A0A060XVW7_ONCMY Loading...

RAB, member of RAS oncogene family-like 2

AlphaFold DB , UniProt , Accession A0A060XVW7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110521966, Length 224 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	37.5	Very low	40	Very low	249 Å²	249	142 Å²	142	100%	1.227	85%	0.85	S	S	*	*				0	92.7	0	-73	173.2	171.8	0	0	106.7
2	A	34.9	Very low	40.4	Very low	103 Å²	103	138.3 Å²	138.3	85%	0.851	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-95.6	119.5	172.6	0	0	0	0	0	106.3
3	S	38.3	Very low	40.8	Very low	118 Å²	118	140.5 Å²	140.5	83%	0.825	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-101	121.6	172.6	53	0	0	0	0	108.4	A5	S3-A5 PolarHBondContact O-N 3.1Å
4	D	38.3	Very low	41.1	Very low	156 Å²	156	139.9 Å²	139.9	83%	0.834	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-52.1	123.2	-178	-64.8	-55.5	0	0	0	113.5
5	A	44.8	Very low	41.3	Very low	102 Å²	102	139.5 Å²	139.5	84%	0.843	80%	0.796	S	S	*	*			trans	-105.7	78.6	162.5	0	0	0	0	0	107.8	S3	S3-A5 PolarHBondContact O-N 3.1Å
6	N	43	Very low	41.8	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	78%	0.779	S	S	*	*			trans	-125.9	49.7	176.4	-123.2	7.6	0	0	0	110.8	I8	N6-I8 PolarHBondContact O-N 3.18Å
7	G	36.3	Very low	42.6	Very low	72 Å²	72	138.8 Å²	138.8	74%	0.742	78%	0.775	S	S	*	*			trans	-77.2	108.5	164.7	0	0	0	0	0	109
8	I	41.6	Very low	43.8	Very low	154 Å²	154	132.9 Å²	132.9	79%	0.79	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-56.1	128.8	163.2	-58.7	169.3	0	0	0	106	N6 E10	N6-I8 PolarHBondContact O-N 3.18Å; I8-E10 PolarHBondContact O-N 2.94Å
9	P	40.6	Very low	45.6	Very low	112 Å²	112	131.8 Å²	131.8	73%	0.727	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-59.7	117.4	175.1	-14.7	26.8	0	0	0	107.8	L11	P9-L11 PolarHBondContact O-N 3.45Å
10	E	43.4	Very low	47.6	Very low	189 Å²	189	127.6 Å²	127.6	88%	0.883	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-51.7	117.2	166	-88.9	176.9	151.6	0	0	107.1	I8 D12	I8-E10 PolarHBondContact O-N 2.94Å; E10-D12 PolarHBondContact O-N 3.42Å; E10-D12 VanDerWaalsContact O-N 3.09Å
11	L	41.6	Very low	49.7	Very low	149 Å²	149	125.8 Å²	125.8	78%	0.78	70%	0.699	S	S	*	*			trans	-63	111.6	169.3	-69.2	165	0	0	0	105.8	P9 Q13	P9-L11 PolarHBondContact O-N 3.45Å; L11-Q13 VanDerWaalsContact C-N 3.34Å; L11-Q13 PolarHBondContact O-N 3.03Å
12	D	44.2	Very low	52.4	Low	97 Å²	97	114 Å²	114	52%	0.519	64%	0.641	S	S	.	*			trans	-45.2	96.6	169.9	-87.4	-22.2	0	0	0	109.2	E10 D14 K15	E10-D12 PolarHBondContact O-N 3.42Å; E10-D12 VanDerWaalsContact O-N 3.09Å; D12-D14 PolarHBondContact O-N 3.4Å; D12-K15 HydrophobicContact CB-CB 4.5Å; D12-K15 HydrophobicContact CB-CD 4.24Å; D12-K15 HydrophobicContact CB-CG 4.4Å; D12-K15 PolarHBondContact O-N 3.43Å; D12-K15 IonicContact OD2-NZ 2.84Å; D12-K15 PolarHBondContact OD2-NZ 3.28Å
