobicContact CB-CG2 4.05Å; K315-V318 PolarHBondContact O-N 2.82Å; V318-N320 PolarHBondContact O-N 3.24Å
319	K	71.8	Confident	81.3	Confident	194 Å²	194	69.5 Å²	69.5	84%	0.843	40%	0.404	S	S	*	.			trans	-65.9	129.6	171.9	-69.1	-173.6	179.2	-176.6	0	109.5	P321	K319-P321 VanDerWaalsContact O-CD 3.24Å; K319-P321 WeakPolarHBondContact O-CD 3.47Å
320	N	77.8	Confident	81.5	Confident	84 Å²	84	66.4 Å²	66.4	45%	0.449	39%	0.385	S	S	.	.			trans	-69.9	115.9	175.2	-179.5	11.3	0	0	0	109.4	V318 N322	V318-N320 PolarHBondContact O-N 3.24Å; N320-N322 PolarHBondContact ND2-O 3.12Å; N320-N322 PolarHBondContact O-N 3.18Å; N320-N322 PolarHBondContact OD1-N 3.44Å; N320-N322 PolarHBondContact OD1-O 3Å
321	P	75.8	Confident	81.8	Confident	69 Å²	69	64.6 Å²	64.6	45%	0.448	37%	0.369	S	S	.	.	S	Bend	trans	-75.2	-8.6	-179.1	31	-34.4	0	0	0	113.3	L313 K319	L313-P321 HydrophobicContact CD2-CG 4.42Å; K319-P321 VanDerWaalsContact O-CD 3.24Å; K319-P321 WeakPolarHBondContact O-CD 3.47Å
322	N	82.3	Confident	82.1	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.037	35%	0.35	C	S	.	.	S	Bend	trans	-131.1	80.1	179.9	-43	-78.1	0	0	0	110.2	N320 L327 L402 S403 F406	N320-N322 PolarHBondContact ND2-O 3.12Å; N320-N322 PolarHBondContact O-N 3.18Å; N320-N322 PolarHBondContact OD1-N 3.44Å; N320-N322 PolarHBondContact OD1-O 3Å; N322-L327 HydrophobicContact CB-CD1 4.3Å; N322-L327 HydrophobicContact CB-CD2 4.16Å; N322-L327 HydrophobicContact CB-CG 4.31Å; N322-L402 HydrophobicContact CB-CD2 4.1Å; N322-S403 VanDerWaalsContact CG-OG 3.29Å; N322-S403 PolarHBondContact ND2-OG 3.08Å; N322-S403 WeakPolarHBondContact OD1-CB 3.48Å; N322-S403 PolarHBondContact OD1-N 3.27Å; N322-S403 PolarHBondContact OD1-OG 2.99Å; N322-F406 HydrophobicContact CB-CD1 4.14Å; N322-F406 HydrophobicContact CB-CE1 4.42Å; N322-F406 HydrophobicContact CB-CG 4.32Å; N322-F406 WeakPolarHBondContact ND2-CD2 3.44Å; N322-F406 WeakPolarHBondContact ND2-CE2 3.39Å
323	P	85.5	Confident	82.4	Confident	38 Å²	38	55.9 Å²	55.9	25%	0.247	32%	0.32	C	S	.	.			trans	-70.4	152.9	172.2	30.7	-33.7	0	0	0	111.1	W325 A326 L327	P323-W325 VanDerWaalsContact C-N 3.3Å; P323-W325 HydrophobicContact CB-CG 4.44Å; P323-W325 HydrophobicContact CG-CD2 4.35Å; P323-W325 HydrophobicContact CG-CZ2 3.91Å; P323-W325 PolarHBondContact O-N 3.16Å; P323-A326 HydrophobicContact CG-CB 3.74Å; P323-A326 PolarHBondContact O-N 3.46Å; P323-A326 VanDerWaalsContact O-N 3.13Å; P323-L327 PolarHBondContact O-N 3.14Å; P323-L327 VanDerWaalsContact O-N 3.13Å
324	I	85	Confident	82.8	Confident	85 Å²	85	55.8 Å²	55.8	44%	0.436	32%	0.319	S	S	.	.	H	α-helix	trans	-60.2	-39.9	-174.6	-62.9	172.5	0	0	0	111.4	F238 A326 L327 R328	F238-I324 HydrophobicContact CE2-CG2 4.34Å; F238-I324 HydrophobicContact CZ-CG2 4.16Å; I324-A326 VanDerWaalsContact C-N 3.32Å; I324-A326 PolarHBondContact O-N 2.9Å; I324-L327 PolarHBondContact O-N 2.9Å; I324-R328 WeakPolarHBondContact O-CB 3.33Å; I324-R328 PolarHBondContact O-N 3.45Å
325	W	87.6	Confident	83.3	Confident	59 Å²	59	54.2 Å²	54.2	22%	0.223	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-38.4	177.7	69.3	-102.7	0	0	0	112.5	P323 R328 L329 A370 Q374 I378	P323-W325 VanDerWaalsContact C-N 3.3Å; P323-W325 HydrophobicContact CB-CG 4.44Å; P323-W325 HydrophobicContact CG-CD2 4.35Å; P323-W325 HydrophobicContact CG-CZ2 3.91Å; P323-W325 PolarHBondContact O-N 3.16Å; W325-R328 PolarHBondContact O-N 3.33Å; W325-L329 PolarHBondContact O-N 3.2Å; W325-A370 HydrophobicContact CE3-CB 3.87Å; W325-A370 HydrophobicContact CZ3-CB 4.33Å; W325-Q374 HydrophobicContact CD2-CG 4.42Å; W325-Q374 HydrophobicContact CE3-CB 4.24Å; W325-Q374 HydrophobicContact CH2-CB 3.59Å; W325-Q374 HydrophobicContact CH2-CG 4Å; W325-Q374 HydrophobicContact CZ2-CB 3.92Å; W325-Q374 HydrophobicContact CZ2-CG 3.77Å; W325-Q374 HydrophobicContact CZ3-CB 3.75Å; W325-Q374 HydrophobicContact CZ3-CG 4.39Å; W325-I378 HydrophobicContact CH2-CD1 3.89Å; W325-I378 HydrophobicContact CH2-CG1 4.3Å; W325-I378 HydrophobicContact CZ3-CD1 3.67Å
326	A	87.1	Confident	83.6	Confident	3 Å²	3	49.9 Å²	49.9	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-74.9	-34	179.6	0	0	0	0	0	112	P323 I324 R328 H330 Y401 L402	P323-A326 HydrophobicContact CG-CB 3.74Å; P323-A326 PolarHBondContact O-N 3.46Å; P323-A326 VanDerWaalsContact O-N 3.13Å; I324-A326 VanDerWaalsContact C-N 3.32Å; I324-A326 PolarHBondContact O-N 2.9Å; A326-R328 VanDerWaalsContact C-N 3.33Å; A326-H330 WeakPolarHBondContact O-CB 3.33Å; A326-H330 PolarHBondContact O-N 3.32Å; A326-H330 VanDerWaalsContact O-N 3.08Å; A326-Y401 HydrophobicContact CB-CD2 4.47Å; A326-L402 HydrophobicContact CB-CD2 4.11Å
327	L	89.1	Confident	84.6	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-40.6	170.8	-66.2	175	0	0	0	111.1	F238 Q272 N322 P323 I324 H330 D331 L402 F406	F238-L327 HydrophobicContact CE1-CB 4.27Å; F238-L327 HydrophobicContact CZ-CB 4.39Å; Q272-L327 WeakPolarHBondContact O-CD1 3.3Å; N322-L327 HydrophobicContact CB-CD1 4.3Å; N322-L327 HydrophobicContact CB-CD2 4.16Å; N322-L327 HydrophobicContact CB-CG 4.31Å; P323-L327 PolarHBondContact O-N 3.14Å; P323-L327 VanDerWaalsContact O-N 3.13Å; I324-L327 PolarHBondContact O-N 2.9Å; L327-H330 PolarHBondContact O-N 2.89Å; L327-D331 VanDerWaalsContact O-CG 3.29Å; L327-D331 PolarHBondContact O-N 3.03Å; L327-L402 HydrophobicContact CD2-CD1 3.86Å; L327-L402 HydrophobicContact CD2-CD2 3.62Å; L327-L402 HydrophobicContact CD2-CG 4.32Å; L327-L402 HydrophobicContact CG-CD2 4.24Å; L327-F406 HydrophobicContact CD1-CD1 4.1Å; L327-F406 HydrophobicContact CD2-CB 3.81Å; L327-F406 HydrophobicContact CD2-CD1 4.12Å; L327-F406 HydrophobicContact CD2-CG 4.4Å
328	R	88.2	Confident	85.5	Confident	47 Å²	47	46.3 Å²	46.3	18%	0.177	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-44.8	176.3	-171.7	170.1	-68.6	149.6	-3.6	111.6	F238 I324 W325 A326 H330 D331 W332 F369	F238-R328 HydrophobicContact CE1-CB 3.91Å; F238-R328 HydrophobicContact CE1-CG 4.44Å; F238-R328 HydrophobicContact CZ-CB 4Å; I324-R328 WeakPolarHBondContact O-CB 3.33Å; I324-R328 PolarHBondContact O-N 3.45Å; W325-R328 PolarHBondContact O-N 3.33Å; A326-R328 VanDerWaalsContact C-N 3.33Å; R328-H330 VanDerWaalsContact C-N 3.29Å; R328-H330 PolarHBondContact O-N 3.18Å; R328-D331 PolarHBondContact O-N 3.36Å; R328-W332 WeakPolarHBondContact O-CB 3.43Å; R328-W332 PolarHBondContact O-N 3.34Å; R328-F369 HydrophobicContact CB-CD2 4.37Å; R328-F369 HydrophobicContact CB-CE2 4.32Å; R328-F369 HydrophobicContact CG-CD1 4.31Å; R328-F369 HydrophobicContact CG-CD2 4.23Å; R328-F369 HydrophobicContact CG-CE1 4.24Å; R328-F369 HydrophobicContact CG-CE2 4.19Å; R328-F369 HydrophobicContact CG-CG 4.31Å; R328-F369 HydrophobicContact CG-CZ 4.2Å
329	L	89.3	Confident	85.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.2	-44.8	174.8	-170.6	63.3	0	0	0	112.3	W325 W332 S333 Q367 F369 L375 I378 F395	W325-L329 PolarHBondContact O-N 3.2Å; L329-W332 HydrophobicContact CD1-CE3 4.31Å; L329-S333 WeakPolarHBondContact O-CB 3.48Å; L329-S333 PolarHBondContact O-N 3.1Å; L329-S333 PolarHBondContact O-OG 3.42Å; L329-Q367 HydrophobicContact CD1-CG 4.4Å; L329-F369 VanDerWaalsContact CA-CE2 3.43Å; L329-F369 HydrophobicContact CB-CE2 3.72Å; L329-F369 HydrophobicContact CB-CZ 4.33Å; L329-F369 HydrophobicContact CD1-CE2 3.76Å; L329-F369 HydrophobicContact CD1-CZ 3.91Å; L329-F369 HydrophobicContact CG-CE2 4.34Å; L329-L375 HydrophobicContact CD1-CD2 4.31Å; L329-L375 HydrophobicContact CD2-CD2 3.69Å; L329-I378 HydrophobicContact CD2-CD1 3.55Å; L329-F395 HydrophobicContact CD2-CE2 4.5Å
330	H	89.9	Confident	86.6	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-49.2	176.6	176	-87.6	0	0	0	112.6	A326 L327 R328 S333 I334 G398 Y401 L402	A326-H330 WeakPolarHBondContact O-CB 3.33Å; A326-H330 PolarHBondContact O-N 3.32Å; A326-H330 VanDerWaalsContact O-N 3.08Å; L327-H330 PolarHBondContact O-N 2.89Å; R328-H330 VanDerWaalsContact C-N 3.29Å; R328-H330 PolarHBondContact O-N 3.18Å; H330-S333 PolarHBondContact O-N 3.1Å; H330-S333 PolarHBondContact O-OG 2.89Å; H330-I334 WeakPolarHBondContact CE1-CD1 3.35Å; H330-I334 WeakPolarHBondContact O-CG1 3.46Å; H330-I334 PolarHBondContact O-N 2.82Å; H330-I334 VanDerWaalsContact O-N 3.16Å; H330-G398 VanDerWaalsContact CD2-CA 3.49Å; H330-G398 WeakPolarHBondContact CD2-CA 3.46Å; H330-Y401 HydrophobicContact CB-CE2 4.18Å; H330-Y401 WeakPolarHBondContact CB-OH 3.42Å; H330-Y401 PolarHBondContact CD2-OH 3.16Å; H330-L402 HydrophobicContact CB-CD1 3.49Å; H330-L402 VanDerWaalsContact CB-CD1 3.49Å
331	D	89.6	Confident	87	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-70.8	-36.7	-176.9	-63.8	-9.3	0	0	0	111.2	F238 Y269 R273 L327 R328 E335 L408	F238-D331 HydrophobicContact CD1-CB 4.13Å; F238-D331 WeakPolarHBondContact CD1-OD2 3.03Å; Y269-D331 PolarHBondContact OH-OD2 3.34Å; Y269-D331 VanDerWaalsContact OH-OD2 3.09Å; R273-D331 IonicContact CZ-OD2 2.74Å; R273-D331 IonicContact NE-OD2 2.64Å; R273-D331 PolarHBondContact NE-OD2 2.95Å; R273-D331 VanDerWaalsContact NH2-CG 3.32Å; R273-D331 IonicContact NH2-OD1 2.82Å; R273-D331 PolarHBondContact NH2-OD1 3.26Å; R273-D331 IonicContact NH2-OD2 2.97Å; R273-D331 PolarHBondContact NH2-OD2 3.37Å; L327-D331 VanDerWaalsContact O-CG 3.29Å; L327-D331 PolarHBondContact O-N 3.03Å; R328-D331 PolarHBondContact O-N 3.36Å; D331-E335 PolarHBondContact O-N 3.26Å; D331-L408 WeakPolarHBondContact OD1-CG 3.47Å
332	W	90.9	Very high	87.5	Confident	23 Å²	23	41.6 Å²	41.6	9%	0.087	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-44.8	173.2	175.5	87.6	0	0	0	112.5	R328 L329 I334 E335 H336 L340 L363 R366 Q367 F369	R328-W332 WeakPolarHBondContact O-CB 3.43Å; R328-W332 PolarHBondContact O-N 3.34Å; L329-W332 HydrophobicContact CD1-CE3 4.31Å; W332-I334 VanDerWaalsContact C-N 3.34Å; W332-I334 PolarHBondContact O-N 3.03Å; W332-E335 PolarHBondContact O-N 2.84Å; W332-H336 AromaticContact CD1-CE1 3.5Å; W332-H336 VanDerWaalsContact CD1-CE1 3.5Å; W332-H336 AromaticContact CD1-ND1 3.46Å; W332-H336 AromaticContact CE2-ND1 3.75Å; W332-H336 AromaticContact CG-ND1 3.89Å; W332-H336 AromaticContact NE1-CE1 3.35Å; W332-H336 PolarHBondContact NE1-CE1 2.9Å; W332-H336 AromaticContact NE1-ND1 3.35Å; W332-H336 PolarHBondContact NE1-ND1 2.97Å; W332-H336 PolarHBondContact O-N 3.09Å; W332-H336 PolarHBondContact O-ND1 3.5Å; W332-L340 HydrophobicContact CE3-CD1 4.46Å; W332-L340 HydrophobicContact CH2-CD1 4.32Å; W332-L340 HydrophobicContact CH2-CD2 4.04Å; W332-L340 HydrophobicContact CZ3-CD1 3.88Å; W332-L340 HydrophobicContact CZ3-CD2 4.25Å; W332-L363 HydrophobicContact CZ3-CD2 4.04Å; W332-R366 HydrophobicContact CH2-CB 3.86Å; W332-R366 HydrophobicContact CZ2-CB 4.17Å; W332-R366 WeakPolarHBondContact CZ2-O 3.48Å; W332-Q367 HydrophobicContact CE3-CB 4.49Å; W332-Q367 HydrophobicContact CH2-CB 4.04Å; W332-Q367 HydrophobicContact CZ2-CB 4.16Å; W332-Q367 HydrophobicContact CZ3-CB 4.21Å; W332-F369 HydrophobicContact CB-CE1 4.24Å; W332-F369 HydrophobicContact CB-CZ 3.97Å; W332-F369 HydrophobicContact CD2-CE1 4.3Å; W332-F369 HydrophobicContact CD2-CZ 4.19Å; W332-F369 HydrophobicContact CE3-CZ 4.33Å; W332-F369 HydrophobicContact CG-CE1 4.01Å; W332-F369 HydrophobicContact CG-CZ 4.03Å
333	S	90.1	Very high	87.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-35.4	-179.8	59.6	0	0	0	0	112.8	L329 H330 E335 H336 E337 F396	L329-S333 WeakPolarHBondContact O-CB 3.48Å; L329-S333 PolarHBondContact O-N 3.1Å; L329-S333 PolarHBondContact O-OG 3.42Å; H330-S333 PolarHBondContact O-N 3.1Å; H330-S333 PolarHBondContact O-OG 2.89Å; S333-E335 VanDerWaalsContact C-N 3.34Å; S333-H336 CarbonylContact O-C 3.53Å; S333-E337 WeakPolarHBondContact O-CA 3.47Å; S333-E337 PolarHBondContact O-N 3.08Å; S333-F396 VanDerWaalsContact O-CE1 3.26Å; S333-F396 WeakPolarHBondContact O-CE1 3.43Å
334	I	88.8	Confident	87.6	Confident	48 Å²	48	40 Å²	40	25%	0.246	20%	0.195	C	C	.	.	H	α-helix	trans	-67.2	-40	174	-71.4	172.4	0	0	0	110.6	H330 W332 H336 E337 L408	H330-I334 WeakPolarHBondContact CE1-CD1 3.35Å; H330-I334 WeakPolarHBondContact O-CG1 3.46Å; H330-I334 PolarHBondContact O-N 2.82Å; H330-I334 VanDerWaalsContact O-N 3.16Å; W332-I334 VanDerWaalsContact C-N 3.34Å; W332-I334 PolarHBondContact O-N 3.03Å; I334-H336 VanDerWaalsContact C-N 3.35Å; I334-E337 VanDerWaalsContact O-CB 3.26Å; I334-E337 WeakPolarHBondContact O-CB 3.43Å; I334-E337 PolarHBondContact O-N 3.44Å; I334-L408 HydrophobicContact CB-CD1 4.33Å; I334-L408 HydrophobicContact CD1-CB 4.3Å; I334-L408 HydrophobicContact CD1-CD1 3.73Å; I334-L408 HydrophobicContact CD1-CG 4.23Å; I334-L408 HydrophobicContact CG2-CD1 4.15Å
335	E	87.6	Confident	87.5	Confident	50 Å²	50	40.1 Å²	40.1	23%	0.234	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-37.6	-179.6	-169.8	67.3	134.7	0	0	112.7	R202 L236 A239 D331 W332 S333 E337	R202-E335 VanDerWaalsContact CZ-CD 3.49Å; R202-E335 IonicContact CZ-OE1 3.98Å; R202-E335 IonicContact CZ-OE2 2.76Å; R202-E335 IonicContact NH1-OE1 3.47Å; R202-E335 PolarHBondContact NH1-OE1 3.29Å; R202-E335 IonicContact NH1-OE2 2.85Å; R202-E335 PolarHBondContact NH1-OE2 3.29Å; R202-E335 VanDerWaalsContact NH2-CD 3.28Å; R202-E335 IonicContact NH2-OE1 3.98Å; R202-E335 PolarHBondContact NH2-OE1 3.29Å; R202-E335 IonicContact NH2-OE2 3.82Å; R202-E335 PolarHBondContact NH2-OE2 3.37Å; R202-E335 VanDerWaalsContact NH2-OE2 3.08Å; L236-E335 HydrophobicContact CD2-CG 4.41Å; L236-E335 WeakPolarHBondContact CD2-OE1 3.16Å; L236-E335 VanDerWaalsContact CG-OE1 3.25Å; L236-E335 WeakPolarHBondContact CG-OE1 3.43Å; A239-E335 HydrophobicContact CB-CB 4.4Å; D331-E335 PolarHBondContact O-N 3.26Å; W332-E335 PolarHBondContact O-N 2.84Å; S333-E335 VanDerWaalsContact C-N 3.34Å; E335-E337 VanDerWaalsContact C-N 3.32Å
336	H	87.8	Confident	87.1	Confident	42 Å²	42	45.1 Å²	45.1	19%	0.194	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	22.6	177	-60.2	81.5	0	0	0	112.4	W332 S333 I334 A338 F339 L340	W332-H336 AromaticContact CD1-CE1 3.5Å; W332-H336 VanDerWaalsContact CD1-CE1 3.5Å; W332-H336 AromaticContact CD1-ND1 3.46Å; W332-H336 AromaticContact CE2-ND1 3.75Å; W332-H336 AromaticContact CG-ND1 3.89Å; W332-H336 AromaticContact NE1-CE1 3.35Å; W332-H336 PolarHBondContact NE1-CE1 2.9Å; W332-H336 AromaticContact NE1-ND1 3.35Å; W332-H336 PolarHBondContact NE1-ND1 2.97Å; W332-H336 PolarHBondContact O-N 3.09Å; W332-H336 PolarHBondContact O-ND1 3.5Å; S333-H336 CarbonylContact O-C 3.53Å; I334-H336 VanDerWaalsContact C-N 3.35Å; H336-A338 VanDerWaalsContact C-N 3.31Å; H336-A338 PolarHBondContact O-N 3.07Å; H336-F339 PolarHBondContact O-N 3.49Å; H336-L340 HydrophobicContact CB-CD1 4.35Å; H336-L340 HydrophobicContact CB-CG 4.33Å; H336-L340 WeakPolarHBondContact O-CB 3.22Å; H336-L340 WeakPolarHBondContact O-CG 3.43Å; H336-L340 PolarHBondContact O-N 3.43Å
337	E	88.3	Confident	86.7	Confident	64 Å²	64	47 Å²	47	30%	0.299	24%	0.235	S	C	.	.	H	α-helix	trans	-57.4	-42.9	-172.8	176.1	173.8	-175.9	0	0	112.1	S333 I334 E335 L340 R341 F396	S333-E337 WeakPolarHBondContact O-CA 3.47Å; S333-E337 PolarHBondContact O-N 3.08Å; I334-E337 VanDerWaalsContact O-CB 3.26Å; I334-E337 WeakPolarHBondContact O-CB 3.43Å; I334-E337 PolarHBondContact O-N 3.44Å; E335-E337 VanDerWaalsContact C-N 3.32Å; E337-L340 PolarHBondContact O-N 3.32Å; E337-R341 HydrophobicContact CG-CG 4.25Å; E337-R341 WeakPolarHBondContact O-CB 3.36Å; E337-R341 WeakPolarHBondContact O-CG 3.34Å; E337-R341 PolarHBondContact O-N 2.94Å; E337-R341 IonicContact OE1-CZ 3.69Å; E337-R341 IonicContact OE1-NE 2.78Å; E337-R341 PolarHBondContact OE1-NE 3.3Å; E337-R341 IonicContact OE1-NH2 3.2Å; E337-R341 PolarHBondContact OE1-NH2 3.08Å; E337-F396 HydrophobicContact CB-CE1 4.15Å; E337-F396 HydrophobicContact CB-CZ 4.32Å; E337-F396 HydrophobicContact CG-CD1 4.33Å; E337-F396 HydrophobicContact CG-CD2 4.26Å; E337-F396 HydrophobicContact CG-CE1 4.07Å; E337-F396 HydrophobicContact CG-CE2 3.95Å; E337-F396 HydrophobicContact CG-CG 4.44Å; E337-F396 HydrophobicContact CG-CZ 3.88Å
338	A	86.4	Confident	86.2	Confident	82 Å²	82	49.4 Å²	49.4	68%	0.678	25%	0.248	S	C	*	.	H	α-helix	trans	-61.5	-49.5	179.9	0	0	0	0	0	111.7	H336 R341 E342	H336-A338 VanDerWaalsContact C-N 3.31Å; H336-A338 PolarHBondContact O-N 3.07Å; A338-R341 PolarHBondContact O-N 3.43Å; A338-E342 PolarHBondContact O-N 3.39Å; A338-E342 VanDerWaalsContact O-N 3.14Å
339	F	84.8	Confident	85.5	Confident	111 Å²	111	53.8 Å²	53.8	49%	0.487	27%	0.265	S	S	.	.	H	α-helix	trans	-64.9	-41.2	178.8	-178.6	-107.1	0	0	0	112.2	H336 E342 A343 R366	H336-F339 PolarHBondContact O-N 3.49Å; F339-E342 PolarHBondContact O-N 2.86Å; F339-A343 PolarHBondContact O-N 2.99Å; F339-R366 HydrophobicContact CE1-CG 4.41Å
340	L	86.3	Confident	84.5	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-67.4	-40	177.1	-74.1	175	0	0	0	111.9	W332 H336 E337 E342 A343 F344 L363 F396	W332-L340 HydrophobicContact CE3-CD1 4.46Å; W332-L340 HydrophobicContact CH2-CD1 4.32Å; W332-L340 HydrophobicContact CH2-CD2 4.04Å; W332-L340 HydrophobicContact CZ3-CD1 3.88Å; W332-L340 HydrophobicContact CZ3-CD2 4.25Å; H336-L340 HydrophobicContact CB-CD1 4.35Å; H336-L340 HydrophobicContact CB-CG 4.33Å; H336-L340 WeakPolarHBondContact O-CB 3.22Å; H336-L340 WeakPolarHBondContact O-CG 3.43Å; H336-L340 PolarHBondContact O-N 3.43Å; E337-L340 PolarHBondContact O-N 3.32Å; L340-E342 VanDerWaalsContact C-N 3.32Å; L340-E342 PolarHBondContact O-N 3.5Å; L340-A343 PolarHBondContact O-N 3.33Å; L340-F344 HydrophobicContact CB-CD2 4.28Å; L340-F344 HydrophobicContact CB-CE2 4.09Å; L340-F344 HydrophobicContact CD2-CE2 4.44Å; L340-F344 WeakPolarHBondContact O-CB 3.29Å; L340-F344 WeakPolarHBondContact O-CD2 3.25Å; L340-F344 WeakPolarHBondContact O-CG 3.49Å; L340-F344 PolarHBondContact O-N 3.01Å; L340-L363 HydrophobicContact CD2-CD2 4.12Å; L340-F396 HydrophobicContact CB-CE1 4.4Å; L340-F396 HydrophobicContact CB-CZ 3.95Å; L340-F396 HydrophobicContact CD1-CE1 4.04Å; L340-F396 HydrophobicContact CD1-CZ 4.4Å
341	R	86.9	Confident	83.5	Confident	88 Å²	88	63.9 Å²	63.9	33%	0.332	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-44.7	175.9	-79	178.5	178.5	-72.6	-2.4	111.3	E337 A338 F344 T345 N393 F396	E337-R341 HydrophobicContact CG-CG 4.25Å; E337-R341 WeakPolarHBondContact O-CB 3.36Å; E337-R341 WeakPolarHBondContact O-CG 3.34Å; E337-R341 PolarHBondContact O-N 2.94Å; E337-R341 IonicContact OE1-CZ 3.69Å; E337-R341 IonicContact OE1-NE 2.78Å; E337-R341 PolarHBondContact OE1-NE 3.3Å; E337-R341 IonicContact OE1-NH2 3.2Å; E337-R341 PolarHBondContact OE1-NH2 3.08Å; A338-R341 PolarHBondContact O-N 3.43Å; R341-F344 PolarHBondContact O-N 3.45Å; R341-T345 WeakPolarHBondContact O-CG2 3.42Å; R341-T345 PolarHBondContact O-N 2.94Å; R341-N393 PolarHBondContact NH1-OD1 3.17Å; R341-N393 PolarHBondContact NH2-OD1 3.46Å; R341-F396 HydrophobicContact CG-CE2 3.86Å; R341-F396 HydrophobicContact CG-CZ 4.28Å
342	E	86.3	Confident	82.6	Confident	119 Å²	119	65 Å²	65	56%	0.556	35%	0.347	S	S	*	.	H	α-helix	trans	-59.6	-50.4	174.5	-174.8	175	-170.6	0	0	111.2	A338 F339 L340 F344 T345 F346	A338-E342 PolarHBondContact O-N 3.39Å; A338-E342 VanDerWaalsContact O-N 3.14Å; F339-E342 PolarHBondContact O-N 2.86Å; L340-E342 VanDerWaalsContact C-N 3.32Å; L340-E342 PolarHBondContact O-N 3.5Å; E342-F344 VanDerWaalsContact C-N 3.28Å; E342-F344 PolarHBondContact O-N 3.06Å; E342-T345 WeakPolarHBondContact O-CB 3.46Å; E342-T345 PolarHBondContact O-N 2.74Å; E342-T345 PolarHBondContact O-OG1 3.27Å; E342-F346 HydrophobicContact CG-CE2 4.15Å; E342-F346 VanDerWaalsContact O-CD2 3.24Å; E342-F346 WeakPolarHBondContact O-CD2 3.11Å
343	A	84.4	Confident	82.1	Confident	11 Å²	11	64.8 Å²	64.8	9%	0.091	35%	0.349	C	S	.	.	H	α-helix	trans	-56.3	-41.6	176.5	0	0	0	0	0	112.7	F339 L340 T345	F339-A343 PolarHBondContact O-N 2.99Å; L340-A343 PolarHBondContact O-N 3.33Å; A343-T345 VanDerWaalsContact C-N 3.34Å; A343-T345 PolarHBondContact O-N 3.49Å
344	F	84.6	Confident	81.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-72.4	-23.5	178.2	-72.5	-56.5	0	0	0	113.6	L340 R341 E342 F346 V347 D348 V354 F359 T362 L363 I392	L340-F344 HydrophobicContact CB-CD2 4.28Å; L340-F344 HydrophobicContact CB-CE2 4.09Å; L340-F344 HydrophobicContact CD2-CE2 4.44Å; L340-F344 WeakPolarHBondContact O-CB 3.29Å; L340-F344 WeakPolarHBondContact O-CD2 3.25Å; L340-F344 WeakPolarHBondContact O-CG 3.49Å; L340-F344 PolarHBondContact O-N 3.01Å; R341-F344 PolarHBondContact O-N 3.45Å; E342-F344 VanDerWaalsContact C-N 3.28Å; E342-F344 PolarHBondContact O-N 3.06Å; F344-F346 VanDerWaalsContact C-N 3.27Å; F344-F346 PolarHBondContact O-N 3.41Å; F344-V347 CarbonylContact O-C 3.59Å; F344-V347 PolarHBondContact O-N 3.1Å; F344-V347 VanDerWaalsContact O-N 3.17Å; F344-D348 WeakPolarHBondContact O-CB 3.34Å; F344-D348 PolarHBondContact O-N 2.66Å; F344-V354 HydrophobicContact CB-CG2 4.23Å; F344-V354 HydrophobicContact CD1-CB 4.5Å; F344-V354 HydrophobicContact CD1-CG1 4.21Å; F344-V354 HydrophobicContact CD1-CG2 3.81Å; F344-V354 HydrophobicContact CG-CG2 4.29Å; F344-F359 AromaticContact CE1-CD2 3.87Å; F344-F359 HydrophobicContact CE1-CD2 3.87Å; F344-F359 HydrophobicContact CE1-CE2 4.49Å; F344-F359 AromaticContact CZ-CD2 3.91Å; F344-F359 HydrophobicContact CZ-CD2 3.91Å; F344-F359 HydrophobicContact CZ-CE2 4.08Å; F344-T362 WeakPolarHBondContact CE1-OG1 3.4Å; F344-L363 HydrophobicContact CZ-CD2 4.3Å; F344-L363 HydrophobicContact CZ-CG 4.37Å; F344-I392 HydrophobicContact CB-CD1 3.54Å; F344-I392 HydrophobicContact CB-CG1 4.34Å; F344-I392 HydrophobicContact CD2-CD1 4.39Å; F344-I392 HydrophobicContact CD2-CG1 4.41Å; F344-I392 HydrophobicContact CD2-CG2 3.84Å; F344-I392 HydrophobicContact CE2-CG2 4.27Å; F344-I392 HydrophobicContact CG-CD1 4.02Å; F344-I392 HydrophobicContact CG-CG1 4.29Å
345	T	83.4	Confident	81.6	Confident	88 Å²	88	63.2 Å²	63.2	54%	0.54	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-33.8	176.9	64.8	0	0	0	0	112.8	R341 E342 A343 V347	R341-T345 WeakPolarHBondContact O-CG2 3.42Å; R341-T345 PolarHBondContact O-N 2.94Å; E342-T345 WeakPolarHBondContact O-CB 3.46Å; E342-T345 PolarHBondContact O-N 2.74Å; E342-T345 PolarHBondContact O-OG1 3.27Å; A343-T345 VanDerWaalsContact C-N 3.34Å; A343-T345 PolarHBondContact O-N 3.49Å; T345-V347 PolarHBondContact O-N 2.66Å
346	F	78.7	Confident	81.3	Confident	164 Å²	164	64 Å²	64	72%	0.719	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.5	177.8	-68.2	-78.1	0	0	0	113.4	E342 F344	E342-F346 HydrophobicContact CG-CE2 4.15Å; E342-F346 VanDerWaalsContact O-CD2 3.24Å; E342-F346 WeakPolarHBondContact O-CD2 3.11Å; F344-F346 VanDerWaalsContact C-N 3.27Å; F344-F346 PolarHBondContact O-N 3.41Å
347	V	79.4	Confident	81.1	Confident	43 Å²	43	67.2 Å²	67.2	26%	0.261	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	8.8	-174.2	-148.6	0	0	0	0	112.1	F344 T345 D358 T362	F344-V347 CarbonylContact O-C 3.59Å; F344-V347 PolarHBondContact O-N 3.1Å; F344-V347 VanDerWaalsContact O-N 3.17Å; T345-V347 PolarHBondContact O-N 2.66Å; V347-D358 HydrophobicContact CB-CB 4.32Å; V347-D358 HydrophobicContact CG1-CB 3.36Å; V347-D358 WeakPolarHBondContact CG1-OD2 3.44Å; V347-T362 HydrophobicContact CG2-CG2 4.16Å
348	D	78.5	Confident	81	Confident	53 Å²	53	67.2 Å²	67.2	28%	0.283	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-73.6	139.3	175.9	-170.2	5.9	0	0	0	110	F344 G350 G352 S353	F344-D348 WeakPolarHBondContact O-CB 3.34Å; F344-D348 PolarHBondContact O-N 2.66Å; D348-G350 PolarHBondContact O-N 2.81Å; D348-G350 PolarHBondContact OD1-N 3.34Å; D348-G352 WeakPolarHBondContact OD1-CA 3.48Å; D348-G352 PolarHBondContact OD1-N 2.84Å; D348-G352 WeakPolarHBondContact OD2-CA 3.34Å; D348-G352 PolarHBondContact OD2-N 3.21Å; D348-G352 VanDerWaalsContact OD2-N 3.12Å; D348-S353 PolarHBondContact OD1-N 3.22Å; D348-S353 VanDerWaalsContact OD1-O 3.08Å
349	R	73.9	Confident	81	Confident	138 Å²	138	63.3 Å²	63.3	52%	0.521	33%	0.333	S	S	.	.			trans	-75.3	3	175	-63.8	177.6	176.2	179.4	-2.7	113	S353 G387	R349-S353 PolarHBondContact N-O 3.19Å; R349-G387 PolarHBondContact NH1-O 2.95Å
350	G	67.4	Low	81	Confident	66 Å²	66	58.5 Å²	58.5	68%	0.68	31%	0.313	S	S	*	.	S	Bend	trans	94.3	-11.8	-177.2	0	0	0	0	0	114.4	D348	D348-G350 PolarHBondContact O-N 2.81Å; D348-G350 PolarHBondContact OD1-N 3.34Å
351	D	69.3	Low	81.1	Confident	146 Å²	146	61.7 Å²	61.7	78%	0.781	33%	0.332	S	S	*	.	S	Bend	trans	-101.5	5.4	-178.3	-66	-24	0	0	0	113.1
352	G	71.7	Confident	81	Confident	28 Å²	28	57.9 Å²	57.9	29%	0.289	32%	0.319	S	S	.	.	S	Bend	trans	78.2	26.4	-172.4	0	0	0	0	0	113.4	D348	D348-G352 WeakPolarHBondContact OD1-CA 3.48Å; D348-G352 PolarHBondContact OD1-N 2.84Å; D348-G352 WeakPolarHBondContact OD2-CA 3.34Å; D348-G352 PolarHBondContact OD2-N 3.21Å; D348-G352 VanDerWaalsContact OD2-N 3.12Å
353	S	80.6	Confident	80.9	Confident	19 Å²	19	52.2 Å²	52.2	13%	0.133	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.2	-177	80	0	0	0	0	112.9	D348 R349 I390	D348-S353 PolarHBondContact OD1-N 3.22Å; D348-S353 VanDerWaalsContact OD1-O 3.08Å; R349-S353 PolarHBondContact N-O 3.19Å; S353-I390 VanDerWaalsContact CA-O 3.29Å; S353-I390 WeakPolarHBondContact CA-O 2.97Å
354	V	82.9	Confident	81	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	148.4	-174.4	-174.3	0	0	0	0	110.1	F344 D358 F359 G389 I390 I392	F344-V354 HydrophobicContact CB-CG2 4.23Å; F344-V354 HydrophobicContact CD1-CB 4.5Å; F344-V354 HydrophobicContact CD1-CG1 4.21Å; F344-V354 HydrophobicContact CD1-CG2 3.81Å; F344-V354 HydrophobicContact CG-CG2 4.29Å; V354-D358 HydrophobicContact CG1-CB 3.73Å; V354-F359 HydrophobicContact CG1-CB 4.22Å; V354-G389 CarbonylContact O-C 3.59Å; V354-G389 WeakPolarHBondContact O-CA 3.3Å; V354-I390 PolarHBondContact N-O 3.16Å; V354-I390 PolarHBondContact O-N 3.43Å; V354-I392 HydrophobicContact CG2-CD1 3.69Å; V354-I392 HydrophobicContact CG2-CG1 3.75Å
355	S	84.3	Confident	81	Confident	15 Å²	15	62.5 Å²	62.5	11%	0.105	34%	0.339	C	S	.	.			trans	-67.6	161.4	173.4	95.1	0	0	0	0	111.3	D358 F359	S355-D358 VanDerWaalsContact CB-OD2 3.25Å; S355-D358 WeakPolarHBondContact CB-OD2 3.48Å; S355-D358 VanDerWaalsContact OG-CB 3.3Å; S355-D358 WeakPolarHBondContact OG-CB 3.38Å; S355-D358 PolarHBondContact OG-N 3.05Å; S355-D358 PolarHBondContact OG-OD2 2.97Å; S355-F359 WeakPolarHBondContact O-CB 3.38Å; S355-F359 PolarHBondContact O-N 2.92Å
356	K	82.3	Confident	80.9	Confident	65 Å²	65	62 Å²	62	28%	0.283	33%	0.327	S	S	.	.	H	α-helix	trans	-64.9	-44.6	-179.1	174.6	174.1	172.7	-163.8	0	112.1	F359 V360 L376 A379	K356-F359 PolarHBondContact O-N 3.03Å; K356-V360 WeakPolarHBondContact O-CG2 3.47Å; K356-V360 PolarHBondContact O-N 3.38Å; K356-V360 VanDerWaalsContact O-N 3.11Å; K356-L376 HydrophobicContact CD-CD2 4.43Å; K356-L376 HydrophobicContact CG-CD2 4.33Å; K356-A379 HydrophobicContact CD-CB 4.48Å; K356-A379 HydrophobicContact CG-CB 3.92Å
357	D	83.8	Confident	81.2	Confident	111 Å²	111	54.6 Å²	54.6	59%	0.594	29%	0.294	S	S	*	.	H	α-helix	trans	-71.1	-42.8	-175.3	-56.9	-31.9	0	0	0	109.6	F359 V360 V361	D357-F359 VanDerWaalsContact C-N 3.33Å; D357-F359 PolarHBondContact O-N 3.43Å; D357-V360 PolarHBondContact O-N 2.87Å; D357-V361 VanDerWaalsContact O-CG2 3.3Å; D357-V361 WeakPolarHBondContact O-CG2 3.33Å; D357-V361 PolarHBondContact O-N 3.1Å
358	D	85.3	Confident	81	Confident	63 Å²	63	60.5 Å²	60.5	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-39.7	174.4	-64.4	-34.6	0	0	0	112.4	V347 V354 S355 V360 T362	V347-D358 HydrophobicContact CB-CB 4.32Å; V347-D358 HydrophobicContact CG1-CB 3.36Å; V347-D358 WeakPolarHBondContact CG1-OD2 3.44Å; V354-D358 HydrophobicContact CG1-CB 3.73Å; S355-D358 VanDerWaalsContact CB-OD2 3.25Å; S355-D358 WeakPolarHBondContact CB-OD2 3.48Å; S355-D358 VanDerWaalsContact OG-CB 3.3Å; S355-D358 WeakPolarHBondContact OG-CB 3.38Å; S355-D358 PolarHBondContact OG-N 3.05Å; S355-D358 PolarHBondContact OG-OD2 2.97Å; D358-V360 VanDerWaalsContact C-N 3.35Å; D358-V360 PolarHBondContact O-N 3.11Å; D358-T362 VanDerWaalsContact O-CB 3.29Å; D358-T362 WeakPolarHBondContact O-CB 3.14Å; D358-T362 WeakPolarHBondContact O-CG2 3.29Å; D358-T362 PolarHBondContact O-N 3.04Å; D358-T362 PolarHBondContact O-OG1 3.28Å
359	F	85.8	Confident	81.1	Confident	1 Å²	1	60 Å²	60	0%	0.004	32%	0.32	C	S	.	.	H	α-helix	trans	-64.3	-38.4	176.7	176	-93.5	0	0	0	112.6	F344 V354 S355 K356 D357 T362 L363 A379 I390 F395	F344-F359 AromaticContact CE1-CD2 3.87Å; F344-F359 HydrophobicContact CE1-CD2 3.87Å; F344-F359 HydrophobicContact CE1-CE2 4.49Å; F344-F359 AromaticContact CZ-CD2 3.91Å; F344-F359 HydrophobicContact CZ-CD2 3.91Å; F344-F359 HydrophobicContact CZ-CE2 4.08Å; V354-F359 HydrophobicContact CG1-CB 4.22Å; S355-F359 WeakPolarHBondContact O-CB 3.38Å; S355-F359 PolarHBondContact O-N 2.92Å; K356-F359 PolarHBondContact O-N 3.03Å; D357-F359 VanDerWaalsContact C-N 3.33Å; D357-F359 PolarHBondContact O-N 3.43Å; F359-T362 WeakPolarHBondContact CA-OG1 3.45Å; F359-T362 PolarHBondContact O-OG1 3.45Å; F359-T362 VanDerWaalsContact O-OG1 3.13Å; F359-L363 HydrophobicContact CD1-CD1 4.19Å; F359-L363 HydrophobicContact CD2-CD1 4.43Å; F359-L363 HydrophobicContact CE1-CD1 3.57Å; F359-L363 HydrophobicContact CE2-CD1 3.84Å; F359-L363 HydrophobicContact CZ-CD1 3.38Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 2.74Å; F359-A379 HydrophobicContact CD1-CB 4.01Å; F359-A379 HydrophobicContact CE1-CB 4.34Å; F359-I390 HydrophobicContact CB-CD1 3.71Å; F359-I390 HydrophobicContact CD1-CD1 3.85Å; F359-I390 HydrophobicContact CD2-CD1 4.28Å; F359-I390 HydrophobicContact CD2-CG2 4.18Å; F359-I390 HydrophobicContact CE2-CG2 4.27Å; F359-I390 HydrophobicContact CG-CD1 3.68Å; F359-F395 HydrophobicContact CE2-CB 4.46Å; F359-F395 HydrophobicContact CE2-CD1 4.14Å; F359-F395 HydrophobicContact CE2-CD2 4.05Å; F359-F395 HydrophobicContact CE2-CE1 4.4Å; F359-F395 HydrophobicContact CE2-CE2 4.33Å; F359-F395 AromaticContact CE2-CG 3.95Å; F359-F395 HydrophobicContact CE2-CG 3.95Å; F359-F395 HydrophobicContact CE2-CZ 4.49Å; F359-F395 HydrophobicContact CZ-CD1 4.44Å; F359-F395 AromaticContact CZ-CD2 3.62Å; F359-F395 HydrophobicContact CZ-CD2 3.62Å; F359-F395 HydrophobicContact CZ-CE1 4.48Å; F359-F395 AromaticContact CZ-CE2 3.69Å; F359-F395 HydrophobicContact CZ-CE2 3.69Å; F359-F395 HydrophobicContact CZ-CG 4.01Å; F359-F395 HydrophobicContact CZ-CZ 4.13Å
360	V	86.1	Confident	81.6	Confident	10 Å²	10	53.9 Å²	53.9	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-72.6	-48.1	178	173.8	0	0	0	0	110.5	K356 D357 D358 T362 L363 E364 L375 L376	K356-V360 WeakPolarHBondContact O-CG2 3.47Å; K356-V360 PolarHBondContact O-N 3.38Å; K356-V360 VanDerWaalsContact O-N 3.11Å; D357-V360 PolarHBondContact O-N 2.87Å; D358-V360 VanDerWaalsContact C-N 3.35Å; D358-V360 PolarHBondContact O-N 3.11Å; V360-T362 PolarHBondContact O-N 2.89Å; V360-L363 PolarHBondContact O-N 3.45Å; V360-E364 VanDerWaalsContact O-CB 3.25Å; V360-E364 WeakPolarHBondContact O-CB 3.33Å; V360-E364 PolarHBondContact O-N 3.38Å; V360-L375 HydrophobicContact CG1-CB 4.16Å; V360-L375 HydrophobicContact CG1-CD1 4.29Å; V360-L375 HydrophobicContact CG2-CB 4.1Å; V360-L376 HydrophobicContact CG2-CD2 3.8Å; V360-L376 HydrophobicContact CG2-CG 4Å
361	V	86.9	Confident	82.5	Confident	67 Å²	67	54 Å²	54	41%	0.406	29%	0.286	S	S	.	.	H	α-helix	trans	-59.4	-48	179.8	171	0	0	0	0	110.9	D357 L363 E364 E365	D357-V361 VanDerWaalsContact O-CG2 3.3Å; D357-V361 WeakPolarHBondContact O-CG2 3.33Å; D357-V361 PolarHBondContact O-N 3.1Å; V361-L363 VanDerWaalsContact C-N 3.28Å; V361-L363 PolarHBondContact O-N 2.86Å; V361-E364 PolarHBondContact O-N 3.12Å; V361-E365 HydrophobicContact CG1-CG 4.37Å; V361-E365 WeakPolarHBondContact O-CG 3.49Å; V361-E365 PolarHBondContact O-N 3.44Å
362	T	84.8	Confident	83.2	Confident	9 Å²	9	49.5 Å²	49.5	6%	0.055	27%	0.265	C	S	.	.	H	α-helix	trans	-61.1	-36.6	179.9	48.4	0	0	0	0	112.8	F344 V347 D358 F359 V360 R366	F344-T362 WeakPolarHBondContact CE1-OG1 3.4Å; V347-T362 HydrophobicContact CG2-CG2 4.16Å; D358-T362 VanDerWaalsContact O-CB 3.29Å; D358-T362 WeakPolarHBondContact O-CB 3.14Å; D358-T362 WeakPolarHBondContact O-CG2 3.29Å; D358-T362 PolarHBondContact O-N 3.04Å; D358-T362 PolarHBondContact O-OG1 3.28Å; F359-T362 WeakPolarHBondContact CA-OG1 3.45Å; F359-T362 PolarHBondContact O-OG1 3.45Å; F359-T362 VanDerWaalsContact O-OG1 3.13Å; V360-T362 PolarHBondContact O-N 2.89Å; T362-R366 VanDerWaalsContact CA-NH1 3.29Å; T362-R366 WeakPolarHBondContact O-CD 3.43Å; T362-R366 WeakPolarHBondContact O-CG 3.4Å; T362-R366 PolarHBondContact O-NH1 3.17Å
363	L	85.6	Confident	83.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-75.3	-47.2	175.2	-71.2	177.8	0	0	0	111.5	W332 L340 F344 F359 V360 V361 E365 R366 Q367 L375 F395	W332-L363 HydrophobicContact CZ3-CD2 4.04Å; L340-L363 HydrophobicContact CD2-CD2 4.12Å; F344-L363 HydrophobicContact CZ-CD2 4.3Å; F344-L363 HydrophobicContact CZ-CG 4.37Å; F359-L363 HydrophobicContact CD1-CD1 4.19Å; F359-L363 HydrophobicContact CD2-CD1 4.43Å; F359-L363 HydrophobicContact CE1-CD1 3.57Å; F359-L363 HydrophobicContact CE2-CD1 3.84Å; F359-L363 HydrophobicContact CZ-CD1 3.38Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 2.74Å; V360-L363 PolarHBondContact O-N 3.45Å; V361-L363 VanDerWaalsContact C-N 3.28Å; V361-L363 PolarHBondContact O-N 2.86Å; L363-E365 VanDerWaalsContact C-N 3.33Å; L363-E365 PolarHBondContact O-N 3.1Å; L363-R366 PolarHBondContact O-N 3.48Å; L363-Q367 WeakPolarHBondContact O-CG 3.5Å; L363-Q367 PolarHBondContact O-N 3.28Å; L363-Q367 VanDerWaalsContact O-N 3.12Å; L363-L375 HydrophobicContact CB-CD1 3.9Å; L363-L375 HydrophobicContact CB-CD2 4.32Å; L363-L375 HydrophobicContact CD1-CD2 4.03Å; L363-F395 HydrophobicContact CD1-CE2 4.46Å; L363-F395 HydrophobicContact CD1-CZ 4.01Å; L363-F395 HydrophobicContact CD2-CZ 4.49Å
364	E	86.4	Confident	84.1	Confident	92 Å²	92	54.5 Å²	54.5	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-55.9	-42.2	-178.4	-177.2	171.7	-154	0	0	113	V360 V361 R366 L375	V360-E364 VanDerWaalsContact O-CB 3.25Å; V360-E364 WeakPolarHBondContact O-CB 3.33Å; V360-E364 PolarHBondContact O-N 3.38Å; V361-E364 PolarHBondContact O-N 3.12Å; E364-R366 PolarHBondContact O-N 3.38Å; E364-R366 VanDerWaalsContact O-N 3.13Å; E364-L375 HydrophobicContact CB-CD1 4.35Å
365	E	83.1	Confident	84.2	Confident	135 Å²	135	54.6 Å²	54.6	63%	0.631	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.7	176.8	-71.5	173.4	164.6	0	0	114.2	V361 L363	V361-E365 HydrophobicContact CG1-CG 4.37Å; V361-E365 WeakPolarHBondContact O-CG 3.49Å; V361-E365 PolarHBondContact O-N 3.44Å; L363-E365 VanDerWaalsContact C-N 3.33Å; L363-E365 PolarHBondContact O-N 3.1Å
366	R	82.9	Confident	84.3	Confident	76 Å²	76	56.1 Å²	56.1	29%	0.287	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-10.1	-167	-64.4	174.7	179.1	66.8	2.9	113.5	W332 F339 T362 L363 E364	W332-R366 HydrophobicContact CH2-CB 3.86Å; W332-R366 HydrophobicContact CZ2-CB 4.17Å; W332-R366 WeakPolarHBondContact CZ2-O 3.48Å; F339-R366 HydrophobicContact CE1-CG 4.41Å; T362-R366 VanDerWaalsContact CA-NH1 3.29Å; T362-R366 WeakPolarHBondContact O-CD 3.43Å; T362-R366 WeakPolarHBondContact O-CG 3.4Å; T362-R366 PolarHBondContact O-NH1 3.17Å; L363-R366 PolarHBondContact O-N 3.48Å; E364-R366 PolarHBondContact O-N 3.38Å; E364-R366 VanDerWaalsContact O-N 3.13Å
367	Q	83.6	Confident	84.4	Confident	9 Å²	9	58 Å²	58	4%	0.042	30%	0.3	C	S	.	.			trans	-139.6	140.3	-176.6	70.1	85.8	18.5	0	0	112.1	L329 W332 L363 F369 A370	L329-Q367 HydrophobicContact CD1-CG 4.4Å; W332-Q367 HydrophobicContact CE3-CB 4.49Å; W332-Q367 HydrophobicContact CH2-CB 4.04Å; W332-Q367 HydrophobicContact CZ2-CB 4.16Å; W332-Q367 HydrophobicContact CZ3-CB 4.21Å; L363-Q367 WeakPolarHBondContact O-CG 3.5Å; L363-Q367 PolarHBondContact O-N 3.28Å; L363-Q367 VanDerWaalsContact O-N 3.12Å; Q367-F369 HydrophobicContact CB-CD1 4.38Å; Q367-F369 HydrophobicContact CB-CE1 3.85Å; Q367-F369 HydrophobicContact CB-CZ 4.02Å; Q367-A370 PolarHBondContact NE2-O 3.03Å
368	D	75.8	Confident	84.5	Confident	167 Å²	167	52.9 Å²	52.9	89%	0.893	27%	0.272	S	S	*	.	S	Bend	trans	-104.2	-0.9	-172.8	-58.9	-36	0	0	0	114.5
369	F	80.8	Confident	84.4	Confident	44 Å²	44	50 Å²	50	19%	0.193	26%	0.256	C	S	.	.	S	Bend	trans	-109.2	-18.1	-165.2	55.7	-101.9	0	0	0	116.1	R328 L329 W332 Q367	R328-F369 HydrophobicContact CB-CD2 4.37Å; R328-F369 HydrophobicContact CB-CE2 4.32Å; R328-F369 HydrophobicContact CG-CD1 4.31Å; R328-F369 HydrophobicContact CG-CD2 4.23Å; R328-F369 HydrophobicContact CG-CE1 4.24Å; R328-F369 HydrophobicContact CG-CE2 4.19Å; R328-F369 HydrophobicContact CG-CG 4.31Å; R328-F369 HydrophobicContact CG-CZ 4.2Å; L329-F369 VanDerWaalsContact CA-CE2 3.43Å; L329-F369 HydrophobicContact CB-CE2 3.72Å; L329-F369 HydrophobicContact CB-CZ 4.33Å; L329-F369 HydrophobicContact CD1-CE2 3.76Å; L329-F369 HydrophobicContact CD1-CZ 3.91Å; L329-F369 HydrophobicContact CG-CE2 4.34Å; W332-F369 HydrophobicContact CB-CE1 4.24Å; W332-F369 HydrophobicContact CB-CZ 3.97Å; W332-F369 HydrophobicContact CD2-CE1 4.3Å; W332-F369 HydrophobicContact CD2-CZ 4.19Å; W332-F369 HydrophobicContact CE3-CZ 4.33Å; W332-F369 HydrophobicContact CG-CE1 4.01Å; W332-F369 HydrophobicContact CG-CZ 4.03Å; Q367-F369 HydrophobicContact CB-CD1 4.38Å; Q367-F369 HydrophobicContact CB-CE1 3.85Å; Q367-F369 HydrophobicContact CB-CZ 4.02Å
370	A	84.6	Confident	84.3	Confident	9 Å²	9	55 Å²	55	7%	0.074	28%	0.28	C	S	.	.	S	Bend	trans	-112.3	134.9	177.5	0	0	0	0	0	110.6	W325 Q367 L375	W325-A370 HydrophobicContact CE3-CB 3.87Å; W325-A370 HydrophobicContact CZ3-CB 4.33Å; Q367-A370 PolarHBondContact NE2-O 3.03Å; A370-L375 HydrophobicContact CB-CD2 4.18Å; A370-L375 HydrophobicContact CB-CG 4.43Å
371	T	85.9	Confident	84.1	Confident	67 Å²	67	59.1 Å²	59.1	41%	0.411	30%	0.3	S	S	.	.			trans	-75.8	155.1	-178.8	63.4	0	0	0	0	111.5	D373 Q374 L375	T371-D373 PolarHBondContact O-N 3.23Å; T371-Q374 VanDerWaalsContact N-OE1 3.16Å; T371-Q374 WeakPolarHBondContact O-CA 3.28Å; T371-Q374 WeakPolarHBondContact O-CB 3.37Å; T371-Q374 PolarHBondContact O-N 3.04Å; T371-Q374 VanDerWaalsContact OG1-CD 3.28Å; T371-Q374 VanDerWaalsContact OG1-CG 3.22Å; T371-Q374 WeakPolarHBondContact OG1-CG 3.33Å; T371-L375 PolarHBondContact O-N 3.19Å
372	P	83.4	Confident	83.8	Confident	53 Å²	53	56.2 Å²	56.2	34%	0.344	28%	0.282	S	S	.	.	H	α-helix	trans	-55.8	-37.9	177.9	19.4	-32.3	0	0	0	112.1	Q374 L375 L376	P372-Q374 VanDerWaalsContact C-N 3.3Å; P372-Q374 PolarHBondContact O-N 2.77Å; P372-L375 PolarHBondContact O-N 3.04Å; P372-L376 WeakPolarHBondContact O-CB 3.06Å; P372-L376 VanDerWaalsContact O-CG 3.25Å; P372-L376 WeakPolarHBondContact O-CG 3.48Å; P372-L376 PolarHBondContact O-N 2.64Å
373	D	85.3	Confident	83.5	Confident	110 Å²	110	58.7 Å²	58.7	59%	0.588	29%	0.293	S	S	*	.	H	α-helix	trans	-60.5	-36.9	174.7	-67.2	-27.2	0	0	0	113.4	T371 Q377	T371-D373 PolarHBondContact O-N 3.23Å; D373-Q377 VanDerWaalsContact O-CG 3.29Å; D373-Q377 WeakPolarHBondContact O-CG 3.29Å; D373-Q377 PolarHBondContact O-N 3.47Å; D373-Q377 VanDerWaalsContact O-N 3.09Å
374	Q	87	Confident	82.6	Confident	42 Å²	42	66.8 Å²	66.8	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-72.5	-39.9	178.3	-74.4	170.1	-0.9	0	0	111.5	W325 T371 P372 Q377 I378	W325-Q374 HydrophobicContact CD2-CG 4.42Å; W325-Q374 HydrophobicContact CE3-CB 4.24Å; W325-Q374 HydrophobicContact CH2-CB 3.59Å; W325-Q374 HydrophobicContact CH2-CG 4Å; W325-Q374 HydrophobicContact CZ2-CB 3.92Å; W325-Q374 HydrophobicContact CZ2-CG 3.77Å; W325-Q374 HydrophobicContact CZ3-CB 3.75Å; W325-Q374 HydrophobicContact CZ3-CG 4.39Å; T371-Q374 VanDerWaalsContact N-OE1 3.16Å; T371-Q374 WeakPolarHBondContact O-CA 3.28Å; T371-Q374 WeakPolarHBondContact O-CB 3.37Å; T371-Q374 PolarHBondContact O-N 3.04Å; T371-Q374 VanDerWaalsContact OG1-CD 3.28Å; T371-Q374 VanDerWaalsContact OG1-CG 3.22Å; T371-Q374 WeakPolarHBondContact OG1-CG 3.33Å; P372-Q374 VanDerWaalsContact C-N 3.3Å; P372-Q374 PolarHBondContact O-N 2.77Å; Q374-Q377 WeakPolarHBondContact O-CB 3.3Å; Q374-Q377 PolarHBondContact O-N 3Å; Q374-I378 PolarHBondContact O-N 3.49Å; Q374-I378 VanDerWaalsContact O-N 3.14Å
375	L	85.4	Confident	81.6	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-64.8	-41.2	173.7	-65.3	179.3	0	0	0	111.4	L329 V360 L363 E364 A370 T371 P372 Q377 I378 A379	L329-L375 HydrophobicContact CD1-CD2 4.31Å; L329-L375 HydrophobicContact CD2-CD2 3.69Å; V360-L375 HydrophobicContact CG1-CB 4.16Å; V360-L375 HydrophobicContact CG1-CD1 4.29Å; V360-L375 HydrophobicContact CG2-CB 4.1Å; L363-L375 HydrophobicContact CB-CD1 3.9Å; L363-L375 HydrophobicContact CB-CD2 4.32Å; L363-L375 HydrophobicContact CD1-CD2 4.03Å; E364-L375 HydrophobicContact CB-CD1 4.35Å; A370-L375 HydrophobicContact CB-CD2 4.18Å; A370-L375 HydrophobicContact CB-CG 4.43Å; T371-L375 PolarHBondContact O-N 3.19Å; P372-L375 PolarHBondContact O-N 3.04Å; L375-Q377 VanDerWaalsContact C-N 3.3Å; L375-Q377 PolarHBondContact O-N 3.09Å; L375-I378 PolarHBondContact O-N 3.05Å; L375-I378 VanDerWaalsContact O-N 3.14Å; L375-A379 WeakPolarHBondContact O-CB 3.49Å; L375-A379 PolarHBondContact O-N 3.05Å
376	L	85.4	Confident	80.4	Confident	47 Å²	47	71.8 Å²	71.8	25%	0.246	35%	0.35	C	S	.	.	H	α-helix	trans	-60.3	-37.9	174.1	-76.1	167	0	0	0	112.1	K356 V360 P372 A379 Q380	K356-L376 HydrophobicContact CD-CD2 4.43Å; K356-L376 HydrophobicContact CG-CD2 4.33Å; V360-L376 HydrophobicContact CG2-CD2 3.8Å; V360-L376 HydrophobicContact CG2-CG 4Å; P372-L376 WeakPolarHBondContact O-CB 3.06Å; P372-L376 VanDerWaalsContact O-CG 3.25Å; P372-L376 WeakPolarHBondContact O-CG 3.48Å; P372-L376 PolarHBondContact O-N 2.64Å; L376-A379 PolarHBondContact O-N 3.22Å; L376-Q380 VanDerWaalsContact O-CG 3.23Å; L376-Q380 WeakPolarHBondContact O-CG 3.36Å; L376-Q380 PolarHBondContact O-N 2.75Å
377	Q	84.9	Confident	79.4	Confident	106 Å²	106	70.6 Å²	70.6	50%	0.495	36%	0.361	S	S	.	.	H	α-helix	trans	-64.3	-41.8	173.9	-74	169.5	32.4	0	0	111.8	D373 Q374 L375 Q380 M381	D373-Q377 VanDerWaalsContact O-CG 3.29Å; D373-Q377 WeakPolarHBondContact O-CG 3.29Å; D373-Q377 PolarHBondContact O-N 3.47Å; D373-Q377 VanDerWaalsContact O-N 3.09Å; Q374-Q377 WeakPolarHBondContact O-CB 3.3Å; Q374-Q377 PolarHBondContact O-N 3Å; L375-Q377 VanDerWaalsContact C-N 3.3Å; L375-Q377 PolarHBondContact O-N 3.09Å; Q377-Q380 PolarHBondContact O-N 3.24Å; Q377-M381 WeakPolarHBondContact O-CG 3.43Å; Q377-M381 PolarHBondContact O-N 3.38Å; Q377-M381 VanDerWaalsContact O-N 3.16Å
378	I	85.1	Confident	78.6	Confident	3 Å²	3	72.8 Å²	72.8	2%	0.015	38%	0.378	C	S	.	.	H	α-helix	trans	-64.7	-45.3	176	-67.2	175.4	0	0	0	110.6	W325 L329 Q374 L375 Q380 M381 H382 F395 Y401	W325-I378 HydrophobicContact CH2-CD1 3.89Å; W325-I378 HydrophobicContact CH2-CG1 4.3Å; W325-I378 HydrophobicContact CZ3-CD1 3.67Å; L329-I378 HydrophobicContact CD2-CD1 3.55Å; Q374-I378 PolarHBondContact O-N 3.49Å; Q374-I378 VanDerWaalsContact O-N 3.14Å; L375-I378 PolarHBondContact O-N 3.05Å; L375-I378 VanDerWaalsContact O-N 3.14Å; I378-Q380 VanDerWaalsContact C-N 3.31Å; I378-Q380 PolarHBondContact O-N 2.62Å; I378-M381 HydrophobicContact CB-CE 4.43Å; I378-M381 HydrophobicContact CG1-CE 4Å; I378-M381 PolarHBondContact O-N 2.86Å; I378-M381 VanDerWaalsContact O-N 3.12Å; I378-H382 PolarHBondContact O-CD2 3.38Å; I378-H382 VanDerWaalsContact O-CD2 3.25Å; I378-H382 PolarHBondContact O-N 3.39Å; I378-F395 HydrophobicContact CG2-CD2 4.36Å; I378-F395 HydrophobicContact CG2-CE2 4.36Å; I378-Y401 HydrophobicContact CD1-CD2 4.1Å; I378-Y401 HydrophobicContact CD1-CE2 4.41Å; I378-Y401 HydrophobicContact CD1-CG 4.36Å; I378-Y401 HydrophobicContact CG1-CG 4.34Å; I378-Y401 HydrophobicContact CG2-CD1 3.95Å; I378-Y401 HydrophobicContact CG2-CE1 4.34Å; I378-Y401 HydrophobicContact CG2-CG 4.27Å
379	A	83.8	Confident	78.4	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.008	34%	0.343	C	S	.	.	H	α-helix	trans	-56	-45.2	176.7	0	0	0	0	0	111.9	K356 F359 L375 L376 M381 H382 E383 I390	K356-A379 HydrophobicContact CD-CB 4.48Å; K356-A379 HydrophobicContact CG-CB 3.92Å; F359-A379 HydrophobicContact CD1-CB 4.01Å; F359-A379 HydrophobicContact CE1-CB 4.34Å; L375-A379 WeakPolarHBondContact O-CB 3.49Å; L375-A379 PolarHBondContact O-N 3.05Å; L376-A379 PolarHBondContact O-N 3.22Å; A379-M381 VanDerWaalsContact C-N 3.34Å; A379-M381 PolarHBondContact O-N 3.38Å; A379-H382 PolarHBondContact O-N 2.92Å; A379-H382 VanDerWaalsContact O-N 3.12Å; A379-E383 PolarHBondContact O-N 3.47Å; A379-I390 HydrophobicContact CB-CD1 3.69Å
380	Q	84.4	Confident	78.4	Confident	106 Å²	106	63.7 Å²	63.7	50%	0.495	34%	0.335	S	S	.	.	H	α-helix	trans	-61.4	-37.6	176.5	-73.2	170.8	30.8	0	0	113.2	L376 Q377 I378 H382 E383	L376-Q380 VanDerWaalsContact O-CG 3.23Å; L376-Q380 WeakPolarHBondContact O-CG 3.36Å; L376-Q380 PolarHBondContact O-N 2.75Å; Q377-Q380 PolarHBondContact O-N 3.24Å; I378-Q380 VanDerWaalsContact C-N 3.31Å; I378-Q380 PolarHBondContact O-N 2.62Å; Q380-H382 PolarHBondContact O-N 3.17Å; Q380-E383 PolarHBondContact O-N 2.97Å
381	M	81.6	Confident	78.4	Confident	98 Å²	98	66.3 Å²	66.3	48%	0.483	35%	0.348	S	S	.	.	H	α-helix	trans	-68.9	-22	177.1	-71.2	-173.5	-73.8	0	0	113.2	Q377 I378 A379 Y401	Q377-M381 WeakPolarHBondContact O-CG 3.43Å; Q377-M381 PolarHBondContact O-N 3.38Å; Q377-M381 VanDerWaalsContact O-N 3.16Å; I378-M381 HydrophobicContact CB-CE 4.43Å; I378-M381 HydrophobicContact CG1-CE 4Å; I378-M381 PolarHBondContact O-N 2.86Å; I378-M381 VanDerWaalsContact O-N 3.12Å; A379-M381 VanDerWaalsContact C-N 3.34Å; A379-M381 PolarHBondContact O-N 3.38Å; M381-Y401 VanDerWaalsContact CE-CB 3.49Å
382	H	80.6	Confident	78.2	Confident	5 Å²	5	63.8 Å²	63.8	2%	0.023	33%	0.332	C	S	.	.	H	α-helix	trans	-89.4	-21.7	178.7	-81.3	-108.1	0	0	0	113.4	I378 A379 Q380 K384 I390 D394 Y401	I378-H382 PolarHBondContact O-CD2 3.38Å; I378-H382 VanDerWaalsContact O-CD2 3.25Å; I378-H382 PolarHBondContact O-N 3.39Å; A379-H382 PolarHBondContact O-N 2.92Å; A379-H382 VanDerWaalsContact O-N 3.12Å; Q380-H382 PolarHBondContact O-N 3.17Å; H382-K384 PolarHBondContact O-N 2.77Å; H382-I390 HydrophobicContact CB-CG1 4.41Å; H382-I390 HydrophobicContact CB-CG2 3.99Å; H382-D394 PolarHBondContact CE1-O 3.31Å; H382-Y401 AromaticContact NE2-CD1 3.53Å
383	E	78.1	Confident	78.2	Confident	61 Å²	61	64.9 Å²	64.9	29%	0.285	34%	0.335	S	S	.	.			trans	-75.6	114.8	177.9	-170.8	172.4	-165.7	0	0	110.8	A379 Q380 S385 R386 G387	A379-E383 PolarHBondContact O-N 3.47Å; Q380-E383 PolarHBondContact O-N 2.97Å; E383-S385 VanDerWaalsContact CG-O 3.23Å; E383-S385 WeakPolarHBondContact CG-O 3.47Å; E383-R386 WeakPolarHBondContact OE1-CA 3.3Å; E383-G387 PolarHBondContact OE1-N 3.4Å
384	K	67.4	Low	78.1	Confident	171 Å²	171	61.2 Å²	61.2	74%	0.743	32%	0.315	S	S	*	.	S	Bend	trans	-83.9	-25.5	-179.6	-66.9	179.7	-177.2	171.8	0	113.3	H382	H382-K384 PolarHBondContact O-N 2.77Å
385	S	64.1	Low	78.1	Confident	84 Å²	84	59.2 Å²	59.2	59%	0.587	31%	0.306	S	S	*	.	S	Bend	trans	-153.8	149.7	178.1	-174.9	0	0	0	0	109	E383 G387 S388	E383-S385 VanDerWaalsContact CG-O 3.23Å; E383-S385 WeakPolarHBondContact CG-O 3.47Å; S385-G387 PolarHBondContact O-N 3.33Å; S385-S388 VanDerWaalsContact O-CB 3.25Å; S385-S388 WeakPolarHBondContact O-CB 2.98Å; S385-S388 PolarHBondContact O-N 2.91Å
386	R	58.8	Low	78.1	Confident	247 Å²	247	59.8 Å²	59.8	93%	0.932	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	113.4	-179	-74.9	-173.6	176.3	-179	-1.2	110.4	E383	E383-R386 WeakPolarHBondContact OE1-CA 3.3Å
387	G	60.9	Low	78	Confident	51 Å²	51	62.9 Å²	62.9	53%	0.526	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.1	-5.8	179.5	0	0	0	0	0	115.8	R349 E383 S385 G389	R349-G387 PolarHBondContact NH1-O 2.95Å; E383-G387 PolarHBondContact OE1-N 3.4Å; S385-G387 PolarHBondContact O-N 3.33Å; G387-G389 PolarHBondContact O-N 3.25Å
388	S	66.6	Low	77.9	Confident	56 Å²	56	57.9 Å²	57.9	39%	0.392	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-69.3	116.7	172.4	179.7	0	0	0	0	109.2	S385	S385-S388 VanDerWaalsContact O-CB 3.25Å; S385-S388 WeakPolarHBondContact O-CB 2.98Å; S385-S388 PolarHBondContact O-N 2.91Å
389	G	71.6	Confident	77.8	Confident	16 Å²	16	61 Å²	61	17%	0.165	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-56.5	153.5	178.3	0	0	0	0	0	113.1	V354 G387 N391	V354-G389 CarbonylContact O-C 3.59Å; V354-G389 WeakPolarHBondContact O-CA 3.3Å; G387-G389 PolarHBondContact O-N 3.25Å; G389-N391 PolarHBondContact O-N 3.15Å
390	I	81.2	Confident	77.8	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	119.7	179.7	-63.2	166.3	0	0	0	108.6	S353 V354 F359 A379 H382 I392	S353-I390 VanDerWaalsContact CA-O 3.29Å; S353-I390 WeakPolarHBondContact CA-O 2.97Å; V354-I390 PolarHBondContact N-O 3.16Å; V354-I390 PolarHBondContact O-N 3.43Å; F359-I390 HydrophobicContact CB-CD1 3.71Å; F359-I390 HydrophobicContact CD1-CD1 3.85Å; F359-I390 HydrophobicContact CD2-CD1 4.28Å; F359-I390 HydrophobicContact CD2-CG2 4.18Å; F359-I390 HydrophobicContact CE2-CG2 4.27Å; F359-I390 HydrophobicContact CG-CD1 3.68Å; A379-I390 HydrophobicContact CB-CD1 3.69Å; H382-I390 HydrophobicContact CB-CG1 4.41Å; H382-I390 HydrophobicContact CB-CG2 3.99Å; I390-I392 PolarHBondContact O-N 3.47Å
391	N	84	Confident	77.7	Confident	63 Å²	63	60 Å²	60	34%	0.337	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	116.1	173.6	-170.1	-51	0	0	0	110.3	G389 N393 D394 F395	G389-N391 PolarHBondContact O-N 3.15Å; N391-N393 VanDerWaalsContact C-N 3.31Å; N391-N393 PolarHBondContact O-N 3.46Å; N391-N393 WeakPolarHBondContact OD1-CB 3.43Å; N391-N393 PolarHBondContact OD1-N 3.21Å; N391-D394 HydrophobicContact CB-CB 4.34Å; N391-D394 PolarHBondContact O-N 3.09Å; N391-D394 VanDerWaalsContact O-N 3.12Å; N391-D394 PolarHBondContact OD1-N 3.41Å; N391-F395 PolarHBondContact O-N 3.28Å
392	I	82.1	Confident	77.9	Confident	15 Å²	15	55.7 Å²	55.7	8%	0.077	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-36.7	-176.1	-53.7	159.6	0	0	0	111.3	F344 V354 I390 D394 F395 F396	F344-I392 HydrophobicContact CB-CD1 3.54Å; F344-I392 HydrophobicContact CB-CG1 4.34Å; F344-I392 HydrophobicContact CD2-CD1 4.39Å; F344-I392 HydrophobicContact CD2-CG1 4.41Å; F344-I392 HydrophobicContact CD2-CG2 3.84Å; F344-I392 HydrophobicContact CE2-CG2 4.27Å; F344-I392 HydrophobicContact CG-CD1 4.02Å; F344-I392 HydrophobicContact CG-CG1 4.29Å; V354-I392 HydrophobicContact CG2-CD1 3.69Å; V354-I392 HydrophobicContact CG2-CG1 3.75Å; I390-I392 PolarHBondContact O-N 3.47Å; I392-D394 PolarHBondContact O-N 2.96Å; I392-F395 WeakPolarHBondContact O-CB 3.5Å; I392-F395 PolarHBondContact O-N 3.29Å; I392-F395 VanDerWaalsContact O-N 3.08Å; I392-F396 HydrophobicContact CG2-CD2 3.88Å; I392-F396 HydrophobicContact CG2-CE2 3.37Å; I392-F396 HydrophobicContact CG2-CZ 4.15Å; I392-F396 WeakPolarHBondContact O-CD2 3.19Å; I392-F396 PolarHBondContact O-N 2.89Å
393	N	84.1	Confident	78.1	Confident	76 Å²	76	57.2 Å²	57.2	41%	0.406	30%	0.299	S	S	.	.	H	α-helix	trans	-67.5	-27.1	178.7	-66.2	-39.4	0	0	0	112.5	R341 N391 K397	R341-N393 PolarHBondContact NH1-OD1 3.17Å; R341-N393 PolarHBondContact NH2-OD1 3.46Å; N391-N393 VanDerWaalsContact C-N 3.31Å; N391-N393 PolarHBondContact O-N 3.46Å; N391-N393 WeakPolarHBondContact OD1-CB 3.43Å; N391-N393 PolarHBondContact OD1-N 3.21Å; N393-K397 WeakPolarHBondContact O-CE 3.43Å; N393-K397 WeakPolarHBondContact O-CG 3.47Å
394	D	83.6	Confident	78.3	Confident	33 Å²	33	62.3 Å²	62.3	18%	0.176	32%	0.32	C	S	.	.	H	α-helix	trans	-77	-29.8	173.6	-81.5	-6.7	0	0	0	111.9	H382 N391 I392 K397 K400	H382-D394 PolarHBondContact CE1-O 3.31Å; N391-D394 HydrophobicContact CB-CB 4.34Å; N391-D394 PolarHBondContact O-N 3.09Å; N391-D394 VanDerWaalsContact O-N 3.12Å; N391-D394 PolarHBondContact OD1-N 3.41Å; I392-D394 PolarHBondContact O-N 2.96Å; D394-K397 IonicContact OD1-NZ 3.91Å; D394-K397 PolarHBondContact OD1-NZ 3.03Å; D394-K397 VanDerWaalsContact OD1-NZ 3.13Å; D394-K400 WeakPolarHBondContact OD2-CE 3.42Å; D394-K400 IonicContact OD2-NZ 2.75Å; D394-K400 PolarHBondContact OD2-NZ 3.09Å
395	F	86.1	Confident	79	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-51.2	175.1	170	-110.4	0	0	0	111.6	L329 F359 L363 I378 N391 I392 K397 G398 Y401	L329-F395 HydrophobicContact CD2-CE2 4.5Å; F359-F395 HydrophobicContact CE2-CB 4.46Å; F359-F395 HydrophobicContact CE2-CD1 4.14Å; F359-F395 HydrophobicContact CE2-CD2 4.05Å; F359-F395 HydrophobicContact CE2-CE1 4.4Å; F359-F395 HydrophobicContact CE2-CE2 4.33Å; F359-F395 AromaticContact CE2-CG 3.95Å; F359-F395 HydrophobicContact CE2-CG 3.95Å; F359-F395 HydrophobicContact CE2-CZ 4.49Å; F359-F395 HydrophobicContact CZ-CD1 4.44Å; F359-F395 AromaticContact CZ-CD2 3.62Å; F359-F395 HydrophobicContact CZ-CD2 3.62Å; F359-F395 HydrophobicContact CZ-CE1 4.48Å; F359-F395 AromaticContact CZ-CE2 3.69Å; F359-F395 HydrophobicContact CZ-CE2 3.69Å; F359-F395 HydrophobicContact CZ-CG 4.01Å; F359-F395 HydrophobicContact CZ-CZ 4.13Å; L363-F395 HydrophobicContact CD1-CE2 4.46Å; L363-F395 HydrophobicContact CD1-CZ 4.01Å; L363-F395 HydrophobicContact CD2-CZ 4.49Å; I378-F395 HydrophobicContact CG2-CD2 4.36Å; I378-F395 HydrophobicContact CG2-CE2 4.36Å; N391-F395 PolarHBondContact O-N 3.28Å; I392-F395 WeakPolarHBondContact O-CB 3.5Å; I392-F395 PolarHBondContact O-N 3.29Å; I392-F395 VanDerWaalsContact O-N 3.08Å; F395-K397 PolarHBondContact O-N 3.32Å; F395-G398 PolarHBondContact O-N 2.96Å; F395-Y401 AromaticContact CD2-CE1 3.94Å; F395-Y401 HydrophobicContact CD2-CE1 3.94Å; F395-Y401 HydrophobicContact CE2-CE1 4.14Å
396	F	85.3	Confident	79.9	Confident	13 Å²	13	54.1 Å²	54.1	6%	0.057	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-23.8	178.4	-68.7	-57.5	0	0	0	113.9	S333 E337 L340 R341 I392 G398	S333-F396 VanDerWaalsContact O-CE1 3.26Å; S333-F396 WeakPolarHBondContact O-CE1 3.43Å; E337-F396 HydrophobicContact CB-CE1 4.15Å; E337-F396 HydrophobicContact CB-CZ 4.32Å; E337-F396 HydrophobicContact CG-CD1 4.33Å; E337-F396 HydrophobicContact CG-CD2 4.26Å; E337-F396 HydrophobicContact CG-CE1 4.07Å; E337-F396 HydrophobicContact CG-CE2 3.95Å; E337-F396 HydrophobicContact CG-CG 4.44Å; E337-F396 HydrophobicContact CG-CZ 3.88Å; L340-F396 HydrophobicContact CB-CE1 4.4Å; L340-F396 HydrophobicContact CB-CZ 3.95Å; L340-F396 HydrophobicContact CD1-CE1 4.04Å; L340-F396 HydrophobicContact CD1-CZ 4.4Å; R341-F396 HydrophobicContact CG-CE2 3.86Å; R341-F396 HydrophobicContact CG-CZ 4.28Å; I392-F396 HydrophobicContact CG2-CD2 3.88Å; I392-F396 HydrophobicContact CG2-CE2 3.37Å; I392-F396 HydrophobicContact CG2-CZ 4.15Å; I392-F396 WeakPolarHBondContact O-CD2 3.19Å; I392-F396 PolarHBondContact O-N 2.89Å; F396-G398 VanDerWaalsContact C-N 3.26Å; F396-G398 PolarHBondContact O-N 3.45Å
397	K	84.1	Confident	81.1	Confident	112 Å²	112	43 Å²	43	49%	0.487	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-22.3	174.1	-73.2	170.2	-163.7	159.7	0	113.1	N393 D394 F395 T399 V407	N393-K397 WeakPolarHBondContact O-CE 3.43Å; N393-K397 WeakPolarHBondContact O-CG 3.47Å; D394-K397 IonicContact OD1-NZ 3.91Å; D394-K397 PolarHBondContact OD1-NZ 3.03Å; D394-K397 VanDerWaalsContact OD1-NZ 3.13Å; F395-K397 PolarHBondContact O-N 3.32Å; K397-T399 PolarHBondContact O-N 3.47Å; K397-V407 WeakPolarHBondContact O-CG1 3.4Å
398	G	82.4	Confident	82	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.223	C	C	.	.			trans	67.2	-12.9	-179.8	0	0	0	0	0	116.6	H330 F395 F396 K400 Y401 L402	H330-G398 VanDerWaalsContact CD2-CA 3.49Å; H330-G398 WeakPolarHBondContact CD2-CA 3.46Å; F395-G398 PolarHBondContact O-N 2.96Å; F396-G398 VanDerWaalsContact C-N 3.26Å; F396-G398 PolarHBondContact O-N 3.45Å; G398-K400 PolarHBondContact O-N 3.02Å; G398-K400 VanDerWaalsContact O-N 3.08Å; G398-Y401 PolarHBondContact O-N 3.26Å; G398-L402 WeakPolarHBondContact O-CB 2.87Å; G398-L402 PolarHBondContact O-N 3.11Å
399	T	83.4	Confident	82.4	Confident	69 Å²	69	42.8 Å²	42.8	42%	0.423	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-11.8	-167.1	55.7	0	0	0	0	115.8	K397 L402 K404	K397-T399 PolarHBondContact O-N 3.47Å; T399-L402 CarbonylContact C-O 3.59Å; T399-K404 HydrophobicContact CG2-CG 4.3Å
400	K	82.6	Confident	82.7	Confident	68 Å²	68	43.5 Å²	43.5	30%	0.296	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-33.5	178.6	-67.7	-169.8	-169.4	162.7	0	112.5	D394 G398	D394-K400 WeakPolarHBondContact OD2-CE 3.42Å; D394-K400 IonicContact OD2-NZ 2.75Å; D394-K400 PolarHBondContact OD2-NZ 3.09Å; G398-K400 PolarHBondContact O-N 3.02Å; G398-K400 VanDerWaalsContact O-N 3.08Å
401	Y	83.9	Confident	82.5	Confident	17 Å²	17	44.3 Å²	44.3	7%	0.067	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-11.4	-179.1	65	-91.1	0	0	0	113.7	A326 H330 I378 M381 H382 F395 G398	A326-Y401 HydrophobicContact CB-CD2 4.47Å; H330-Y401 HydrophobicContact CB-CE2 4.18Å; H330-Y401 WeakPolarHBondContact CB-OH 3.42Å; H330-Y401 PolarHBondContact CD2-OH 3.16Å; I378-Y401 HydrophobicContact CD1-CD2 4.1Å; I378-Y401 HydrophobicContact CD1-CE2 4.41Å; I378-Y401 HydrophobicContact CD1-CG 4.36Å; I378-Y401 HydrophobicContact CG1-CG 4.34Å; I378-Y401 HydrophobicContact CG2-CD1 3.95Å; I378-Y401 HydrophobicContact CG2-CE1 4.34Å; I378-Y401 HydrophobicContact CG2-CG 4.27Å; M381-Y401 VanDerWaalsContact CE-CB 3.49Å; H382-Y401 AromaticContact NE2-CD1 3.53Å; F395-Y401 AromaticContact CD2-CE1 3.94Å; F395-Y401 HydrophobicContact CD2-CE1 3.94Å; F395-Y401 HydrophobicContact CE2-CE1 4.14Å; G398-Y401 PolarHBondContact O-N 3.26Å
402	L	84.4	Confident	81.5	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.042	25%	0.247	C	C	.	.	S	Bend	trans	-122.6	150.5	172.2	-65.6	173.2	0	0	0	111.8	N322 A326 L327 H330 G398 T399 V407	N322-L402 HydrophobicContact CB-CD2 4.1Å; A326-L402 HydrophobicContact CB-CD2 4.11Å; L327-L402 HydrophobicContact CD2-CD1 3.86Å; L327-L402 HydrophobicContact CD2-CD2 3.62Å; L327-L402 HydrophobicContact CD2-CG 4.32Å; L327-L402 HydrophobicContact CG-CD2 4.24Å; H330-L402 HydrophobicContact CB-CD1 3.49Å; H330-L402 VanDerWaalsContact CB-CD1 3.49Å; G398-L402 WeakPolarHBondContact O-CB 2.87Å; G398-L402 PolarHBondContact O-N 3.11Å; T399-L402 CarbonylContact C-O 3.59Å; L402-V407 HydrophobicContact CB-CG2 4.06Å
403	S	84.4	Confident	80.2	Confident	37 Å²	37	48.3 Å²	48.3	26%	0.259	28%	0.283	S	S	.	.			trans	-69.4	141.4	172.4	63.7	0	0	0	0	111.7	N322 S405 F406	N322-S403 VanDerWaalsContact CG-OG 3.29Å; N322-S403 PolarHBondContact ND2-OG 3.08Å; N322-S403 WeakPolarHBondContact OD1-CB 3.48Å; N322-S403 PolarHBondContact OD1-N 3.27Å; N322-S403 PolarHBondContact OD1-OG 2.99Å; S403-S405 PolarHBondContact O-N 3.47Å; S403-F406 PolarHBondContact O-N 3.39Å; S403-F406 WeakPolarHBondContact OG-CD2 3.48Å
404	K	82.3	Confident	78.7	Confident	168 Å²	168	53.3 Å²	53.3	73%	0.73	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-20.2	-175.1	-65.5	-179.7	-179.4	177	0	115	T399 S410	T399-K404 HydrophobicContact CG2-CG 4.3Å; K404-S410 WeakPolarHBondContact O-CB 3.15Å