13	Q	45.6	Very low	55.3	Low	167 Å²	167	109.8 Å²	109.8	78%	0.78	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-65.1	-29.9	180	-86.6	172.2	-10.9	0	0	110.9	L11 K15 Y16	L11-Q13 VanDerWaalsContact C-N 3.34Å; L11-Q13 PolarHBondContact O-N 3.03Å; Q13-K15 PolarHBondContact O-N 3.26Å; Q13-K15 VanDerWaalsContact O-N 3.1Å; Q13-Y16 PolarHBondContact O-N 3.28Å
14	D	44.9	Very low	58.1	Low	133 Å²	133	104.2 Å²	104.2	71%	0.711	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-63.2	-17.2	179.2	-59.9	-15.1	0	0	0	114.3	D12 Y16	D12-D14 PolarHBondContact O-N 3.4Å; D14-Y16 VanDerWaalsContact C-N 3.3Å; D14-Y16 PolarHBondContact O-N 3.3Å
15	K	44.4	Very low	60.7	Low	133 Å²	133	96.8 Å²	96.8	58%	0.578	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-81.6	-5.3	178.8	-86.2	177.6	-176.3	140.5	0	114.6	D12 Q13 N62	D12-K15 HydrophobicContact CB-CB 4.5Å; D12-K15 HydrophobicContact CB-CD 4.24Å; D12-K15 HydrophobicContact CB-CG 4.4Å; D12-K15 PolarHBondContact O-N 3.43Å; D12-K15 IonicContact OD2-NZ 2.84Å; D12-K15 PolarHBondContact OD2-NZ 3.28Å; Q13-K15 PolarHBondContact O-N 3.26Å; Q13-K15 VanDerWaalsContact O-N 3.1Å; K15-N62 PolarHBondContact O-ND2 2.96Å
16	Y	48.8	Very low	63.1	Low	136 Å²	136	92 Å²	92	53%	0.533	49%	0.486	S	S	.	.	S	Bend	trans	-114.6	1.5	176.1	-71.2	-79.3	0	0	0	113.7	Q13 D14 A18 K60	Q13-Y16 PolarHBondContact O-N 3.28Å; D14-Y16 VanDerWaalsContact C-N 3.3Å; D14-Y16 PolarHBondContact O-N 3.3Å; Y16-A18 VanDerWaalsContact C-N 3.28Å; Y16-A18 PolarHBondContact O-N 3.09Å; Y16-K60 HydrophobicContact CE1-CD 4.08Å
17	D	55.7	Low	65.5	Low	132 Å²	132	84.5 Å²	84.5	71%	0.706	45%	0.445	S	S	*	.			trans	-75.5	83	168.5	-85.6	-13.4	0	0	0	109.5
18	A	65.4	Low	68.2	Low	33 Å²	33	81.2 Å²	81.2	27%	0.273	41%	0.411	S	S	.	.			trans	-96.7	134.1	166.1	0	0	0	0	0	109.4	Y16 E20 L71	Y16-A18 VanDerWaalsContact C-N 3.28Å; Y16-A18 PolarHBondContact O-N 3.09Å; A18-E20 PolarHBondContact O-N 3.37Å; A18-L71 HydrophobicContact CB-CB 3.56Å
19	D	76.5	Confident	70.5	Confident	112 Å²	112	74.8 Å²	74.8	60%	0.599	38%	0.379	S	S	*	.	S	Bend	trans	-59.1	-32.2	173	-56.3	-44.6	0	0	0	111	K68 A69	D19-K68 HydrophobicContact CB-CB 4.45Å; D19-K68 WeakPolarHBondContact OD2-CA 3.41Å; D19-A69 PolarHBondContact N-O 3Å; D19-A69 PolarHBondContact OD2-N 3.01Å
20	E	87.2	Confident	72.8	Confident	47 Å²	47	71.6 Å²	71.6	22%	0.22	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.4	-175.7	-69.4	-69.9	-179.4	0	0	111.8	A18 K68 A69 V70 L71 M179 K182	A18-E20 PolarHBondContact O-N 3.37Å; E20-K68 HydrophobicContact CG-CD 4.41Å; E20-A69 PolarHBondContact N-O 3.13Å; E20-A69 VanDerWaalsContact N-O 3.12Å; E20-V70 HydrophobicContact CB-CG2 4.39Å; E20-V70 CarbonylContact O-C 3.56Å; E20-V70 VanDerWaalsContact O-CA 3.29Å; E20-V70 WeakPolarHBondContact O-CA 3.48Å; E20-L71 PolarHBondContact O-N 2.77Å; E20-M179 HydrophobicContact CB-CE 3.97Å; E20-M179 HydrophobicContact CB-SD 4.35Å; E20-M179 HydrophobicContact CG-CE 4.06Å; E20-K182 WeakPolarHBondContact OE2-CE 3.35Å; E20-K182 IonicContact OE2-NZ 2.78Å; E20-K182 PolarHBondContact OE2-NZ 3.15Å