405	S	82.3	Confident	76.8	Confident	60 Å²	60	61.8 Å²	61.8	42%	0.42	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.3	178.8	54.7	0	0	0	0	114.8	Q272 S403 S410	Q272-S405 PolarHBondContact NE2-O 3.1Å; Q272-S405 PolarHBondContact OE1-O 3.01Å; S403-S405 PolarHBondContact O-N 3.47Å; S405-S410 PolarHBondContact O-OG 2.97Å; S405-S410 VanDerWaalsContact O-OG 3.07Å
406	F	83.1	Confident	74.6	Confident	23 Å²	23	71.2 Å²	71.2	10%	0.101	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-15.2	-177.4	-74.3	-107.9	0	0	0	113.1	Q272 R273 N322 L327 S403	Q272-F406 HydrophobicContact CB-CD1 3.68Å; Q272-F406 HydrophobicContact CB-CE1 3.63Å; Q272-F406 HydrophobicContact CG-CD1 3.79Å; Q272-F406 HydrophobicContact CG-CE1 3.55Å; Q272-F406 HydrophobicContact CG-CG 4.45Å; Q272-F406 HydrophobicContact CG-CZ 4.05Å; R273-F406 PolarHBondContact NH1-O 3.05Å; R273-F406 PolarHBondContact NH2-O 3.07Å; N322-F406 HydrophobicContact CB-CD1 4.14Å; N322-F406 HydrophobicContact CB-CE1 4.42Å; N322-F406 HydrophobicContact CB-CG 4.32Å; N322-F406 WeakPolarHBondContact ND2-CD2 3.44Å; N322-F406 WeakPolarHBondContact ND2-CE2 3.39Å; L327-F406 HydrophobicContact CD1-CD1 4.1Å; L327-F406 HydrophobicContact CD2-CB 3.81Å; L327-F406 HydrophobicContact CD2-CD1 4.12Å; L327-F406 HydrophobicContact CD2-CG 4.4Å; S403-F406 PolarHBondContact O-N 3.39Å; S403-F406 WeakPolarHBondContact OG-CD2 3.48Å
407	V	84.9	Confident	72.3	Confident	14 Å²	14	80.1 Å²	80.1	9%	0.085	42%	0.417	C	S	.	.	S	Bend	trans	-68.1	143.9	172.2	174.1	0	0	0	0	110.3	K397 L402 G409 S410	K397-V407 WeakPolarHBondContact O-CG1 3.4Å; L402-V407 HydrophobicContact CB-CG2 4.06Å; V407-G409 PolarHBondContact O-N 2.96Å; V407-S410 VanDerWaalsContact O-CB 3.25Å; V407-S410 WeakPolarHBondContact O-CB 3.39Å; V407-S410 PolarHBondContact O-N 3.46Å; V407-S410 PolarHBondContact O-OG 3.01Å
408	L	80.4	Confident	69.9	Low	27 Å²	27	84.6 Å²	84.6	14%	0.141	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-57	-33.9	-178.4	-67.6	-177.3	0	0	0	113.3	K235 Y269 D331 I334 S410 F411	K235-L408 HydrophobicContact CD-CD1 4.47Å; K235-L408 HydrophobicContact CD-CD2 4.15Å; K235-L408 HydrophobicContact CG-CD2 4.22Å; Y269-L408 HydrophobicContact CE2-CD2 3.91Å; D331-L408 WeakPolarHBondContact OD1-CG 3.47Å; I334-L408 HydrophobicContact CB-CD1 4.33Å; I334-L408 HydrophobicContact CD1-CB 4.3Å; I334-L408 HydrophobicContact CD1-CD1 3.73Å; I334-L408 HydrophobicContact CD1-CG 4.23Å; I334-L408 HydrophobicContact CG2-CD1 4.15Å; L408-S410 PolarHBondContact O-N 2.98Å; L408-F411 WeakPolarHBondContact O-CD2 3.41Å; L408-F411 PolarHBondContact O-N 3.33Å
409	G	73.1	Confident	67.4	Low	76 Å²	76	89.7 Å²	89.7	78%	0.784	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-62.9	-7	174.6	0	0	0	0	0	115.5	V407	V407-G409 PolarHBondContact O-N 2.96Å
410	S	78.2	Confident	65.4	Low	30 Å²	30	94.1 Å²	94.1	21%	0.21	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-86.7	-5.8	173.9	79.9	0	0	0	0	114.2	K268 K404 S405 V407 L408	K268-S410 PolarHBondContact NZ-O 3.01Å; K268-S410 VanDerWaalsContact NZ-O 3.08Å; K268-S410 PolarHBondContact NZ-OG 3.48Å; K404-S410 WeakPolarHBondContact O-CB 3.15Å; S405-S410 PolarHBondContact O-OG 2.97Å; S405-S410 VanDerWaalsContact O-OG 3.07Å; V407-S410 VanDerWaalsContact O-CB 3.25Å; V407-S410 WeakPolarHBondContact O-CB 3.39Å; V407-S410 PolarHBondContact O-N 3.46Å; V407-S410 PolarHBondContact O-OG 3.01Å; L408-S410 PolarHBondContact O-N 2.98Å
411	F	78.2	Confident	63	Low	21 Å²	21	96.1 Å²	96.1	9%	0.092	51%	0.514	C	S	.	.	S	Bend	trans	-102.8	151.7	179	-62.4	-91.9	0	0	0	110.4	F231 K268 Y269 Q272 L408	F231-F411 HydrophobicContact CE1-CB 3.68Å; F231-F411 HydrophobicContact CE1-CG 4.28Å; F231-F411 HydrophobicContact CE2-CB 4.5Å; F231-F411 HydrophobicContact CE2-CD1 4.01Å; F231-F411 HydrophobicContact CE2-CE1 4.44Å; F231-F411 HydrophobicContact CE2-CG 4.25Å; F231-F411 HydrophobicContact CZ-CB 3.42Å; F231-F411 VanDerWaalsContact CZ-CB 3.42Å; F231-F411 AromaticContact CZ-CD1 3.69Å; F231-F411 HydrophobicContact CZ-CD1 3.69Å; F231-F411 HydrophobicContact CZ-CD2 4.16Å; F231-F411 HydrophobicContact CZ-CE1 4.46Å; F231-F411 AromaticContact CZ-CG 3.5Å; F231-F411 HydrophobicContact CZ-CG 3.5Å; K268-F411 HydrophobicContact CB-CE1 4.07Å; K268-F411 HydrophobicContact CD-CD1 4.06Å; K268-F411 HydrophobicContact CD-CE1 3.63Å; K268-F411 HydrophobicContact CD-CZ 4.33Å; K268-F411 HydrophobicContact CG-CE1 3.72Å; K268-F411 HydrophobicContact CG-CZ 4.31Å; Y269-F411 HydrophobicContact CD2-CE1 4.14Å; Y269-F411 HydrophobicContact CD2-CE2 4.11Å; Y269-F411 AromaticContact CD2-CZ 3.76Å; Y269-F411 HydrophobicContact CD2-CZ 3.76Å; Y269-F411 HydrophobicContact CG-CE1 4.48Å; Y269-F411 HydrophobicContact CG-CZ 4.44Å; Q272-F411 VanDerWaalsContact OE1-CZ 3.25Å; L408-F411 WeakPolarHBondContact O-CD2 3.41Å; L408-F411 PolarHBondContact O-N 3.33Å
412	G	62.7	Low	60.5	Low	32 Å²	32	106.6 Å²	106.6	33%	0.33	55%	0.554	S	S	.	*	S	Bend	trans	99.8	171.2	-176.2	0	0	0	0	0	114.3	K414	G412-K414 PolarHBondContact O-N 2.75Å
413	P	55.5	Low	58.1	Low	130 Å²	130	116 Å²	116	84%	0.844	59%	0.594	S	S	*	*			trans	-64.8	109.2	-173.7	24.7	-32.3	0	0	0	109.7	K415	P413-K415 PolarHBondContact O-N 2.6Å
414	K	52.5	Low	56	Low	182 Å²	182	119.9 Å²	119.9	79%	0.791	62%	0.619	S	S	*	*			trans	-53.4	112.6	170	-67.9	-174.4	179.3	-176.5	0	107.5	G412 K416	G412-K414 PolarHBondContact O-N 2.75Å; K414-K416 VanDerWaalsContact C-N 3.32Å; K414-K416 PolarHBondContact O-N 2.83Å
415	K	42.8	Very low	53.9	Low	210 Å²	210	121.9 Å²	121.9	91%	0.913	63%	0.628	S	S	*	*			trans	-53.3	101.7	169.1	-73.5	-174.9	179.6	179	0	106.7	P413 K417	P413-K415 PolarHBondContact O-N 2.6Å; K415-K417 PolarHBondContact O-N 3.43Å
416	K	39.8	Very low	51.6	Low	199 Å²	199	129 Å²	129	87%	0.865	65%	0.651	S	S	*	*			trans	-60.8	109.8	176	-81.4	-178.5	177.9	173.9	0	106	K414 K418	K414-K416 VanDerWaalsContact C-N 3.32Å; K414-K416 PolarHBondContact O-N 2.83Å; K416-K418 PolarHBondContact O-N 3.38Å
417	K	36.7	Very low	49.3	Very low	200 Å²	200	131 Å²	131	87%	0.87	68%	0.678	S	S	*	*			trans	-51.7	116.8	159.3	-87.5	-175	172.3	-177.7	0	106.1	K415 S419	K415-K417 PolarHBondContact O-N 3.43Å; K417-S419 VanDerWaalsContact C-N 3.33Å; K417-S419 PolarHBondContact O-N 3.15Å
418	K	33.7	Very low	47	Very low	205 Å²	205	140.2 Å²	140.2	89%	0.891	72%	0.717	S	S	*	*			trans	-59.1	96	174.6	-77.1	179.4	176	175.8	0	108.1	K416	K416-K418 PolarHBondContact O-N 3.38Å
419	S	31.3	Very low	44.8	Very low	108 Å²	108	148 Å²	148	76%	0.755	75%	0.75	S	S	*	*			trans	-83.8	114.3	162.5	59.6	0	0	0	0	107.5	K417	K417-S419 VanDerWaalsContact C-N 3.33Å; K417-S419 PolarHBondContact O-N 3.15Å
420	L	39.9	Very low	43	Very low	161 Å²	161	153.2 Å²	153.2	84%	0.843	75%	0.752	S	S	*	*			trans	-57.5	153.3	166.9	-92.9	88.4	0	0	0	111.3
421	S	32.2	Very low	40.8	Very low	110 Å²	110	158.7 Å²	158.7	77%	0.769	78%	0.778	S	S	*	*			trans	88.3	127.3	174.3	83.8	0	0	0	0	114.6
422	R	33.1	Very low	39	Very low	238 Å²	238	162.6 Å²	162.6	90%	0.898	81%	0.805	S	S	*	*			cis	-143.2	145.1	24	-80.5	170.6	152.4	160.3	-7.2	110.6
423	K	33.8	Very low	38	Very low	205 Å²	205	168.9 Å²	168.9	89%	0.891	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-67.9	135.7	171.4	-70.9	-179.6	175.4	177.6	0	110.7
424	P	38.6	Very low	37.3	Very low	119 Å²	119	167 Å²	167	77%	0.773	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79.4	143.6	168	31.8	-30.3	0	0	0	110.8	K426	P424-K426 PolarHBondContact O-N 3.04Å
425	K	38.4	Very low	37.1	Very low	210 Å²	210	163.5 Å²	163.5	91%	0.913	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-64.1	120.1	172.9	-72.5	177.5	174.6	179	0	109.1	G427	K425-G427 PolarHBondContact O-N 3.12Å
426	K	35.7	Very low	37.6	Very low	209 Å²	209	157.4 Å²	157.4	91%	0.909	80%	0.795	S	S	*	*			trans	-71.9	112.7	171.2	-76.1	-176.3	173.7	-175.7	0	109.1	P424	P424-K426 PolarHBondContact O-N 3.04Å
427	G	33.5	Very low	38.4	Very low	66 Å²	66	151.8 Å²	151.8	68%	0.68	78%	0.778	S	S	*	*			trans	-66.3	147.8	157.5	0	0	0	0	0	109.8	K425 F429	K425-G427 PolarHBondContact O-N 3.12Å; G427-F429 PolarHBondContact O-N 3.28Å
428	K	37.8	Very low	39.6	Very low	206 Å²	206	143.8 Å²	143.8	90%	0.896	74%	0.744	S	S	*	*			trans	-62.7	106.5	173.8	-86.5	178.9	174.1	178.2	0	109.1
429	F	34.2	Very low	40.9	Very low	191 Å²	191	138.1 Å²	138.1	84%	0.838	73%	0.728	S	S	*	*			trans	-84.9	115.9	167.5	-144	-94.8	0	0	0	106.8	G427 L431	G427-F429 PolarHBondContact O-N 3.28Å; F429-L431 PolarHBondContact O-N 3.36Å
430	F	35	Very low	42.2	Very low	185 Å²	185	140.4 Å²	140.4	81%	0.811	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-76.5	117.8	163.7	-89.6	-90.1	0	0	0	106.8	P432	F430-P432 WeakPolarHBondContact O-CD 3.37Å
431	L	32.5	Very low	43.1	Very low	145 Å²	145	140 Å²	140	76%	0.759	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-59.1	123.8	168.9	-86.4	134.1	0	0	0	107.6	F429 L433	F429-L431 PolarHBondContact O-N 3.36Å; L431-L433 PolarHBondContact O-N 3.35Å
432	P	40.1	Very low	44.6	Very low	104 Å²	104	137.9 Å²	137.9	68%	0.675	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-56.6	127.2	159	25.6	-29.4	0	0	0	105.7	F430 P434	F430-P432 WeakPolarHBondContact O-CD 3.37Å; P432-P434 WeakPolarHBondContact O-CD 3.48Å
433	L	40.2	Very low	46.2	Very low	163 Å²	163	127.4 Å²	127.4	85%	0.853	68%	0.676	S	S	*	*			trans	-46.1	112.4	178.6	-76.9	159.5	0	0	0	107.7	L431 V435	L431-L433 PolarHBondContact O-N 3.35Å; L433-V435 PolarHBondContact O-N 3.17Å
434	P	42.2	Very low	47.6	Very low	90 Å²	90	121.3 Å²	121.3	58%	0.584	66%	0.657	S	S	*	*			trans	-61.4	127.7	173.4	24.3	-29.6	0	0	0	105.8	P432 C436	P432-P434 WeakPolarHBondContact O-CD 3.48Å; P434-C436 VanDerWaalsContact C-N 3.34Å; P434-C436 PolarHBondContact O-N 3.43Å
435	V	48.3	Very low	49	Very low	109 Å²	109	124.4 Å²	124.4	66%	0.661	65%	0.654	S	S	*	*			trans	-56.1	108.8	165.5	-178.7	0	0	0	0	104.7	L433 T437	L433-V435 PolarHBondContact O-N 3.17Å; V435-T437 HydrophobicContact CG1-CG2 3.94Å; V435-T437 PolarHBondContact O-N 3.35Å
436	C	53.1	Low	50.4	Low	83 Å²	83	116.3 Å²	116.3	56%	0.561	62%	0.617	S	S	*	*			trans	-71.7	73.5	179.1	-65.8	0	0	0	0	108.3	P434 N556	P434-C436 VanDerWaalsContact C-N 3.34Å; P434-C436 PolarHBondContact O-N 3.43Å; C436-N556 PolarHBondContact O-ND2 3.12Å
437	T	57.1	Low	51.7	Low	81 Å²	81	111.5 Å²	111.5	50%	0.497	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-73.4	133.9	163.9	50.2	0	0	0	0	107.8	V435 P439 S523	V435-T437 HydrophobicContact CG1-CG2 3.94Å; V435-T437 PolarHBondContact O-N 3.35Å; T437-P439 WeakPolarHBondContact O-CD 3.49Å; T437-S523 WeakPolarHBondContact CA-O 3.41Å
438	I	60.5	Low	53.1	Low	31 Å²	31	115.3 Å²	115.3	16%	0.159	61%	0.612	C	S	.	*	P	Polyproline II helix	trans	-64.4	122.2	171	-58.2	173.7	0	0	0	106.4	E440 A442 F443 S523 Y525	I438-E440 PolarHBondContact O-N 3.09Å; I438-A442 HydrophobicContact CG2-CB 3.87Å; I438-F443 HydrophobicContact CB-CE2 3.79Å; I438-F443 HydrophobicContact CB-CZ 3.73Å; I438-F443 HydrophobicContact CD1-CE1 4.01Å; I438-F443 HydrophobicContact CD1-CZ 3.82Å; I438-F443 HydrophobicContact CG1-CZ 4.33Å; I438-F443 HydrophobicContact CG2-CD2 4.07Å; I438-F443 HydrophobicContact CG2-CE1 4.34Å; I438-F443 HydrophobicContact CG2-CE2 3.64Å; I438-F443 HydrophobicContact CG2-CZ 3.8Å; I438-S523 PolarHBondContact N-O 3.26Å; I438-Y525 HydrophobicContact CD1-CD1 4.46Å; I438-Y525 HydrophobicContact CD1-CD2 4.01Å; I438-Y525 HydrophobicContact CD1-CE1 3.99Å; I438-Y525 HydrophobicContact CD1-CE2 3.57Å; I438-Y525 HydrophobicContact CD1-CG 4.48Å; I438-Y525 HydrophobicContact CG1-CD2 4.03Å; I438-Y525 HydrophobicContact CG1-CE1 4.47Å; I438-Y525 HydrophobicContact CG1-CE2 3.28Å
439	P	60.7	Low	54.4	Low	87 Å²	87	108.7 Å²	108.7	57%	0.565	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-61.7	137.9	174.8	23.6	-30.3	0	0	0	109.2	T437 N441 A442	T437-P439 WeakPolarHBondContact O-CD 3.49Å; P439-N441 PolarHBondContact O-N 3.01Å; P439-A442 HydrophobicContact CG-CB 4.23Å; P439-A442 WeakPolarHBondContact O-CB 3.41Å; P439-A442 PolarHBondContact O-N 3.46Å
440	E	58.6	Low	56	Low	155 Å²	155	100.7 Å²	100.7	72%	0.724	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-51.9	-27.4	-174	-65.6	-179.1	168.2	0	0	113.7	I438 A442	I438-E440 PolarHBondContact O-N 3.09Å; E440-A442 VanDerWaalsContact C-N 3.29Å; E440-A442 PolarHBondContact O-N 3.38Å
441	N	60.6	Low	57.9	Low	152 Å²	152	93.5 Å²	93.5	81%	0.813	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-71.7	-15.8	179.1	-60.8	-16	0	0	0	114.7	P439	P439-N441 PolarHBondContact O-N 3.01Å
442	A	63.5	Low	59.8	Low	67 Å²	67	87.5 Å²	87.5	55%	0.554	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-92.9	-4.3	-177.5	0	0	0	0	0	113.4	I438 P439 E440	I438-A442 HydrophobicContact CG2-CB 3.87Å; P439-A442 HydrophobicContact CG-CB 4.23Å; P439-A442 WeakPolarHBondContact O-CB 3.41Å; P439-A442 PolarHBondContact O-N 3.46Å; E440-A442 VanDerWaalsContact C-N 3.29Å; E440-A442 PolarHBondContact O-N 3.38Å
443	F	65.7	Low	61.3	Low	17 Å²	17	85.7 Å²	85.7	8%	0.075	50%	0.496	C	S	.	.	S	Bend	trans	-79.2	134.1	178	-76.4	-76.9	0	0	0	111.8	I438 R445 P452 Y454 M520 K521	I438-F443 HydrophobicContact CB-CE2 3.79Å; I438-F443 HydrophobicContact CB-CZ 3.73Å; I438-F443 HydrophobicContact CD1-CE1 4.01Å; I438-F443 HydrophobicContact CD1-CZ 3.82Å; I438-F443 HydrophobicContact CG1-CZ 4.33Å; I438-F443 HydrophobicContact CG2-CD2 4.07Å; I438-F443 HydrophobicContact CG2-CE1 4.34Å; I438-F443 HydrophobicContact CG2-CE2 3.64Å; I438-F443 HydrophobicContact CG2-CZ 3.8Å; F443-R445 PolarHBondContact O-N 3.35Å; F443-P452 HydrophobicContact CB-CB 4.27Å; F443-Y454 HydrophobicContact CB-CD1 4.49Å; F443-Y454 HydrophobicContact CB-CE1 3.98Å; F443-Y454 AromaticContact CD1-CD1 3.87Å; F443-Y454 HydrophobicContact CD1-CD1 3.87Å; F443-Y454 AromaticContact CD1-CE1 3.94Å; F443-Y454 HydrophobicContact CD1-CE1 3.94Å; F443-Y454 AromaticContact CD2-CE1 3.81Å; F443-Y454 HydrophobicContact CD2-CE1 3.81Å; F443-Y454 HydrophobicContact CE1-CD1 4.2Å; F443-Y454 HydrophobicContact CE1-CE1 4.37Å; F443-Y454 HydrophobicContact CE2-CE1 4.25Å; F443-Y454 HydrophobicContact CG-CD1 4.06Å; F443-Y454 AromaticContact CG-CE1 3.63Å; F443-Y454 HydrophobicContact CG-CE1 3.63Å; F443-M520 HydrophobicContact CD1-CE 4.07Å; F443-M520 HydrophobicContact CE1-CE 4.16Å; F443-K521 WeakPolarHBondContact CE1-O 3.36Å
444	P	64.4	Low	62.9	Low	77 Å²	77	79.1 Å²	79.1	50%	0.5	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-62.7	124.1	174.6	24.3	-30.9	0	0	0	109.9	Y453	P444-Y453 WeakPolarHBondContact O-CD2 3.37Å
445	R	66.5	Low	64.6	Low	185 Å²	185	77.8 Å²	77.8	70%	0.698	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-80.8	156.6	173.3	-66.3	-173.2	179.6	-153.2	-0.6	110.3	F443	F443-R445 PolarHBondContact O-N 3.35Å
446	R	69	Low	65.9	Low	39 Å²	39	72.8 Å²	72.8	15%	0.147	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-65.4	146.8	174.3	-68.9	173.1	-172.1	-128.8	4.6	110.3	D448 G449 P451 Y453 M455 I516	R446-D448 PolarHBondContact O-N 3.03Å; R446-G449 PolarHBondContact O-N 2.96Å; R446-G449 VanDerWaalsContact O-N 3.15Å; R446-P451 WeakPolarHBondContact CD-O 3.41Å; R446-P451 VanDerWaalsContact CG-O 3.25Å; R446-P451 WeakPolarHBondContact CG-O 3.48Å; R446-P451 PolarHBondContact NE-O 2.97Å; R446-Y453 HydrophobicContact CG-CD1 4.19Å; R446-Y453 HydrophobicContact CG-CD2 4.44Å; R446-Y453 HydrophobicContact CG-CE1 4.04Å; R446-Y453 HydrophobicContact CG-CE2 4.29Å; R446-Y453 HydrophobicContact CG-CG 4.4Å; R446-M455 PolarHBondContact NH2-O 2.72Å; R446-I516 VanDerWaalsContact NH2-CD1 3.34Å
447	P	62.2	Low	67	Low	108 Å²	108	72.1 Å²	72.1	70%	0.701	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.1	177.8	23.9	-33.3	0	0	0	112.9	G449 Y453	P447-G449 PolarHBondContact O-N 2.57Å; P447-Y453 WeakPolarHBondContact CD-OH 3.45Å
448	D	63.3	Low	67.5	Low	146 Å²	146	69.3 Å²	69.3	78%	0.781	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	5.2	178.9	-53.9	-41.9	0	0	0	113.9	R446 G450	R446-D448 PolarHBondContact O-N 3.03Å; D448-G450 PolarHBondContact O-N 2.93Å
449	G	65.4	Low	67.8	Low	67 Å²	67	73.6 Å²	73.6	69%	0.691	40%	0.403	S	S	*	.	S	Bend	trans	75.3	5.3	-174.6	0	0	0	0	0	114.4	R446 P447	R446-G449 PolarHBondContact O-N 2.96Å; R446-G449 VanDerWaalsContact O-N 3.15Å; P447-G449 PolarHBondContact O-N 2.57Å
450	G	67.8	Low	67.6	Low	24 Å²	24	75.7 Å²	75.7	25%	0.247	41%	0.405	C	S	.	.			trans	-76.2	177.5	178	0	0	0	0	0	114.7	D448	D448-G450 PolarHBondContact O-N 2.93Å
451	P	73.6	Confident	67.4	Low	34 Å²	34	72.5 Å²	72.5	22%	0.221	39%	0.392	C	S	.	.	S	Bend	trans	-62	160.7	-178.7	25.6	-32.8	0	0	0	112.2	R446 M455 F493	R446-P451 WeakPolarHBondContact CD-O 3.41Å; R446-P451 VanDerWaalsContact CG-O 3.25Å; R446-P451 WeakPolarHBondContact CG-O 3.48Å; R446-P451 PolarHBondContact NE-O 2.97Å; P451-M455 HydrophobicContact CB-CB 4.07Å; P451-M455 HydrophobicContact CB-SD 3.92Å; P451-M455 HydrophobicContact CG-CB 4.45Å; P451-F493 HydrophobicContact CG-CB 4.37Å; P451-F493 HydrophobicContact CG-CD1 3.35Å; P451-F493 HydrophobicContact CG-CD2 3.86Å; P451-F493 HydrophobicContact CG-CE1 3.37Å; P451-F493 HydrophobicContact CG-CE2 3.9Å; P451-F493 HydrophobicContact CG-CG 3.59Å; P451-F493 HydrophobicContact CG-CZ 3.67Å
452	P	73.9	Confident	67	Low	19 Å²	19	68.3 Å²	68.3	12%	0.123	37%	0.373	C	S	.	.			trans	-53.4	156.8	-178.8	-26.8	35.7	0	0	0	113.9	F443 Y454 M455	F443-P452 HydrophobicContact CB-CB 4.27Å; P452-Y454 HydrophobicContact CB-CD1 3.56Å; P452-Y454 HydrophobicContact CB-CE1 3.23Å; P452-Y454 HydrophobicContact CB-CG 4.45Å; P452-Y454 HydrophobicContact CG-CE1 3.72Å; P452-Y454 PolarHBondContact O-N 2.97Å; P452-Y454 VanDerWaalsContact O-N 3.09Å; P452-M455 WeakPolarHBondContact O-CB 3.44Å; P452-M455 PolarHBondContact O-N 2.94Å
453	Y	71.6	Confident	66.4	Low	65 Å²	65	66.7 Å²	66.7	26%	0.255	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.9	-176.1	-76.3	-81.8	0	0	0	115.3	P444 R446 P447 M455 I516	P444-Y453 WeakPolarHBondContact O-CD2 3.37Å; R446-Y453 HydrophobicContact CG-CD1 4.19Å; R446-Y453 HydrophobicContact CG-CD2 4.44Å; R446-Y453 HydrophobicContact CG-CE1 4.04Å; R446-Y453 HydrophobicContact CG-CE2 4.29Å; R446-Y453 HydrophobicContact CG-CG 4.4Å; P447-Y453 WeakPolarHBondContact CD-OH 3.45Å; Y453-M455 PolarHBondContact O-N 2.77Å; Y453-I516 HydrophobicContact CD1-CG1 4.37Å
454	Y	72.3	Confident	65.6	Low	25 Å²	25	70 Å²	70	10%	0.098	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-13.2	175.9	67.3	-97.6	0	0	0	113.5	F443 P452 N495 I496	F443-Y454 HydrophobicContact CB-CD1 4.49Å; F443-Y454 HydrophobicContact CB-CE1 3.98Å; F443-Y454 AromaticContact CD1-CD1 3.87Å; F443-Y454 HydrophobicContact CD1-CD1 3.87Å; F443-Y454 AromaticContact CD1-CE1 3.94Å; F443-Y454 HydrophobicContact CD1-CE1 3.94Å; F443-Y454 AromaticContact CD2-CE1 3.81Å; F443-Y454 HydrophobicContact CD2-CE1 3.81Å; F443-Y454 HydrophobicContact CE1-CD1 4.2Å; F443-Y454 HydrophobicContact CE1-CE1 4.37Å; F443-Y454 HydrophobicContact CE2-CE1 4.25Å; F443-Y454 HydrophobicContact CG-CD1 4.06Å; F443-Y454 AromaticContact CG-CE1 3.63Å; F443-Y454 HydrophobicContact CG-CE1 3.63Å; P452-Y454 HydrophobicContact CB-CD1 3.56Å; P452-Y454 HydrophobicContact CB-CE1 3.23Å; P452-Y454 HydrophobicContact CB-CG 4.45Å; P452-Y454 HydrophobicContact CG-CE1 3.72Å; P452-Y454 PolarHBondContact O-N 2.97Å; P452-Y454 VanDerWaalsContact O-N 3.09Å; Y454-N495 WeakPolarHBondContact O-CA 3.27Å; Y454-I496 PolarHBondContact O-N 3.03Å
455	M	77.8	Confident	64.9	Low	63 Å²	63	71.7 Å²	71.7	31%	0.31	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.4	173.6	-77.3	-171.8	175.8	0	0	109.7	R446 P451 P452 Y453 F493 A494	R446-M455 PolarHBondContact NH2-O 2.72Å; P451-M455 HydrophobicContact CB-CB 4.07Å; P451-M455 HydrophobicContact CB-SD 3.92Å; P451-M455 HydrophobicContact CG-CB 4.45Å; P452-M455 WeakPolarHBondContact O-CB 3.44Å; P452-M455 PolarHBondContact O-N 2.94Å; Y453-M455 PolarHBondContact O-N 2.77Å; M455-F493 HydrophobicContact CB-CB 4.15Å; M455-A494 CarbonylContact C-O 3.57Å; M455-A494 WeakPolarHBondContact CA-O 3.35Å
456	I	76.8	Confident	64.2	Low	4 Å²	4	67.7 Å²	67.7	2%	0.021	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	143.1	-177.1	-64.6	169.6	0	0	0	109.5	T458 F493 A494 I496 I499 L508 A511 I516	I456-T458 PolarHBondContact O-N 3.19Å; I456-F493 CarbonylContact O-C 3.59Å; I456-F493 VanDerWaalsContact O-CA 3.32Å; I456-F493 WeakPolarHBondContact O-CA 3.33Å; I456-A494 PolarHBondContact N-O 3.23Å; I456-A494 PolarHBondContact O-N 3.32Å; I456-I496 HydrophobicContact CD1-CB 3.49Å; I456-I496 VanDerWaalsContact CD1-CB 3.49Å; I456-I496 HydrophobicContact CD1-CD1 3.63Å; I456-I496 HydrophobicContact CD1-CG1 3.36Å; I456-I496 HydrophobicContact CG1-CB 4.26Å; I456-I499 HydrophobicContact CB-CD1 3.81Å; I456-I499 HydrophobicContact CD1-CD1 4.29Å; I456-I499 HydrophobicContact CG2-CD1 4.15Å; I456-L508 HydrophobicContact CD1-CD2 4.36Å; I456-A511 HydrophobicContact CB-CB 4.45Å; I456-A511 HydrophobicContact CD1-CB 3.49Å; I456-A511 VanDerWaalsContact CD1-CB 3.49Å; I456-A511 HydrophobicContact CG1-CB 3.92Å; I456-A511 HydrophobicContact CG2-CB 3.65Å; I456-I516 HydrophobicContact CG1-CD1 3.83Å
457	E	75.6	Confident	63.4	Low	69 Å²	69	72.5 Å²	72.5	32%	0.322	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	117.8	171.4	-66.4	-172.6	177.3	0	0	110.2	K491 V492 F493	E457-K491 IonicContact OE1-NZ 3.7Å; E457-K491 PolarHBondContact OE1-NZ 2.94Å; E457-K491 IonicContact OE2-NZ 3.83Å; E457-K491 PolarHBondContact OE2-NZ 2.98Å; E457-V492 WeakPolarHBondContact CA-O 3.36Å; E457-F493 HydrophobicContact CB-CE1 4.45Å; E457-F493 HydrophobicContact CG-CD1 3.91Å; E457-F493 HydrophobicContact CG-CE1 3.31Å; E457-F493 HydrophobicContact CG-CZ 3.84Å
458	T	68.6	Low	63.1	Low	21 Å²	21	70.5 Å²	70.5	13%	0.129	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152.4	174.3	53.9	0	0	0	0	110.1	I456 V492 A494 I499	I456-T458 PolarHBondContact O-N 3.19Å; T458-V492 PolarHBondContact N-O 3.14Å; T458-V492 VanDerWaalsContact O-O 3.07Å; T458-V492 PolarHBondContact OG1-O 3.16Å; T458-A494 HydrophobicContact CG2-CB 3.7Å; T458-I499 HydrophobicContact CG2-CD1 3.29Å; T458-I499 HydrophobicContact CG2-CG1 3.77Å
459	Y	65.3	Low	62.6	Low	122 Å²	122	69.5 Å²	69.5	48%	0.478	38%	0.381	S	S	.	.			trans	-98	121.4	171.3	-56.3	-82.3	0	0	0	107.7	N461	Y459-N461 PolarHBondContact O-N 3.32Å
460	Q	57.2	Low	62	Low	131 Å²	131	77.3 Å²	77.3	61%	0.612	39%	0.39	S	S	*	.			trans	-69.3	118.3	166.6	-171.7	166	5.9	0	0	106.9	V462 V492	Q460-V462 VanDerWaalsContact C-N 3.35Å; Q460-V462 VanDerWaalsContact O-CG2 3.3Å; Q460-V462 WeakPolarHBondContact O-CG2 3.26Å; Q460-V462 PolarHBondContact O-N 2.91Å; Q460-V492 HydrophobicContact CB-CG2 4.49Å
461	N	54.2	Low	61.2	Low	87 Å²	87	82 Å²	82	47%	0.465	41%	0.41	S	S	.	.			trans	-66.1	103.8	164.9	-85.5	-13.6	0	0	0	106	Y459 S463 R723	Y459-N461 PolarHBondContact O-N 3.32Å; N461-S463 PolarHBondContact O-N 3.08Å; N461-R723 PolarHBondContact OD1-NH2 3.21Å
462	V	51.6	Low	60.3	Low	65 Å²	65	87.2 Å²	87.2	39%	0.394	43%	0.431	S	S	.	.			trans	-81.1	5.5	179.6	-154.9	0	0	0	0	111	Q460 D464 M486 P489	Q460-V462 VanDerWaalsContact C-N 3.35Å; Q460-V462 VanDerWaalsContact O-CG2 3.3Å; Q460-V462 WeakPolarHBondContact O-CG2 3.26Å; Q460-V462 PolarHBondContact O-N 2.91Å; V462-D464 PolarHBondContact O-N 3.41Å; V462-M486 HydrophobicContact CG1-CE 3.73Å; V462-M486 HydrophobicContact CG1-SD 3.81Å; V462-P489 HydrophobicContact CG2-CB 4.45Å
463	S	52.3	Low	59.4	Low	33 Å²	33	89.5 Å²	89.5	23%	0.231	45%	0.445	C	S	.	.	S	Bend	trans	-58.9	114.1	169.4	43.5	0	0	0	0	108	N461 C465 D480	N461-S463 PolarHBondContact O-N 3.08Å; S463-C465 VanDerWaalsContact C-N 3.31Å; S463-C465 PolarHBondContact O-N 3.09Å; S463-C465 PolarHBondContact O-SG 3.36Å; S463-C465 VanDerWaalsContact O-SG 3.34Å; S463-D480 WeakPolarHBondContact CB-OD2 3.33Å
464	D	48.8	Very low	58.5	Low	87 Å²	87	88.3 Å²	88.3	47%	0.465	45%	0.446	S	S	.	.			trans	-61.7	94.1	178.7	-176.7	-1	0	0	0	108.4	V462 S466 R467	V462-D464 PolarHBondContact O-N 3.41Å; D464-S466 PolarHBondContact O-N 3.32Å; D464-S466 WeakPolarHBondContact OD1-CB 3.19Å; D464-S466 PolarHBondContact OD1-N 2.89Å; D464-S466 PolarHBondContact OD1-OG 3.45Å; D464-R467 HydrophobicContact CB-CB 4Å; D464-R467 WeakPolarHBondContact O-CB 3.47Å; D464-R467 PolarHBondContact O-N 3.41Å
465	C	48.8	Very low	57.7	Low	111 Å²	111	94 Å²	94	75%	0.75	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-5.3	-179.7	-63	0	0	0	0	112.4	S463	S463-C465 VanDerWaalsContact C-N 3.31Å; S463-C465 PolarHBondContact O-N 3.09Å; S463-C465 PolarHBondContact O-SG 3.36Å; S463-C465 VanDerWaalsContact O-SG 3.34Å
466	S	51.1	Low	56.4	Low	101 Å²	101	95.7 Å²	95.7	71%	0.706	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-14.3	172.5	78.6	0	0	0	0	113.8	D464 F468	D464-S466 PolarHBondContact O-N 3.32Å; D464-S466 WeakPolarHBondContact OD1-CB 3.19Å; D464-S466 PolarHBondContact OD1-N 2.89Å; D464-S466 PolarHBondContact OD1-OG 3.45Å; S466-F468 VanDerWaalsContact C-N 3.33Å
467	R	52.9	Low	55.1	Low	140 Å²	140	99 Å²	99	53%	0.528	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-25	178.3	-170.1	172.9	-179.9	-161	-2.9	112.8	D464 D481	D464-R467 HydrophobicContact CB-CB 4Å; D464-R467 WeakPolarHBondContact O-CB 3.47Å; D464-R467 PolarHBondContact O-N 3.41Å; R467-D481 IonicContact CZ-OD1 2.67Å; R467-D481 IonicContact NH1-OD1 3.6Å; R467-D481 PolarHBondContact NH1-OD1 3.49Å; R467-D481 IonicContact NH2-OD1 3.59Å
468	F	55.8	Low	54	Low	67 Å²	67	100.7 Å²	100.7	29%	0.294	52%	0.516	S	S	.	.	S	Bend	trans	-118.2	139.8	174	-60.6	-75.9	0	0	0	110.3	S466 R470 P474 D480	S466-F468 VanDerWaalsContact C-N 3.33Å; F468-R470 PolarHBondContact O-N 3.16Å; F468-P474 HydrophobicContact CD1-CB 4.44Å; F468-P474 HydrophobicContact CD2-CG 4.13Å; F468-P474 HydrophobicContact CE1-CB 4.33Å; F468-P474 HydrophobicContact CE2-CG 4.26Å; F468-P474 HydrophobicContact CG-CG 4.26Å; F468-P474 HydrophobicContact CZ-CB 4.45Å; F468-D480 HydrophobicContact CE2-CB 4.32Å
469	N	53.4	Low	53.3	Low	124 Å²	124	104.5 Å²	104.5	66%	0.663	53%	0.533	S	S	*	.			trans	-58	134.1	-179.4	-102.7	-28.7	0	0	0	110.2	D471 H472	N469-D471 PolarHBondContact O-N 2.82Å; N469-H472 HydrophobicContact CB-CB 4.17Å; N469-H472 CarbonylContact O-C 3.49Å; N469-H472 PolarHBondContact O-N 2.95Å
470	R	51.7	Low	52.8	Low	232 Å²	232	100.3 Å²	100.3	88%	0.875	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-26.2	177.8	-159.3	179.9	75.1	176.3	3.4	112.8	F468	F468-R470 PolarHBondContact O-N 3.16Å
471	D	52.2	Low	52.7	Low	123 Å²	123	97 Å²	97	66%	0.658	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-8.6	178.8	-58.3	-38.7	0	0	0	113.8	N469	N469-D471 PolarHBondContact O-N 2.82Å
472	H	54.8	Low	52.6	Low	143 Å²	143	93.4 Å²	93.4	66%	0.662	49%	0.487	S	S	*	.	S	Bend	trans	-141.5	78.6	179.6	-69.1	76.2	0	0	0	110.6	N469	N469-H472 HydrophobicContact CB-CB 4.17Å; N469-H472 CarbonylContact O-C 3.49Å; N469-H472 PolarHBondContact O-N 2.95Å
473	P	55.1	Low	52.6	Low	66 Å²	66	95.2 Å²	95.2	43%	0.429	50%	0.498	S	S	.	.			trans	-67.9	158.8	174.2	29.8	-34.4	0	0	0	111.2	T731	P473-T731 HydrophobicContact CG-CG2 4.36Å
474	P	52.4	Low	52.6	Low	41 Å²	41	104.1 Å²	104.1	27%	0.266	53%	0.527	S	S	.	.			trans	-60.5	138	178.7	22.2	-31.3	0	0	0	112	F468 H476 Q479	F468-P474 HydrophobicContact CD1-CB 4.44Å; F468-P474 HydrophobicContact CD2-CG 4.13Å; F468-P474 HydrophobicContact CE1-CB 4.33Å; F468-P474 HydrophobicContact CE2-CG 4.26Å; F468-P474 HydrophobicContact CG-CG 4.26Å; F468-P474 HydrophobicContact CZ-CB 4.45Å; P474-H476 PolarHBondContact O-N 2.93Å; P474-Q479 HydrophobicContact CB-CB 3.93Å
475	D	54.9	Low	52.8	Low	145 Å²	145	108.9 Å²	108.9	78%	0.775	54%	0.539	S	S	*	.	S	Bend	trans	-69.6	-20.6	-174.7	-72.6	-41.2	0	0	0	113.1
476	H	50.7	Low	52.7	Low	97 Å²	97	108.4 Å²	108.4	45%	0.449	53%	0.528	S	S	.	.	S	Bend	trans	-136.9	138.7	-177.2	-162.6	-78.9	0	0	0	111.9	P474 I478 Q479	P474-H476 PolarHBondContact O-N 2.93Å; H476-I478 WeakPolarHBondContact ND1-CB 3.42Å; H476-I478 PolarHBondContact ND1-N 3.28Å; H476-I478 PolarHBondContact O-N 3.17Å; H476-Q479 HydrophobicContact CB-CG 4.25Å; H476-Q479 WeakPolarHBondContact O-CB 3.45Å; H476-Q479 PolarHBondContact O-N 3.36Å
477	P	49.7	Very low	52.9	Low	75 Å²	75	111 Å²	111	49%	0.487	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-4	178.8	-23.5	31.7	0	0	0	116.5
478	I	52.6	Low	52.9	Low	103 Å²	103	112.5 Å²	112.5	53%	0.528	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-11.3	-178.7	-62.8	176.3	0	0	0	111	H476 D480 W725	H476-I478 WeakPolarHBondContact ND1-CB 3.42Å; H476-I478 PolarHBondContact ND1-N 3.28Å; H476-I478 PolarHBondContact O-N 3.17Å; I478-D480 PolarHBondContact O-N 3.3Å; I478-W725 HydrophobicContact CD1-CH2 4.25Å; I478-W725 HydrophobicContact CD1-CZ2 4.23Å; I478-W725 HydrophobicContact CG1-CZ2 3.99Å
479	Q	53.6	Low	52.8	Low	102 Å²	102	112.9 Å²	112.9	48%	0.477	56%	0.556	S	S	.	*	S	Bend	trans	-72.2	-13.3	176.1	-76.1	175.2	-11.6	0	0	112.8	P474 H476	P474-Q479 HydrophobicContact CB-CB 3.93Å; H476-Q479 HydrophobicContact CB-CG 4.25Å; H476-Q479 WeakPolarHBondContact O-CB 3.45Å; H476-Q479 PolarHBondContact O-N 3.36Å
480	D	54.4	Low	53.1	Low	33 Å²	33	109.9 Å²	109.9	18%	0.176	55%	0.554	C	S	.	*			trans	-96.9	94.3	168.4	-169.3	4.9	0	0	0	110.1	S463 F468 I478 S482	S463-D480 WeakPolarHBondContact CB-OD2 3.33Å; F468-D480 HydrophobicContact CE2-CB 4.32Å; I478-D480 PolarHBondContact O-N 3.3Å; D480-S482 VanDerWaalsContact C-N 3.27Å; D480-S482 VanDerWaalsContact CG-OG 3.23Å; D480-S482 WeakPolarHBondContact OD1-CB 3.44Å; D480-S482 PolarHBondContact OD1-N 3.28Å; D480-S482 PolarHBondContact OD1-OG 3.24Å; D480-S482 PolarHBondContact OD2-OG 2.96Å
481	D	55.2	Low	53.9	Low	61 Å²	61	105.8 Å²	105.8	33%	0.326	54%	0.542	S	S	.	.			trans	-83.4	-0.1	177.8	64.9	-11.5	0	0	0	113.1	R467 V483 W484 Y485	R467-D481 IonicContact CZ-OD1 2.67Å; R467-D481 IonicContact NH1-OD1 3.6Å; R467-D481 PolarHBondContact NH1-OD1 3.49Å; R467-D481 IonicContact NH2-OD1 3.59Å; D481-V483 PolarHBondContact O-N 3.3Å; D481-V483 VanDerWaalsContact O-N 3.09Å; D481-W484 WeakPolarHBondContact O-CB 3.35Å; D481-W484 PolarHBondContact O-N 3.33Å; D481-Y485 HydrophobicContact CB-CE2 4.32Å; D481-Y485 WeakPolarHBondContact O-CD2 3.49Å
482	S	53.2	Low	54.8	Low	13 Å²	13	102.7 Å²	102.7	9%	0.091	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-58.2	-29.4	-174.6	59.7	0	0	0	0	113.3	D480 W484 Y485 M486	D480-S482 VanDerWaalsContact C-N 3.27Å; D480-S482 VanDerWaalsContact CG-OG 3.23Å; D480-S482 WeakPolarHBondContact OD1-CB 3.44Å; D480-S482 PolarHBondContact OD1-N 3.28Å; D480-S482 PolarHBondContact OD1-OG 3.24Å; D480-S482 PolarHBondContact OD2-OG 2.96Å; S482-W484 PolarHBondContact O-N 2.91Å; S482-Y485 PolarHBondContact O-N 2.74Å; S482-M486 WeakPolarHBondContact O-CG 3.43Å
483	V	52	Low	56	Low	102 Å²	102	99.2 Å²	99.2	62%	0.618	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-65.6	-24.4	177.1	-178	0	0	0	0	112.7	D481 Y485	D481-V483 PolarHBondContact O-N 3.3Å; D481-V483 VanDerWaalsContact O-N 3.09Å; V483-Y485 VanDerWaalsContact C-N 3.29Å; V483-Y485 PolarHBondContact O-N 2.92Å
484	W	51.5	Low	57.1	Low	220 Å²	220	97.1 Å²	97.1	83%	0.833	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-75.6	-18.8	179	-72.9	71.2	0	0	0	113.5	D481 S482	D481-W484 WeakPolarHBondContact O-CB 3.35Å; D481-W484 PolarHBondContact O-N 3.33Å; S482-W484 PolarHBondContact O-N 2.91Å
485	Y	52.4	Low	58.5	Low	187 Å²	187	97.3 Å²	97.3	73%	0.733	50%	0.498	S	S	*	.	S	Bend	trans	-113.6	3.5	-172.5	-58.9	-73	0	0	0	113.5	D481 S482 V483	D481-Y485 HydrophobicContact CB-CE2 4.32Å; D481-Y485 WeakPolarHBondContact O-CD2 3.49Å; S482-Y485 PolarHBondContact O-N 2.74Å; V483-Y485 VanDerWaalsContact C-N 3.29Å; V483-Y485 PolarHBondContact O-N 2.92Å
486	M	48.2	Very low	59.9	Low	102 Å²	102	90.4 Å²	90.4	50%	0.502	46%	0.461	S	S	.	.	S	Bend	trans	-103.6	131.6	179.7	-65.7	-86.5	-174.7	0	0	109.7	V462 S482	V462-M486 HydrophobicContact CG1-CE 3.73Å; V462-M486 HydrophobicContact CG1-SD 3.81Å; S482-M486 WeakPolarHBondContact O-CG 3.43Å
487	D	54.4	Low	61.4	Low	155 Å²	155	86.3 Å²	86.3	83%	0.829	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-55.6	156.6	167.4	-71.4	-40	0	0	0	110.5	P489	D487-P489 WeakPolarHBondContact O-CD 3.41Å
488	E	52.1	Low	62.9	Low	172 Å²	172	88.9 Å²	88.9	80%	0.804	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-46.7	117.7	178.5	-73.3	-168.6	161	0	0	109.9	G490	E488-G490 PolarHBondContact O-N 3.32Å; E488-G490 VanDerWaalsContact O-N 3.14Å
489	P	55	Low	64.2	Low	75 Å²	75	84.3 Å²	84.3	49%	0.487	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-61.8	126.8	-176.3	22.6	-31.8	0	0	0	108.3	V462 D487	V462-P489 HydrophobicContact CG2-CB 4.45Å; D487-P489 WeakPolarHBondContact O-CD 3.41Å
490	G	59.1	Low	65.6	Low	60 Å²	60	79.4 Å²	79.4	62%	0.619	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-53.4	149.8	176.4	0	0	0	0	0	111	E488 V492	E488-G490 PolarHBondContact O-N 3.32Å; E488-G490 VanDerWaalsContact O-N 3.14Å; G490-V492 PolarHBondContact O-N 3.16Å
491	K	68.4	Low	66.7	Low	147 Å²	147	82.7 Å²	82.7	64%	0.639	42%	0.415	S	S	*	.			trans	-62.1	109.2	175.5	-69.2	-177.3	167.6	-152.2	0	109.6	E457 F493	E457-K491 IonicContact OE1-NZ 3.7Å; E457-K491 PolarHBondContact OE1-NZ 2.94Å; E457-K491 IonicContact OE2-NZ 3.83Å; E457-K491 PolarHBondContact OE2-NZ 2.98Å; K491-F493 HydrophobicContact CB-CE2 4.25Å
492	V	70.8	Confident	67.6	Low	57 Å²	57	83 Å²	83	35%	0.345	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	138.4	172.5	-177.1	0	0	0	0	108.3	E457 T458 Q460 G490	E457-V492 WeakPolarHBondContact CA-O 3.36Å; T458-V492 PolarHBondContact N-O 3.14Å; T458-V492 VanDerWaalsContact O-O 3.07Å; T458-V492 PolarHBondContact OG1-O 3.16Å; Q460-V492 HydrophobicContact CB-CG2 4.49Å; G490-V492 PolarHBondContact O-N 3.16Å
493	F	79.5	Confident	68.7	Low	71 Å²	71	83.7 Å²	83.7	31%	0.311	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.2	176	-66.6	-89.5	0	0	0	109.9	P451 M455 I456 E457 K491	P451-F493 HydrophobicContact CG-CB 4.37Å; P451-F493 HydrophobicContact CG-CD1 3.35Å; P451-F493 HydrophobicContact CG-CD2 3.86Å; P451-F493 HydrophobicContact CG-CE1 3.37Å; P451-F493 HydrophobicContact CG-CE2 3.9Å; P451-F493 HydrophobicContact CG-CG 3.59Å; P451-F493 HydrophobicContact CG-CZ 3.67Å; M455-F493 HydrophobicContact CB-CB 4.15Å; I456-F493 CarbonylContact O-C 3.59Å; I456-F493 VanDerWaalsContact O-CA 3.32Å; I456-F493 WeakPolarHBondContact O-CA 3.33Å; E457-F493 HydrophobicContact CB-CE1 4.45Å; E457-F493 HydrophobicContact CG-CD1 3.91Å; E457-F493 HydrophobicContact CG-CE1 3.31Å; E457-F493 HydrophobicContact CG-CZ 3.84Å; K491-F493 HydrophobicContact CB-CE2 4.25Å
494	A	79.1	Confident	70	Confident	22 Å²	22	81.8 Å²	81.8	18%	0.182	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	156.1	175.7	0	0	0	0	0	111.1	M455 I456 T458 I496 I499	M455-A494 CarbonylContact C-O 3.57Å; M455-A494 WeakPolarHBondContact CA-O 3.35Å; I456-A494 PolarHBondContact N-O 3.23Å; I456-A494 PolarHBondContact O-N 3.32Å; T458-A494 HydrophobicContact CG2-CB 3.7Å; A494-I496 PolarHBondContact O-N 3.47Å; A494-I499 HydrophobicContact CB-CD1 4.19Å; A494-I499 HydrophobicContact CB-CG1 4.15Å
495	N	82.8	Confident	71.3	Confident	44 Å²	44	73.7 Å²	73.7	24%	0.235	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	130.7	177.8	-176	-27.5	0	0	0	110.6	Y454 N497 F498 I499 D522	Y454-N495 WeakPolarHBondContact O-CA 3.27Å; N495-N497 PolarHBondContact O-N 2.98Å; N495-N497 VanDerWaalsContact O-N 3.14Å; N495-N497 PolarHBondContact OD1-N 3.16Å; N495-F498 HydrophobicContact CB-CB 4.3Å; N495-F498 WeakPolarHBondContact O-CB 3.18Å; N495-F498 PolarHBondContact O-N 3.32Å; N495-I499 WeakPolarHBondContact O-CG1 3.32Å; N495-I499 PolarHBondContact O-N 2.67Å; N495-I499 VanDerWaalsContact O-N 3.11Å; N495-D522 VanDerWaalsContact ND2-CG 3.28Å; N495-D522 PolarHBondContact ND2-OD1 3.31Å; N495-D522 PolarHBondContact ND2-OD2 2.73Å
496	I	82.8	Confident	72.5	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-49.1	-39.5	176.6	-170.8	170.1	0	0	0	112.6	Y454 I456 A494 I499 T500 L508 F512 P528	Y454-I496 PolarHBondContact O-N 3.03Å; I456-I496 HydrophobicContact CD1-CB 3.49Å; I456-I496 VanDerWaalsContact CD1-CB 3.49Å; I456-I496 HydrophobicContact CD1-CD1 3.63Å; I456-I496 HydrophobicContact CD1-CG1 3.36Å; I456-I496 HydrophobicContact CG1-CB 4.26Å; A494-I496 PolarHBondContact O-N 3.47Å; I496-I499 PolarHBondContact O-N 3.02Å; I496-T500 HydrophobicContact CG1-CG2 4.38Å; I496-T500 WeakPolarHBondContact O-CG2 3.31Å; I496-T500 PolarHBondContact O-N 2.88Å; I496-T500 PolarHBondContact O-OG1 3.36Å; I496-L508 HydrophobicContact CD1-CD2 4.4Å; I496-L508 HydrophobicContact CG1-CD2 3.83Å; I496-F512 HydrophobicContact CD1-CE1 4.17Å; I496-F512 HydrophobicContact CD1-CZ 4.37Å; I496-P528 HydrophobicContact CD1-CB 4.47Å; I496-P528 HydrophobicContact CD1-CG 3.53Å; I496-P528 HydrophobicContact CG1-CG 3.88Å; I496-P528 HydrophobicContact CG2-CG 4.34Å
497	N	82	Confident	74	Confident	11 Å²	11	63.3 Å²	63.3	6%	0.059	36%	0.359	C	S	.	.	H	α-helix	trans	-67.4	-40.2	179.1	-75.9	-26	0	0	0	111.9	N495 I499 T500 M501 D522 K526 T531	N495-N497 PolarHBondContact O-N 2.98Å; N495-N497 VanDerWaalsContact O-N 3.14Å; N495-N497 PolarHBondContact OD1-N 3.16Å; N497-I499 VanDerWaalsContact C-N 3.32Å; N497-I499 PolarHBondContact O-N 3.28Å; N497-T500 WeakPolarHBondContact CA-OG1 3.14Å; N497-T500 PolarHBondContact O-N 3.25Å; N497-T500 PolarHBondContact O-OG1 2.95Å; N497-M501 WeakPolarHBondContact O-CB 2.9Å; N497-M501 PolarHBondContact O-N 3.15Å; N497-D522 WeakPolarHBondContact ND2-CB 3.41Å; N497-D522 PolarHBondContact ND2-OD2 3.17Å; N497-D522 VanDerWaalsContact ND2-OD2 3.15Å; N497-K526 PolarHBondContact ND2-O 2.88Å; N497-T531 HydrophobicContact CB-CG2 4.29Å; N497-T531 WeakPolarHBondContact O-CG2 3.27Å; N497-T531 PolarHBondContact OD1-OG1 3.24Å
498	F	81.4	Confident	75.4	Confident	129 Å²	129	56 Å²	56	57%	0.566	32%	0.32	S	S	*	.	H	α-helix	trans	-62.5	-42.2	175.6	-178.2	-97.5	0	0	0	111.3	N495 T500 M501 A502	N495-F498 HydrophobicContact CB-CB 4.3Å; N495-F498 WeakPolarHBondContact O-CB 3.18Å; N495-F498 PolarHBondContact O-N 3.32Å; F498-T500 PolarHBondContact O-N 3.3Å; F498-M501 HydrophobicContact CD2-CE 3.84Å; F498-M501 HydrophobicContact CE2-CE 3.94Å; F498-M501 WeakPolarHBondContact O-CB 3.13Å; F498-M501 PolarHBondContact O-N 2.95Å; F498-A502 WeakPolarHBondContact O-CB 3.43Å; F498-A502 PolarHBondContact O-N 2.83Å
499	I	80.3	Confident	76.8	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-42.6	176.4	-58.8	168.3	0	0	0	110.8	I456 T458 A494 N495 I496 N497 M501 A502 G503 D504 L508	I456-I499 HydrophobicContact CB-CD1 3.81Å; I456-I499 HydrophobicContact CD1-CD1 4.29Å; I456-I499 HydrophobicContact CG2-CD1 4.15Å; T458-I499 HydrophobicContact CG2-CD1 3.29Å; T458-I499 HydrophobicContact CG2-CG1 3.77Å; A494-I499 HydrophobicContact CB-CD1 4.19Å; A494-I499 HydrophobicContact CB-CG1 4.15Å; N495-I499 WeakPolarHBondContact O-CG1 3.32Å; N495-I499 PolarHBondContact O-N 2.67Å; N495-I499 VanDerWaalsContact O-N 3.11Å; I496-I499 PolarHBondContact O-N 3.02Å; N497-I499 VanDerWaalsContact C-N 3.32Å; N497-I499 PolarHBondContact O-N 3.28Å; I499-M501 VanDerWaalsContact C-N 3.33Å; I499-M501 PolarHBondContact O-N 3.4Å; I499-A502 PolarHBondContact O-N 2.89Å; I499-G503 PolarHBondContact O-N 3.24Å; I499-D504 HydrophobicContact CG2-CB 3.91Å; I499-D504 PolarHBondContact O-N 2.94Å; I499-L508 HydrophobicContact CG2-CD2 4.18Å; I499-L508 HydrophobicContact CG2-CG 3.99Å
500	T	82.4	Confident	78	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-36.1	177.4	63.6	0	0	0	0	112.7	I496 N497 F498 G503 L508 P528 T531 N537	I496-T500 HydrophobicContact CG1-CG2 4.38Å; I496-T500 WeakPolarHBondContact O-CG2 3.31Å; I496-T500 PolarHBondContact O-N 2.88Å; I496-T500 PolarHBondContact O-OG1 3.36Å; N497-T500 WeakPolarHBondContact CA-OG1 3.14Å; N497-T500 PolarHBondContact O-N 3.25Å; N497-T500 PolarHBondContact O-OG1 2.95Å; F498-T500 PolarHBondContact O-N 3.3Å; T500-G503 PolarHBondContact O-N 2.98Å; T500-L508 HydrophobicContact CG2-CD1 3.76Å; T500-L508 HydrophobicContact CG2-CD2 3.83Å; T500-L508 HydrophobicContact CG2-CG 4.43Å; T500-P528 HydrophobicContact CG2-CB 3.77Å; T500-T531 WeakPolarHBondContact OG1-CB 3.48Å; T500-T531 WeakPolarHBondContact OG1-CG2 3.44Å; T500-N537 PolarHBondContact O-ND2 3.16Å
501	M	78.3	Confident	78.9	Confident	102 Å²	102	51.4 Å²	51.4	50%	0.502	27%	0.274	S	S	.	.	H	α-helix	trans	-66.9	-43.6	174.8	-173.7	-178.7	72.3	0	0	110.8	N497 F498 I499 G503 T531 N537	N497-M501 WeakPolarHBondContact O-CB 2.9Å; N497-M501 PolarHBondContact O-N 3.15Å; F498-M501 HydrophobicContact CD2-CE 3.84Å; F498-M501 HydrophobicContact CE2-CE 3.94Å; F498-M501 WeakPolarHBondContact O-CB 3.13Å; F498-M501 PolarHBondContact O-N 2.95Å; I499-M501 VanDerWaalsContact C-N 3.33Å; I499-M501 PolarHBondContact O-N 3.4Å; M501-G503 PolarHBondContact O-N 3.45Å; M501-T531 HydrophobicContact CB-CG2 4.09Å; M501-N537 PolarHBondContact O-ND2 3.17Å; M501-N537 VanDerWaalsContact O-ND2 3.09Å
502	A	74.8	Confident	79.6	Confident	67 Å²	67	45.5 Å²	45.5	55%	0.554	25%	0.248	S	C	*	.	H	α-helix	trans	-66.1	-21	175.6	0	0	0	0	0	113.3	F498 I499	F498-A502 WeakPolarHBondContact O-CB 3.43Å; F498-A502 PolarHBondContact O-N 2.83Å; I499-A502 PolarHBondContact O-N 2.89Å
503	G	74.9	Confident	80	Confident	28 Å²	28	50.2 Å²	50.2	29%	0.289	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	21.2	178	0	0	0	0	0	114.1	I499 T500 M501 L505	I499-G503 PolarHBondContact O-N 3.24Å; T500-G503 PolarHBondContact O-N 2.98Å; M501-G503 PolarHBondContact O-N 3.45Å; G503-L505 PolarHBondContact O-N 3.29Å
504	D	79.1	Confident	79.7	Confident	61 Å²	61	50.4 Å²	50.4	33%	0.326	28%	0.281	S	S	.	.			trans	-79.1	89.3	178.9	-180	5.3	0	0	0	111.2	I499 S506 S507 L508	I499-D504 HydrophobicContact CG2-CB 3.91Å; I499-D504 PolarHBondContact O-N 2.94Å; D504-S506 VanDerWaalsContact C-N 3.27Å; D504-S506 PolarHBondContact O-N 3.45Å; D504-S506 WeakPolarHBondContact OD1-CB 3.28Å; D504-S506 PolarHBondContact OD1-N 2.94Å; D504-S506 VanDerWaalsContact OD1-N 3.08Å; D504-S507 PolarHBondContact OD1-N 2.89Å; D504-S507 VanDerWaalsContact OD1-N 3.14Å; D504-S507 WeakPolarHBondContact OD2-CB 3.43Å; D504-S507 PolarHBondContact OD2-OG 2.94Å; D504-L508 WeakPolarHBondContact O-CG 3.33Å; D504-L508 PolarHBondContact O-N 3.5Å
505	L	79.6	Confident	79.4	Confident	51 Å²	51	52 Å²	52	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-65.6	-27.8	177.6	-70.6	173.4	0	0	0	113.2	G503 L508 K509 D539 V540 F543	G503-L505 PolarHBondContact O-N 3.29Å; L505-L508 PolarHBondContact O-N 3.38Å; L505-K509 WeakPolarHBondContact O-CB 3.47Å; L505-K509 VanDerWaalsContact O-CG 3.28Å; L505-K509 WeakPolarHBondContact O-CG 3.34Å; L505-K509 PolarHBondContact O-N 2.93Å; L505-D539 HydrophobicContact CD1-CB 4.28Å; L505-V540 HydrophobicContact CD2-CB 4.22Å; L505-V540 HydrophobicContact CD2-CG2 3.69Å; L505-V540 HydrophobicContact CG-CG2 4.25Å; L505-F543 HydrophobicContact CD2-CB 4.2Å; L505-F543 HydrophobicContact CD2-CD1 4.11Å; L505-F543 HydrophobicContact CD2-CG 4.28Å
506	S	78	Confident	79.2	Confident	65 Å²	65	50.3 Å²	50.3	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-71.3	-44.9	-175.5	-63.6	0	0	0	0	110.9	D504 L508 K509 K510	D504-S506 VanDerWaalsContact C-N 3.27Å; D504-S506 PolarHBondContact O-N 3.45Å; D504-S506 WeakPolarHBondContact OD1-CB 3.28Å; D504-S506 PolarHBondContact OD1-N 2.94Å; D504-S506 VanDerWaalsContact OD1-N 3.08Å; S506-L508 VanDerWaalsContact C-N 3.34Å; S506-K509 PolarHBondContact O-N 3.47Å; S506-K510 WeakPolarHBondContact O-CG 3.39Å; S506-K510 PolarHBondContact O-N 2.86Å; S506-K510 VanDerWaalsContact O-N 3.17Å
507	S	80.2	Confident	79.1	Confident	6 Å²	6	53.4 Å²	53.4	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-36.5	174.9	-63.2	0	0	0	0	111.6	D504 A511	D504-S507 PolarHBondContact OD1-N 2.89Å; D504-S507 VanDerWaalsContact OD1-N 3.14Å; D504-S507 WeakPolarHBondContact OD2-CB 3.43Å; D504-S507 PolarHBondContact OD2-OG 2.94Å; S507-A511 VanDerWaalsContact O-CB 3.3Å; S507-A511 WeakPolarHBondContact O-CB 3.38Å; S507-A511 PolarHBondContact O-N 3.01Å
508	L	82	Confident	79.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.3	-39.9	174.9	-68.9	172.7	0	0	0	113.3	I456 I496 I499 T500 D504 L505 S506 A511 F512 V540 F543	I456-L508 HydrophobicContact CD1-CD2 4.36Å; I496-L508 HydrophobicContact CD1-CD2 4.4Å; I496-L508 HydrophobicContact CG1-CD2 3.83Å; I499-L508 HydrophobicContact CG2-CD2 4.18Å; I499-L508 HydrophobicContact CG2-CG 3.99Å; T500-L508 HydrophobicContact CG2-CD1 3.76Å; T500-L508 HydrophobicContact CG2-CD2 3.83Å; T500-L508 HydrophobicContact CG2-CG 4.43Å; D504-L508 WeakPolarHBondContact O-CG 3.33Å; D504-L508 PolarHBondContact O-N 3.5Å; L505-L508 PolarHBondContact O-N 3.38Å; S506-L508 VanDerWaalsContact C-N 3.34Å; L508-A511 WeakPolarHBondContact O-CB 3.25Å; L508-A511 PolarHBondContact O-N 3.29Å; L508-F512 HydrophobicContact CB-CE2 4.19Å; L508-F512 HydrophobicContact CD2-CZ 4.47Å; L508-F512 WeakPolarHBondContact O-CD2 3.45Å; L508-F512 WeakPolarHBondContact O-CG 3.32Å; L508-F512 PolarHBondContact O-N 2.72Å; L508-V540 HydrophobicContact CD1-CG1 4.04Å; L508-F543 HydrophobicContact CB-CE1 4.29Å
509	K	83.3	Confident	79.1	Confident	102 Å²	102	50.8 Å²	50.8	44%	0.443	30%	0.303	S	S	.	.	H	α-helix	trans	-60.1	-49.2	174.7	-78.6	172.2	-178.6	-175.4	0	111.4	L505 S506 A511 F512 E513 F543	L505-K509 WeakPolarHBondContact O-CB 3.47Å; L505-K509 VanDerWaalsContact O-CG 3.28Å; L505-K509 WeakPolarHBondContact O-CG 3.34Å; L505-K509 PolarHBondContact O-N 2.93Å; S506-K509 PolarHBondContact O-N 3.47Å; K509-A511 VanDerWaalsContact C-N 3.3Å; K509-A511 PolarHBondContact O-N 3.1Å; K509-F512 PolarHBondContact O-N 2.93Å; K509-E513 WeakPolarHBondContact O-CG 3.49Å; K509-E513 PolarHBondContact O-N 3.16Å; K509-F543 HydrophobicContact CB-CZ 4.32Å; K509-F543 HydrophobicContact CD-CE2 4.42Å; K509-F543 HydrophobicContact CD-CZ 4.43Å; K509-F543 HydrophobicContact CG-CE1 4.05Å; K509-F543 HydrophobicContact CG-CE2 3.74Å; K509-F543 HydrophobicContact CG-CZ 3.33Å
510	K	79.9	Confident	79.1	Confident	106 Å²	106	51.8 Å²	51.8	46%	0.461	31%	0.308	S	S	.	.	H	α-helix	trans	-59.9	-40.1	176.5	-71.6	179.6	177.3	-177.3	0	112.2	S506 E513 A514	S506-K510 WeakPolarHBondContact O-CG 3.39Å; S506-K510 PolarHBondContact O-N 2.86Å; S506-K510 VanDerWaalsContact O-N 3.17Å; K510-E513 PolarHBondContact O-N 2.77Å; K510-A514 WeakPolarHBondContact O-CB 3.39Å; K510-A514 PolarHBondContact O-N 3.08Å
511	A	78.3	Confident	79	Confident	4 Å²	4	55 Å²	55	3%	0.033	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-46.7	177.3	0	0	0	0	0	112.6	I456 S507 L508 K509 A514 I516	I456-A511 HydrophobicContact CB-CB 4.45Å; I456-A511 HydrophobicContact CD1-CB 3.49Å; I456-A511 VanDerWaalsContact CD1-CB 3.49Å; I456-A511 HydrophobicContact CG1-CB 3.92Å; I456-A511 HydrophobicContact CG2-CB 3.65Å; S507-A511 VanDerWaalsContact O-CB 3.3Å; S507-A511 WeakPolarHBondContact O-CB 3.38Å; S507-A511 PolarHBondContact O-N 3.01Å; L508-A511 WeakPolarHBondContact O-CB 3.25Å; L508-A511 PolarHBondContact O-N 3.29Å; K509-A511 VanDerWaalsContact C-N 3.3Å; K509-A511 PolarHBondContact O-N 3.1Å; A511-A514 PolarHBondContact O-N 3.05Å; A511-I516 HydrophobicContact CB-CD1 3.94Å; A511-I516 WeakPolarHBondContact O-CB 3.27Å; A511-I516 VanDerWaalsContact O-CG1 3.29Å; A511-I516 WeakPolarHBondContact O-CG1 3.25Å; A511-I516 PolarHBondContact O-N 3.27Å
512	F	81.5	Confident	78.8	Confident	23 Å²	23	51.3 Å²	51.3	10%	0.101	30%	0.304	C	S	.	.	H	α-helix	trans	-74.5	-32.6	-179.6	-60.2	-40.7	0	0	0	112.6	I496 L508 K509 A514 G515 I516 V518 F543 L544	I496-F512 HydrophobicContact CD1-CE1 4.17Å; I496-F512 HydrophobicContact CD1-CZ 4.37Å; L508-F512 HydrophobicContact CB-CE2 4.19Å; L508-F512 HydrophobicContact CD2-CZ 4.47Å; L508-F512 WeakPolarHBondContact O-CD2 3.45Å; L508-F512 WeakPolarHBondContact O-CG 3.32Å; L508-F512 PolarHBondContact O-N 2.72Å; K509-F512 PolarHBondContact O-N 2.93Å; F512-A514 VanDerWaalsContact C-N 3.27Å; F512-A514 PolarHBondContact O-N 3.02Å; F512-G515 PolarHBondContact O-N 3.07Å; F512-G515 VanDerWaalsContact O-N 3.12Å; F512-I516 WeakPolarHBondContact CD1-O 3.47Å; F512-V518 HydrophobicContact CD1-CG2 4.02Å; F512-V518 HydrophobicContact CE1-CB 4.31Å; F512-V518 HydrophobicContact CE1-CG1 4.49Å; F512-V518 HydrophobicContact CE1-CG2 4.06Å; F512-V518 HydrophobicContact CG-CG2 4.43Å; F512-V518 HydrophobicContact CZ-CG1 4.32Å; F512-V518 HydrophobicContact CZ-CG2 4.49Å; F512-F543 AromaticContact CD2-CE1 3.7Å; F512-F543 HydrophobicContact CD2-CE1 3.7Å; F512-F543 HydrophobicContact CD2-CZ 4.06Å; F512-F543 HydrophobicContact CE2-CD1 4.47Å; F512-F543 AromaticContact CE2-CE1 3.74Å; F512-F543 HydrophobicContact CE2-CE1 3.74Å; F512-L544 HydrophobicContact CE2-CD2 3.65Å; F512-L544 HydrophobicContact CZ-CD2 3.59Å
513	E	80.1	Confident	78.8	Confident	156 Å²	156	50.1 Å²	50.1	73%	0.729	29%	0.292	S	S	*	.	H	α-helix	trans	-62.9	-33.9	169.5	-75	171.2	-171	0	0	112.1	K509 K510 G515	K509-E513 WeakPolarHBondContact O-CG 3.49Å; K509-E513 PolarHBondContact O-N 3.16Å; K510-E513 PolarHBondContact O-N 2.77Å; E513-G515 PolarHBondContact O-N 3.17Å
514	A	73	Confident	78.7	Confident	75 Å²	75	50.8 Å²	50.8	62%	0.62	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	4.7	174.1	0	0	0	0	0	114.1	K510 A511 F512	K510-A514 WeakPolarHBondContact O-CB 3.39Å; K510-A514 PolarHBondContact O-N 3.08Å; A511-A514 PolarHBondContact O-N 3.05Å; F512-A514 VanDerWaalsContact C-N 3.27Å; F512-A514 PolarHBondContact O-N 3.02Å
515	G	73.1	Confident	78.7	Confident	56 Å²	56	51.9 Å²	51.9	58%	0.577	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	18.6	174.8	0	0	0	0	0	115.2	F512 E513	F512-G515 PolarHBondContact O-N 3.07Å; F512-G515 VanDerWaalsContact O-N 3.12Å; E513-G515 PolarHBondContact O-N 3.17Å
516	I	78.5	Confident	78.9	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.041	30%	0.296	C	S	.	.			trans	-73.5	132.5	175.4	-60.1	176.2	0	0	0	109.4	R446 Y453 I456 A511 F512	R446-I516 VanDerWaalsContact NH2-CD1 3.34Å; Y453-I516 HydrophobicContact CD1-CG1 4.37Å; I456-I516 HydrophobicContact CG1-CD1 3.83Å; A511-I516 HydrophobicContact CB-CD1 3.94Å; A511-I516 WeakPolarHBondContact O-CB 3.27Å; A511-I516 VanDerWaalsContact O-CG1 3.29Å; A511-I516 WeakPolarHBondContact O-CG1 3.25Å; A511-I516 PolarHBondContact O-N 3.27Å; F512-I516 WeakPolarHBondContact CD1-O 3.47Å
517	P	80.8	Confident	79.3	Confident	65 Å²	65	50 Å²	50	42%	0.422	27%	0.274	S	S	.	.			trans	-65.9	136.6	179.2	24.1	-31.6	0	0	0	111.9	D519 M520	P517-D519 PolarHBondContact O-N 3.29Å; P517-M520 HydrophobicContact CG-CB 4.5Å; P517-M520 HydrophobicContact CG-SD 4.32Å; P517-M520 PolarHBondContact O-N 3.16Å
518	V	81.9	Confident	79.7	Confident	27 Å²	27	49.8 Å²	49.8	16%	0.164	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-35.5	-174.8	-177.8	0	0	0	0	112.5	F512 M520 P528 L544 K547 A549	F512-V518 HydrophobicContact CD1-CG2 4.02Å; F512-V518 HydrophobicContact CE1-CB 4.31Å; F512-V518 HydrophobicContact CE1-CG1 4.49Å; F512-V518 HydrophobicContact CE1-CG2 4.06Å; F512-V518 HydrophobicContact CG-CG2 4.43Å; F512-V518 HydrophobicContact CZ-CG1 4.32Å; F512-V518 HydrophobicContact CZ-CG2 4.49Å; V518-M520 VanDerWaalsContact C-N 3.3Å; V518-M520 PolarHBondContact O-N 3.3Å; V518-P528 WeakPolarHBondContact O-CG 3.48Å; V518-L544 HydrophobicContact CG1-CD2 4.03Å; V518-K547 HydrophobicContact CG1-CB 4.44Å; V518-K547 HydrophobicContact CG2-CB 4.06Å; V518-A549 HydrophobicContact CG1-CB 3.76Å
519	D	81.9	Confident	80.1	Confident	58 Å²	58	49.9 Å²	49.9	31%	0.31	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	27.6	-178.4	-67.8	-39.5	0	0	0	113.7	P517 K521 A549 N550	P517-D519 PolarHBondContact O-N 3.29Å; D519-K521 PolarHBondContact O-N 2.87Å; D519-A549 WeakPolarHBondContact OD1-CA 3.33Å; D519-N550 VanDerWaalsContact CG-N 3.34Å; D519-N550 PolarHBondContact OD1-N 2.79Å; D519-N550 WeakPolarHBondContact OD2-CB 3.26Å; D519-N550 PolarHBondContact OD2-N 3.31Å; D519-N550 VanDerWaalsContact OD2-N 3.07Å
520	M	79.6	Confident	80.4	Confident	28 Å²	28	45 Å²	45	14%	0.138	25%	0.252	C	S	.	.			trans	-59.6	132.2	179.1	-170.5	64.4	-133.3	0	0	110.9	F443 P517 V518 P528	F443-M520 HydrophobicContact CD1-CE 4.07Å; F443-M520 HydrophobicContact CE1-CE 4.16Å; P517-M520 HydrophobicContact CG-CB 4.5Å; P517-M520 HydrophobicContact CG-SD 4.32Å; P517-M520 PolarHBondContact O-N 3.16Å; V518-M520 VanDerWaalsContact C-N 3.3Å; V518-M520 PolarHBondContact O-N 3.3Å; M520-P528 VanDerWaalsContact O-CD 3.22Å; M520-P528 WeakPolarHBondContact O-CD 3.25Å
521	K	80.5	Confident	80.7	Confident	67 Å²	67	41 Å²	41	29%	0.291	24%	0.236	S	C	.	.			trans	-99	137.2	179.3	-65.4	-170.5	-175.3	-167.8	0	111.1	F443 D519 Y525 T527 T554	F443-K521 WeakPolarHBondContact CE1-O 3.36Å; D519-K521 PolarHBondContact O-N 2.87Å; K521-Y525 HydrophobicContact CD-CD1 3.76Å; K521-Y525 HydrophobicContact CD-CG 4.38Å; K521-T527 HydrophobicContact CG-CG2 4.02Å; K521-T554 PolarHBondContact NZ-O 3.38Å
522	D	74.8	Confident	81.1	Confident	24 Å²	24	40.8 Å²	40.8	13%	0.128	24%	0.235	C	C	.	.			trans	-84.2	180	174.3	-168.3	-0.7	0	0	0	111.5	N495 N497 S524 Y525 K526	N495-D522 VanDerWaalsContact ND2-CG 3.28Å; N495-D522 PolarHBondContact ND2-OD1 3.31Å; N495-D522 PolarHBondContact ND2-OD2 2.73Å; N497-D522 WeakPolarHBondContact ND2-CB 3.41Å; N497-D522 PolarHBondContact ND2-OD2 3.17Å; N497-D522 VanDerWaalsContact ND2-OD2 3.15Å; D522-S524 PolarHBondContact O-N 3.21Å; D522-Y525 WeakPolarHBondContact O-CA 3.45Å; D522-Y525 PolarHBondContact O-N 2.91Å; D522-K526 PolarHBondContact N-O 3.3Å; D522-K526 VanDerWaalsContact N-O 3.11Å
523	S	73.3	Confident	81.3	Confident	42 Å²	42	39.7 Å²	39.7	29%	0.294	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-29.9	175.3	56.7	0	0	0	0	114.5	T437 I438	T437-S523 WeakPolarHBondContact CA-O 3.41Å; I438-S523 PolarHBondContact N-O 3.26Å
524	S	73.1	Confident	81.6	Confident	43 Å²	43	34.7 Å²	34.7	30%	0.301	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-3	178.8	-61.2	0	0	0	0	114.9	D522 N556	D522-S524 PolarHBondContact O-N 3.21Å; S524-N556 WeakPolarHBondContact O-CB 3.46Å; S524-N556 PolarHBondContact O-ND2 3.01Å
525	Y	78.9	Confident	81.9	Confident	84 Å²	84	32.7 Å²	32.7	33%	0.329	20%	0.196	S	C	.	.	S	Bend	trans	76.2	11.9	-169.6	-69.7	-109	0	0	0	116.7	I438 K521 D522 D555 N556	I438-Y525 HydrophobicContact CD1-CD1 4.46Å; I438-Y525 HydrophobicContact CD1-CD2 4.01Å; I438-Y525 HydrophobicContact CD1-CE1 3.99Å; I438-Y525 HydrophobicContact CD1-CE2 3.57Å; I438-Y525 HydrophobicContact CD1-CG 4.48Å; I438-Y525 HydrophobicContact CG1-CD2 4.03Å; I438-Y525 HydrophobicContact CG1-CE1 4.47Å; I438-Y525 HydrophobicContact CG1-CE2 3.28Å; K521-Y525 HydrophobicContact CD-CD1 3.76Å; K521-Y525 HydrophobicContact CD-CG 4.38Å; D522-Y525 WeakPolarHBondContact O-CA 3.45Å; D522-Y525 PolarHBondContact O-N 2.91Å; Y525-D555 WeakPolarHBondContact CA-OD1 3.3Å; Y525-D555 WeakPolarHBondContact CB-OD1 3.45Å; Y525-N556 VanDerWaalsContact CD2-CG 3.41Å; Y525-N556 WeakPolarHBondContact CD2-OD1 3.37Å; Y525-N556 VanDerWaalsContact CE2-OD1 3.26Å; Y525-N556 WeakPolarHBondContact CE2-OD1 3.49Å; Y525-N556 VanDerWaalsContact CG-OD1 3.3Å
526	K	83.8	Confident	82.1	Confident	77 Å²	77	30.2 Å²	30.2	34%	0.335	17%	0.171	S	C	.	.			trans	-77.3	133	177.1	-65.7	-179.1	-180	179.3	0	112.2	N497 D522 D555	N497-K526 PolarHBondContact ND2-O 2.88Å; D522-K526 PolarHBondContact N-O 3.3Å; D522-K526 VanDerWaalsContact N-O 3.11Å; K526-D555 WeakPolarHBondContact CE-OD2 3.4Å; K526-D555 VanDerWaalsContact CG-OD2 3.31Å; K526-D555 WeakPolarHBondContact CG-OD2 3.48Å; K526-D555 PolarHBondContact N-OD1 3.14Å
527	T	87.6	Confident	82.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.176	C	C	.	.			trans	-90.2	159.1	172.2	64.2	0	0	0	0	111.6	K521 L529 M530 T531 A553	K521-T527 HydrophobicContact CG-CG2 4.02Å; T527-L529 PolarHBondContact O-N 3.4Å; T527-M530 HydrophobicContact CG2-CE 4.44Å; T527-M530 WeakPolarHBondContact O-CB 3.25Å; T527-M530 PolarHBondContact O-N 3.08Å; T527-M530 WeakPolarHBondContact OG1-CG 3.21Å; T527-M530 PolarHBondContact OG1-N 3.08Å; T527-T531 PolarHBondContact O-N 3.3Å; T527-T531 PolarHBondContact O-OG1 3.4Å; T527-A553 HydrophobicContact CG2-CB 3.95Å
528	P	87.3	Confident	82.4	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-50	-39.4	172.6	-33.8	39	0	0	0	113.4	I496 T500 V518 M520 T531 A532 L544	I496-P528 HydrophobicContact CD1-CB 4.47Å; I496-P528 HydrophobicContact CD1-CG 3.53Å; I496-P528 HydrophobicContact CG1-CG 3.88Å; I496-P528 HydrophobicContact CG2-CG 4.34Å; T500-P528 HydrophobicContact CG2-CB 3.77Å; V518-P528 WeakPolarHBondContact O-CG 3.48Å; M520-P528 VanDerWaalsContact O-CD 3.22Å; M520-P528 WeakPolarHBondContact O-CD 3.25Å; P528-T531 PolarHBondContact O-N 3.41Å; P528-A532 WeakPolarHBondContact O-CB 3.37Å; P528-A532 PolarHBondContact O-N 2.99Å; P528-L544 HydrophobicContact CB-CD1 3.89Å; P528-L544 HydrophobicContact CB-CD2 4.12Å
529	L	90.6	Very high	82.6	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-42.4	179.7	-175.7	63.8	0	0	0	111.7	T527 T531 A532 C533 V541 L544 L545 A549 P561 L577	T527-L529 PolarHBondContact O-N 3.4Å; L529-T531 VanDerWaalsContact C-N 3.34Å; L529-T531 PolarHBondContact O-N 2.99Å; L529-A532 PolarHBondContact O-N 3.28Å; L529-C533 WeakPolarHBondContact O-CB 3.39Å; L529-C533 PolarHBondContact O-N 3.23Å; L529-C533 PolarHBondContact O-SG 3.01Å; L529-V541 HydrophobicContact CD1-CG1 3.9Å; L529-L544 HydrophobicContact CB-CD1 4.34Å; L529-L544 HydrophobicContact CD1-CB 4.19Å; L529-L544 HydrophobicContact CD1-CD1 4.42Å; L529-L545 HydrophobicContact CD1-CD2 4.34Å; L529-L545 HydrophobicContact CD1-CG 4.38Å; L529-L545 HydrophobicContact CD2-CD2 4.07Å; L529-A549 HydrophobicContact CB-CB 4.33Å; L529-A549 HydrophobicContact CD2-CB 4.02Å; L529-P561 HydrophobicContact CD2-CB 4.19Å; L529-P561 HydrophobicContact CD2-CG 3.89Å; L529-P561 HydrophobicContact CG-CB 4.17Å; L529-P561 HydrophobicContact CG-CG 4.13Å; L529-L577 HydrophobicContact CD2-CD2 4.43Å
530	M	89.5	Confident	82.8	Confident	1 Å²	1	30 Å²	30	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-43.6	176.2	-67.9	171.1	-176	0	0	111.5	T527 C533 A534 A553 D555 W559 P561 F564	T527-M530 HydrophobicContact CG2-CE 4.44Å; T527-M530 WeakPolarHBondContact O-CB 3.25Å; T527-M530 PolarHBondContact O-N 3.08Å; T527-M530 WeakPolarHBondContact OG1-CG 3.21Å; T527-M530 PolarHBondContact OG1-N 3.08Å; M530-C533 PolarHBondContact O-N 3.27Å; M530-A534 PolarHBondContact O-N 3.36Å; M530-A553 HydrophobicContact CE-CB 3.83Å; M530-A553 WeakPolarHBondContact CE-O 3.33Å; M530-D555 HydrophobicContact CE-CB 4.35Å; M530-D555 HydrophobicContact SD-CB 3.97Å; M530-W559 WeakPolarHBondContact CE-O 3.49Å; M530-P561 HydrophobicContact CG-CG 3.94Å; M530-F564 HydrophobicContact CB-CD2 3.81Å; M530-F564 HydrophobicContact CB-CE2 3.89Å; M530-F564 HydrophobicContact CB-CG 4.49Å; M530-F564 HydrophobicContact CG-CD2 3.91Å; M530-F564 HydrophobicContact CG-CE2 3.91Å; M530-F564 HydrophobicContact SD-CD2 4.47Å; M530-F564 HydrophobicContact SD-CE2 3.88Å