21	Q	91.5	Very high	75	Confident	90 Å²	90	65.9 Å²	65.9	42%	0.421	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.8	170	-169.7	177.7	17	0	0	110.8	L71 D73 K182	Q21-L71 CarbonylContact C-O 3.57Å; Q21-L71 VanDerWaalsContact CA-O 3.26Å; Q21-L71 WeakPolarHBondContact CA-O 3.33Å; Q21-L71 HydrophobicContact CG-CB 4.37Å; Q21-L71 HydrophobicContact CG-CD2 4.24Å; Q21-L71 HydrophobicContact CG-CG 4.23Å; Q21-D73 PolarHBondContact NE2-OD2 2.77Å; Q21-K182 WeakPolarHBondContact O-CE 3.47Å; Q21-K182 PolarHBondContact O-NZ 2.99Å
22	V	94.5	Very high	77.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138	171.9	-71.7	0	0	0	0	110.8	V70 L71 V72 D73 H95 I175 A178 M179 K182	V22-V70 HydrophobicContact CG2-CG1 3.85Å; V22-L71 PolarHBondContact N-O 2.9Å; V22-V72 HydrophobicContact CG2-CB 4.29Å; V22-V72 HydrophobicContact CG2-CG1 4.2Å; V22-V72 HydrophobicContact CG2-CG2 3.84Å; V22-V72 CarbonylContact O-C 3.51Å; V22-V72 WeakPolarHBondContact O-CA 3.48Å; V22-D73 PolarHBondContact O-N 3.04Å; V22-H95 HydrophobicContact CB-CB 4.41Å; V22-H95 HydrophobicContact CG1-CB 4.47Å; V22-I175 HydrophobicContact CG2-CG2 4.42Å; V22-A178 HydrophobicContact CB-CB 4.29Å; V22-A178 HydrophobicContact CG1-CB 4.42Å; V22-M179 HydrophobicContact CB-SD 4.49Å; V22-M179 HydrophobicContact CG1-CG 4.21Å; V22-M179 HydrophobicContact CG1-SD 3.44Å; V22-M179 WeakPolarHBondContact CG1-SD 3.46Å; V22-M179 HydrophobicContact CG2-SD 4.23Å; V22-K182 HydrophobicContact CG1-CB 4.4Å; V22-K182 HydrophobicContact CG1-CD 3.9Å
23	K	95	Very high	79.9	Confident	16 Å²	16	54.8 Å²	54.8	7%	0.07	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.1	175.8	168	176.1	172.3	177.8	0	110.1	I25 D73 W75 Y90 H92 K93 H95	K23-I25 HydrophobicContact CG-CG2 4.43Å; K23-D73 CarbonylContact C-O 3.54Å; K23-D73 WeakPolarHBondContact CA-O 3.16Å; K23-D73 HydrophobicContact CB-CB 4.48Å; K23-W75 HydrophobicContact CD-CD2 4.13Å; K23-W75 HydrophobicContact CD-CG 4.32Å; K23-W75 HydrophobicContact CD-CZ2 4.23Å; K23-W75 VanDerWaalsContact CE-CE2 3.49Å; K23-W75 HydrophobicContact CG-CG 4.24Å; K23-Y90 VanDerWaalsContact CE-O 3.28Å; K23-Y90 WeakPolarHBondContact CE-O 3.44Å; K23-Y90 PolarHBondContact NZ-O 2.97Å; K23-H92 WeakPolarHBondContact CE-O 3.41Å; K23-H92 PolarHBondContact NZ-O 2.93Å; K23-K93 WeakPolarHBondContact CB-O 3.35Å; K23-H95 PolarHBondContact N-ND1 3.04Å; K23-H95 PolarHBondContact O-N 3.27Å