531	T	86.5	Confident	83.2	Confident	21 Å²	21	28.7 Å²	28.7	13%	0.129	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-42.5	179.3	-52.3	0	0	0	0	111.3	N497 T500 M501 T527 P528 L529 C533 A534 S535	N497-T531 HydrophobicContact CB-CG2 4.29Å; N497-T531 WeakPolarHBondContact O-CG2 3.27Å; N497-T531 PolarHBondContact OD1-OG1 3.24Å; T500-T531 WeakPolarHBondContact OG1-CB 3.48Å; T500-T531 WeakPolarHBondContact OG1-CG2 3.44Å; M501-T531 HydrophobicContact CB-CG2 4.09Å; T527-T531 PolarHBondContact O-N 3.3Å; T527-T531 PolarHBondContact O-OG1 3.4Å; P528-T531 PolarHBondContact O-N 3.41Å; L529-T531 VanDerWaalsContact C-N 3.34Å; L529-T531 PolarHBondContact O-N 2.99Å; T531-C533 VanDerWaalsContact C-N 3.33Å; T531-C533 PolarHBondContact O-N 3.05Å; T531-A534 PolarHBondContact O-N 3.39Å; T531-S535 PolarHBondContact O-N 3.01Å; T531-S535 PolarHBondContact O-OG 3Å
532	A	86.4	Confident	83.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-36.2	175.2	0	0	0	0	0	112.9	P528 L529 S535 G536 N537 V540 V541 L544	P528-A532 WeakPolarHBondContact O-CB 3.37Å; P528-A532 PolarHBondContact O-N 2.99Å; L529-A532 PolarHBondContact O-N 3.28Å; A532-S535 PolarHBondContact O-OG 2.98Å; A532-G536 PolarHBondContact O-N 3.37Å; A532-G536 VanDerWaalsContact O-N 3.14Å; A532-N537 PolarHBondContact O-N 3Å; A532-V540 HydrophobicContact CB-CB 4.18Å; A532-V540 HydrophobicContact CB-CG1 3.83Å; A532-V541 HydrophobicContact CB-CG2 3.78Å; A532-L544 HydrophobicContact CB-CD1 4.18Å
533	C	87.2	Confident	84.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69.1	-37	175.2	-66.9	0	0	0	0	112.2	L529 M530 T531 F564 A565 I573	L529-C533 WeakPolarHBondContact O-CB 3.39Å; L529-C533 PolarHBondContact O-N 3.23Å; L529-C533 PolarHBondContact O-SG 3.01Å; M530-C533 PolarHBondContact O-N 3.27Å; T531-C533 VanDerWaalsContact C-N 3.33Å; T531-C533 PolarHBondContact O-N 3.05Å; C533-F564 HydrophobicContact CB-CB 4.21Å; C533-A565 HydrophobicContact CB-CB 4.19Å; C533-I573 HydrophobicContact CB-CG2 4.31Å
534	A	84.4	Confident	84.9	Confident	50 Å²	50	27.6 Å²	27.6	41%	0.413	15%	0.148	S	C	.	.	H	α-helix	trans	-69.8	-35.6	176.1	0	0	0	0	0	112.4	M530 T531 F564	M530-A534 PolarHBondContact O-N 3.36Å; T531-A534 PolarHBondContact O-N 3.39Å; A534-F564 HydrophobicContact CB-CB 4.31Å; A534-F564 HydrophobicContact CB-CD1 4.08Å
535	S	79.9	Confident	85.7	Confident	33 Å²	33	27.2 Å²	27.2	23%	0.231	14%	0.142	C	C	.	.	H	α-helix	trans	-81.2	-16	179.1	70.1	0	0	0	0	114.2	T531 A532 N537	T531-S535 PolarHBondContact O-N 3.01Å; T531-S535 PolarHBondContact O-OG 3Å; A532-S535 PolarHBondContact O-OG 2.98Å; S535-N537 VanDerWaalsContact OG-CG 3.26Å; S535-N537 PolarHBondContact OG-ND2 2.84Å
536	G	78	Confident	86.1	Confident	4 Å²	4	30.5 Å²	30.5	4%	0.041	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	17.8	-177.6	0	0	0	0	0	114.6	A532 L538	A532-G536 PolarHBondContact O-N 3.37Å; A532-G536 VanDerWaalsContact O-N 3.14Å; G536-L538 PolarHBondContact O-N 3.08Å
537	N	82	Confident	86.2	Confident	29 Å²	29	32.1 Å²	32.1	16%	0.155	17%	0.167	C	C	.	.			trans	-81.9	81.7	-177.7	-70.4	-26	0	0	0	111.6	T500 M501 A532 S535 D539 V540 V541	T500-N537 PolarHBondContact O-ND2 3.16Å; M501-N537 PolarHBondContact O-ND2 3.17Å; M501-N537 VanDerWaalsContact O-ND2 3.09Å; A532-N537 PolarHBondContact O-N 3Å; S535-N537 VanDerWaalsContact OG-CG 3.26Å; S535-N537 PolarHBondContact OG-ND2 2.84Å; N537-D539 VanDerWaalsContact C-N 3.28Å; N537-D539 PolarHBondContact O-N 2.93Å; N537-V540 HydrophobicContact CB-CB 4.11Å; N537-V540 HydrophobicContact CB-CG2 3.92Å; N537-V540 PolarHBondContact O-N 3.46Å; N537-V540 VanDerWaalsContact O-N 3.11Å; N537-V541 WeakPolarHBondContact O-CG2 3.15Å; N537-V541 PolarHBondContact O-N 2.88Å; N537-V541 VanDerWaalsContact O-N 3.09Å
538	L	83.9	Confident	86	Confident	21 Å²	21	34.8 Å²	34.8	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-51.9	-40.8	-176.9	-174.7	68.7	0	0	0	114	G536 V540 V541 K542 D572 I573 L576	G536-L538 PolarHBondContact O-N 3.08Å; L538-V540 VanDerWaalsContact C-N 3.33Å; L538-V540 PolarHBondContact O-N 2.89Å; L538-V541 PolarHBondContact O-N 2.75Å; L538-K542 HydrophobicContact CG-CD 4.45Å; L538-K542 WeakPolarHBondContact O-CG 3.46Å; L538-K542 PolarHBondContact O-N 2.96Å; L538-D572 HydrophobicContact CD1-CB 4.29Å; L538-I573 HydrophobicContact CD1-CG1 3.79Å; L538-L576 HydrophobicContact CD1-CD2 4.45Å
539	D	84.9	Confident	86.1	Confident	102 Å²	102	35 Å²	35	55%	0.545	20%	0.197	S	C	.	.	H	α-helix	trans	-66.2	-37.4	-177.5	-58	-33	0	0	0	111.9	L505 N537 F543	L505-D539 HydrophobicContact CD1-CB 4.28Å; N537-D539 VanDerWaalsContact C-N 3.28Å; N537-D539 PolarHBondContact O-N 2.93Å; D539-F543 WeakPolarHBondContact O-CB 2.8Å; D539-F543 PolarHBondContact O-N 2.94Å
540	V	85.9	Confident	85.9	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-69.5	-40.6	174.9	-177.4	0	0	0	0	110.3	L505 L508 A532 N537 L538 F543 L544	L505-V540 HydrophobicContact CD2-CB 4.22Å; L505-V540 HydrophobicContact CD2-CG2 3.69Å; L505-V540 HydrophobicContact CG-CG2 4.25Å; L508-V540 HydrophobicContact CD1-CG1 4.04Å; A532-V540 HydrophobicContact CB-CB 4.18Å; A532-V540 HydrophobicContact CB-CG1 3.83Å; N537-V540 HydrophobicContact CB-CB 4.11Å; N537-V540 HydrophobicContact CB-CG2 3.92Å; N537-V540 PolarHBondContact O-N 3.46Å; N537-V540 VanDerWaalsContact O-N 3.11Å; L538-V540 VanDerWaalsContact C-N 3.33Å; L538-V540 PolarHBondContact O-N 2.89Å; V540-F543 PolarHBondContact O-N 3.27Å; V540-L544 HydrophobicContact CG1-CD1 3.84Å; V540-L544 HydrophobicContact CG1-CG 4.23Å; V540-L544 WeakPolarHBondContact O-CB 3.36Å; V540-L544 VanDerWaalsContact O-CG 3.26Å; V540-L544 WeakPolarHBondContact O-CG 3.37Å; V540-L544 PolarHBondContact O-N 3.17Å
541	V	88.1	Confident	85.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-48.3	176.9	179.3	0	0	0	0	110.8	L529 A532 N537 L538 F543 L544 L545 I573 L576	L529-V541 HydrophobicContact CD1-CG1 3.9Å; A532-V541 HydrophobicContact CB-CG2 3.78Å; N537-V541 WeakPolarHBondContact O-CG2 3.15Å; N537-V541 PolarHBondContact O-N 2.88Å; N537-V541 VanDerWaalsContact O-N 3.09Å; L538-V541 PolarHBondContact O-N 2.75Å; V541-F543 VanDerWaalsContact C-N 3.34Å; V541-F543 PolarHBondContact O-N 3.23Å; V541-L544 PolarHBondContact O-N 3.33Å; V541-L545 HydrophobicContact CG1-CD1 4.11Å; V541-L545 HydrophobicContact CG1-CG 4.46Å; V541-L545 WeakPolarHBondContact O-CG 3.36Å; V541-L545 PolarHBondContact O-N 3.48Å; V541-I573 HydrophobicContact CG1-CG2 4.26Å; V541-I573 HydrophobicContact CG2-CD1 4.24Å; V541-I573 HydrophobicContact CG2-CG2 4.26Å; V541-L576 HydrophobicContact CB-CD2 4.27Å; V541-L576 HydrophobicContact CG1-CD2 3.47Å; V541-L576 VanDerWaalsContact CG1-CD2 3.47Å
542	K	88.9	Confident	86	Confident	87 Å²	87	41.6 Å²	41.6	38%	0.378	23%	0.232	S	C	.	.	H	α-helix	trans	-57.1	-48.9	176.1	-74	177.4	179.5	176.2	0	111.4	L538 L544 L545 E546 L576	L538-K542 HydrophobicContact CG-CD 4.45Å; L538-K542 WeakPolarHBondContact O-CG 3.46Å; L538-K542 PolarHBondContact O-N 2.96Å; K542-L544 PolarHBondContact O-N 3.05Å; K542-L545 PolarHBondContact O-N 3.23Å; K542-E546 WeakPolarHBondContact O-CG 3.48Å; K542-E546 PolarHBondContact O-N 3.41Å; K542-L576 HydrophobicContact CG-CD1 3.94Å; K542-L576 HydrophobicContact CG-CD2 4.04Å
543	F	88.4	Confident	86	Confident	21 Å²	21	42 Å²	42	9%	0.092	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-42.6	179.8	177.3	-110.1	0	0	0	112.9	L505 L508 K509 F512 D539 V540 V541 E546 K547	L505-F543 HydrophobicContact CD2-CB 4.2Å; L505-F543 HydrophobicContact CD2-CD1 4.11Å; L505-F543 HydrophobicContact CD2-CG 4.28Å; L508-F543 HydrophobicContact CB-CE1 4.29Å; K509-F543 HydrophobicContact CB-CZ 4.32Å; K509-F543 HydrophobicContact CD-CE2 4.42Å; K509-F543 HydrophobicContact CD-CZ 4.43Å; K509-F543 HydrophobicContact CG-CE1 4.05Å; K509-F543 HydrophobicContact CG-CE2 3.74Å; K509-F543 HydrophobicContact CG-CZ 3.33Å; F512-F543 AromaticContact CD2-CE1 3.7Å; F512-F543 HydrophobicContact CD2-CE1 3.7Å; F512-F543 HydrophobicContact CD2-CZ 4.06Å; F512-F543 HydrophobicContact CE2-CD1 4.47Å; F512-F543 AromaticContact CE2-CE1 3.74Å; F512-F543 HydrophobicContact CE2-CE1 3.74Å; D539-F543 WeakPolarHBondContact O-CB 2.8Å; D539-F543 PolarHBondContact O-N 2.94Å; V540-F543 PolarHBondContact O-N 3.27Å; V541-F543 VanDerWaalsContact C-N 3.34Å; V541-F543 PolarHBondContact O-N 3.23Å; F543-E546 PolarHBondContact O-N 3.37Å; F543-K547 HydrophobicContact CE1-CG 4.49Å; F543-K547 HydrophobicContact CE2-CG 4.16Å; F543-K547 HydrophobicContact CZ-CG 4.09Å; F543-K547 WeakPolarHBondContact O-CG 3.42Å; F543-K547 PolarHBondContact O-N 3.29Å; F543-K547 VanDerWaalsContact O-N 3.13Å
544	L	88.4	Confident	86	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-67.2	-38.7	177.7	-71.6	172.2	0	0	0	112.1	F512 V518 P528 L529 A532 V540 V541 K542 K547 G548 A549	F512-L544 HydrophobicContact CE2-CD2 3.65Å; F512-L544 HydrophobicContact CZ-CD2 3.59Å; V518-L544 HydrophobicContact CG1-CD2 4.03Å; P528-L544 HydrophobicContact CB-CD1 3.89Å; P528-L544 HydrophobicContact CB-CD2 4.12Å; L529-L544 HydrophobicContact CB-CD1 4.34Å; L529-L544 HydrophobicContact CD1-CB 4.19Å; L529-L544 HydrophobicContact CD1-CD1 4.42Å; A532-L544 HydrophobicContact CB-CD1 4.18Å; V540-L544 HydrophobicContact CG1-CD1 3.84Å; V540-L544 HydrophobicContact CG1-CG 4.23Å; V540-L544 WeakPolarHBondContact O-CB 3.36Å; V540-L544 VanDerWaalsContact O-CG 3.26Å; V540-L544 WeakPolarHBondContact O-CG 3.37Å; V540-L544 PolarHBondContact O-N 3.17Å; V541-L544 PolarHBondContact O-N 3.33Å; K542-L544 PolarHBondContact O-N 3.05Å; L544-K547 CarbonylContact O-C 3.54Å; L544-K547 PolarHBondContact O-N 3.49Å; L544-G548 PolarHBondContact O-N 2.88Å; L544-A549 HydrophobicContact CB-CB 4.12Å; L544-A549 WeakPolarHBondContact O-CB 3.18Å; L544-A549 PolarHBondContact O-N 2.72Å
545	L	88.6	Confident	86	Confident	35 Å²	35	42.5 Å²	42.5	18%	0.183	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-40.6	175.4	-69.5	177.2	0	0	0	112.1	L529 V541 K542 K547 G548 V551 L576	L529-L545 HydrophobicContact CD1-CD2 4.34Å; L529-L545 HydrophobicContact CD1-CG 4.38Å; L529-L545 HydrophobicContact CD2-CD2 4.07Å; V541-L545 HydrophobicContact CG1-CD1 4.11Å; V541-L545 HydrophobicContact CG1-CG 4.46Å; V541-L545 WeakPolarHBondContact O-CG 3.36Å; V541-L545 PolarHBondContact O-N 3.48Å; K542-L545 PolarHBondContact O-N 3.23Å; L545-K547 PolarHBondContact O-N 3.28Å; L545-G548 PolarHBondContact O-N 3.13Å; L545-V551 HydrophobicContact CD2-CG2 3.62Å; L545-L576 HydrophobicContact CD1-CD2 3.43Å; L545-L576 VanDerWaalsContact CD1-CD2 3.43Å; L545-L576 HydrophobicContact CD1-CG 3.99Å
546	E	88.6	Confident	86.2	Confident	154 Å²	154	43 Å²	43	72%	0.72	23%	0.233	S	C	*	.	H	α-helix	trans	-60.6	-31.6	173.2	-74.9	172.3	-170.9	0	0	112.4	K542 F543 G548	K542-E546 WeakPolarHBondContact O-CG 3.48Å; K542-E546 PolarHBondContact O-N 3.41Å; F543-E546 PolarHBondContact O-N 3.37Å; E546-G548 VanDerWaalsContact C-N 3.26Å; E546-G548 PolarHBondContact O-N 2.65Å
547	K	84.6	Confident	86.4	Confident	110 Å²	110	48.5 Å²	48.5	48%	0.478	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	4	175.3	-67.4	-66.7	-177.7	-179.2	0	113.9	V518 F543 L544 L545	V518-K547 HydrophobicContact CG1-CB 4.44Å; V518-K547 HydrophobicContact CG2-CB 4.06Å; F543-K547 HydrophobicContact CE1-CG 4.49Å; F543-K547 HydrophobicContact CE2-CG 4.16Å; F543-K547 HydrophobicContact CZ-CG 4.09Å; F543-K547 WeakPolarHBondContact O-CG 3.42Å; F543-K547 PolarHBondContact O-N 3.29Å; F543-K547 VanDerWaalsContact O-N 3.13Å; L544-K547 CarbonylContact O-C 3.54Å; L544-K547 PolarHBondContact O-N 3.49Å; L545-K547 PolarHBondContact O-N 3.28Å
548	G	84.6	Confident	86.5	Confident	56 Å²	56	51 Å²	51	58%	0.577	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	26.4	173.6	0	0	0	0	0	115.1	L544 L545 E546	L544-G548 PolarHBondContact O-N 2.88Å; L545-G548 PolarHBondContact O-N 3.13Å; E546-G548 VanDerWaalsContact C-N 3.26Å; E546-G548 PolarHBondContact O-N 2.65Å
549	A	88.4	Confident	86.7	Confident	7 Å²	7	52.5 Å²	52.5	6%	0.058	27%	0.274	C	S	.	.			trans	-58.7	138.9	176.1	0	0	0	0	0	112.5	V518 D519 L529 L544 V551	V518-A549 HydrophobicContact CG1-CB 3.76Å; D519-A549 WeakPolarHBondContact OD1-CA 3.33Å; L529-A549 HydrophobicContact CB-CB 4.33Å; L529-A549 HydrophobicContact CD2-CB 4.02Å; L544-A549 HydrophobicContact CB-CB 4.12Å; L544-A549 WeakPolarHBondContact O-CB 3.18Å; L544-A549 PolarHBondContact O-N 2.72Å; A549-V551 PolarHBondContact O-N 3.43Å; A549-V551 VanDerWaalsContact O-N 3.14Å
550	N	87.6	Confident	86.9	Confident	81 Å²	81	48 Å²	48	43%	0.433	25%	0.249	S	C	.	.			trans	-73.1	107.4	179.6	-174.5	-9.7	0	0	0	111.6	D519 N552 A553	D519-N550 VanDerWaalsContact CG-N 3.34Å; D519-N550 PolarHBondContact OD1-N 2.79Å; D519-N550 WeakPolarHBondContact OD2-CB 3.26Å; D519-N550 PolarHBondContact OD2-N 3.31Å; D519-N550 VanDerWaalsContact OD2-N 3.07Å; N550-N552 PolarHBondContact O-N 2.9Å; N550-N552 PolarHBondContact OD1-N 3.02Å; N550-A553 HydrophobicContact CB-CB 4.32Å; N550-A553 WeakPolarHBondContact O-CB 3.21Å; N550-A553 PolarHBondContact O-N 2.95Å; N550-A553 PolarHBondContact OD1-N 3.47Å
551	V	89.1	Confident	87.2	Confident	15 Å²	15	47.8 Å²	47.8	9%	0.091	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.5	-177.6	-167.1	0	0	0	0	113.1	L545 A549 P561 L577 A582	L545-V551 HydrophobicContact CD2-CG2 3.62Å; A549-V551 PolarHBondContact O-N 3.43Å; A549-V551 VanDerWaalsContact O-N 3.14Å; V551-P561 VanDerWaalsContact O-CD 3.29Å; V551-P561 WeakPolarHBondContact O-CD 3.36Å; V551-P561 WeakPolarHBondContact O-CG 3.33Å; V551-L577 HydrophobicContact CG1-CB 4.48Å; V551-L577 HydrophobicContact CG1-CD2 3.9Å; V551-A582 HydrophobicContact CG1-CB 3.66Å
552	N	88.2	Confident	87.3	Confident	64 Å²	64	47.9 Å²	47.9	34%	0.342	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	17.3	-177.7	-66.6	-53.8	0	0	0	112.8	N550 G581 A582 A583	N550-N552 PolarHBondContact O-N 2.9Å; N550-N552 PolarHBondContact OD1-N 3.02Å; N552-G581 PolarHBondContact ND2-O 3.44Å; N552-G581 VanDerWaalsContact ND2-O 3.09Å; N552-A582 WeakPolarHBondContact OD1-CA 3.42Å; N552-A583 PolarHBondContact OD1-N 3.17Å
553	A	87.1	Confident	87.3	Confident	9 Å²	9	43.7 Å²	43.7	7%	0.074	23%	0.231	C	C	.	.			trans	-56.5	146.1	172	0	0	0	0	0	110.6	T527 M530 N550 T560 P561	T527-A553 HydrophobicContact CG2-CB 3.95Å; M530-A553 HydrophobicContact CE-CB 3.83Å; M530-A553 WeakPolarHBondContact CE-O 3.33Å; N550-A553 HydrophobicContact CB-CB 4.32Å; N550-A553 WeakPolarHBondContact O-CB 3.21Å; N550-A553 PolarHBondContact O-N 2.95Å; N550-A553 PolarHBondContact OD1-N 3.47Å; A553-T560 WeakPolarHBondContact O-CA 3.29Å; A553-P561 WeakPolarHBondContact O-CD 3.38Å
554	T	85.9	Confident	87.3	Confident	52 Å²	52	43.5 Å²	43.5	32%	0.319	23%	0.23	S	C	.	.			trans	-120.4	138	180	57.4	0	0	0	0	112.4	K521 W559 T560	K521-T554 PolarHBondContact NZ-O 3.38Å; T554-W559 WeakPolarHBondContact CA-O 3.36Å; T554-T560 HydrophobicContact CG2-CG2 4.04Å
555	D	85.9	Confident	87.2	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.043	23%	0.229	C	C	.	.			trans	-79.3	179.5	173	-161.1	15.3	0	0	0	111.9	Y525 K526 M530 F557 L558 W559 F564	Y525-D555 WeakPolarHBondContact CA-OD1 3.3Å; Y525-D555 WeakPolarHBondContact CB-OD1 3.45Å; K526-D555 WeakPolarHBondContact CE-OD2 3.4Å; K526-D555 VanDerWaalsContact CG-OD2 3.31Å; K526-D555 WeakPolarHBondContact CG-OD2 3.48Å; K526-D555 PolarHBondContact N-OD1 3.14Å; M530-D555 HydrophobicContact CE-CB 4.35Å; M530-D555 HydrophobicContact SD-CB 3.97Å; D555-F557 PolarHBondContact O-N 2.85Å; D555-L558 WeakPolarHBondContact O-CA 3.35Å; D555-L558 PolarHBondContact O-N 3.45Å; D555-W559 HydrophobicContact CB-CB 4.33Å; D555-W559 PolarHBondContact N-O 2.85Å; D555-F564 HydrophobicContact CB-CE2 4.37Å; D555-F564 HydrophobicContact CB-CZ 4.49Å
556	N	83.4	Confident	87.1	Confident	44 Å²	44	41.8 Å²	41.8	24%	0.235	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-26.1	174.3	-91.7	-13.5	0	0	0	114.6	C436 S524 Y525 I589	C436-N556 PolarHBondContact O-ND2 3.12Å; S524-N556 WeakPolarHBondContact O-CB 3.46Å; S524-N556 PolarHBondContact O-ND2 3.01Å; Y525-N556 VanDerWaalsContact CD2-CG 3.41Å; Y525-N556 WeakPolarHBondContact CD2-OD1 3.37Å; Y525-N556 VanDerWaalsContact CE2-OD1 3.26Å; Y525-N556 WeakPolarHBondContact CE2-OD1 3.49Å; Y525-N556 VanDerWaalsContact CG-OD1 3.3Å; N556-I589 WeakPolarHBondContact O-CD1 3.36Å
557	F	81.9	Confident	86.9	Confident	120 Å²	120	38.9 Å²	38.9	53%	0.526	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	12.1	178.1	-58.6	-71	0	0	0	114.1	D555 W559 I589	D555-F557 PolarHBondContact O-N 2.85Å; F557-W559 HydrophobicContact CB-CG 4.31Å; F557-W559 PolarHBondContact O-N 2.76Å; F557-I589 PolarHBondContact O-N 3.32Å
558	L	84.3	Confident	86.7	Confident	81 Å²	81	35.1 Å²	35.1	42%	0.424	20%	0.197	S	C	.	.			trans	58.4	28.8	-169.2	-59.9	170.6	0	0	0	113	D555 I589	D555-L558 WeakPolarHBondContact O-CA 3.35Å; D555-L558 PolarHBondContact O-N 3.45Å; L558-I589 HydrophobicContact CB-CG1 4.38Å; L558-I589 HydrophobicContact CD1-CG1 3.85Å; L558-I589 HydrophobicContact CG-CG1 3.98Å
559	W	87.8	Confident	86.4	Confident	53 Å²	53	32.8 Å²	32.8	20%	0.201	17%	0.173	C	C	.	.			trans	-82.2	129.6	175	-77.6	24.8	0	0	0	110	M530 T554 D555 F557 H563 F564	M530-W559 WeakPolarHBondContact CE-O 3.49Å; T554-W559 WeakPolarHBondContact CA-O 3.36Å; D555-W559 HydrophobicContact CB-CB 4.33Å; D555-W559 PolarHBondContact N-O 2.85Å; F557-W559 HydrophobicContact CB-CG 4.31Å; F557-W559 PolarHBondContact O-N 2.76Å; W559-H563 HydrophobicContact CB-CB 4.19Å; W559-H563 HydrophobicContact CD2-CB 4.35Å; W559-H563 HydrophobicContact CE3-CB 4.5Å; W559-H563 HydrophobicContact CG-CB 4.22Å; W559-F564 HydrophobicContact CB-CD2 4.29Å; W559-F564 HydrophobicContact CB-CE2 3.66Å; W559-F564 HydrophobicContact CB-CZ 4.09Å; W559-F564 HydrophobicContact CD2-CZ 4.42Å; W559-F564 AromaticContact CE3-CD1 3.86Å; W559-F564 HydrophobicContact CE3-CD1 3.86Å; W559-F564 HydrophobicContact CE3-CD2 4.35Å; W559-F564 AromaticContact CE3-CE1 3.54Å; W559-F564 HydrophobicContact CE3-CE1 3.54Å; W559-F564 HydrophobicContact CE3-CE2 4.06Å; W559-F564 HydrophobicContact CE3-CG 4.26Å; W559-F564 AromaticContact CE3-CZ 3.65Å; W559-F564 HydrophobicContact CE3-CZ 3.65Å; W559-F564 HydrophobicContact CZ3-CD1 4.15Å; W559-F564 AromaticContact CZ3-CE1 3.94Å; W559-F564 HydrophobicContact CZ3-CE1 3.94Å; W559-F564 HydrophobicContact CZ3-CZ 4.47Å
560	T	89.7	Confident	86.1	Confident	6 Å²	6	33.3 Å²	33.3	4%	0.037	17%	0.174	C	C	.	.			trans	-89.3	161.6	172.5	61.9	0	0	0	0	111.1	A553 T554 L562 H563 F564 A586	A553-T560 WeakPolarHBondContact O-CA 3.29Å; T554-T560 HydrophobicContact CG2-CG2 4.04Å; T560-L562 PolarHBondContact O-N 3.35Å; T560-L562 VanDerWaalsContact O-N 3.09Å; T560-H563 PolarHBondContact N-ND1 2.91Å; T560-H563 WeakPolarHBondContact O-CB 3.49Å; T560-H563 PolarHBondContact O-N 3.47Å; T560-H563 PolarHBondContact OG1-ND1 3.29Å; T560-F564 WeakPolarHBondContact O-CD2 3.44Å; T560-F564 PolarHBondContact O-N 3.39Å; T560-A586 HydrophobicContact CG2-CB 3.88Å
561	P	91.3	Very high	85.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-46.6	-37.2	169.6	-30.7	34.2	0	0	0	113.6	L529 M530 V551 A553 H563 F564 A565 L577	L529-P561 HydrophobicContact CD2-CB 4.19Å; L529-P561 HydrophobicContact CD2-CG 3.89Å; L529-P561 HydrophobicContact CG-CB 4.17Å; L529-P561 HydrophobicContact CG-CG 4.13Å; M530-P561 HydrophobicContact CG-CG 3.94Å; V551-P561 VanDerWaalsContact O-CD 3.29Å; V551-P561 WeakPolarHBondContact O-CD 3.36Å; V551-P561 WeakPolarHBondContact O-CG 3.33Å; A553-P561 WeakPolarHBondContact O-CD 3.38Å; P561-H563 PolarHBondContact O-N 3.09Å; P561-F564 PolarHBondContact O-N 3.49Å; P561-A565 PolarHBondContact O-N 3.41Å; P561-L577 HydrophobicContact CB-CD1 4.25Å; P561-L577 HydrophobicContact CB-CD2 4.15Å
562	L	90.9	Very high	85.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-63.6	-38.1	176.4	-170.7	63.9	0	0	0	113	T560 F564 A565 C566 V574 L577 I578 A582 P594	T560-L562 PolarHBondContact O-N 3.35Å; T560-L562 VanDerWaalsContact O-N 3.09Å; L562-F564 VanDerWaalsContact C-N 3.34Å; L562-F564 PolarHBondContact O-N 2.9Å; L562-A565 PolarHBondContact O-N 2.97Å; L562-C566 WeakPolarHBondContact O-CB 3.27Å; L562-C566 PolarHBondContact O-N 3.42Å; L562-C566 PolarHBondContact O-SG 2.97Å; L562-V574 HydrophobicContact CD1-CB 4.39Å; L562-V574 HydrophobicContact CD1-CG1 3.98Å; L562-V574 HydrophobicContact CD1-CG2 4.31Å; L562-L577 HydrophobicContact CD1-CB 4.28Å; L562-L577 HydrophobicContact CD1-CD1 4.32Å; L562-I578 HydrophobicContact CD1-CD1 4.44Å; L562-I578 HydrophobicContact CD1-CG1 4.15Å; L562-I578 HydrophobicContact CD2-CG1 4.47Å; L562-A582 HydrophobicContact CB-CB 4.33Å; L562-A582 HydrophobicContact CD2-CB 4.11Å; L562-P594 HydrophobicContact CD2-CB 4.06Å; L562-P594 HydrophobicContact CD2-CG 3.89Å; L562-P594 HydrophobicContact CG-CB 3.99Å; L562-P594 HydrophobicContact CG-CG 4.13Å
563	H	88.8	Confident	85.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-42	174.1	-74.1	86.5	0	0	0	111.8	W559 T560 P561 C566 H567 A586 S592	W559-H563 HydrophobicContact CB-CB 4.19Å; W559-H563 HydrophobicContact CD2-CB 4.35Å; W559-H563 HydrophobicContact CE3-CB 4.5Å; W559-H563 HydrophobicContact CG-CB 4.22Å; T560-H563 PolarHBondContact N-ND1 2.91Å; T560-H563 WeakPolarHBondContact O-CB 3.49Å; T560-H563 PolarHBondContact O-N 3.47Å; T560-H563 PolarHBondContact OG1-ND1 3.29Å; P561-H563 PolarHBondContact O-N 3.09Å; H563-C566 PolarHBondContact O-N 2.86Å; H563-H567 VanDerWaalsContact O-CB 3.32Å; H563-H567 WeakPolarHBondContact O-CB 3.12Å; H563-H567 PolarHBondContact O-N 3.49Å; H563-A586 PolarHBondContact CE1-O 2.83Å; H563-A586 PolarHBondContact NE2-O 3.2Å; H563-S592 PolarHBondContact NE2-O 3.09Å; H563-S592 VanDerWaalsContact NE2-O 3.13Å
564	F	87.6	Confident	85.7	Confident	16 Å²	16	32.1 Å²	32.1	7%	0.07	16%	0.164	C	C	.	.	H	α-helix	trans	-65.7	-44.1	177.4	-73.7	-78.1	0	0	0	111.6	M530 C533 A534 D555 W559 T560 P561 L562 C566 H567 A568	M530-F564 HydrophobicContact CB-CD2 3.81Å; M530-F564 HydrophobicContact CB-CE2 3.89Å; M530-F564 HydrophobicContact CB-CG 4.49Å; M530-F564 HydrophobicContact CG-CD2 3.91Å; M530-F564 HydrophobicContact CG-CE2 3.91Å; M530-F564 HydrophobicContact SD-CD2 4.47Å; M530-F564 HydrophobicContact SD-CE2 3.88Å; C533-F564 HydrophobicContact CB-CB 4.21Å; A534-F564 HydrophobicContact CB-CB 4.31Å; A534-F564 HydrophobicContact CB-CD1 4.08Å; D555-F564 HydrophobicContact CB-CE2 4.37Å; D555-F564 HydrophobicContact CB-CZ 4.49Å; W559-F564 HydrophobicContact CB-CD2 4.29Å; W559-F564 HydrophobicContact CB-CE2 3.66Å; W559-F564 HydrophobicContact CB-CZ 4.09Å; W559-F564 HydrophobicContact CD2-CZ 4.42Å; W559-F564 AromaticContact CE3-CD1 3.86Å; W559-F564 HydrophobicContact CE3-CD1 3.86Å; W559-F564 HydrophobicContact CE3-CD2 4.35Å; W559-F564 AromaticContact CE3-CE1 3.54Å; W559-F564 HydrophobicContact CE3-CE1 3.54Å; W559-F564 HydrophobicContact CE3-CE2 4.06Å; W559-F564 HydrophobicContact CE3-CG 4.26Å; W559-F564 AromaticContact CE3-CZ 3.65Å; W559-F564 HydrophobicContact CE3-CZ 3.65Å; W559-F564 HydrophobicContact CZ3-CD1 4.15Å; W559-F564 AromaticContact CZ3-CE1 3.94Å; W559-F564 HydrophobicContact CZ3-CE1 3.94Å; W559-F564 HydrophobicContact CZ3-CZ 4.47Å; T560-F564 WeakPolarHBondContact O-CD2 3.44Å; T560-F564 PolarHBondContact O-N 3.39Å; P561-F564 PolarHBondContact O-N 3.49Å; L562-F564 VanDerWaalsContact C-N 3.34Å; L562-F564 PolarHBondContact O-N 2.9Å; F564-C566 PolarHBondContact O-N 3Å; F564-H567 PolarHBondContact O-N 3.05Å; F564-A568 WeakPolarHBondContact O-CB 3.48Å; F564-A568 PolarHBondContact O-N 3.19Å
565	A	87.1	Confident	85.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-41	176.7	0	0	0	0	0	112.5	C533 P561 L562 A568 G569 Q570 I573 V574 L577	C533-A565 HydrophobicContact CB-CB 4.19Å; P561-A565 PolarHBondContact O-N 3.41Å; L562-A565 PolarHBondContact O-N 2.97Å; A565-A568 PolarHBondContact O-N 2.89Å; A565-G569 PolarHBondContact O-N 3.22Å; A565-Q570 PolarHBondContact O-N 3.22Å; A565-Q570 VanDerWaalsContact O-N 3.13Å; A565-I573 HydrophobicContact CB-CB 4.42Å; A565-I573 HydrophobicContact CB-CG2 3.82Å; A565-V574 HydrophobicContact CB-CG2 3.77Å; A565-L577 HydrophobicContact CB-CD1 3.82Å
566	C	86.7	Confident	86.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.7	-40.2	177.3	-68	0	0	0	0	112.3	L562 H563 F564 G569 P594 R597 A598 S601	L562-C566 WeakPolarHBondContact O-CB 3.27Å; L562-C566 PolarHBondContact O-N 3.42Å; L562-C566 PolarHBondContact O-SG 2.97Å; H563-C566 PolarHBondContact O-N 2.86Å; F564-C566 PolarHBondContact O-N 3Å; C566-G569 PolarHBondContact O-N 3.48Å; C566-P594 HydrophobicContact CB-CB 4.49Å; C566-P594 WeakPolarHBondContact CB-O 3.41Å; C566-R597 HydrophobicContact CB-CB 4.27Å; C566-A598 HydrophobicContact CB-CB 4.06Å; C566-S601 PolarHBondContact O-OG 3.48Å
567	H	84.2	Confident	86.4	Confident	94 Å²	94	31.3 Å²	31.3	44%	0.435	16%	0.156	S	C	.	.	H	α-helix	trans	-67	-38.5	175.4	-174.3	63.9	0	0	0	112.1	H563 F564 G569 R597 S601	H563-H567 VanDerWaalsContact O-CB 3.32Å; H563-H567 WeakPolarHBondContact O-CB 3.12Å; H563-H567 PolarHBondContact O-N 3.49Å; F564-H567 PolarHBondContact O-N 3.05Å; H567-G569 PolarHBondContact O-N 3.16Å; H567-R597 HydrophobicContact CB-CB 4.46Å; H567-S601 WeakPolarHBondContact O-CB 3.45Å
568	A	80.7	Confident	86.7	Confident	31 Å²	31	27 Å²	27	26%	0.256	14%	0.138	S	C	.	.	H	α-helix	trans	-74.8	-11.1	174.1	0	0	0	0	0	113.5	F564 A565 Q570	F564-A568 WeakPolarHBondContact O-CB 3.48Å; F564-A568 PolarHBondContact O-N 3.19Å; A565-A568 PolarHBondContact O-N 2.89Å; A568-Q570 HydrophobicContact CB-CG 3.99Å; A568-Q570 PolarHBondContact O-N 3.27Å; A568-Q570 PolarHBondContact O-NE2 3.04Å
569	G	77.9	Confident	87	Confident	7 Å²	7	30.8 Å²	30.8	7%	0.072	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	20.4	175.6	0	0	0	0	0	115.3	A565 C566 H567 Q571	A565-G569 PolarHBondContact O-N 3.22Å; C566-G569 PolarHBondContact O-N 3.48Å; H567-G569 PolarHBondContact O-N 3.16Å; G569-Q571 PolarHBondContact O-N 2.93Å
570	Q	81.6	Confident	86.9	Confident	18 Å²	18	30.6 Å²	30.6	8%	0.084	16%	0.158	C	C	.	.			trans	-93.5	92.1	-171.2	-59.5	-63	-38.6	0	0	111.5	A565 A568 D572 I573 V574 F745	A565-Q570 PolarHBondContact O-N 3.22Å; A565-Q570 VanDerWaalsContact O-N 3.13Å; A568-Q570 HydrophobicContact CB-CG 3.99Å; A568-Q570 PolarHBondContact O-N 3.27Å; A568-Q570 PolarHBondContact O-NE2 3.04Å; Q570-D572 PolarHBondContact O-N 2.88Å; Q570-I573 HydrophobicContact CB-CB 4.14Å; Q570-I573 HydrophobicContact CB-CD1 3.94Å; Q570-I573 HydrophobicContact CB-CG1 4.24Å; Q570-I573 HydrophobicContact CG-CD1 4.3Å; Q570-I573 PolarHBondContact O-N 3.08Å; Q570-V574 WeakPolarHBondContact O-CG2 3.44Å; Q570-V574 PolarHBondContact O-N 3.06Å; Q570-V574 VanDerWaalsContact O-N 3.09Å; Q570-F745 VanDerWaalsContact NE2-CZ 3.3Å
571	Q	82.9	Confident	86.7	Confident	56 Å²	56	32.6 Å²	32.6	26%	0.262	18%	0.18	S	C	.	.	H	α-helix	trans	-57.1	-50.8	-176.8	-176.4	-179.5	-15.8	0	0	112.8	G569 I573 V574 E575 T606	G569-Q571 PolarHBondContact O-N 2.93Å; Q571-I573 PolarHBondContact O-N 3.47Å; Q571-I573 VanDerWaalsContact O-N 3.11Å; Q571-V574 CarbonylContact O-C 3.56Å; Q571-V574 WeakPolarHBondContact O-CA 3.34Å; Q571-V574 VanDerWaalsContact O-CB 3.31Å; Q571-V574 WeakPolarHBondContact O-CB 3.47Å; Q571-V574 PolarHBondContact O-N 3.42Å; Q571-E575 HydrophobicContact CG-CG 4.06Å; Q571-E575 PolarHBondContact NE2-OE1 3.13Å; Q571-E575 VanDerWaalsContact O-CG 3.29Å; Q571-E575 WeakPolarHBondContact O-CG 3.46Å; Q571-E575 PolarHBondContact O-N 3.24Å; Q571-T606 HydrophobicContact CB-CG2 3.82Å
572	D	85.9	Confident	86.6	Confident	85 Å²	85	33 Å²	33	46%	0.455	18%	0.183	S	C	.	.	H	α-helix	trans	-54.6	-37.5	-176.9	-58.5	-15.1	0	0	0	112.8	L538 Q570 L576	L538-D572 HydrophobicContact CD1-CB 4.29Å; Q570-D572 PolarHBondContact O-N 2.88Å; D572-L576 VanDerWaalsContact O-CB 3.3Å; D572-L576 WeakPolarHBondContact O-CB 3.24Å; D572-L576 PolarHBondContact O-N 3.09Å
573	I	87.7	Confident	86.4	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-73.7	-40	177.5	-63.5	175.3	0	0	0	110.2	C533 L538 V541 A565 Q570 Q571 E575 L576 L577	C533-I573 HydrophobicContact CB-CG2 4.31Å; L538-I573 HydrophobicContact CD1-CG1 3.79Å; V541-I573 HydrophobicContact CG1-CG2 4.26Å; V541-I573 HydrophobicContact CG2-CD1 4.24Å; V541-I573 HydrophobicContact CG2-CG2 4.26Å; A565-I573 HydrophobicContact CB-CB 4.42Å; A565-I573 HydrophobicContact CB-CG2 3.82Å; Q570-I573 HydrophobicContact CB-CB 4.14Å; Q570-I573 HydrophobicContact CB-CD1 3.94Å; Q570-I573 HydrophobicContact CB-CG1 4.24Å; Q570-I573 HydrophobicContact CG-CD1 4.3Å; Q570-I573 PolarHBondContact O-N 3.08Å; Q571-I573 PolarHBondContact O-N 3.47Å; Q571-I573 VanDerWaalsContact O-N 3.11Å; I573-E575 VanDerWaalsContact C-N 3.35Å; I573-L576 PolarHBondContact O-N 2.97Å; I573-L577 HydrophobicContact CG2-CD1 3.86Å; I573-L577 HydrophobicContact CG2-CG 4.18Å; I573-L577 WeakPolarHBondContact O-CB 3.39Å; I573-L577 WeakPolarHBondContact O-CG 3.34Å; I573-L577 PolarHBondContact O-N 3.19Å