24	I	96.3	Very high	82.2	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.4	176.8	-58.7	177.2	0	0	0	108.3	V72 D73 F74 W75 A96 I98 T174 I175 A178	I24-V72 HydrophobicContact CD1-CG1 3.76Å; I24-V72 HydrophobicContact CG1-CG1 4.21Å; I24-D73 PolarHBondContact N-O 2.79Å; I24-F74 HydrophobicContact CB-CD1 3.81Å; I24-F74 HydrophobicContact CB-CE1 4.01Å; I24-F74 HydrophobicContact CD1-CD1 4.36Å; I24-F74 HydrophobicContact CD1-CE1 3.68Å; I24-F74 HydrophobicContact CD1-CZ 4.36Å; I24-F74 HydrophobicContact CG1-CE1 4.37Å; I24-F74 HydrophobicContact CG2-CD1 4.05Å; I24-F74 HydrophobicContact CG2-CE1 4.15Å; I24-F74 WeakPolarHBondContact O-CA 3.41Å; I24-W75 PolarHBondContact O-N 2.78Å; I24-A96 WeakPolarHBondContact CA-O 3.36Å; I24-A96 HydrophobicContact CG1-CB 4.32Å; I24-I98 HydrophobicContact CG2-CD1 3.9Å; I24-I98 HydrophobicContact CG2-CG1 3.92Å; I24-T174 HydrophobicContact CD1-CG2 4.17Å; I24-T174 HydrophobicContact CG2-CG2 4.03Å; I24-I175 HydrophobicContact CD1-CB 4.34Å; I24-I175 HydrophobicContact CD1-CG1 3.74Å; I24-A178 HydrophobicContact CD1-CB 4.22Å; I24-A178 HydrophobicContact CG1-CB 4.15Å
25	I	94.4	Very high	84.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.7	177.5	55.8	167.2	0	0	0	109.9	K23 L27 W75 Y91 A94 A96 C97 I98 L119	K23-I25 HydrophobicContact CG-CG2 4.43Å; I25-L27 HydrophobicContact CD1-CD1 4.42Å; I25-L27 HydrophobicContact CD1-CG 4.48Å; I25-W75 HydrophobicContact CG2-CB 3.85Å; I25-W75 HydrophobicContact CG2-CG 4.33Å; I25-Y91 HydrophobicContact CD1-CD1 3.67Å; I25-Y91 HydrophobicContact CD1-CE1 4.12Å; I25-A94 HydrophobicContact CD1-CB 3.97Å; I25-A94 HydrophobicContact CG1-CB 3.95Å; I25-A94 HydrophobicContact CG2-CB 3.98Å; I25-A96 PolarHBondContact N-O 2.98Å; I25-A96 VanDerWaalsContact N-O 3.09Å; I25-C97 HydrophobicContact CD1-CB 4.29Å; I25-C97 HydrophobicContact CG1-CB 3.95Å; I25-C97 CarbonylContact O-C 3.55Å; I25-C97 WeakPolarHBondContact O-CA 3.12Å; I25-I98 PolarHBondContact O-N 2.82Å; I25-L119 HydrophobicContact CD1-CD1 3.67Å
26	C	93.6	Very high	86.7	Confident	3 Å²	3	42 Å²	42	2%	0.02	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.2	170.8	-74.1	0	0	0	0	109.6	K34 M38 W75 T77 I98	C26-K34 HydrophobicContact CB-CB 4.42Å; C26-K34 HydrophobicContact CB-CD 4.16Å; C26-M38 HydrophobicContact CB-CE 3.59Å; C26-M38 WeakPolarHBondContact SG-CE 3.49Å; C26-W75 PolarHBondContact N-O 2.78Å; C26-T77 WeakPolarHBondContact O-CB 3.37Å; C26-T77 VanDerWaalsContact O-CG2 3.22Å; C26-T77 WeakPolarHBondContact O-CG2 3.35Å; C26-T77 PolarHBondContact O-OG1 3.49Å; C26-I98 CarbonylContact C-O 3.58Å; C26-I98 VanDerWaalsContact CA-O 3.32Å; C26-I98 WeakPolarHBondContact CA-O 3.33Å
27	L	93.4	Very high	88.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	158.8	178	-58.3	178.6	0	0	0	110.8	I25 T77 M86 Y91 C97 I98 M99 V100 W115 L119	I25-L27 HydrophobicContact CD1-CD1 4.42Å; I25-L27 HydrophobicContact CD1-CG 4.48Å; L27-T77 HydrophobicContact CD2-CG2 4.31Å; L27-M86 HydrophobicContact CD2-CE 3.4Å; L27-M86 VanDerWaalsContact CD2-CE 3.4Å; L27-M86 HydrophobicContact CD2-SD 4.41Å; L27-Y91 HydrophobicContact CD1-CE1 3.94Å; L27-Y91 HydrophobicContact CD2-CE1 4.02Å; L27-C97 VanDerWaalsContact CD1-SG 3.52Å; L27-I98 PolarHBondContact N-O 2.86Å; L27-M99 HydrophobicContact CB-CG 4.48Å; L27-V100 PolarHBondContact O-N 2.82Å; L27-W115 HydrophobicContact CB-CB 4.4Å; L27-W115 HydrophobicContact CB-CE3 4.44Å; L27-L119 HydrophobicContact CD1-CB 4.03Å; L27-L119 HydrophobicContact CD1-CD1 4.38Å; L27-L119 HydrophobicContact CD1-CD2 4.3Å; L27-L119 HydrophobicContact CD1-CG 4.49Å
28	G	92.7	Very high	90.6	Very high	3 Å²	3	29.4 Å²	29.4	3%	0.031	17%	0.171	C	C	.	.			trans	137.1	165.2	178.7	0	0	0	0	0	112.1	K34 V100	G28-K34 PolarHBondContact O-NZ 3.2Å; G28-V100 WeakPolarHBondContact CA-O 3.49Å
29	D	91.1	Very high	91.7	Very high	19 Å²	19	31.4 Å²	31.4	10%	0.102	17%	0.174	C	C	.	.			trans	-59.3	165.5	-174.8	-73	20.8	0	0	0	113.6	V32 K34 T108 N111 W115	D29-V32 HydrophobicContact CB-CG1 3.79Å; D29-V32 WeakPolarHBondContact O-CG1 3.48Å; D29-V32 WeakPolarHBondContact O-CG2 3.5Å; D29-K34 PolarHBondContact O-NZ 3.43Å; D29-K34 VanDerWaalsContact O-NZ 3.15Å; D29-T108 HydrophobicContact CB-CG2 3.79Å; D29-T108 WeakPolarHBondContact OD2-CA 3.29Å; D29-N111 VanDerWaalsContact OD1-CB 3.31Å; D29-N111 WeakPolarHBondContact OD1-CB 3.46Å; D29-N111 PolarHBondContact OD1-ND2 2.93Å; D29-N111 PolarHBondContact OD2-ND2 2.98Å; D29-W115 PolarHBondContact OD1-NE1 3.48Å
30	S	89.1	Confident	92.3	Very high	44 Å²	44	30.6 Å²	30.6	31%	0.308	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	142.7	170.2	-154.2	0	0	0	0	112.3	V32 E81 R105	S30-V32 PolarHBondContact O-N 3.29Å; S30-V32 VanDerWaalsContact O-N 3.13Å; S30-E81 WeakPolarHBondContact CB-OE1 3.41Å; S30-E81 WeakPolarHBondContact CB-OE2 3.47Å; S30-E81 PolarHBondContact OG-OE1 3.43Å; S30-R105 PolarHBondContact O-NH1 2.95Å
31	A	90.1	Very high	92.5	Very high	69 Å²	69	29.1 Å²	29.1	57%	0.57	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	17.2	177.8	0	0	0	0	0	116.2	G33 K134	A31-G33 PolarHBondContact O-N 2.84Å; A31-K134 WeakPolarHBondContact O-CE 3.09Å; A31-K134 PolarHBondContact O-NZ 2.91Å
32	V	94.1	Very high	92.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-72.7	-17.4	171	-59.5	0	0	0	0	113.1	D29 S30 K34 V100 D102 T108 N133	D29-V32 HydrophobicContact CB-CG1 3.79Å; D29-V32 WeakPolarHBondContact O-CG1 3.48Å; D29-V32 WeakPolarHBondContact O-CG2 3.5Å; S30-V32 PolarHBondContact O-N 3.29Å; S30-V32 VanDerWaalsContact O-N 3.13Å; V32-K34 HydrophobicContact CG2-CD 4.46Å; V32-K34 HydrophobicContact CG2-CG 3.74Å; V32-V100 HydrophobicContact CB-CG1 4.25Å; V32-V100 HydrophobicContact CG2-CB 3.89Å; V32-V100 HydrophobicContact CG2-CG1 3.81Å; V32-D102 HydrophobicContact CB-CB 4.31Å; V32-D102 HydrophobicContact CG1-CB 4.13Å; V32-T108 HydrophobicContact CG1-CG2 3.75Å; V32-N133 PolarHBondContact O-ND2 3.16Å