574	V	88	Confident	86.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-45.9	173.3	169.8	0	0	0	0	110.8	L562 A565 Q570 Q571 L576 L577 I578 Y609 L610	L562-V574 HydrophobicContact CD1-CB 4.39Å; L562-V574 HydrophobicContact CD1-CG1 3.98Å; L562-V574 HydrophobicContact CD1-CG2 4.31Å; A565-V574 HydrophobicContact CB-CG2 3.77Å; Q570-V574 WeakPolarHBondContact O-CG2 3.44Å; Q570-V574 PolarHBondContact O-N 3.06Å; Q570-V574 VanDerWaalsContact O-N 3.09Å; Q571-V574 CarbonylContact O-C 3.56Å; Q571-V574 WeakPolarHBondContact O-CA 3.34Å; Q571-V574 VanDerWaalsContact O-CB 3.31Å; Q571-V574 WeakPolarHBondContact O-CB 3.47Å; Q571-V574 PolarHBondContact O-N 3.42Å; V574-L576 VanDerWaalsContact C-N 3.35Å; V574-L576 PolarHBondContact O-N 3.39Å; V574-L577 PolarHBondContact O-N 3.24Å; V574-I578 HydrophobicContact CG1-CD1 3.85Å; V574-I578 VanDerWaalsContact O-CG1 3.32Å; V574-I578 WeakPolarHBondContact O-CG1 3.42Å; V574-I578 PolarHBondContact O-N 2.69Å; V574-Y609 HydrophobicContact CG1-CD1 4.04Å; V574-Y609 HydrophobicContact CG1-CE1 4.25Å; V574-L610 HydrophobicContact CG1-CD2 4.01Å; V574-L610 HydrophobicContact CG1-CG 4.42Å
575	E	89.1	Confident	86.1	Confident	46 Å²	46	38 Å²	38	22%	0.215	22%	0.217	C	C	.	.	H	α-helix	trans	-61.9	-44.2	176.8	-48	-157	166.6	0	0	111.8	Q571 I573 I578 K579 Y609	Q571-E575 HydrophobicContact CG-CG 4.06Å; Q571-E575 PolarHBondContact NE2-OE1 3.13Å; Q571-E575 VanDerWaalsContact O-CG 3.29Å; Q571-E575 WeakPolarHBondContact O-CG 3.46Å; Q571-E575 PolarHBondContact O-N 3.24Å; I573-E575 VanDerWaalsContact C-N 3.35Å; E575-I578 PolarHBondContact O-N 3.13Å; E575-K579 WeakPolarHBondContact O-CB 3.28Å; E575-K579 VanDerWaalsContact O-CG 3.27Å; E575-K579 WeakPolarHBondContact O-CG 3.45Å; E575-K579 PolarHBondContact O-N 3.09Å; E575-K579 IonicContact OE2-NZ 3.33Å; E575-Y609 HydrophobicContact CB-CE1 4Å; E575-Y609 WeakPolarHBondContact CB-OH 3.26Å; E575-Y609 HydrophobicContact CG-CD1 4.21Å; E575-Y609 HydrophobicContact CG-CD2 4.44Å; E575-Y609 HydrophobicContact CG-CE1 3.61Å; E575-Y609 HydrophobicContact CG-CE2 3.88Å; E575-Y609 VanDerWaalsContact CG-CZ 3.41Å; E575-Y609 WeakPolarHBondContact OE1-CE2 3.36Å
576	L	90.1	Very high	86	Confident	42 Å²	42	38.8 Å²	38.8	22%	0.22	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-43.5	-179.9	-168.1	100.3	0	0	0	111.6	L538 V541 K542 L545 D572 I573 V574 K579 S580	L538-L576 HydrophobicContact CD1-CD2 4.45Å; V541-L576 HydrophobicContact CB-CD2 4.27Å; V541-L576 HydrophobicContact CG1-CD2 3.47Å; V541-L576 VanDerWaalsContact CG1-CD2 3.47Å; K542-L576 HydrophobicContact CG-CD1 3.94Å; K542-L576 HydrophobicContact CG-CD2 4.04Å; L545-L576 HydrophobicContact CD1-CD2 3.43Å; L545-L576 VanDerWaalsContact CD1-CD2 3.43Å; L545-L576 HydrophobicContact CD1-CG 3.99Å; D572-L576 VanDerWaalsContact O-CB 3.3Å; D572-L576 WeakPolarHBondContact O-CB 3.24Å; D572-L576 PolarHBondContact O-N 3.09Å; I573-L576 PolarHBondContact O-N 2.97Å; V574-L576 VanDerWaalsContact C-N 3.35Å; V574-L576 PolarHBondContact O-N 3.39Å; L576-K579 PolarHBondContact O-N 3.37Å; L576-S580 PolarHBondContact O-N 2.87Å; L576-S580 PolarHBondContact O-OG 3.29Å
577	L	89.6	Confident	85.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-40.1	177.6	-72.2	171.4	0	0	0	112	L529 V551 P561 L562 A565 I573 V574 S580 G581 A582	L529-L577 HydrophobicContact CD2-CD2 4.43Å; V551-L577 HydrophobicContact CG1-CB 4.48Å; V551-L577 HydrophobicContact CG1-CD2 3.9Å; P561-L577 HydrophobicContact CB-CD1 4.25Å; P561-L577 HydrophobicContact CB-CD2 4.15Å; L562-L577 HydrophobicContact CD1-CB 4.28Å; L562-L577 HydrophobicContact CD1-CD1 4.32Å; A565-L577 HydrophobicContact CB-CD1 3.82Å; I573-L577 HydrophobicContact CG2-CD1 3.86Å; I573-L577 HydrophobicContact CG2-CG 4.18Å; I573-L577 WeakPolarHBondContact O-CB 3.39Å; I573-L577 WeakPolarHBondContact O-CG 3.34Å; I573-L577 PolarHBondContact O-N 3.19Å; V574-L577 PolarHBondContact O-N 3.24Å; L577-S580 WeakPolarHBondContact CA-OG 3.47Å; L577-S580 CarbonylContact O-C 3.55Å; L577-S580 PolarHBondContact O-N 3.09Å; L577-S580 PolarHBondContact O-OG 3.33Å; L577-G581 PolarHBondContact O-N 3.12Å; L577-A582 HydrophobicContact CB-CB 4.09Å; L577-A582 WeakPolarHBondContact O-CB 3.11Å; L577-A582 PolarHBondContact O-N 3.31Å
578	I	89.2	Confident	85.9	Confident	30 Å²	30	38.4 Å²	38.4	15%	0.154	22%	0.224	C	C	.	.	H	α-helix	trans	-68.4	-41.7	177.5	-67	170.4	0	0	0	110.4	L562 V574 E575 S580 G581 V584 Y609 L610 I613	L562-I578 HydrophobicContact CD1-CD1 4.44Å; L562-I578 HydrophobicContact CD1-CG1 4.15Å; L562-I578 HydrophobicContact CD2-CG1 4.47Å; V574-I578 HydrophobicContact CG1-CD1 3.85Å; V574-I578 VanDerWaalsContact O-CG1 3.32Å; V574-I578 WeakPolarHBondContact O-CG1 3.42Å; V574-I578 PolarHBondContact O-N 2.69Å; E575-I578 PolarHBondContact O-N 3.13Å; I578-S580 PolarHBondContact O-N 2.93Å; I578-G581 PolarHBondContact O-N 3.39Å; I578-V584 HydrophobicContact CD1-CG2 4.28Å; I578-V584 HydrophobicContact CG1-CG2 4.26Å; I578-V584 HydrophobicContact CG2-CG2 4.42Å; I578-Y609 HydrophobicContact CD1-CE1 4.03Å; I578-L610 HydrophobicContact CD1-CD2 3.88Å; I578-I613 HydrophobicContact CD1-CD1 3.8Å; I578-I613 HydrophobicContact CG2-CD1 4.19Å; I578-I613 HydrophobicContact CG2-CG2 4.43Å
579	K	89.3	Confident	86	Confident	160 Å²	160	39.6 Å²	39.6	70%	0.696	23%	0.226	S	C	*	.	H	α-helix	trans	-59.9	-30.6	172.8	-74.8	170.4	-176.6	164.2	0	112.6	E575 L576 G581	E575-K579 WeakPolarHBondContact O-CB 3.28Å; E575-K579 VanDerWaalsContact O-CG 3.27Å; E575-K579 WeakPolarHBondContact O-CG 3.45Å; E575-K579 PolarHBondContact O-N 3.09Å; E575-K579 IonicContact OE2-NZ 3.33Å; L576-K579 PolarHBondContact O-N 3.37Å; K579-G581 VanDerWaalsContact C-N 3.33Å
580	S	86.4	Confident	86.1	Confident	49 Å²	49	43.3 Å²	43.3	34%	0.343	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	9.4	175.3	65.9	0	0	0	0	114.6	L576 L577 I578	L576-S580 PolarHBondContact O-N 2.87Å; L576-S580 PolarHBondContact O-OG 3.29Å; L577-S580 WeakPolarHBondContact CA-OG 3.47Å; L577-S580 CarbonylContact O-C 3.55Å; L577-S580 PolarHBondContact O-N 3.09Å; L577-S580 PolarHBondContact O-OG 3.33Å; I578-S580 PolarHBondContact O-N 2.93Å
581	G	85.6	Confident	86.1	Confident	48 Å²	48	45.4 Å²	45.4	50%	0.495	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	25.7	171.7	0	0	0	0	0	115.5	N552 L577 I578 K579	N552-G581 PolarHBondContact ND2-O 3.44Å; N552-G581 VanDerWaalsContact ND2-O 3.09Å; L577-G581 PolarHBondContact O-N 3.12Å; I578-G581 PolarHBondContact O-N 3.39Å; K579-G581 VanDerWaalsContact C-N 3.33Å
582	A	88.9	Confident	86.1	Confident	9 Å²	9	42.7 Å²	42.7	7%	0.074	24%	0.243	C	C	.	.			trans	-63.7	136.9	173.4	0	0	0	0	0	112.5	V551 N552 L562 L577 V584	V551-A582 HydrophobicContact CG1-CB 3.66Å; N552-A582 WeakPolarHBondContact OD1-CA 3.42Å; L562-A582 HydrophobicContact CB-CB 4.33Å; L562-A582 HydrophobicContact CD2-CB 4.11Å; L577-A582 HydrophobicContact CB-CB 4.09Å; L577-A582 WeakPolarHBondContact O-CB 3.11Å; L577-A582 PolarHBondContact O-N 3.31Å; A582-V584 PolarHBondContact O-N 3.48Å
583	A	87.1	Confident	86.2	Confident	45 Å²	45	38.9 Å²	38.9	37%	0.372	22%	0.223	S	C	.	.			trans	-72.1	108	173.8	0	0	0	0	0	111.1	N552 D585 A586	N552-A583 PolarHBondContact OD1-N 3.17Å; A583-D585 VanDerWaalsContact C-N 3.33Å; A583-D585 PolarHBondContact O-N 3.02Å; A583-A586 HydrophobicContact CB-CB 4.21Å; A583-A586 PolarHBondContact O-N 3.36Å
584	V	85.6	Confident	86.1	Confident	27 Å²	27	38.8 Å²	38.8	16%	0.164	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-35.6	-175.9	-177.9	0	0	0	0	112.8	I578 A582 P594 L610 I613 A615	I578-V584 HydrophobicContact CD1-CG2 4.28Å; I578-V584 HydrophobicContact CG1-CG2 4.26Å; I578-V584 HydrophobicContact CG2-CG2 4.42Å; A582-V584 PolarHBondContact O-N 3.48Å; V584-P594 VanDerWaalsContact O-CD 3.27Å; V584-P594 WeakPolarHBondContact O-CD 3.48Å; V584-P594 VanDerWaalsContact O-CG 3.3Å; V584-P594 WeakPolarHBondContact O-CG 3.49Å; V584-L610 HydrophobicContact CG1-CD2 4.38Å; V584-I613 HydrophobicContact CG2-CG2 4.14Å; V584-A615 HydrophobicContact CG1-CB 3.62Å
585	D	83.7	Confident	86.1	Confident	48 Å²	48	38.9 Å²	38.9	26%	0.257	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	23.4	-177.6	-64.4	-33.2	0	0	0	113.2	A583 M587 K616 I619	A583-D585 VanDerWaalsContact C-N 3.33Å; A583-D585 PolarHBondContact O-N 3.02Å; D585-M587 PolarHBondContact O-N 2.77Å; D585-K616 PolarHBondContact OD1-N 3.48Å; D585-K616 VanDerWaalsContact OD2-CD 3.22Å; D585-K616 WeakPolarHBondContact OD2-CD 3.36Å; D585-K616 WeakPolarHBondContact OD2-CE 2.95Å; D585-K616 WeakPolarHBondContact OD2-CG 3.39Å; D585-K616 IonicContact OD2-NZ 3.78Å; D585-I619 HydrophobicContact CB-CD1 4.29Å
586	A	84.8	Confident	85.9	Confident	18 Å²	18	36.9 Å²	36.9	15%	0.149	21%	0.213	C	C	.	.			trans	-59.1	136.9	179.3	0	0	0	0	0	111.2	T560 H563 A583 P594	T560-A586 HydrophobicContact CG2-CB 3.88Å; H563-A586 PolarHBondContact CE1-O 2.83Å; H563-A586 PolarHBondContact NE2-O 3.2Å; A583-A586 HydrophobicContact CB-CB 4.21Å; A583-A586 PolarHBondContact O-N 3.36Å; A586-P594 VanDerWaalsContact O-CD 3.29Å; A586-P594 WeakPolarHBondContact O-CD 3Å
587	M	84.7	Confident	85.6	Confident	83 Å²	83	35.6 Å²	35.6	41%	0.409	21%	0.206	S	C	.	.			trans	-104.6	129.9	-177.1	-64.5	178.3	70.6	0	0	111	D585 N591 I619	D585-M587 PolarHBondContact O-N 2.77Å; M587-N591 HydrophobicContact CE-CB 3.37Å; M587-N591 VanDerWaalsContact CE-CG 3.46Å; M587-I619 HydrophobicContact CE-CG2 4.03Å; M587-I619 HydrophobicContact SD-CG2 4.43Å
588	S	85.3	Confident	85.4	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.021	21%	0.206	C	C	.	.			trans	-74.8	176.7	169.9	85.1	0	0	0	0	112.2	N590 N591 S592	S588-N590 PolarHBondContact O-N 2.89Å; S588-N590 VanDerWaalsContact O-N 3.09Å; S588-N590 PolarHBondContact OG-N 2.93Å; S588-N590 VanDerWaalsContact OG-N 3.09Å; S588-N591 WeakPolarHBondContact O-CA 3.44Å; S588-N591 PolarHBondContact O-N 2.88Å; S588-S592 WeakPolarHBondContact CB-OG 3.49Å; S588-S592 PolarHBondContact N-O 3.28Å; S588-S592 PolarHBondContact OG-OG 3.46Å
589	I	82.2	Confident	85.1	Confident	56 Å²	56	34.2 Å²	34.2	29%	0.287	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-37.5	169.9	-80.2	-176.6	0	0	0	112	N556 F557 L558 N591 R622	N556-I589 WeakPolarHBondContact O-CD1 3.36Å; F557-I589 PolarHBondContact O-N 3.32Å; L558-I589 HydrophobicContact CB-CG1 4.38Å; L558-I589 HydrophobicContact CD1-CG1 3.85Å; L558-I589 HydrophobicContact CG-CG1 3.98Å; I589-N591 PolarHBondContact O-N 3.24Å; I589-R622 PolarHBondContact O-NE 3.34Å; I589-R622 PolarHBondContact O-NH2 2.85Å
590	N	79.9	Confident	84.7	Confident	85 Å²	85	28.5 Å²	28.5	46%	0.455	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	14	-179.4	-71.2	-24.5	0	0	0	113.9	S588 S592 R622	S588-N590 PolarHBondContact O-N 2.89Å; S588-N590 VanDerWaalsContact O-N 3.09Å; S588-N590 PolarHBondContact OG-N 2.93Å; S588-N590 VanDerWaalsContact OG-N 3.09Å; N590-S592 PolarHBondContact O-N 2.78Å; N590-R622 PolarHBondContact O-N 3.37Å
591	N	82.8	Confident	84.1	Confident	61 Å²	61	27.6 Å²	27.6	33%	0.326	17%	0.168	S	C	.	.			trans	59.4	19.8	-172	-65.7	-2.9	0	0	0	113.7	M587 S588 I589 N621 R622	M587-N591 HydrophobicContact CE-CB 3.37Å; M587-N591 VanDerWaalsContact CE-CG 3.46Å; S588-N591 WeakPolarHBondContact O-CA 3.44Å; S588-N591 PolarHBondContact O-N 2.88Å; I589-N591 PolarHBondContact O-N 3.24Å; N591-N621 PolarHBondContact O-OD1 3.12Å; N591-R622 HydrophobicContact CB-CG 4.49Å
592	S	82.6	Confident	83.6	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.			trans	-81.5	136.8	178.9	69.4	0	0	0	0	111.6	H563 S588 N590 S596 R597 N621	H563-S592 PolarHBondContact NE2-O 3.09Å; H563-S592 VanDerWaalsContact NE2-O 3.13Å; S588-S592 WeakPolarHBondContact CB-OG 3.49Å; S588-S592 PolarHBondContact N-O 3.28Å; S588-S592 PolarHBondContact OG-OG 3.46Å; N590-S592 PolarHBondContact O-N 2.78Å; S592-S596 WeakPolarHBondContact CB-OG 3.48Å; S592-R597 PolarHBondContact OG-NH1 3.39Å; S592-R597 PolarHBondContact OG-NH2 3.33Å; S592-N621 WeakPolarHBondContact CA-OD1 3.44Å
593	T	86.8	Confident	83	Confident	5 Å²	5	30.3 Å²	30.3	3%	0.031	17%	0.166	C	C	.	.			trans	-91.1	162.1	176.2	61.2	0	0	0	0	111.9	L595 S596 R597 I619	T593-L595 PolarHBondContact O-N 3.08Å; T593-S596 PolarHBondContact N-OG 3.24Å; T593-S596 VanDerWaalsContact N-OG 3.13Å; T593-S596 PolarHBondContact O-N 2.97Å; T593-S596 PolarHBondContact O-OG 3.25Å; T593-S596 PolarHBondContact OG1-N 3.06Å; T593-R597 PolarHBondContact O-N 3.06Å; T593-I619 HydrophobicContact CG2-CB 3.93Å; T593-I619 HydrophobicContact CG2-CD1 3.84Å; T593-I619 HydrophobicContact CG2-CG1 4.47Å; T593-I619 HydrophobicContact CG2-CG2 3.85Å
594	P	87	Confident	82.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-54.9	-37.3	171.1	-27	35	0	0	0	112.6	L562 C566 V584 A586 S596 R597 A598	L562-P594 HydrophobicContact CD2-CB 4.06Å; L562-P594 HydrophobicContact CD2-CG 3.89Å; L562-P594 HydrophobicContact CG-CB 3.99Å; L562-P594 HydrophobicContact CG-CG 4.13Å; C566-P594 HydrophobicContact CB-CB 4.49Å; C566-P594 WeakPolarHBondContact CB-O 3.41Å; V584-P594 VanDerWaalsContact O-CD 3.27Å; V584-P594 WeakPolarHBondContact O-CD 3.48Å; V584-P594 VanDerWaalsContact O-CG 3.3Å; V584-P594 WeakPolarHBondContact O-CG 3.49Å; A586-P594 VanDerWaalsContact O-CD 3.29Å; A586-P594 WeakPolarHBondContact O-CD 3Å; P594-S596 PolarHBondContact O-N 2.93Å; P594-R597 WeakPolarHBondContact O-CB 3.44Å; P594-R597 PolarHBondContact O-N 3.29Å; P594-R597 VanDerWaalsContact O-N 3.12Å; P594-A598 PolarHBondContact O-N 2.86Å
595	L	86.8	Confident	82.5	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-45.7	174.1	-179	65.4	0	0	0	111.8	T593 R597 A598 I599 V607 L610 L611 A615 F617 A627	T593-L595 PolarHBondContact O-N 3.08Å; L595-R597 PolarHBondContact O-N 3.28Å; L595-A598 PolarHBondContact O-N 2.97Å; L595-I599 HydrophobicContact CG-CD1 4.29Å; L595-I599 VanDerWaalsContact O-CG1 3.32Å; L595-I599 WeakPolarHBondContact O-CG1 3.28Å; L595-I599 PolarHBondContact O-N 2.81Å; L595-V607 HydrophobicContact CD1-CG1 4.2Å; L595-L610 HydrophobicContact CD1-CB 3.91Å; L595-L610 HydrophobicContact CD1-CD1 4.29Å; L595-L611 HydrophobicContact CD1-CD2 4.29Å; L595-L611 HydrophobicContact CD1-CG 4.27Å; L595-L611 HydrophobicContact CD2-CD2 4.03Å; L595-A615 HydrophobicContact CB-CB 4.38Å; L595-A615 HydrophobicContact CD2-CB 4.25Å; L595-F617 HydrophobicContact CD2-CB 3.93Å; L595-A627 HydrophobicContact CD2-CB 4.31Å
596	S	85	Confident	82.4	Confident	3 Å²	3	30 Å²	30	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-34.7	176.6	70.6	0	0	0	0	112.6	S592 T593 P594 I599 E600	S592-S596 WeakPolarHBondContact CB-OG 3.48Å; T593-S596 PolarHBondContact N-OG 3.24Å; T593-S596 VanDerWaalsContact N-OG 3.13Å; T593-S596 PolarHBondContact O-N 2.97Å; T593-S596 PolarHBondContact O-OG 3.25Å; T593-S596 PolarHBondContact OG1-N 3.06Å; P594-S596 PolarHBondContact O-N 2.93Å; S596-I599 PolarHBondContact O-N 3.41Å; S596-E600 WeakPolarHBondContact O-CG 3.34Å; S596-E600 PolarHBondContact O-N 2.98Å
597	R	85.4	Confident	82.4	Confident	16 Å²	16	29.1 Å²	29.1	6%	0.06	15%	0.15	C	C	.	.	H	α-helix	trans	-73.2	-33.8	175.8	-71.2	-71.5	137.4	63.2	9.5	113.4	C566 H567 S592 T593 P594 L595 I599 E600 S601	C566-R597 HydrophobicContact CB-CB 4.27Å; H567-R597 HydrophobicContact CB-CB 4.46Å; S592-R597 PolarHBondContact OG-NH1 3.39Å; S592-R597 PolarHBondContact OG-NH2 3.33Å; T593-R597 PolarHBondContact O-N 3.06Å; P594-R597 WeakPolarHBondContact O-CB 3.44Å; P594-R597 PolarHBondContact O-N 3.29Å; P594-R597 VanDerWaalsContact O-N 3.12Å; L595-R597 PolarHBondContact O-N 3.28Å; R597-I599 VanDerWaalsContact C-N 3.3Å; R597-E600 WeakPolarHBondContact CD-OE2 3.43Å; R597-E600 IonicContact CZ-OE1 3.76Å; R597-E600 IonicContact CZ-OE2 3.6Å; R597-E600 VanDerWaalsContact NE-CD 3.31Å; R597-E600 IonicContact NE-OE1 3.16Å; R597-E600 PolarHBondContact NE-OE1 3.24Å; R597-E600 VanDerWaalsContact NE-OE1 3.12Å; R597-E600 IonicContact NE-OE2 3.13Å; R597-E600 PolarHBondContact NE-OE2 3.25Å; R597-E600 IonicContact NH2-OE1 2.74Å; R597-E600 PolarHBondContact O-N 3.46Å; R597-S601 PolarHBondContact O-N 2.96Å; R597-S601 VanDerWaalsContact O-N 3.12Å
598	A	84.3	Confident	82.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.2	-35.1	172.2	0	0	0	0	0	111.6	C566 P594 L595 S601 C602 V607 L610	C566-A598 HydrophobicContact CB-CB 4.06Å; P594-A598 PolarHBondContact O-N 2.86Å; L595-A598 PolarHBondContact O-N 2.97Å; A598-S601 PolarHBondContact O-N 2.84Å; A598-S601 PolarHBondContact O-OG 3.3Å; A598-C602 PolarHBondContact O-N 3.08Å; A598-V607 HydrophobicContact CB-CG2 3.75Å; A598-L610 HydrophobicContact CB-CD1 3.75Å
599	I	83.1	Confident	82.4	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-67.5	-42.6	173.4	-63.8	168.4	0	0	0	110.5	L595 S596 R597 S601 C602 V607 A627 V630 A631 I639 I643	L595-I599 HydrophobicContact CG-CD1 4.29Å; L595-I599 VanDerWaalsContact O-CG1 3.32Å; L595-I599 WeakPolarHBondContact O-CG1 3.28Å; L595-I599 PolarHBondContact O-N 2.81Å; S596-I599 PolarHBondContact O-N 3.41Å; R597-I599 VanDerWaalsContact C-N 3.3Å; I599-S601 PolarHBondContact O-N 3.16Å; I599-C602 PolarHBondContact O-N 3.19Å; I599-C602 VanDerWaalsContact O-N 3.09Å; I599-V607 HydrophobicContact CG1-CG1 4.39Å; I599-V607 HydrophobicContact CG1-CG2 4.04Å; I599-A627 HydrophobicContact CD1-CB 3.82Å; I599-V630 HydrophobicContact CG2-CG1 4.1Å; I599-A631 HydrophobicContact CG2-CB 3.77Å; I599-I639 HydrophobicContact CG1-CG2 4.05Å; I599-I639 HydrophobicContact CG2-CG2 4.24Å; I599-I643 HydrophobicContact CD1-CD1 3.77Å
600	E	80.9	Confident	82.6	Confident	40 Å²	40	29 Å²	29	19%	0.187	14%	0.143	C	C	.	.	H	α-helix	trans	-59.5	-32.7	175	-70.6	171.8	-162.2	0	0	112.5	S596 R597 C602 V630 Y634	S596-E600 WeakPolarHBondContact O-CG 3.34Å; S596-E600 PolarHBondContact O-N 2.98Å; R597-E600 WeakPolarHBondContact CD-OE2 3.43Å; R597-E600 IonicContact CZ-OE1 3.76Å; R597-E600 IonicContact CZ-OE2 3.6Å; R597-E600 VanDerWaalsContact NE-CD 3.31Å; R597-E600 IonicContact NE-OE1 3.16Å; R597-E600 PolarHBondContact NE-OE1 3.24Å; R597-E600 VanDerWaalsContact NE-OE1 3.12Å; R597-E600 IonicContact NE-OE2 3.13Å; R597-E600 PolarHBondContact NE-OE2 3.25Å; R597-E600 IonicContact NH2-OE1 2.74Å; R597-E600 PolarHBondContact O-N 3.46Å; E600-C602 VanDerWaalsContact C-N 3.29Å; E600-C602 PolarHBondContact O-N 3.2Å; E600-V630 HydrophobicContact CG-CG1 4.22Å; E600-Y634 HydrophobicContact CB-CE1 4.4Å; E600-Y634 HydrophobicContact CG-CE1 4.42Å; E600-Y634 HydrophobicContact CG-CE2 3.83Å
601	S	74.6	Confident	82.7	Confident	29 Å²	29	25.5 Å²	25.5	20%	0.203	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-4.1	177.7	67.9	0	0	0	0	114.3	C566 H567 R597 A598 I599 R603	C566-S601 PolarHBondContact O-OG 3.48Å; H567-S601 WeakPolarHBondContact O-CB 3.45Å; R597-S601 PolarHBondContact O-N 2.96Å; R597-S601 VanDerWaalsContact O-N 3.12Å; A598-S601 PolarHBondContact O-N 2.84Å; A598-S601 PolarHBondContact O-OG 3.3Å; I599-S601 PolarHBondContact O-N 3.16Å; S601-R603 PolarHBondContact O-N 3.45Å; S601-R603 VanDerWaalsContact O-N 3.12Å
602	C	73.6	Confident	82.8	Confident	31 Å²	31	27.6 Å²	27.6	21%	0.209	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	24.8	177.8	-57.5	0	0	0	0	114.6	A598 I599 E600	A598-C602 PolarHBondContact O-N 3.08Å; I599-C602 PolarHBondContact O-N 3.19Å; I599-C602 VanDerWaalsContact O-N 3.09Å; E600-C602 VanDerWaalsContact C-N 3.29Å; E600-C602 PolarHBondContact O-N 3.2Å
603	R	76.6	Confident	82.9	Confident	84 Å²	84	30.9 Å²	30.9	32%	0.317	15%	0.153	S	C	.	.			trans	-93.8	112.6	177.7	-64.5	-62.7	-68	-171.5	-2.9	109.9	S601 D605 T606 V607	S601-R603 PolarHBondContact O-N 3.45Å; S601-R603 VanDerWaalsContact O-N 3.12Å; R603-D605 PolarHBondContact O-N 3Å; R603-T606 HydrophobicContact CB-CG2 4.38Å; R603-T606 WeakPolarHBondContact CB-OG1 3.45Å; R603-T606 PolarHBondContact O-OG1 2.82Å; R603-V607 WeakPolarHBondContact O-CG2 3.46Å; R603-V607 PolarHBondContact O-N 3.23Å
604	L	79.8	Confident	82.5	Confident	32 Å²	32	33.1 Å²	33.1	17%	0.168	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-45.9	-175.9	-59.1	-179.5	0	0	0	111.8	T606 V607 K608 R638 I639	L604-T606 PolarHBondContact O-N 2.87Å; L604-V607 PolarHBondContact O-N 2.97Å; L604-V607 VanDerWaalsContact O-N 3.14Å; L604-K608 WeakPolarHBondContact O-CG 3.49Å; L604-K608 PolarHBondContact O-N 3.09Å; L604-R638 HydrophobicContact CD1-CB 4.22Å; L604-R638 HydrophobicContact CD2-CB 3.72Å; L604-I639 HydrophobicContact CD2-CD1 4.16Å; L604-I639 HydrophobicContact CD2-CG1 3.43Å; L604-I639 VanDerWaalsContact CD2-CG1 3.43Å
605	D	81.9	Confident	82.2	Confident	80 Å²	80	33.3 Å²	33.3	43%	0.428	18%	0.179	S	C	.	.	H	α-helix	trans	-66.7	-38.2	-169.2	-48.7	-46.1	0	0	0	112.4	R603 K608 Y609	R603-D605 PolarHBondContact O-N 3Å; D605-K608 PolarHBondContact O-N 3.02Å; D605-Y609 WeakPolarHBondContact O-CB 3.42Å; D605-Y609 PolarHBondContact O-N 3.05Å
606	T	82.9	Confident	81.9	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-66.3	-39.1	173.7	55.9	0	0	0	0	112.1	Q571 R603 L604 L610	Q571-T606 HydrophobicContact CB-CG2 3.82Å; R603-T606 HydrophobicContact CB-CG2 4.38Å; R603-T606 WeakPolarHBondContact CB-OG1 3.45Å; R603-T606 PolarHBondContact O-OG1 2.82Å; L604-T606 PolarHBondContact O-N 2.87Å; T606-L610 VanDerWaalsContact O-CG 3.31Å; T606-L610 WeakPolarHBondContact O-CG 3.36Å; T606-L610 PolarHBondContact O-N 2.9Å
607	V	84.1	Confident	81.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.8	-42.3	177.1	175.5	0	0	0	0	111.1	L595 A598 I599 R603 L604 Y609 L610 L611 I639	L595-V607 HydrophobicContact CD1-CG1 4.2Å; A598-V607 HydrophobicContact CB-CG2 3.75Å; I599-V607 HydrophobicContact CG1-CG1 4.39Å; I599-V607 HydrophobicContact CG1-CG2 4.04Å; R603-V607 WeakPolarHBondContact O-CG2 3.46Å; R603-V607 PolarHBondContact O-N 3.23Å; L604-V607 PolarHBondContact O-N 2.97Å; L604-V607 VanDerWaalsContact O-N 3.14Å; V607-Y609 VanDerWaalsContact C-N 3.32Å; V607-Y609 PolarHBondContact O-N 3.2Å; V607-L610 PolarHBondContact O-N 3.17Å; V607-L611 HydrophobicContact CG1-CD1 3.93Å; V607-L611 HydrophobicContact CG1-CG 4.42Å; V607-L611 WeakPolarHBondContact O-CB 3.33Å; V607-L611 VanDerWaalsContact O-CG 3.27Å; V607-L611 WeakPolarHBondContact O-CG 3.26Å; V607-L611 PolarHBondContact O-N 3.18Å; V607-I639 HydrophobicContact CG1-CG2 4.13Å; V607-I639 HydrophobicContact CG2-CD1 4.45Å
608	K	84.8	Confident	80.7	Confident	92 Å²	92	47.3 Å²	47.3	40%	0.4	24%	0.242	S	C	.	.	H	α-helix	trans	-55.4	-51.5	174.2	-45.5	-139.9	169.7	153	0	110.1	L604 D605 L610 L611 D612 M642	L604-K608 WeakPolarHBondContact O-CG 3.49Å; L604-K608 PolarHBondContact O-N 3.09Å; D605-K608 PolarHBondContact O-N 3.02Å; K608-L610 PolarHBondContact O-N 3.49Å; K608-L611 PolarHBondContact O-N 3.45Å; K608-L611 VanDerWaalsContact O-N 3.16Å; K608-D612 PolarHBondContact O-N 2.79Å; K608-M642 VanDerWaalsContact CA-CE 3.48Å; K608-M642 HydrophobicContact CB-CE 3.6Å; K608-M642 HydrophobicContact CD-CE 3.53Å; K608-M642 HydrophobicContact CD-SD 3.85Å; K608-M642 WeakPolarHBondContact CE-SD 3.45Å; K608-M642 HydrophobicContact CG-CE 3.17Å; K608-M642 HydrophobicContact CG-SD 3.73Å
609	Y	86.4	Confident	80.4	Confident	45 Å²	45	49.2 Å²	49.2	18%	0.176	25%	0.252	C	S	.	.	H	α-helix	trans	-61.4	-44.8	-176.1	-174.3	-104.3	0	0	0	112.8	V574 E575 I578 D605 V607 L611 D612 I613	V574-Y609 HydrophobicContact CG1-CD1 4.04Å; V574-Y609 HydrophobicContact CG1-CE1 4.25Å; E575-Y609 HydrophobicContact CB-CE1 4Å; E575-Y609 WeakPolarHBondContact CB-OH 3.26Å; E575-Y609 HydrophobicContact CG-CD1 4.21Å; E575-Y609 HydrophobicContact CG-CD2 4.44Å; E575-Y609 HydrophobicContact CG-CE1 3.61Å; E575-Y609 HydrophobicContact CG-CE2 3.88Å; E575-Y609 VanDerWaalsContact CG-CZ 3.41Å; E575-Y609 WeakPolarHBondContact OE1-CE2 3.36Å; I578-Y609 HydrophobicContact CD1-CE1 4.03Å; D605-Y609 WeakPolarHBondContact O-CB 3.42Å; D605-Y609 PolarHBondContact O-N 3.05Å; V607-Y609 VanDerWaalsContact C-N 3.32Å; V607-Y609 PolarHBondContact O-N 3.2Å; Y609-L611 VanDerWaalsContact C-N 3.33Å; Y609-L611 PolarHBondContact O-N 3.08Å; Y609-D612 PolarHBondContact O-N 3.3Å; Y609-I613 HydrophobicContact CD1-CD1 3.7Å; Y609-I613 HydrophobicContact CD2-CD1 4.4Å; Y609-I613 HydrophobicContact CE1-CD1 3.17Å; Y609-I613 HydrophobicContact CE2-CD1 3.97Å; Y609-I613 HydrophobicContact CG-CD1 4.28Å; Y609-I613 WeakPolarHBondContact O-CG1 3.37Å; Y609-I613 PolarHBondContact O-N 3.06Å; Y609-I613 VanDerWaalsContact O-N 3.14Å
610	L	84.9	Confident	80.1	Confident	1 Å²	1	55 Å²	55	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-36.3	176.5	-71.6	170.4	0	0	0	112.5	V574 I578 V584 L595 A598 T606 V607 K608 G614 A615	V574-L610 HydrophobicContact CG1-CD2 4.01Å; V574-L610 HydrophobicContact CG1-CG 4.42Å; I578-L610 HydrophobicContact CD1-CD2 3.88Å; V584-L610 HydrophobicContact CG1-CD2 4.38Å; L595-L610 HydrophobicContact CD1-CB 3.91Å; L595-L610 HydrophobicContact CD1-CD1 4.29Å; A598-L610 HydrophobicContact CB-CD1 3.75Å; T606-L610 VanDerWaalsContact O-CG 3.31Å; T606-L610 WeakPolarHBondContact O-CG 3.36Å; T606-L610 PolarHBondContact O-N 2.9Å; V607-L610 PolarHBondContact O-N 3.17Å; K608-L610 PolarHBondContact O-N 3.49Å; L610-G614 PolarHBondContact O-N 2.86Å; L610-A615 HydrophobicContact CB-CB 4.28Å; L610-A615 WeakPolarHBondContact O-CB 3.49Å; L610-A615 PolarHBondContact O-N 3.35Å; L610-A615 VanDerWaalsContact O-N 3.07Å
611	L	83.5	Confident	79.9	Confident	13 Å²	13	54.2 Å²	54.2	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-69.4	-35.9	175.4	-70.3	171.3	0	0	0	112.3	L595 V607 K608 Y609 I613 G614 M642 I643 K646	L595-L611 HydrophobicContact CD1-CD2 4.29Å; L595-L611 HydrophobicContact CD1-CG 4.27Å; L595-L611 HydrophobicContact CD2-CD2 4.03Å; V607-L611 HydrophobicContact CG1-CD1 3.93Å; V607-L611 HydrophobicContact CG1-CG 4.42Å; V607-L611 WeakPolarHBondContact O-CB 3.33Å; V607-L611 VanDerWaalsContact O-CG 3.27Å; V607-L611 WeakPolarHBondContact O-CG 3.26Å; V607-L611 PolarHBondContact O-N 3.18Å; K608-L611 PolarHBondContact O-N 3.45Å; K608-L611 VanDerWaalsContact O-N 3.16Å; Y609-L611 VanDerWaalsContact C-N 3.33Å; Y609-L611 PolarHBondContact O-N 3.08Å; L611-I613 VanDerWaalsContact C-N 3.32Å; L611-G614 PolarHBondContact O-N 3.27Å; L611-M642 HydrophobicContact CD1-CE 4.28Å; L611-I643 HydrophobicContact CD1-CG1 4.16Å; L611-K646 HydrophobicContact CB-CG 4.37Å; L611-K646 HydrophobicContact CD1-CG 4.4Å
612	D	84.5	Confident	79.8	Confident	105 Å²	105	60.6 Å²	60.6	56%	0.561	30%	0.295	S	S	*	.	H	α-helix	trans	-68.5	-31.4	177	-71.4	-26.7	0	0	0	112.7	K608 Y609 G614 K646	K608-D612 PolarHBondContact O-N 2.79Å; Y609-D612 PolarHBondContact O-N 3.3Å; D612-G614 PolarHBondContact O-N 3.41Å; D612-K646 VanDerWaalsContact OD1-CE 3.29Å; D612-K646 WeakPolarHBondContact OD1-CE 3.26Å; D612-K646 IonicContact OD1-NZ 2.68Å; D612-K646 PolarHBondContact OD1-NZ 3.37Å
613	I	83.1	Confident	79.8	Confident	68 Å²	68	69.2 Å²	69.2	35%	0.349	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-8.5	175.6	-69.4	170	0	0	0	112.5	I578 V584 Y609 L611	I578-I613 HydrophobicContact CD1-CD1 3.8Å; I578-I613 HydrophobicContact CG2-CD1 4.19Å; I578-I613 HydrophobicContact CG2-CG2 4.43Å; V584-I613 HydrophobicContact CG2-CG2 4.14Å; Y609-I613 HydrophobicContact CD1-CD1 3.7Å; Y609-I613 HydrophobicContact CD2-CD1 4.4Å; Y609-I613 HydrophobicContact CE1-CD1 3.17Å; Y609-I613 HydrophobicContact CE2-CD1 3.97Å; Y609-I613 HydrophobicContact CG-CD1 4.28Å; Y609-I613 WeakPolarHBondContact O-CG1 3.37Å; Y609-I613 PolarHBondContact O-N 3.06Å; Y609-I613 VanDerWaalsContact O-N 3.14Å; L611-I613 VanDerWaalsContact C-N 3.32Å
614	G	79.6	Confident	79.7	Confident	53 Å²	53	67 Å²	67	55%	0.546	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	29.1	176.5	0	0	0	0	0	114.4	L610 L611 D612 K616	L610-G614 PolarHBondContact O-N 2.86Å; L611-G614 PolarHBondContact O-N 3.27Å; D612-G614 PolarHBondContact O-N 3.41Å; G614-K616 PolarHBondContact O-N 3.23Å
615	A	81.5	Confident	79.6	Confident	4 Å²	4	69 Å²	69	3%	0.033	34%	0.335	C	S	.	.			trans	-56.9	135	172.8	0	0	0	0	0	111.5	V584 L595 L610 F617	V584-A615 HydrophobicContact CG1-CB 3.62Å; L595-A615 HydrophobicContact CB-CB 4.38Å; L595-A615 HydrophobicContact CD2-CB 4.25Å; L610-A615 HydrophobicContact CB-CB 4.28Å; L610-A615 WeakPolarHBondContact O-CB 3.49Å; L610-A615 PolarHBondContact O-N 3.35Å; L610-A615 VanDerWaalsContact O-N 3.07Å; A615-F617 PolarHBondContact O-N 3.35Å
616	K	79.8	Confident	79.7	Confident	125 Å²	125	66.2 Å²	66.2	54%	0.543	32%	0.322	S	S	.	.			trans	-73.4	113.6	-177.5	-69	174.6	-171.1	165.9	0	111	D585 G614 I619	D585-K616 PolarHBondContact OD1-N 3.48Å; D585-K616 VanDerWaalsContact OD2-CD 3.22Å; D585-K616 WeakPolarHBondContact OD2-CD 3.36Å; D585-K616 WeakPolarHBondContact OD2-CE 2.95Å; D585-K616 WeakPolarHBondContact OD2-CG 3.39Å; D585-K616 IonicContact OD2-NZ 3.78Å; G614-K616 PolarHBondContact O-N 3.23Å; K616-I619 HydrophobicContact CB-CD1 3.64Å; K616-I619 HydrophobicContact CB-CG1 3.88Å; K616-I619 HydrophobicContact CD-CD1 4.05Å; K616-I619 HydrophobicContact CG-CD1 4.49Å
617	F	73.1	Confident	79.4	Confident	39 Å²	39	66.4 Å²	66.4	17%	0.171	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.9	179.6	56.9	-95.3	0	0	0	114.3	L595 A615 A627 I647 L650	L595-F617 HydrophobicContact CD2-CB 3.93Å; A615-F617 PolarHBondContact O-N 3.35Å; F617-A627 HydrophobicContact CB-CB 4.08Å; F617-A627 WeakPolarHBondContact O-CB 3.39Å; F617-A627 PolarHBondContact O-N 2.98Å; F617-I647 HydrophobicContact CD2-CD1 4.47Å; F617-I647 HydrophobicContact CD2-CG1 4.16Å; F617-I647 HydrophobicContact CE2-CD1 4.25Å; F617-I647 HydrophobicContact CE2-CG1 3.57Å; F617-I647 HydrophobicContact CZ-CG1 4.01Å; F617-L650 HydrophobicContact CE1-CD1 3.87Å; F617-L650 HydrophobicContact CZ-CD1 3.52Å
618	Q	72.3	Confident	79.2	Confident	151 Å²	151	68.5 Å²	68.5	71%	0.706	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-1.4	178.2	-63.2	-177.3	3.5	0	0	113.9	E620	Q618-E620 PolarHBondContact O-N 3.31Å
619	I	76.4	Confident	79	Confident	39 Å²	39	67.1 Å²	67.1	20%	0.2	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-72.3	124.5	179.1	-63	173.6	0	0	0	108.8	D585 M587 T593 K616	D585-I619 HydrophobicContact CB-CD1 4.29Å; M587-I619 HydrophobicContact CE-CG2 4.03Å; M587-I619 HydrophobicContact SD-CG2 4.43Å; T593-I619 HydrophobicContact CG2-CB 3.93Å; T593-I619 HydrophobicContact CG2-CD1 3.84Å; T593-I619 HydrophobicContact CG2-CG1 4.47Å; T593-I619 HydrophobicContact CG2-CG2 3.85Å; K616-I619 HydrophobicContact CB-CD1 3.64Å; K616-I619 HydrophobicContact CB-CG1 3.88Å; K616-I619 HydrophobicContact CD-CD1 4.05Å; K616-I619 HydrophobicContact CG-CD1 4.49Å
620	E	78.2	Confident	78.7	Confident	122 Å²	122	65.3 Å²	65.3	57%	0.57	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-91	136	179.8	-66.4	179	-172.6	0	0	112	Q618	Q618-E620 PolarHBondContact O-N 3.31Å
621	N	76.2	Confident	78.5	Confident	24 Å²	24	65.3 Å²	65.3	13%	0.128	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.7	171.1	171.1	-68.3	-9	0	0	0	110.9	N591 S592 R623 G624 H625	N591-N621 PolarHBondContact O-OD1 3.12Å; S592-N621 WeakPolarHBondContact CA-OD1 3.44Å; N621-R623 PolarHBondContact O-N 3.3Å; N621-G624 PolarHBondContact O-N 3.47Å; N621-H625 PolarHBondContact N-O 2.98Å
622	R	73.4	Confident	78.3	Confident	164 Å²	164	70 Å²	70	62%	0.619	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-18.7	172.3	-79.7	-171.4	-179.9	173.7	2	115	I589 N590 N591	I589-R622 PolarHBondContact O-NE 3.34Å; I589-R622 PolarHBondContact O-NH2 2.85Å; N590-R622 PolarHBondContact O-N 3.37Å; N591-R622 HydrophobicContact CB-CG 4.49Å
623	R	72.3	Confident	78	Confident	212 Å²	212	67.8 Å²	67.8	80%	0.8	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	0.1	176.8	-62.6	-176.8	-178.9	178.8	0.6	113.5	N621 H625	N621-R623 PolarHBondContact O-N 3.3Å; R623-H625 VanDerWaalsContact C-N 3.28Å; R623-H625 PolarHBondContact O-CD2 3.43Å
624	G	75.2	Confident	77.7	Confident	36 Å²	36	68.7 Å²	68.7	37%	0.371	34%	0.341	S	S	.	.	S	Bend	trans	74.6	15.4	-174.1	0	0	0	0	0	113.9	N621	N621-G624 PolarHBondContact O-N 3.47Å
625	H	78.6	Confident	77.2	Confident	76 Å²	76	68.5 Å²	68.5	35%	0.352	33%	0.334	S	S	.	.			trans	-90.4	124.1	-179.8	-63.3	-174.7	0	0	0	109.6	N621 R623 D629 V630	N621-H625 PolarHBondContact N-O 2.98Å; R623-H625 VanDerWaalsContact C-N 3.28Å; R623-H625 PolarHBondContact O-CD2 3.43Å; H625-D629 HydrophobicContact CB-CB 4.07Å; H625-V630 HydrophobicContact CB-CG2 4.13Å
626	A	82.1	Confident	76.7	Confident	20 Å²	20	69 Å²	69	17%	0.165	34%	0.337	C	S	.	.			trans	-80.7	171.8	168	0	0	0	0	0	111.1	M628 D629 V630	A626-M628 PolarHBondContact O-N 3.04Å; A626-M628 VanDerWaalsContact O-N 3.14Å; A626-D629 PolarHBondContact N-OD2 3.33Å; A626-D629 PolarHBondContact O-N 3.17Å; A626-V630 PolarHBondContact O-N 2.82Å
627	A	77.9	Confident	76.5	Confident	5 Å²	5	70.5 Å²	70.5	4%	0.041	34%	0.34	C	S	.	.	H	α-helix	trans	-54.4	-35.8	179.5	0	0	0	0	0	112.8	L595 I599 F617 V630 A631	L595-A627 HydrophobicContact CD2-CB 4.31Å; I599-A627 HydrophobicContact CD1-CB 3.82Å; F617-A627 HydrophobicContact CB-CB 4.08Å; F617-A627 WeakPolarHBondContact O-CB 3.39Å; F617-A627 PolarHBondContact O-N 2.98Å; A627-V630 PolarHBondContact O-N 3.49Å; A627-A631 PolarHBondContact O-N 3.06Å
628	M	79.6	Confident	76.7	Confident	44 Å²	44	73.9 Å²	73.9	22%	0.217	35%	0.351	C	S	.	.	H	α-helix	trans	-66.3	-39.3	175.8	-174.6	-176.8	-109.7	0	0	112.7	A626 V630 A631 K632 I643 K644 I647	A626-M628 PolarHBondContact O-N 3.04Å; A626-M628 VanDerWaalsContact O-N 3.14Å; M628-V630 VanDerWaalsContact C-N 3.34Å; M628-A631 PolarHBondContact O-N 3.01Å; M628-K632 WeakPolarHBondContact O-CG 3.5Å; M628-K632 PolarHBondContact O-N 2.97Å; M628-I643 HydrophobicContact CB-CG2 4.44Å; M628-K644 HydrophobicContact CE-CD 4.43Å; M628-K644 HydrophobicContact CE-CG 3.43Å; M628-K644 VanDerWaalsContact CE-CG 3.43Å; M628-I647 HydrophobicContact CE-CD1 4.16Å
629	D	80.8	Confident	77.1	Confident	63 Å²	63	66.8 Å²	66.8	34%	0.337	32%	0.318	S	S	.	.	H	α-helix	trans	-73	-32.8	-179.8	-57.6	-43.1	0	0	0	111.3	H625 A626 K632 A633	H625-D629 HydrophobicContact CB-CB 4.07Å; A626-D629 PolarHBondContact N-OD2 3.33Å; A626-D629 PolarHBondContact O-N 3.17Å; D629-K632 PolarHBondContact O-N 3.38Å; D629-K632 IonicContact OD1-NZ 3.17Å; D629-A633 WeakPolarHBondContact O-CB 3.29Å; D629-A633 PolarHBondContact O-N 3.28Å
630	V	79.2	Confident	77.3	Confident	7 Å²	7	66.1 Å²	66.1	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-46.7	169.4	-179.6	0	0	0	0	110.3	I599 E600 H625 A626 A627 M628 K632 A633 Y634	I599-V630 HydrophobicContact CG2-CG1 4.1Å; E600-V630 HydrophobicContact CG-CG1 4.22Å; H625-V630 HydrophobicContact CB-CG2 4.13Å; A626-V630 PolarHBondContact O-N 2.82Å; A627-V630 PolarHBondContact O-N 3.49Å; M628-V630 VanDerWaalsContact C-N 3.34Å; V630-K632 VanDerWaalsContact C-N 3.31Å; V630-K632 PolarHBondContact O-N 3.3Å; V630-A633 WeakPolarHBondContact O-CB 3.21Å; V630-A633 PolarHBondContact O-N 2.64Å; V630-A633 VanDerWaalsContact O-N 3.11Å; V630-Y634 HydrophobicContact CG1-CD2 4.1Å; V630-Y634 HydrophobicContact CG1-CE2 4.22Å; V630-Y634 WeakPolarHBondContact O-CD2 3.37Å; V630-Y634 PolarHBondContact O-N 3.12Å; V630-Y634 VanDerWaalsContact O-N 3.11Å
631	A	81.4	Confident	77.4	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-59.9	-40.2	176.8	0	0	0	0	0	112.4	I599 A627 M628 Y634 A635 I639 I640 I643	I599-A631 HydrophobicContact CG2-CB 3.77Å; A627-A631 PolarHBondContact O-N 3.06Å; M628-A631 PolarHBondContact O-N 3.01Å; A631-Y634 PolarHBondContact O-N 3.3Å; A631-A635 PolarHBondContact O-N 3.21Å; A631-I639 HydrophobicContact CB-CG2 4.05Å; A631-I640 HydrophobicContact CB-CG1 3.79Å; A631-I643 HydrophobicContact CB-CD1 4.15Å
632	K	79.1	Confident	77.6	Confident	111 Å²	111	64 Å²	64	48%	0.483	31%	0.307	S	S	.	.	H	α-helix	trans	-63.2	-40.2	173.3	-73.4	171.9	-173.6	163.6	0	112.7	M628 D629 V630 Y634 A635 I640	M628-K632 WeakPolarHBondContact O-CG 3.5Å; M628-K632 PolarHBondContact O-N 2.97Å; D629-K632 PolarHBondContact O-N 3.38Å; D629-K632 IonicContact OD1-NZ 3.17Å; V630-K632 VanDerWaalsContact C-N 3.31Å; V630-K632 PolarHBondContact O-N 3.3Å; K632-Y634 VanDerWaalsContact C-N 3.32Å; K632-Y634 PolarHBondContact O-N 3.32Å; K632-A635 PolarHBondContact O-N 3.33Å; K632-I640 HydrophobicContact CG-CD1 4.07Å
633	A	78.8	Confident	77.8	Confident	59 Å²	59	56.2 Å²	56.2	49%	0.488	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-35.3	179.3	0	0	0	0	0	112.7	D629 V630	D629-A633 WeakPolarHBondContact O-CB 3.29Å; D629-A633 PolarHBondContact O-N 3.28Å; V630-A633 WeakPolarHBondContact O-CB 3.21Å; V630-A633 PolarHBondContact O-N 2.64Å; V630-A633 VanDerWaalsContact O-N 3.11Å
634	Y	75.6	Confident	78.1	Confident	88 Å²	88	50.3 Å²	50.3	35%	0.345	26%	0.258	S	S	.	.	H	α-helix	trans	-89.9	-5	178.3	-76.5	-99	0	0	0	113.8	E600 V630 A631 K632 D636	E600-Y634 HydrophobicContact CB-CE1 4.4Å; E600-Y634 HydrophobicContact CG-CE1 4.42Å; E600-Y634 HydrophobicContact CG-CE2 3.83Å; V630-Y634 HydrophobicContact CG1-CD2 4.1Å; V630-Y634 HydrophobicContact CG1-CE2 4.22Å; V630-Y634 WeakPolarHBondContact O-CD2 3.37Å; V630-Y634 PolarHBondContact O-N 3.12Å; V630-Y634 VanDerWaalsContact O-N 3.11Å; A631-Y634 PolarHBondContact O-N 3.3Å; K632-Y634 VanDerWaalsContact C-N 3.32Å; K632-Y634 PolarHBondContact O-N 3.32Å; Y634-D636 VanDerWaalsContact C-N 3.35Å; Y634-D636 PolarHBondContact O-N 2.86Å
635	A	70.8	Confident	78.3	Confident	48 Å²	48	54.9 Å²	54.9	40%	0.397	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	26.3	170.3	0	0	0	0	0	116.8	A631 K632 Y637	A631-A635 PolarHBondContact O-N 3.21Å; K632-A635 PolarHBondContact O-N 3.33Å; A635-Y637 PolarHBondContact O-N 3.17Å
636	D	70.9	Confident	78.1	Confident	16 Å²	16	54.7 Å²	54.7	9%	0.086	27%	0.268	C	S	.	.			trans	-87.2	102.9	168.9	-162.6	-25.8	0	0	0	110.5	Y634 R638 I639 I640	Y634-D636 VanDerWaalsContact C-N 3.35Å; Y634-D636 PolarHBondContact O-N 2.86Å; D636-R638 PolarHBondContact O-N 3.24Å; D636-R638 WeakPolarHBondContact OD1-CB 3.24Å; D636-R638 IonicContact OD1-CZ 2.75Å; D636-R638 PolarHBondContact OD1-N 3.19Å; D636-R638 VanDerWaalsContact OD1-N 3.14Å; D636-R638 IonicContact OD1-NE 2.72Å; D636-R638 PolarHBondContact OD1-NE 3.17Å; D636-R638 VanDerWaalsContact OD1-NE 3.13Å; D636-R638 IonicContact OD1-NH2 2.6Å; D636-R638 IonicContact OD2-CZ 3.83Å; D636-R638 IonicContact OD2-NE 3.68Å; D636-R638 IonicContact OD2-NH2 3.87Å; D636-R638 PolarHBondContact OD2-NH2 3.07Å; D636-I639 HydrophobicContact CB-CB 4.43Å; D636-I639 HydrophobicContact CB-CD1 4.04Å; D636-I639 HydrophobicContact CB-CG1 4.18Å; D636-I639 PolarHBondContact O-N 2.9Å; D636-I640 WeakPolarHBondContact O-CG1 3.12Å; D636-I640 PolarHBondContact O-N 3.24Å
637	Y	74.7	Confident	77.7	Confident	156 Å²	156	56.9 Å²	56.9	61%	0.612	28%	0.276	S	S	*	.	H	α-helix	trans	-60.6	-32.2	-178	62.4	-85.4	0	0	0	112.9	A635 I639 I640 D641	A635-Y637 PolarHBondContact O-N 3.17Å; Y637-I639 PolarHBondContact O-N 3.19Å; Y637-I640 PolarHBondContact O-N 3.26Å; Y637-D641 PolarHBondContact O-N 3.22Å
638	R	78.3	Confident	77.2	Confident	110 Å²	110	63 Å²	63	42%	0.415	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-39.3	-177.6	-59.5	170.8	-64.3	176.5	4.4	111.3	L604 D636 M642	L604-R638 HydrophobicContact CD1-CB 4.22Å; L604-R638 HydrophobicContact CD2-CB 3.72Å; D636-R638 PolarHBondContact O-N 3.24Å; D636-R638 WeakPolarHBondContact OD1-CB 3.24Å; D636-R638 IonicContact OD1-CZ 2.75Å; D636-R638 PolarHBondContact OD1-N 3.19Å; D636-R638 VanDerWaalsContact OD1-N 3.14Å; D636-R638 IonicContact OD1-NE 2.72Å; D636-R638 PolarHBondContact OD1-NE 3.17Å; D636-R638 VanDerWaalsContact OD1-NE 3.13Å; D636-R638 IonicContact OD1-NH2 2.6Å; D636-R638 IonicContact OD2-CZ 3.83Å; D636-R638 IonicContact OD2-NE 3.68Å; D636-R638 IonicContact OD2-NH2 3.87Å; D636-R638 PolarHBondContact OD2-NH2 3.07Å; R638-M642 WeakPolarHBondContact O-CB 3.38Å; R638-M642 VanDerWaalsContact O-CG 3.27Å; R638-M642 WeakPolarHBondContact O-CG 3.06Å; R638-M642 PolarHBondContact O-N 2.84Å; R638-M642 VanDerWaalsContact O-N 3.11Å
639	I	79.8	Confident	76.6	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-69.4	-38.1	176.5	-62.1	178.8	0	0	0	110.5	I599 L604 V607 A631 D636 Y637 M642 I643	I599-I639 HydrophobicContact CG1-CG2 4.05Å; I599-I639 HydrophobicContact CG2-CG2 4.24Å; L604-I639 HydrophobicContact CD2-CD1 4.16Å; L604-I639 HydrophobicContact CD2-CG1 3.43Å; L604-I639 VanDerWaalsContact CD2-CG1 3.43Å; V607-I639 HydrophobicContact CG1-CG2 4.13Å; V607-I639 HydrophobicContact CG2-CD1 4.45Å; A631-I639 HydrophobicContact CB-CG2 4.05Å; D636-I639 HydrophobicContact CB-CB 4.43Å; D636-I639 HydrophobicContact CB-CD1 4.04Å; D636-I639 HydrophobicContact CB-CG1 4.18Å; D636-I639 PolarHBondContact O-N 2.9Å; Y637-I639 PolarHBondContact O-N 3.19Å; I639-M642 WeakPolarHBondContact O-CB 3.37Å; I639-M642 PolarHBondContact O-N 3.21Å; I639-I643 HydrophobicContact CG2-CD1 3.74Å; I639-I643 HydrophobicContact CG2-CG1 4.37Å; I639-I643 VanDerWaalsContact O-CG1 3.27Å; I639-I643 WeakPolarHBondContact O-CG1 3.5Å; I639-I643 PolarHBondContact O-N 3.03Å
640	I	79.8	Confident	75.8	Confident	25 Å²	25	66.3 Å²	66.3	13%	0.128	33%	0.332	C	S	.	.	H	α-helix	trans	-62.6	-46.4	177.8	-66	168.5	0	0	0	110.7	A631 K632 D636 Y637 I643 K644	A631-I640 HydrophobicContact CB-CG1 3.79Å; K632-I640 HydrophobicContact CG-CD1 4.07Å; D636-I640 WeakPolarHBondContact O-CG1 3.12Å; D636-I640 PolarHBondContact O-N 3.24Å; Y637-I640 PolarHBondContact O-N 3.26Å; I640-I643 PolarHBondContact O-N 3.31Å; I640-K644 HydrophobicContact CG2-CD 4.35Å; I640-K644 WeakPolarHBondContact O-CG 3.32Å; I640-K644 PolarHBondContact O-N 3.1Å
641	D	80.6	Confident	74.2	Confident	72 Å²	72	71.6 Å²	71.6	39%	0.385	37%	0.367	S	S	.	.	H	α-helix	trans	-67.2	-40.8	-178.9	-67.1	-21.6	0	0	0	111.4	Y637 I643 K644 E645	Y637-D641 PolarHBondContact O-N 3.22Å; D641-I643 PolarHBondContact O-N 3.16Å; D641-K644 WeakPolarHBondContact O-CB 3.47Å; D641-K644 PolarHBondContact O-N 2.88Å; D641-K644 IonicContact OD1-NZ 3.76Å; D641-K644 PolarHBondContact OD1-NZ 3.17Å; D641-K644 VanDerWaalsContact OD1-NZ 3.17Å; D641-E645 WeakPolarHBondContact O-CG 3.47Å; D641-E645 PolarHBondContact O-N 2.84Å
642	M	80.1	Confident	72.2	Confident	29 Å²	29	80.8 Å²	80.8	14%	0.143	41%	0.407	C	S	.	.	H	α-helix	trans	-56.6	-44.7	171.1	-86.4	-167.7	68.8	0	0	114.7	K608 L611 R638 I639 K644 K646	K608-M642 VanDerWaalsContact CA-CE 3.48Å; K608-M642 HydrophobicContact CB-CE 3.6Å; K608-M642 HydrophobicContact CD-CE 3.53Å; K608-M642 HydrophobicContact CD-SD 3.85Å; K608-M642 WeakPolarHBondContact CE-SD 3.45Å; K608-M642 HydrophobicContact CG-CE 3.17Å; K608-M642 HydrophobicContact CG-SD 3.73Å; L611-M642 HydrophobicContact CD1-CE 4.28Å; R638-M642 WeakPolarHBondContact O-CB 3.38Å; R638-M642 VanDerWaalsContact O-CG 3.27Å; R638-M642 WeakPolarHBondContact O-CG 3.06Å; R638-M642 PolarHBondContact O-N 2.84Å; R638-M642 VanDerWaalsContact O-N 3.11Å; I639-M642 WeakPolarHBondContact O-CB 3.37Å; I639-M642 PolarHBondContact O-N 3.21Å; M642-K644 VanDerWaalsContact C-N 3.35Å; M642-K646 PolarHBondContact O-N 3.26Å
643	I	78.4	Confident	70.2	Confident	2 Å²	2	81.6 Å²	81.6	1%	0.01	42%	0.423	C	S	.	.	H	α-helix	trans	-68.6	-37.5	178.5	-68.2	167.7	0	0	0	110	I599 L611 M628 A631 I639 I640 D641 K646 I647	I599-I643 HydrophobicContact CD1-CD1 3.77Å; L611-I643 HydrophobicContact CD1-CG1 4.16Å; M628-I643 HydrophobicContact CB-CG2 4.44Å; A631-I643 HydrophobicContact CB-CD1 4.15Å; I639-I643 HydrophobicContact CG2-CD1 3.74Å; I639-I643 HydrophobicContact CG2-CG1 4.37Å; I639-I643 VanDerWaalsContact O-CG1 3.27Å; I639-I643 WeakPolarHBondContact O-CG1 3.5Å; I639-I643 PolarHBondContact O-N 3.03Å; I640-I643 PolarHBondContact O-N 3.31Å; D641-I643 PolarHBondContact O-N 3.16Å; I643-K646 PolarHBondContact O-N 3.21Å; I643-I647 HydrophobicContact CG2-CD1 3.86Å; I643-I647 HydrophobicContact CG2-CG1 4.48Å; I643-I647 WeakPolarHBondContact O-CD1 3.4Å; I643-I647 VanDerWaalsContact O-CG1 3.24Å; I643-I647 WeakPolarHBondContact O-CG1 3.36Å; I643-I647 PolarHBondContact O-N 2.87Å
644	K	79.6	Confident	68.1	Low	87 Å²	87	87 Å²	87	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-62.2	-48.1	174.1	-71.5	170.6	-171.7	159.1	0	111.8	M628 I640 D641 M642 K646 I647 D648	M628-K644 HydrophobicContact CE-CD 4.43Å; M628-K644 HydrophobicContact CE-CG 3.43Å; M628-K644 VanDerWaalsContact CE-CG 3.43Å; I640-K644 HydrophobicContact CG2-CD 4.35Å; I640-K644 WeakPolarHBondContact O-CG 3.32Å; I640-K644 PolarHBondContact O-N 3.1Å; D641-K644 WeakPolarHBondContact O-CB 3.47Å; D641-K644 PolarHBondContact O-N 2.88Å; D641-K644 IonicContact OD1-NZ 3.76Å; D641-K644 PolarHBondContact OD1-NZ 3.17Å; D641-K644 VanDerWaalsContact OD1-NZ 3.17Å; M642-K644 VanDerWaalsContact C-N 3.35Å; K644-K646 VanDerWaalsContact C-N 3.25Å; K644-K646 PolarHBondContact O-N 3.15Å; K644-I647 WeakPolarHBondContact O-CB 3.36Å; K644-I647 PolarHBondContact O-N 2.93Å; K644-D648 PolarHBondContact O-N 2.79Å
645	E	79.5	Confident	66	Low	133 Å²	133	90 Å²	90	62%	0.621	47%	0.465	S	S	*	.	H	α-helix	trans	-57.3	-38.3	177.8	-73.9	176.4	176.9	0	0	112.2	D641 S649	D641-E645 WeakPolarHBondContact O-CG 3.47Å; D641-E645 PolarHBondContact O-N 2.84Å; E645-S649 WeakPolarHBondContact O-CB 3.42Å; E645-S649 PolarHBondContact O-N 3.22Å; E645-S649 PolarHBondContact O-OG 3.1Å
646	K	74.3	Confident	64	Low	72 Å²	72	94.4 Å²	94.4	31%	0.313	48%	0.482	S	S	.	.	H	α-helix	trans	-72.9	-31.8	174.9	-77.4	-74.8	-173.9	169.9	0	113.7	L611 D612 M642 I643 K644 S649	L611-K646 HydrophobicContact CB-CG 4.37Å; L611-K646 HydrophobicContact CD1-CG 4.4Å; D612-K646 VanDerWaalsContact OD1-CE 3.29Å; D612-K646 WeakPolarHBondContact OD1-CE 3.26Å; D612-K646 IonicContact OD1-NZ 2.68Å; D612-K646 PolarHBondContact OD1-NZ 3.37Å; M642-K646 PolarHBondContact O-N 3.26Å; I643-K646 PolarHBondContact O-N 3.21Å; K644-K646 VanDerWaalsContact C-N 3.25Å; K644-K646 PolarHBondContact O-N 3.15Å; K646-S649 WeakPolarHBondContact CA-OG 3.35Å; K646-S649 PolarHBondContact O-OG 3.24Å
647	I	72.3	Confident	62.2	Low	66 Å²	66	101.4 Å²	101.4	34%	0.338	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-43.6	171.9	-70.6	164.3	0	0	0	110.4	F617 M628 I643 K644 S649 L650	F617-I647 HydrophobicContact CD2-CD1 4.47Å; F617-I647 HydrophobicContact CD2-CG1 4.16Å; F617-I647 HydrophobicContact CE2-CD1 4.25Å; F617-I647 HydrophobicContact CE2-CG1 3.57Å; F617-I647 HydrophobicContact CZ-CG1 4.01Å; M628-I647 HydrophobicContact CE-CD1 4.16Å; I643-I647 HydrophobicContact CG2-CD1 3.86Å; I643-I647 HydrophobicContact CG2-CG1 4.48Å; I643-I647 WeakPolarHBondContact O-CD1 3.4Å; I643-I647 VanDerWaalsContact O-CG1 3.24Å; I643-I647 WeakPolarHBondContact O-CG1 3.36Å; I643-I647 PolarHBondContact O-N 2.87Å; K644-I647 WeakPolarHBondContact O-CB 3.36Å; K644-I647 PolarHBondContact O-N 2.93Å; I647-S649 VanDerWaalsContact C-N 3.34Å; I647-S649 PolarHBondContact O-N 3.48Å; I647-L650 PolarHBondContact O-N 3.48Å
648	D	68.4	Low	59.8	Low	134 Å²	134	103 Å²	103	72%	0.717	52%	0.524	S	S	*	.	H	α-helix	trans	-74.3	-23.7	-176.1	-67.9	-28.3	0	0	0	113	K644	K644-D648 PolarHBondContact O-N 2.79Å
649	S	67.4	Low	57.3	Low	82 Å²	82	107.1 Å²	107.1	57%	0.573	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-5.9	177.2	52.3	0	0	0	0	114.8	E645 K646 I647	E645-S649 WeakPolarHBondContact O-CB 3.42Å; E645-S649 PolarHBondContact O-N 3.22Å; E645-S649 PolarHBondContact O-OG 3.1Å; K646-S649 WeakPolarHBondContact CA-OG 3.35Å; K646-S649 PolarHBondContact O-OG 3.24Å; I647-S649 VanDerWaalsContact C-N 3.34Å; I647-S649 PolarHBondContact O-N 3.48Å
650	L	63.1	Low	54.6	Low	94 Å²	94	116.8 Å²	116.8	49%	0.492	59%	0.592	S	S	.	*	S	Bend	trans	-78.9	133.7	173	-75.9	163.1	0	0	0	110.9	F617 I647 K652	F617-L650 HydrophobicContact CE1-CD1 3.87Å; F617-L650 HydrophobicContact CZ-CD1 3.52Å; I647-L650 PolarHBondContact O-N 3.48Å; L650-K652 PolarHBondContact O-N 3.09Å
651	P	45.3	Very low	52.5	Low	117 Å²	117	121.2 Å²	121.2	76%	0.76	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-63.4	122.9	176.9	23.9	-30.6	0	0	0	110.2	P653	P651-P653 WeakPolarHBondContact O-CD 3.41Å
652	K	40.6	Very low	49.8	Very low	195 Å²	195	127.2 Å²	127.2	85%	0.848	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-53.2	122.9	171.9	-71	174.1	-179.9	173.8	0	109	L650 L654	L650-K652 PolarHBondContact O-N 3.09Å; K652-L654 PolarHBondContact O-N 3.23Å
653	P	35.7	Very low	47.2	Very low	127 Å²	127	133.4 Å²	133.4	83%	0.825	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-65.9	123.8	171.5	24.6	-29.1	0	0	0	108.9	P651 D655	P651-P653 WeakPolarHBondContact O-CD 3.41Å; P653-D655 PolarHBondContact O-N 2.94Å
654	L	34.4	Very low	44.9	Very low	173 Å²	173	138.1 Å²	138.1	91%	0.906	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-58.8	125.5	174.5	-86.3	126.4	0	0	0	110.7	K652 N656	K652-L654 PolarHBondContact O-N 3.23Å; L654-N656 PolarHBondContact O-N 2.76Å
655	D	31.6	Very low	42.2	Very low	151 Å²	151	143.1 Å²	143.1	81%	0.807	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-57.6	123.1	161.9	-91.8	-40.1	0	0	0	110.4	P653	P653-D655 PolarHBondContact O-N 2.94Å
656	N	29.9	Very low	39.6	Very low	141 Å²	141	144.9 Å²	144.9	75%	0.754	74%	0.743	S	S	*	*			trans	-163.4	104	134.8	-100.4	-27.7	0	0	0	113.1	L654	L654-N656 PolarHBondContact O-N 2.76Å
657	Q	32.1	Very low	37.2	Very low	162 Å²	162	151.3 Å²	151.3	76%	0.757	77%	0.771	S	S	*	*			trans	67.1	121.4	131.2	-64.4	-172.8	20.2	0	0	122
658	K	25.2	Very low	35	Very low	190 Å²	190	153 Å²	153	83%	0.826	79%	0.789	S	S	*	*			trans	84.2	94.4	154.7	-66.2	176.9	-176.7	172.4	0	117
659	M	24.5	Very low	32.7	Very low	196 Å²	196	156.3 Å²	156.3	97%	0.966	80%	0.8	S	S	*	*				-146.3	138.4	113.4	-79.1	-157.5	122.5	0	0	111.1
660	K	23.7	Very low	30.6	Very low	204 Å²	204	155.2 Å²	155.2	89%	0.887	80%	0.802	S	S	*	*			trans	-70	153.2	-176.1	-68.8	172.8	173.5	175.1	0	112.1
661	P	37	Very low	28.6	Very low	118 Å²	118	157 Å²	157	77%	0.766	82%	0.817	S	S	*	*			trans	-92.3	136.3	169.6	34.7	-28.5	0	0	0	111.5
662	K	23.5	Very low	27.6	Very low	199 Å²	199	158.2 Å²	158.2	87%	0.865	82%	0.817	S	S	*	*			trans	176.1	116.4	141.2	-99.8	170.2	-177.6	-177.2	0	112.3
663	L	25.8	Very low	26.9	Very low	159 Å²	159	157.2 Å²	157.2	83%	0.832	82%	0.819	S	S	*	*			trans	11.2	164.1	136	-73.1	124	0	0	0	120
664	P	30.1	Very low	26.3	Very low	100 Å²	100	160.1 Å²	160.1	65%	0.649	82%	0.819	S	S	*	*			cis	-142.4	-173.4	-13.9	36.8	-15	0	0	0	115.5
665	K	22.3	Very low	26	Very low	193 Å²	193	161.4 Å²	161.4	84%	0.839	82%	0.817	S	S	*	*			trans	72.6	124.2	153.8	-76.7	177	-179.3	177	0	120.3
666	L	23.7	Very low	25.5	Very low	169 Å²	169	163.4 Å²	163.4	89%	0.885	82%	0.822	S	S	*	*			trans	-135.2	98	133.6	-105.6	136.8	0	0	0	109.8
667	K	25.6	Very low	25.6	Very low	208 Å²	208	166 Å²	166	90%	0.904	83%	0.829	S	S	*	*			trans	-118.7	121	140.4	-90.2	-169.6	175.7	-173.8	0	105.3
668	S	24.4	Very low	25.2	Very low	101 Å²	101	167.1 Å²	167.1	71%	0.706	83%	0.834	S	S	*	*			trans	-147.5	119.4	151.7	52.7	0	0	0	0	107.9
669	E	21.8	Very low	25.1	Very low	203 Å²	203	164 Å²	164	95%	0.949	83%	0.832	S	S	*	*			trans	-61.5	162.6	165.5	-66.8	167.5	136.9	0	0	111.5
670	G	21.5	Very low	25.1	Very low	60 Å²	60	163.5 Å²	163.5	62%	0.619	83%	0.832	S	S	*	*			trans	140	71.9	168.3	0	0	0	0	0	111.6
671	T	22.7	Very low	25.1	Very low	130 Å²	130	158.4 Å²	158.4	80%	0.798	82%	0.822	S	S	*	*				81	129.3	97	51.1	0	0	0	0	115.6
672	D	22.8	Very low	24.8	Very low	143 Å²	143	157 Å²	157	77%	0.765	81%	0.814	S	S	*	*			trans	74.3	93.2	154.5	-61.9	-25.4	0	0	0	120.6
673	I	26	Very low	25	Very low	174 Å²	174	153.6 Å²	153.6	89%	0.892	81%	0.81	S	S	*	*			trans	-130.5	116.9	130.6	-58.4	-179.2	0	0	0	108.4
674	K	23.8	Very low	25.4	Very low	189 Å²	189	156.5 Å²	156.5	82%	0.822	81%	0.812	S	S	*	*			trans	-68.3	134.6	168.1	-76.1	174.4	177.5	170.7	0	109.3
675	K	28.1	Very low	25.2	Very low	199 Å²	199	156.1 Å²	156.1	87%	0.865	82%	0.817	S	S	*	*			trans	28	117.5	147.4	-68.3	-177.3	173.3	-171.8	0	117.5
676	E	21.8	Very low	25.6	Very low	194 Å²	194	153 Å²	153	91%	0.907	81%	0.814	S	S	*	*				-141.3	128.9	126.4	-107.1	163.7	-160.2	0	0	108.4	E678	E676-E678 PolarHBondContact O-N 3.14Å
677	E	31	Very low	25.8	Very low	194 Å²	194	150.1 Å²	150.1	91%	0.907	81%	0.805	S	S	*	*			trans	-71.2	112.6	172.1	-73.1	170.8	149.4	0	0	107.7
678	E	24	Very low	26	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	80%	0.802	S	S	*	*			trans	-107.5	104.6	158.4	-85	-172.1	159.1	0	0	108.8	E676 L680	E676-E678 PolarHBondContact O-N 3.14Å; E678-L680 PolarHBondContact O-N 2.88Å
679	T	22.7	Very low	26.3	Very low	126 Å²	126	149 Å²	149	77%	0.773	81%	0.807	S	S	*	*			trans	-46.7	122.1	162.8	46.2	0	0	0	0	110.4	S681	T679-S681 VanDerWaalsContact C-N 3.3Å; T679-S681 PolarHBondContact O-N 3Å
680	L	26	Very low	26.7	Very low	184 Å²	184	145.6 Å²	145.6	96%	0.963	80%	0.8	S	S	*	*			trans	-59.3	92.3	167.8	-89.2	154.1	0	0	0	109.5	E678	E678-L680 PolarHBondContact O-N 2.88Å
681	S	22.6	Very low	27	Very low	97 Å²	97	151.6 Å²	151.6	68%	0.678	81%	0.812	S	S	*	*			trans	-84.7	135.4	167.5	76.8	0	0	0	0	110.1	T679	T679-S681 VanDerWaalsContact C-N 3.3Å; T679-S681 PolarHBondContact O-N 3Å
682	S	29.6	Very low	27.2	Very low	88 Å²	88	153.3 Å²	153.3	62%	0.615	81%	0.811	S	S	*	*			trans	68.5	96.7	134.7	-176.7	0	0	0	0	118.2
683	V	28.9	Very low	27.8	Very low	128 Å²	128	156 Å²	156	78%	0.776	82%	0.816	S	S	*	*	S	Bend	trans	-122.7	5	150.3	-175.6	0	0	0	0	112.3
684	Y	34.1	Very low	28.2	Very low	220 Å²	220	155.5 Å²	155.5	86%	0.863	81%	0.807	S	S	*	*			trans	-133.3	89.9	171.9	-60.8	-74.8	0	0	0	109.7
685	A	25.3	Very low	28.8	Very low	92 Å²	92	153.8 Å²	153.8	76%	0.76	81%	0.806	S	S	*	*			trans	-95.5	120.7	168.4	0	0	0	0	0	109
686	V	30.7	Very low	29.3	Very low	129 Å²	129	149.3 Å²	149.3	78%	0.782	80%	0.8	S	S	*	*			trans	-114.5	141.4	165	178.9	0	0	0	0	106.5
687	P	29.3	Very low	30.7	Very low	107 Å²	107	144.8 Å²	144.8	70%	0.695	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-66.4	146.7	-170.8	-13.5	27.5	0	0	0	112.2	I689	P687-I689 PolarHBondContact O-N 3.09Å
688	P	28.4	Very low	31.6	Very low	130 Å²	130	142.6 Å²	142.6	84%	0.844	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-79.1	123	177.2	32.2	-29.5	0	0	0	109.4
689	I	30.7	Very low	33.3	Very low	157 Å²	157	138.9 Å²	138.9	81%	0.805	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-102.2	128.6	164.5	-61.8	173.6	0	0	0	107	P687 E691	P687-I689 PolarHBondContact O-N 3.09Å; I689-E691 PolarHBondContact O-N 3.12Å
690	T	30.3	Very low	35.3	Very low	130 Å²	130	137.7 Å²	137.7	80%	0.798	75%	0.75	S	S	*	*			trans	-42.1	125.3	-177.5	40.9	0	0	0	0	114.1	E692	T690-E692 PolarHBondContact O-N 3.14Å
691	E	27.5	Very low	37.1	Very low	187 Å²	187	134.3 Å²	134.3	87%	0.874	74%	0.737	S	S	*	*			trans	-67.1	105.5	170.7	-69.7	-177	161.7	0	0	110.9	I689	I689-E691 PolarHBondContact O-N 3.12Å
692	E	27.4	Very low	39.2	Very low	165 Å²	165	134 Å²	134	77%	0.771	72%	0.722	S	S	*	*			trans	-88.8	115.5	146.8	-77.7	-171.4	168.1	0	0	107.9	T690 K694	T690-E692 PolarHBondContact O-N 3.14Å; E692-K694 PolarHBondContact O-N 3.23Å
693	K	36.2	Very low	40.8	Very low	200 Å²	200	133.9 Å²	133.9	87%	0.87	71%	0.713	S	S	*	*			trans	-55.7	99.2	170.8	-82.4	179.6	175.2	174.6	0	110
694	K	34	Very low	42.6	Very low	164 Å²	164	132 Å²	132	71%	0.713	70%	0.699	S	S	*	*			trans	-89.1	109.8	161.1	-85.4	177.7	-179.9	165.9	0	108.8	E692	E692-K694 PolarHBondContact O-N 3.23Å
695	L	37	Very low	44.5	Very low	152 Å²	152	124.4 Å²	124.4	80%	0.796	68%	0.678	S	S	*	*			trans	-50	144.1	166.6	-110	85.4	0	0	0	110.4	K697	L695-K697 PolarHBondContact O-N 2.98Å
696	S	38.4	Very low	46.2	Very low	105 Å²	105	122.4 Å²	122.4	73%	0.734	65%	0.654	S	S	*	*			trans	-46.2	125.4	169.7	171.2	0	0	0	0	111.2
697	K	51.6	Low	47.8	Very low	99 Å²	99	121.4 Å²	121.4	43%	0.43	64%	0.643	S	S	.	*			trans	-105.6	30.8	-172.6	-80.3	-175.6	176.2	-159.8	0	113.7	L695 N699 Y702	L695-K697 PolarHBondContact O-N 2.98Å; K697-N699 VanDerWaalsContact C-N 3.3Å; K697-N699 PolarHBondContact O-N 3.38Å; K697-Y702 HydrophobicContact CB-CE1 4.47Å; K697-Y702 HydrophobicContact CD-CD1 4.46Å; K697-Y702 HydrophobicContact CD-CE1 3.65Å; K697-Y702 WeakPolarHBondContact CE-OH 3.33Å; K697-Y702 HydrophobicContact CG-CD1 4.22Å; K697-Y702 HydrophobicContact CG-CE1 3.85Å; K697-Y702 PolarHBondContact NZ-OH 3.48Å
698	D	49.4	Very low	49.6	Very low	149 Å²	149	122.3 Å²	122.3	80%	0.797	65%	0.647	S	S	*	*			trans	-98.5	50.2	173.6	-64.7	-16.6	0	0	0	110.9
699	N	59.8	Low	51.4	Low	108 Å²	108	119.7 Å²	119.7	58%	0.578	63%	0.632	S	S	*	*			trans	-114.1	111.2	175.5	-130.1	-13.7	0	0	0	108.7	K697 V701 Y702 L703	K697-N699 VanDerWaalsContact C-N 3.3Å; K697-N699 PolarHBondContact O-N 3.38Å; N699-V701 PolarHBondContact O-N 2.85Å; N699-V701 VanDerWaalsContact O-N 3.09Å; N699-Y702 WeakPolarHBondContact O-CA 3.28Å; N699-Y702 WeakPolarHBondContact O-CB 3.35Å; N699-Y702 PolarHBondContact O-N 3.28Å; N699-L703 PolarHBondContact O-N 2.94Å; N699-L703 VanDerWaalsContact O-N 3.1Å
700	V	64.6	Low	52.5	Low	101 Å²	101	114.7 Å²	114.7	61%	0.612	62%	0.619	S	S	*	*	H	α-helix	trans	-54.6	-32.4	-176.9	177.5	0	0	0	0	111.7	L703 N704	V700-L703 PolarHBondContact O-N 2.83Å; V700-N704 WeakPolarHBondContact O-CB 3.42Å; V700-N704 PolarHBondContact O-N 3.47Å
701	V	63.4	Low	53.4	Low	113 Å²	113	117.8 Å²	117.8	69%	0.685	62%	0.618	S	S	*	*	H	α-helix	trans	-66.4	-38.9	175.9	-176.2	0	0	0	0	112	N699 S705	N699-V701 PolarHBondContact O-N 2.85Å; N699-V701 VanDerWaalsContact O-N 3.09Å; V701-S705 WeakPolarHBondContact O-CB 3.42Å; V701-S705 PolarHBondContact O-N 3.36Å
702	Y	65.8	Low	54.6	Low	91 Å²	91	113 Å²	113	36%	0.357	60%	0.601	S	S	.	*	H	α-helix	trans	-69	-41.8	176	178.7	-106	0	0	0	111.1	K697 N699 S705 L706	K697-Y702 HydrophobicContact CB-CE1 4.47Å; K697-Y702 HydrophobicContact CD-CD1 4.46Å; K697-Y702 HydrophobicContact CD-CE1 3.65Å; K697-Y702 WeakPolarHBondContact CE-OH 3.33Å; K697-Y702 HydrophobicContact CG-CD1 4.22Å; K697-Y702 HydrophobicContact CG-CE1 3.85Å; K697-Y702 PolarHBondContact NZ-OH 3.48Å; N699-Y702 WeakPolarHBondContact O-CA 3.28Å; N699-Y702 WeakPolarHBondContact O-CB 3.35Å; N699-Y702 PolarHBondContact O-N 3.28Å; Y702-S705 PolarHBondContact O-N 3.17Å; Y702-S705 PolarHBondContact O-OG 3Å; Y702-L706 HydrophobicContact CD1-CD1 3.96Å; Y702-L706 HydrophobicContact CE1-CD1 3.48Å; Y702-L706 VanDerWaalsContact CE1-CD1 3.48Å; Y702-L706 HydrophobicContact CE1-CG 4.33Å; Y702-L706 WeakPolarHBondContact O-CG 3.5Å; Y702-L706 PolarHBondContact O-N 2.83Å; Y702-L706 VanDerWaalsContact O-N 3.08Å
703	L	63.2	Low	55.9	Low	85 Å²	85	114.7 Å²	114.7	45%	0.445	61%	0.606	S	S	.	*	H	α-helix	trans	-63.9	-41.6	175.9	-67.4	170.6	0	0	0	112	N699 V700 L706 I707	N699-L703 PolarHBondContact O-N 2.94Å; N699-L703 VanDerWaalsContact O-N 3.1Å; V700-L703 PolarHBondContact O-N 2.83Å; L703-L706 PolarHBondContact O-N 3.47Å; L703-I707 WeakPolarHBondContact O-CG1 3.5Å; L703-I707 PolarHBondContact O-N 3.28Å
704	N	68.1	Low	56.9	Low	89 Å²	89	114.4 Å²	114.4	48%	0.476	61%	0.605	S	S	.	*	H	α-helix	trans	-66.1	-38.2	174.3	-76.2	-17	0	0	0	112	V700 L706 I707 T708	V700-N704 WeakPolarHBondContact O-CB 3.42Å; V700-N704 PolarHBondContact O-N 3.47Å; N704-L706 VanDerWaalsContact C-N 3.28Å; N704-L706 PolarHBondContact O-N 3Å; N704-I707 PolarHBondContact O-N 3.13Å; N704-T708 PolarHBondContact O-N 3.39Å; N704-T708 PolarHBondContact O-OG1 2.88Å
705	S	73.4	Confident	57.6	Low	59 Å²	59	112.5 Å²	112.5	41%	0.413	61%	0.606	S	S	.	*	H	α-helix	trans	-62.7	-34.7	175.5	78.5	0	0	0	0	112.9	V701 Y702 T708 S709	V701-S705 WeakPolarHBondContact O-CB 3.42Å; V701-S705 PolarHBondContact O-N 3.36Å; Y702-S705 PolarHBondContact O-N 3.17Å; Y702-S705 PolarHBondContact O-OG 3Å; S705-T708 PolarHBondContact O-N 2.89Å; S705-S709 VanDerWaalsContact O-CB 3.29Å; S705-S709 WeakPolarHBondContact O-CB 3.46Å; S705-S709 PolarHBondContact O-N 2.8Å; S705-S709 PolarHBondContact O-OG 3.32Å
706	L	60.8	Low	57.7	Low	51 Å²	51	111 Å²	111	27%	0.267	60%	0.599	S	S	.	*	H	α-helix	trans	-69.2	-38.1	176.8	-73.8	170.1	0	0	0	112.1	Y702 L703 N704 S709 G710 Y711	Y702-L706 HydrophobicContact CD1-CD1 3.96Å; Y702-L706 HydrophobicContact CE1-CD1 3.48Å; Y702-L706 VanDerWaalsContact CE1-CD1 3.48Å; Y702-L706 HydrophobicContact CE1-CG 4.33Å; Y702-L706 WeakPolarHBondContact O-CG 3.5Å; Y702-L706 PolarHBondContact O-N 2.83Å; Y702-L706 VanDerWaalsContact O-N 3.08Å; L703-L706 PolarHBondContact O-N 3.47Å; N704-L706 VanDerWaalsContact C-N 3.28Å; N704-L706 PolarHBondContact O-N 3Å; L706-S709 WeakPolarHBondContact CA-OG 3.46Å; L706-S709 PolarHBondContact O-N 3.29Å; L706-S709 PolarHBondContact O-OG 3.4Å; L706-G710 PolarHBondContact O-N 3.2Å; L706-Y711 PolarHBondContact O-N 3Å
707	I	64	Low	58.2	Low	107 Å²	107	114 Å²	114	55%	0.549	61%	0.606	S	S	.	*	H	α-helix	trans	-63.7	-46.9	175.1	-65.4	165.6	0	0	0	110.3	L703 N704 S709 G710	L703-I707 WeakPolarHBondContact O-CG1 3.5Å; L703-I707 PolarHBondContact O-N 3.28Å; N704-I707 PolarHBondContact O-N 3.13Å; I707-S709 VanDerWaalsContact C-N 3.32Å; I707-S709 PolarHBondContact O-N 3.3Å; I707-G710 PolarHBondContact O-N 3.46Å
708	T	67.5	Low	57.7	Low	126 Å²	126	113.5 Å²	113.5	77%	0.773	61%	0.611	S	S	*	*	H	α-helix	trans	-69.5	-30.1	180	-32.9	0	0	0	0	112.6	N704 S705 G710	N704-T708 PolarHBondContact O-N 3.39Å; N704-T708 PolarHBondContact O-OG1 2.88Å; S705-T708 PolarHBondContact O-N 2.89Å; T708-G710 PolarHBondContact O-N 2.77Å
709	S	66.2	Low	57.5	Low	75 Å²	75	115.2 Å²	115.2	52%	0.524	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.9	-0.3	176.3	72.6	0	0	0	0	114.6	S705 L706 I707 Y711	S705-S709 VanDerWaalsContact O-CB 3.29Å; S705-S709 WeakPolarHBondContact O-CB 3.46Å; S705-S709 PolarHBondContact O-N 2.8Å; S705-S709 PolarHBondContact O-OG 3.32Å; L706-S709 WeakPolarHBondContact CA-OG 3.46Å; L706-S709 PolarHBondContact O-N 3.29Å; L706-S709 PolarHBondContact O-OG 3.4Å; I707-S709 VanDerWaalsContact C-N 3.32Å; I707-S709 PolarHBondContact O-N 3.3Å; S709-Y711 VanDerWaalsContact C-N 3.32Å; S709-Y711 PolarHBondContact O-N 2.96Å
710	G	53.3	Low	56.4	Low	53 Å²	53	116.3 Å²	116.3	55%	0.546	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	78.3	11.5	177.6	0	0	0	0	0	114.9	L706 I707 T708 T712	L706-G710 PolarHBondContact O-N 3.2Å; I707-G710 PolarHBondContact O-N 3.46Å; T708-G710 PolarHBondContact O-N 2.77Å; G710-T712 PolarHBondContact O-N 3.08Å
711	Y	50.4	Low	55.2	Low	195 Å²	195	115.4 Å²	115.4	77%	0.765	61%	0.612	S	S	*	*			trans	-79.3	52.7	173.9	-109.6	-87	0	0	0	111.2	L706 S709	L706-Y711 PolarHBondContact O-N 3Å; S709-Y711 VanDerWaalsContact C-N 3.32Å; S709-Y711 PolarHBondContact O-N 2.96Å
712	T	52.6	Low	54.3	Low	85 Å²	85	121 Å²	121	52%	0.521	62%	0.621	S	S	.	*			trans	-88.6	124	172.6	53.3	0	0	0	0	108.9	G710 K714	G710-T712 PolarHBondContact O-N 3.08Å; T712-K714 PolarHBondContact O-N 3.35Å
713	K	54.3	Low	53.1	Low	201 Å²	201	122.7 Å²	122.7	87%	0.874	63%	0.627	S	S	*	*			trans	-62.2	105.8	161.3	-87.8	-175.7	175.9	-179.8	0	106.1	V715	K713-V715 PolarHBondContact O-N 2.82Å
714	K	56.6	Low	51.8	Low	195 Å²	195	126.1 Å²	126.1	85%	0.848	64%	0.644	S	S	*	*			trans	-61	107	166.2	-71.2	-176.8	178	-179.6	0	106.4	T712 D716	T712-K714 PolarHBondContact O-N 3.35Å; K714-D716 PolarHBondContact O-N 2.85Å
715	V	48.5	Very low	50.6	Low	123 Å²	123	130.6 Å²	130.6	75%	0.745	65%	0.654	S	S	*	*			trans	-76.7	116.3	171.6	-174.5	0	0	0	0	105.7	K713 I717	K713-V715 PolarHBondContact O-N 2.82Å; V715-I717 PolarHBondContact O-N 3.46Å
716	D	39.6	Very low	49.3	Very low	121 Å²	121	130.1 Å²	130.1	65%	0.647	65%	0.651	S	S	*	*			trans	-65.6	113.7	171.8	-151.8	-23.1	0	0	0	107.6	K714 T718	K714-D716 PolarHBondContact O-N 2.85Å; D716-T718 PolarHBondContact O-N 3.48Å; D716-T718 WeakPolarHBondContact OD1-CB 3.41Å; D716-T718 WeakPolarHBondContact OD1-CG2 3.21Å; D716-T718 PolarHBondContact OD1-N 3.25Å; D716-T718 PolarHBondContact OD1-OG1 2.82Å; D716-T718 PolarHBondContact OD2-OG1 3.3Å
717	I	49.1	Very low	48.9	Very low	169 Å²	169	133.5 Å²	133.5	87%	0.867	68%	0.676	S	S	*	*			trans	-81.4	8.5	176.1	36	168	0	0	0	111.7	V715 F719	V715-I717 PolarHBondContact O-N 3.46Å; I717-F719 PolarHBondContact O-N 3.03Å
718	T	40.1	Very low	48.4	Very low	88 Å²	88	133.2 Å²	133.2	54%	0.54	67%	0.672	S	S	.	*			trans	-65.7	106.3	166.6	48.9	0	0	0	0	109.2	D716 I720	D716-T718 PolarHBondContact O-N 3.48Å; D716-T718 WeakPolarHBondContact OD1-CB 3.41Å; D716-T718 WeakPolarHBondContact OD1-CG2 3.21Å; D716-T718 PolarHBondContact OD1-N 3.25Å; D716-T718 PolarHBondContact OD1-OG1 2.82Å; D716-T718 PolarHBondContact OD2-OG1 3.3Å; T718-I720 PolarHBondContact O-N 3.19Å
719	F	45.1	Very low	47.8	Very low	184 Å²	184	128.5 Å²	128.5	81%	0.807	65%	0.646	S	S	*	*			trans	-66.3	101.3	174.1	177.3	-98.8	0	0	0	109.1	I717 P721	I717-F719 PolarHBondContact O-N 3.03Å; F719-P721 HydrophobicContact CE1-CB 4.09Å; F719-P721 HydrophobicContact CZ-CB 4.36Å
720	I	37.6	Very low	47.5	Very low	131 Å²	131	128.4 Å²	128.4	67%	0.672	64%	0.642	S	S	*	*			trans	-95.5	115.3	164.2	-57.2	171.7	0	0	0	105.9	T718 R722	T718-I720 PolarHBondContact O-N 3.19Å; I720-R722 PolarHBondContact O-N 2.89Å
721	P	38.8	Very low	47.6	Very low	82 Å²	82	129.2 Å²	129.2	53%	0.532	64%	0.637	S	S	.	*			trans	-56.9	113.6	177.8	20.7	-30.1	0	0	0	109.3	F719 R723	F719-P721 HydrophobicContact CE1-CB 4.09Å; F719-P721 HydrophobicContact CZ-CB 4.36Å; P721-R723 PolarHBondContact O-N 3.31Å
722	R	45.6	Very low	48.1	Very low	232 Å²	232	123.1 Å²	123.1	88%	0.875	63%	0.626	S	S	*	*	S	Bend	trans	-74.2	-11.8	-176.4	-70.2	-171.6	174.5	-167.7	2	113.6	I720	I720-R722 PolarHBondContact O-N 2.89Å
723	R	39.5	Very low	48.7	Very low	125 Å²	125	123.5 Å²	123.5	47%	0.472	62%	0.622	S	S	.	*			trans	-96.6	110.7	164.9	-100.6	-176.9	176.2	-170.5	0.3	107.6	N461 P721 W725	N461-R723 PolarHBondContact OD1-NH2 3.21Å; P721-R723 PolarHBondContact O-N 3.31Å; R723-W725 PolarHBondContact O-N 3.19Å
724	I	37.3	Very low	49.1	Very low	157 Å²	157	118.4 Å²	118.4	81%	0.805	60%	0.604	S	S	*	*			trans	-51.6	120.6	136.2	-57.2	167.7	0	0	0	102.7	S726	I724-S726 PolarHBondContact O-N 3.45Å
725	W	41.9	Very low	49.5	Very low	184 Å²	184	113.5 Å²	113.5	70%	0.697	59%	0.586	S	S	*	*			trans	-47.5	100.2	165.6	-105.2	-62	0	0	0	105.1	I478 R723 P727	I478-W725 HydrophobicContact CD1-CH2 4.25Å; I478-W725 HydrophobicContact CD1-CZ2 4.23Å; I478-W725 HydrophobicContact CG1-CZ2 3.99Å; R723-W725 PolarHBondContact O-N 3.19Å; W725-P727 VanDerWaalsContact O-CD 3.27Å; W725-P727 WeakPolarHBondContact O-CD 3.25Å; W725-P727 VanDerWaalsContact O-N 3.09Å
726	S	46.1	Very low	50.4	Low	48 Å²	48	115.9 Å²	115.9	34%	0.336	58%	0.582	S	S	.	*			trans	-60.6	119.3	164.9	46.6	0	0	0	0	102.1	I724 E728	I724-S726 PolarHBondContact O-N 3.45Å; S726-E728 VanDerWaalsContact C-N 3.3Å; S726-E728 PolarHBondContact O-N 3.15Å
727	P	53.1	Low	51.6	Low	123 Å²	123	115.5 Å²	115.5	80%	0.799	58%	0.575	S	S	*	*			trans	-56.3	106.9	177.9	21.9	-30.3	0	0	0	105.7	W725	W725-P727 VanDerWaalsContact O-CD 3.27Å; W725-P727 WeakPolarHBondContact O-CD 3.25Å; W725-P727 VanDerWaalsContact O-N 3.09Å
728	E	52.5	Low	52.2	Low	101 Å²	101	113.6 Å²	113.6	47%	0.472	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-62.4	139.7	171.1	-68.9	-173.3	166.2	0	0	105.7	S726 T730	S726-E728 VanDerWaalsContact C-N 3.3Å; S726-E728 PolarHBondContact O-N 3.15Å; E728-T730 PolarHBondContact O-N 3.32Å
729	A	56.4	Low	53.4	Low	27 Å²	27	113.9 Å²	113.9	22%	0.223	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-56.5	120.4	-177.4	0	0	0	0	0	107.9	E733 L734	A729-E733 WeakPolarHBondContact CA-OE2 3.4Å; A729-E733 HydrophobicContact CB-CB 3.98Å; A729-L734 HydrophobicContact CB-CD2 3.75Å; A729-L734 HydrophobicContact CB-CG 3.84Å
730	T	58.8	Low	54.4	Low	73 Å²	73	108.1 Å²	108.1	45%	0.448	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-56.7	158	178	54.1	0	0	0	0	109.8	E728 A732 E733 L734	E728-T730 PolarHBondContact O-N 3.32Å; T730-A732 PolarHBondContact O-N 3.05Å; T730-A732 VanDerWaalsContact O-N 3.12Å; T730-E733 CarbonylContact O-C 3.18Å; T730-E733 WeakPolarHBondContact O-CA 3.04Å; T730-E733 WeakPolarHBondContact O-CB 3.5Å; T730-E733 PolarHBondContact O-N 3.17Å; T730-E733 WeakPolarHBondContact OG1-CG 3.23Å; T730-E733 PolarHBondContact OG1-N 3.39Å; T730-L734 PolarHBondContact O-N 2.89Å
731	T	55	Low	55.4	Low	70 Å²	70	109.1 Å²	109.1	43%	0.429	52%	0.524	S	S	.	.	H	α-helix	trans	-49.5	-40.5	174.8	47.9	0	0	0	0	111.5	P473 L734 I735	P473-T731 HydrophobicContact CG-CG2 4.36Å; T731-L734 PolarHBondContact O-N 3.47Å; T731-I735 WeakPolarHBondContact O-CB 3.41Å; T731-I735 WeakPolarHBondContact O-CD1 3.3Å; T731-I735 WeakPolarHBondContact O-CG1 3.46Å; T731-I735 PolarHBondContact O-N 3.33Å
732	A	62.3	Low	56.4	Low	66 Å²	66	110.1 Å²	110.1	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-61	-42.8	173	0	0	0	0	0	113.4	T730 R736	T730-A732 PolarHBondContact O-N 3.05Å; T730-A732 VanDerWaalsContact O-N 3.12Å; A732-R736 WeakPolarHBondContact O-CB 3.24Å; A732-R736 PolarHBondContact O-N 3.05Å
733	E	64.8	Low	57.2	Low	93 Å²	93	106.1 Å²	106.1	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-70.9	-35.8	177.2	-75.2	173.1	-159.9	0	0	113.3	A729 T730 R736 K737	A729-E733 WeakPolarHBondContact CA-OE2 3.4Å; A729-E733 HydrophobicContact CB-CB 3.98Å; T730-E733 CarbonylContact O-C 3.18Å; T730-E733 WeakPolarHBondContact O-CA 3.04Å; T730-E733 WeakPolarHBondContact O-CB 3.5Å; T730-E733 PolarHBondContact O-N 3.17Å; T730-E733 WeakPolarHBondContact OG1-CG 3.23Å; T730-E733 PolarHBondContact OG1-N 3.39Å; E733-R736 PolarHBondContact O-N 3.13Å; E733-K737 WeakPolarHBondContact O-CB 3.46Å; E733-K737 WeakPolarHBondContact O-CG 3.5Å; E733-K737 PolarHBondContact O-N 3.36Å
734	L	61.9	Low	58.1	Low	95 Å²	95	104.3 Å²	104.3	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-68.3	-43.5	174.8	-71.7	176.5	0	0	0	111.3	A729 T730 T731 K737 R738	A729-L734 HydrophobicContact CB-CD2 3.75Å; A729-L734 HydrophobicContact CB-CG 3.84Å; T730-L734 PolarHBondContact O-N 2.89Å; T731-L734 PolarHBondContact O-N 3.47Å; L734-K737 PolarHBondContact O-N 3.25Å; L734-R738 WeakPolarHBondContact O-CB 3.47Å; L734-R738 PolarHBondContact O-N 3.12Å
735	I	65.4	Low	58.9	Low	91 Å²	91	100 Å²	100	47%	0.467	48%	0.477	S	S	.	.	H	α-helix	trans	-61.9	-46	173.1	-68.6	165.3	0	0	0	109.7	T731 K737 R738 E739	T731-I735 WeakPolarHBondContact O-CB 3.41Å; T731-I735 WeakPolarHBondContact O-CD1 3.3Å; T731-I735 WeakPolarHBondContact O-CG1 3.46Å; T731-I735 PolarHBondContact O-N 3.33Å; I735-K737 PolarHBondContact O-N 3.12Å; I735-R738 CarbonylContact O-C 3.47Å; I735-R738 WeakPolarHBondContact O-CA 3.3Å; I735-R738 WeakPolarHBondContact O-CB 3.41Å; I735-R738 PolarHBondContact O-N 3.16Å; I735-R738 VanDerWaalsContact O-N 3.09Å; I735-E739 HydrophobicContact CG2-CG 4.37Å; I735-E739 WeakPolarHBondContact CG2-OE1 3.37Å; I735-E739 WeakPolarHBondContact O-CB 3.18Å; I735-E739 WeakPolarHBondContact O-CG 3.17Å; I735-E739 PolarHBondContact O-N 3.42Å
736	R	68.3	Low	59.5	Low	173 Å²	173	94.5 Å²	94.5	65%	0.653	46%	0.464	S	S	*	.	H	α-helix	trans	-61.9	-39.9	175.7	-172.7	-179	-179.2	-176.6	1.9	112.7	A732 E733 R738 E739 L740	A732-R736 WeakPolarHBondContact O-CB 3.24Å; A732-R736 PolarHBondContact O-N 3.05Å; E733-R736 PolarHBondContact O-N 3.13Å; R736-R738 VanDerWaalsContact C-N 3.33Å; R736-E739 PolarHBondContact O-N 3.36Å; R736-L740 HydrophobicContact CG-CD1 4.22Å; R736-L740 VanDerWaalsContact O-CB 3.3Å; R736-L740 WeakPolarHBondContact O-CB 3.2Å; R736-L740 WeakPolarHBondContact O-CG 3.21Å; R736-L740 PolarHBondContact O-N 2.88Å
737	K	64.1	Low	59.3	Low	114 Å²	114	102.9 Å²	102.9	50%	0.496	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-38	173.1	-82.9	178	178.8	174.7	0	111.4	E733 L734 I735 R741	E733-K737 WeakPolarHBondContact O-CB 3.46Å; E733-K737 WeakPolarHBondContact O-CG 3.5Å; E733-K737 PolarHBondContact O-N 3.36Å; L734-K737 PolarHBondContact O-N 3.25Å; I735-K737 PolarHBondContact O-N 3.12Å; K737-R741 WeakPolarHBondContact O-CB 3.39Å; K737-R741 WeakPolarHBondContact O-CG 3.42Å; K737-R741 PolarHBondContact O-N 3.48Å
738	R	61.5	Low	59	Low	128 Å²	128	102.4 Å²	102.4	48%	0.483	48%	0.477	S	S	.	.	H	α-helix	trans	-66.4	-43.6	175.1	-169.3	-180	-171.6	-174.3	0.6	111.1	L734 I735 R736 R741 R742 D750	L734-R738 WeakPolarHBondContact O-CB 3.47Å; L734-R738 PolarHBondContact O-N 3.12Å; I735-R738 CarbonylContact O-C 3.47Å; I735-R738 WeakPolarHBondContact O-CA 3.3Å; I735-R738 WeakPolarHBondContact O-CB 3.41Å; I735-R738 PolarHBondContact O-N 3.16Å; I735-R738 VanDerWaalsContact O-N 3.09Å; R736-R738 VanDerWaalsContact C-N 3.33Å; R738-R741 PolarHBondContact O-N 3.4Å; R738-R742 WeakPolarHBondContact O-CB 3.35Å; R738-R742 WeakPolarHBondContact O-CG 3.38Å; R738-R742 PolarHBondContact O-N 3.14Å; R738-D750 IonicContact NH2-OD2 2.99Å
739	E	65.9	Low	58.5	Low	94 Å²	94	101.9 Å²	101.9	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-64.1	-46.5	174.7	-72.6	170.1	173.4	0	0	111.4	I735 R736 R741 R742 E743	I735-E739 HydrophobicContact CG2-CG 4.37Å; I735-E739 WeakPolarHBondContact CG2-OE1 3.37Å; I735-E739 WeakPolarHBondContact O-CB 3.18Å; I735-E739 WeakPolarHBondContact O-CG 3.17Å; I735-E739 PolarHBondContact O-N 3.42Å; R736-E739 PolarHBondContact O-N 3.36Å; E739-R741 VanDerWaalsContact C-N 3.3Å; E739-R741 PolarHBondContact O-N 3.43Å; E739-R742 CarbonylContact O-C 3.6Å; E739-R742 WeakPolarHBondContact O-CA 3.2Å; E739-R742 WeakPolarHBondContact O-CB 3.41Å; E739-R742 PolarHBondContact O-N 3.14Å; E739-E743 WeakPolarHBondContact O-CG 3.24Å; E739-E743 PolarHBondContact O-N 3.39Å
740	L	64.8	Low	57.9	Low	64 Å²	64	105.1 Å²	105.1	34%	0.335	49%	0.494	S	S	.	.	H	α-helix	trans	-58.8	-39.3	172.8	-84.1	163.2	0	0	0	112.4	R736 R744	R736-L740 HydrophobicContact CG-CD1 4.22Å; R736-L740 VanDerWaalsContact O-CB 3.3Å; R736-L740 WeakPolarHBondContact O-CB 3.2Å; R736-L740 WeakPolarHBondContact O-CG 3.21Å; R736-L740 PolarHBondContact O-N 2.88Å; L740-R744 VanDerWaalsContact O-CB 3.3Å; L740-R744 WeakPolarHBondContact O-CB 3.46Å; L740-R744 WeakPolarHBondContact O-CD 3.15Å; L740-R744 WeakPolarHBondContact O-CG 3.48Å; L740-R744 PolarHBondContact O-N 3.12Å
741	R	59.3	Low	56.9	Low	152 Å²	152	110.5 Å²	110.5	57%	0.574	51%	0.512	S	S	*	.	H	α-helix	trans	-66	-42.7	172.4	-80.4	-175.1	-175.1	163.9	2	111.4	K737 R738 E739 E743 R744 F745	K737-R741 WeakPolarHBondContact O-CB 3.39Å; K737-R741 WeakPolarHBondContact O-CG 3.42Å; K737-R741 PolarHBondContact O-N 3.48Å; R738-R741 PolarHBondContact O-N 3.4Å; E739-R741 VanDerWaalsContact C-N 3.3Å; E739-R741 PolarHBondContact O-N 3.43Å; R741-E743 VanDerWaalsContact C-N 3.35Å; R741-E743 PolarHBondContact O-N 2.86Å; R741-R744 PolarHBondContact O-N 3.19Å; R741-F745 HydrophobicContact CB-CD2 4.35Å; R741-F745 WeakPolarHBondContact O-CB 3.16Å; R741-F745 WeakPolarHBondContact O-CD2 3.25Å; R741-F745 PolarHBondContact O-N 2.92Å
742	R	60.2	Low	56.2	Low	103 Å²	103	116.6 Å²	116.6	39%	0.389	54%	0.536	S	S	.	.	H	α-helix	trans	-62.6	-38.4	176.6	-73.8	166.2	171.5	-177.3	-6.8	112.5	R738 E739 T746	R738-R742 WeakPolarHBondContact O-CB 3.35Å; R738-R742 WeakPolarHBondContact O-CG 3.38Å; R738-R742 PolarHBondContact O-N 3.14Å; E739-R742 CarbonylContact O-C 3.6Å; E739-R742 WeakPolarHBondContact O-CA 3.2Å; E739-R742 WeakPolarHBondContact O-CB 3.41Å; E739-R742 PolarHBondContact O-N 3.14Å; R742-T746 CarbonylContact O-C 3.49Å; R742-T746 WeakPolarHBondContact O-CA 3.2Å; R742-T746 PolarHBondContact O-N 3.46Å
743	E	61.4	Low	55.2	Low	147 Å²	147	120.8 Å²	120.8	69%	0.687	55%	0.549	S	S	*	.	H	α-helix	trans	-68.7	-42.7	174.8	-72.9	176.3	173.1	0	0	111.6	E739 R741	E739-E743 WeakPolarHBondContact O-CG 3.24Å; E739-E743 PolarHBondContact O-N 3.39Å; R741-E743 VanDerWaalsContact C-N 3.35Å; R741-E743 PolarHBondContact O-N 2.86Å
744	R	58.2	Low	54.2	Low	87 Å²	87	121.8 Å²	121.8	33%	0.328	55%	0.552	S	S	.	*	H	α-helix	trans	-71.6	-41.2	-178.7	-74.8	174.1	-178.2	-175.2	2.8	113.6	L740 R741	L740-R744 VanDerWaalsContact O-CB 3.3Å; L740-R744 WeakPolarHBondContact O-CB 3.46Å; L740-R744 WeakPolarHBondContact O-CD 3.15Å; L740-R744 WeakPolarHBondContact O-CG 3.48Å; L740-R744 PolarHBondContact O-N 3.12Å; R741-R744 PolarHBondContact O-N 3.19Å
745	F	55.1	Low	53.5	Low	66 Å²	66	121.3 Å²	121.3	29%	0.289	55%	0.548	S	S	.	.	H	α-helix	trans	-100	4.3	-174.4	-69.3	-77.2	0	0	0	113.5	Q570 R741 V749	Q570-F745 VanDerWaalsContact NE2-CZ 3.3Å; R741-F745 HydrophobicContact CB-CD2 4.35Å; R741-F745 WeakPolarHBondContact O-CB 3.16Å; R741-F745 WeakPolarHBondContact O-CD2 3.25Å; R741-F745 PolarHBondContact O-N 2.92Å; F745-V749 HydrophobicContact CB-CB 3.97Å; F745-V749 HydrophobicContact CB-CG1 4.3Å; F745-V749 HydrophobicContact CB-CG2 3.71Å; F745-V749 WeakPolarHBondContact O-CG2 3.23Å
746	T	53.9	Low	52.5	Low	70 Å²	70	122 Å²	122	43%	0.429	55%	0.55	S	S	.	*			trans	61.1	167	-168.7	47.3	0	0	0	0	113.5	R742 E748	R742-T746 CarbonylContact O-C 3.49Å; R742-T746 WeakPolarHBondContact O-CA 3.2Å; R742-T746 PolarHBondContact O-N 3.46Å; T746-E748 PolarHBondContact O-N 2.81Å
747	Y	43.3	Very low	51.6	Low	223 Å²	223	117.4 Å²	117.4	88%	0.875	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	5.6	-174.9	-89.9	-89.1	0	0	0	115.8
748	E	45.9	Very low	50.8	Low	114 Å²	114	117 Å²	117	53%	0.533	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	12.3	-162.2	-60.2	-175.2	165.9	0	0	114.4	T746 F754	T746-E748 PolarHBondContact O-N 2.81Å; E748-F754 HydrophobicContact CB-CD2 4.23Å; E748-F754 HydrophobicContact CB-CE2 4.34Å
749	V	42.8	Very low	50.4	Low	89 Å²	89	114.9 Å²	114.9	54%	0.539	54%	0.537	S	S	.	.	S	Bend	trans	-106.5	4.3	-173.8	178.7	0	0	0	0	115.6	F745	F745-V749 HydrophobicContact CB-CB 3.97Å; F745-V749 HydrophobicContact CB-CG1 4.3Å; F745-V749 HydrophobicContact CB-CG2 3.71Å; F745-V749 WeakPolarHBondContact O-CG2 3.23Å
750	D	42.3	Very low	50	Low	96 Å²	96	115.7 Å²	115.7	51%	0.513	54%	0.54	S	S	.	.	S	Bend	trans	-114.5	101.7	157.6	-75.5	-25	0	0	0	107.5	R738	R738-D750 IonicContact NH2-OD2 2.99Å
751	F	39.1	Very low	49.7	Very low	186 Å²	186	115.4 Å²	115.4	82%	0.816	54%	0.538	S	S	*	.	S	Bend	trans	157.8	151.9	142.7	-75.2	-57.5	0	0	0	113	D753	F751-D753 PolarHBondContact O-N 3.24Å
752	E	40.7	Very low	50	Low	198 Å²	198	112.5 Å²	112.5	93%	0.925	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	2.1	-171.8	-67.9	175.9	152.2	0	0	116.1
753	D	40.5	Very low	50.4	Low	154 Å²	154	111.8 Å²	111.8	82%	0.824	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	20.6	-175.3	-68.7	-33.9	0	0	0	114	F751 M755	F751-D753 PolarHBondContact O-N 3.24Å; D753-M755 PolarHBondContact O-N 3.2Å
754	F	43.8	Very low	50.9	Low	113 Å²	113	109.7 Å²	109.7	50%	0.496	53%	0.526	S	S	.	.			trans	-77.6	114.1	173.5	-175.8	-101.3	0	0	0	111.9	E748 M756	E748-F754 HydrophobicContact CB-CD2 4.23Å; E748-F754 HydrophobicContact CB-CE2 4.34Å; F754-M756 HydrophobicContact CE1-CG 4.47Å
755	M	46.6	Very low	51.3	Low	86 Å²	86	112 Å²	112	42%	0.424	54%	0.538	S	S	.	.			trans	-104.1	126.9	170.9	-73.2	-73.6	-85.8	0	0	109.7	D753 Q759 M763	D753-M755 PolarHBondContact O-N 3.2Å; M755-Q759 HydrophobicContact CB-CB 4.23Å; M755-Q759 HydrophobicContact CE-CB 3.65Å; M755-Q759 HydrophobicContact CE-CG 4.15Å; M755-Q759 HydrophobicContact SD-CB 4.31Å; M755-Q759 PolarHBondContact SD-OE1 3.13Å; M755-M763 HydrophobicContact CE-SD 4.46Å
756	M	45.7	Very low	52.1	Low	104 Å²	104	111.2 Å²	111.2	51%	0.512	54%	0.543	S	S	.	.			trans	-53.2	147.8	-178.3	-69.3	-111.4	-78.4	0	0	111	F754 F758 Q759 K760	F754-M756 HydrophobicContact CE1-CG 4.47Å; M756-F758 CarbonylContact O-C 3.48Å; M756-F758 PolarHBondContact O-N 3.49Å; M756-Q759 HydrophobicContact CB-CG 4.49Å; M756-Q759 VanDerWaalsContact N-OE1 3.1Å; M756-Q759 WeakPolarHBondContact O-CA 3.4Å; M756-Q759 WeakPolarHBondContact O-CB 3.25Å; M756-Q759 PolarHBondContact O-N 3.11Å; M756-K760 PolarHBondContact O-N 3.35Å
757	P	49.2	Very low	53.1	Low	78 Å²	78	113.2 Å²	113.2	51%	0.506	55%	0.548	S	S	.	.	H	α-helix	trans	-50.1	-33.3	-179.6	-29.5	34.8	0	0	0	114	N761	P757-N761 VanDerWaalsContact O-CB 3.29Å; P757-N761 WeakPolarHBondContact O-CB 3.33Å; P757-N761 PolarHBondContact O-N 3.35Å
758	F	46.3	Very low	54.5	Low	105 Å²	105	105.6 Å²	105.6	46%	0.461	53%	0.531	S	S	.	.	H	α-helix	trans	-63.6	-45.8	171.8	-179.3	-103.8	0	0	0	113.5	M756 N761 I762	M756-F758 CarbonylContact O-C 3.48Å; M756-F758 PolarHBondContact O-N 3.49Å; F758-N761 PolarHBondContact O-N 3.02Å; F758-I762 HydrophobicContact CD1-CD1 3.78Å; F758-I762 HydrophobicContact CE1-CD1 3.28Å; F758-I762 HydrophobicContact CE1-CG1 4.49Å; F758-I762 HydrophobicContact CE2-CD1 4.14Å; F758-I762 HydrophobicContact CG-CD1 4.4Å; F758-I762 HydrophobicContact CZ-CD1 3.49Å; F758-I762 VanDerWaalsContact CZ-CD1 3.49Å; F758-I762 HydrophobicContact CZ-CG1 4.49Å; F758-I762 WeakPolarHBondContact O-CG1 3.49Å; F758-I762 PolarHBondContact O-N 3.28Å
759	Q	52.6	Low	55.7	Low	84 Å²	84	105.3 Å²	105.3	39%	0.393	53%	0.532	S	S	.	.	H	α-helix	trans	-67.9	-39.1	176.6	-72.3	172	-42.3	0	0	111.5	M755 M756 I762 M763	M755-Q759 HydrophobicContact CB-CB 4.23Å; M755-Q759 HydrophobicContact CE-CB 3.65Å; M755-Q759 HydrophobicContact CE-CG 4.15Å; M755-Q759 HydrophobicContact SD-CB 4.31Å; M755-Q759 PolarHBondContact SD-OE1 3.13Å; M756-Q759 HydrophobicContact CB-CG 4.49Å; M756-Q759 VanDerWaalsContact N-OE1 3.1Å; M756-Q759 WeakPolarHBondContact O-CA 3.4Å; M756-Q759 WeakPolarHBondContact O-CB 3.25Å; M756-Q759 PolarHBondContact O-N 3.11Å; Q759-I762 PolarHBondContact O-N 2.98Å; Q759-M763 WeakPolarHBondContact O-CB 3.29Å; Q759-M763 PolarHBondContact O-N 2.73Å
760	K	59.3	Low	57.1	Low	111 Å²	111	107 Å²	107	48%	0.483	54%	0.535	S	S	.	.	H	α-helix	trans	-59.7	-46.3	173.9	-169.3	174.9	-179.3	175.8	0	111.6	M756 I762 M763 E764	M756-K760 PolarHBondContact O-N 3.35Å; K760-I762 PolarHBondContact O-N 3.29Å; K760-M763 PolarHBondContact O-N 3.13Å; K760-E764 WeakPolarHBondContact O-CG 3.3Å; K760-E764 PolarHBondContact O-N 2.92Å
761	N	57	Low	58.5	Low	58 Å²	58	105.4 Å²	105.4	31%	0.31	54%	0.535	S	S	.	.	H	α-helix	trans	-68.1	-34.6	178.8	-159.6	-11.4	0	0	0	112.7	P757 F758 K765	P757-N761 VanDerWaalsContact O-CB 3.29Å; P757-N761 WeakPolarHBondContact O-CB 3.33Å; P757-N761 PolarHBondContact O-N 3.35Å; F758-N761 PolarHBondContact O-N 3.02Å; N761-K765 WeakPolarHBondContact O-CB 3.25Å; N761-K765 VanDerWaalsContact O-CG 3.31Å; N761-K765 WeakPolarHBondContact O-CG 3.48Å; N761-K765 PolarHBondContact O-N 2.78Å; N761-K765 VanDerWaalsContact O-N 3.07Å
762	I	66.1	Low	59.8	Low	90 Å²	90	100 Å²	100	46%	0.462	52%	0.52	S	S	.	.	H	α-helix	trans	-65.7	-43.4	171.6	-73.7	171.7	0	0	0	111.2	F758 Q759 K760 K765 A766	F758-I762 HydrophobicContact CD1-CD1 3.78Å; F758-I762 HydrophobicContact CE1-CD1 3.28Å; F758-I762 HydrophobicContact CE1-CG1 4.49Å; F758-I762 HydrophobicContact CE2-CD1 4.14Å; F758-I762 HydrophobicContact CG-CD1 4.4Å; F758-I762 HydrophobicContact CZ-CD1 3.49Å; F758-I762 VanDerWaalsContact CZ-CD1 3.49Å; F758-I762 HydrophobicContact CZ-CG1 4.49Å; F758-I762 WeakPolarHBondContact O-CG1 3.49Å; F758-I762 PolarHBondContact O-N 3.28Å; Q759-I762 PolarHBondContact O-N 2.98Å; K760-I762 PolarHBondContact O-N 3.29Å; I762-K765 PolarHBondContact O-N 3.41Å; I762-A766 WeakPolarHBondContact O-CB 3.37Å; I762-A766 PolarHBondContact O-N 2.93Å
763	M	68.7	Low	61	Low	89 Å²	89	96.9 Å²	96.9	44%	0.438	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-45	-179.9	-126.7	176	46.9	0	0	111.6	M755 Q759 K760 K765 A766 Q767	M755-M763 HydrophobicContact CE-SD 4.46Å; Q759-M763 WeakPolarHBondContact O-CB 3.29Å; Q759-M763 PolarHBondContact O-N 2.73Å; K760-M763 PolarHBondContact O-N 3.13Å; M763-K765 VanDerWaalsContact C-N 3.31Å; M763-K765 PolarHBondContact O-N 2.97Å; M763-A766 PolarHBondContact O-N 3.22Å; M763-Q767 WeakPolarHBondContact O-CB 3.22Å; M763-Q767 WeakPolarHBondContact O-CG 3.35Å; M763-Q767 PolarHBondContact O-N 3.22Å
764	E	71	Confident	61.7	Low	103 Å²	103	98.2 Å²	98.2	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-60.8	-41	175.8	-75.2	172.4	-176.1	0	0	111.2	K760 A768	K760-E764 WeakPolarHBondContact O-CG 3.3Å; K760-E764 PolarHBondContact O-N 2.92Å; E764-A768 WeakPolarHBondContact O-CB 3.45Å; E764-A768 PolarHBondContact O-N 3.05Å
765	K	68.3	Low	61.7	Low	136 Å²	136	103 Å²	103	59%	0.591	54%	0.537	S	S	*	.	H	α-helix	trans	-67.5	-37.9	173.8	-76.1	-179.9	-179.1	179.9	0	113.1	N761 I762 M763 A768 L769	N761-K765 WeakPolarHBondContact O-CB 3.25Å; N761-K765 VanDerWaalsContact O-CG 3.31Å; N761-K765 WeakPolarHBondContact O-CG 3.48Å; N761-K765 PolarHBondContact O-N 2.78Å; N761-K765 VanDerWaalsContact O-N 3.07Å; I762-K765 PolarHBondContact O-N 3.41Å; M763-K765 VanDerWaalsContact C-N 3.31Å; M763-K765 PolarHBondContact O-N 2.97Å; K765-A768 PolarHBondContact O-N 2.65Å; K765-L769 WeakPolarHBondContact O-CB 3.29Å; K765-L769 PolarHBondContact O-N 3.4Å
766	A	70.9	Confident	62.5	Low	48 Å²	48	103.9 Å²	103.9	40%	0.397	54%	0.543	S	S	.	.	H	α-helix	trans	-66.2	-42.7	176.2	0	0	0	0	0	111.4	I762 M763 L769 E770	I762-A766 WeakPolarHBondContact O-CB 3.37Å; I762-A766 PolarHBondContact O-N 2.93Å; M763-A766 PolarHBondContact O-N 3.22Å; A766-L769 WeakPolarHBondContact O-CB 3.23Å; A766-L769 PolarHBondContact O-N 2.54Å; A766-E770 PolarHBondContact O-N 3.3Å
767	Q	75.1	Confident	63.4	Low	113 Å²	113	103.9 Å²	103.9	53%	0.528	54%	0.544	S	S	.	.	H	α-helix	trans	-65.9	-39.2	175.7	-73.2	176.2	-4.7	0	0	112.1	M763 L769 E770 A771	M763-Q767 WeakPolarHBondContact O-CB 3.22Å; M763-Q767 WeakPolarHBondContact O-CG 3.35Å; M763-Q767 PolarHBondContact O-N 3.22Å; Q767-L769 VanDerWaalsContact C-N 3.32Å; Q767-L769 PolarHBondContact O-N 3.22Å; Q767-E770 PolarHBondContact O-N 3.09Å; Q767-A771 WeakPolarHBondContact O-CB 3.25Å; Q767-A771 PolarHBondContact O-N 3.02Å
768	A	72.1	Confident	64.2	Low	62 Å²	62	105.3 Å²	105.3	51%	0.512	55%	0.546	S	S	.	.	H	α-helix	trans	-63.9	-37.1	173.5	0	0	0	0	0	112.3	E764 K765 S772	E764-A768 WeakPolarHBondContact O-CB 3.45Å; E764-A768 PolarHBondContact O-N 3.05Å; K765-A768 PolarHBondContact O-N 2.65Å; A768-S772 WeakPolarHBondContact O-CB 3.4Å; A768-S772 PolarHBondContact O-N 2.87Å
769	L	71.6	Confident	65.2	Low	109 Å²	109	105.4 Å²	105.4	57%	0.571	55%	0.551	S	S	*	*	H	α-helix	trans	-68	-43.9	174.4	-115.5	150	0	0	0	112	K765 A766 Q767 A771 S772 L773	K765-L769 WeakPolarHBondContact O-CB 3.29Å; K765-L769 PolarHBondContact O-N 3.4Å; A766-L769 WeakPolarHBondContact O-CB 3.23Å; A766-L769 PolarHBondContact O-N 2.54Å; Q767-L769 VanDerWaalsContact C-N 3.32Å; Q767-L769 PolarHBondContact O-N 3.22Å; L769-A771 VanDerWaalsContact C-N 3.34Å; L769-A771 PolarHBondContact O-N 3.21Å; L769-S772 WeakPolarHBondContact CA-OG 3.3Å; L769-S772 PolarHBondContact O-N 3.44Å; L769-S772 PolarHBondContact O-OG 3.27Å; L769-L773 HydrophobicContact CD2-CD1 4.47Å; L769-L773 WeakPolarHBondContact O-CG 3.4Å; L769-L773 PolarHBondContact O-N 3.33Å; L769-L773 VanDerWaalsContact O-N 3.07Å
770	E	72.9	Confident	66	Low	125 Å²	125	106.7 Å²	106.7	58%	0.584	56%	0.561	S	S	*	*	H	α-helix	trans	-63.3	-37.6	174.6	-79	-172.4	157.5	0	0	112.8	A766 Q767 S772 L773 K774	A766-E770 PolarHBondContact O-N 3.3Å; Q767-E770 PolarHBondContact O-N 3.09Å; E770-S772 VanDerWaalsContact C-N 3.34Å; E770-L773 PolarHBondContact O-N 3.06Å; E770-K774 PolarHBondContact O-N 2.93Å
771	A	70.8	Confident	66.5	Low	62 Å²	62	106.4 Å²	106.4	51%	0.512	57%	0.567	S	S	.	*	H	α-helix	trans	-66.7	-36.1	174.1	0	0	0	0	0	111.8	Q767 L769 L773 K774	Q767-A771 WeakPolarHBondContact O-CB 3.25Å; Q767-A771 PolarHBondContact O-N 3.02Å; L769-A771 VanDerWaalsContact C-N 3.34Å; L769-A771 PolarHBondContact O-N 3.21Å; A771-L773 VanDerWaalsContact C-N 3.31Å; A771-L773 PolarHBondContact O-N 3.35Å; A771-K774 PolarHBondContact O-N 3.2Å
772	S	67.4	Low	67.1	Low	72 Å²	72	109.9 Å²	109.9	50%	0.503	59%	0.585	S	S	.	*	H	α-helix	trans	-72.6	-20.5	175.9	73.3	0	0	0	0	114.4	A768 L769 E770	A768-S772 WeakPolarHBondContact O-CB 3.4Å; A768-S772 PolarHBondContact O-N 2.87Å; L769-S772 WeakPolarHBondContact CA-OG 3.3Å; L769-S772 PolarHBondContact O-N 3.44Å; L769-S772 PolarHBondContact O-OG 3.27Å; E770-S772 VanDerWaalsContact C-N 3.34Å
773	L	64.5	Low	67.2	Low	133 Å²	133	111.4 Å²	111.4	70%	0.696	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-8.9	176	-77.5	162.8	0	0	0	113.4	L769 E770 A771	L769-L773 HydrophobicContact CD2-CD1 4.47Å; L769-L773 WeakPolarHBondContact O-CG 3.4Å; L769-L773 PolarHBondContact O-N 3.33Å; L769-L773 VanDerWaalsContact O-N 3.07Å; E770-L773 PolarHBondContact O-N 3.06Å; A771-L773 VanDerWaalsContact C-N 3.31Å; A771-L773 PolarHBondContact O-N 3.35Å
774	K	55.1	Low	67.1	Low	182 Å²	182	113.3 Å²	113.3	79%	0.791	61%	0.607	S	S	*	*			trans	-102.1	4.7	178.5	-77.2	-178.7	178.5	172.7	0	113.9	E770 A771	E770-K774 PolarHBondContact O-N 2.93Å; A771-K774 PolarHBondContact O-N 3.2Å
775	L	45.6	Very low	66.7	Low	214 Å²	214	114.2 Å²	114.2	100%	1.12	62%	0.619	S	S	*	*			trans	-105.4	0	163.1	-82.9	158.8	0	0	0	108.2

Retrieved 775 of 775 residues in 200.8 ms (Link to these results)

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