33	G	93.6	Very high	91.1	Very high	14 Å²	14	30 Å²	30	14%	0.144	16%	0.162	C	C	.	.	S	Bend	trans	104.9	22.9	174.6	0	0	0	0	0	116	A31 K36 L37	A31-G33 PolarHBondContact O-N 2.84Å; G33-K36 PolarHBondContact O-N 3.47Å; G33-L37 WeakPolarHBondContact O-CG 3.29Å; G33-L37 PolarHBondContact O-N 2.92Å
34	K	93.8	Very high	89.2	Confident	13 Å²	13	37 Å²	37	6%	0.057	20%	0.201	C	C	.	.	H	α-helix	trans	-52.6	-56.7	176.5	-58.3	-173.2	-62.3	-80.4	0	112.4	C26 G28 D29 V32 K36 L37 M38 D76 T77 V100	C26-K34 HydrophobicContact CB-CB 4.42Å; C26-K34 HydrophobicContact CB-CD 4.16Å; G28-K34 PolarHBondContact O-NZ 3.2Å; D29-K34 PolarHBondContact O-NZ 3.43Å; D29-K34 VanDerWaalsContact O-NZ 3.15Å; V32-K34 HydrophobicContact CG2-CD 4.46Å; V32-K34 HydrophobicContact CG2-CG 3.74Å; K34-K36 VanDerWaalsContact C-N 3.3Å; K34-K36 PolarHBondContact O-N 3.35Å; K34-L37 WeakPolarHBondContact O-CB 3.27Å; K34-L37 PolarHBondContact O-N 3.17Å; K34-L37 VanDerWaalsContact O-N 3.13Å; K34-M38 PolarHBondContact O-N 3.38Å; K34-M38 VanDerWaalsContact O-N 3.16Å; K34-D76 WeakPolarHBondContact CB-OD1 3.33Å; K34-T77 WeakPolarHBondContact CE-OG1 3.43Å; K34-V100 HydrophobicContact CG-CB 4.16Å; K34-V100 HydrophobicContact CG-CG2 4.11Å
35	S	91	Very high	87.1	Confident	36 Å²	36	40.6 Å²	40.6	25%	0.252	24%	0.237	S	C	.	.	H	α-helix	trans	-56.4	-43.6	177.2	-36.6	0	0	0	0	112	L37 M38 E39 D76	S35-L37 VanDerWaalsContact C-N 3.35Å; S35-L37 PolarHBondContact O-N 3.45Å; S35-M38 PolarHBondContact O-N 3.49Å; S35-E39 WeakPolarHBondContact O-CB 3.37Å; S35-E39 WeakPolarHBondContact O-CG 3.42Å; S35-E39 PolarHBondContact O-N 3.05Å; S35-D76 WeakPolarHBondContact CA-OD2 3.48Å; S35-D76 WeakPolarHBondContact CB-OD2 3.11Å; S35-D76 PolarHBondContact OG-OD2 3.1Å
36	K	91.9	Very high	85.1	Confident	116 Å²	116	44.1 Å²	44.1	50%	0.504	25%	0.251	S	S	.	.	H	α-helix	trans	-66.5	-33.1	179	-65.1	-50.6	-176.6	-162	0	113.6	G33 K34 E39 R40 A161	G33-K36 PolarHBondContact O-N 3.47Å; K34-K36 VanDerWaalsContact C-N 3.3Å; K34-K36 PolarHBondContact O-N 3.35Å; K36-E39 WeakPolarHBondContact CD-OE2 3.42Å; K36-E39 IonicContact NZ-OE1 2.64Å; K36-E39 PolarHBondContact NZ-OE1 2.7Å; K36-E39 IonicContact NZ-OE2 2.63Å; K36-E39 PolarHBondContact NZ-OE2 3.46Å; K36-R40 WeakPolarHBondContact O-CB 3.27Å; K36-R40 PolarHBondContact O-N 2.94Å; K36-A161 HydrophobicContact CB-CB 3.84Å
37	L	94.3	Very high	82.8	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-44.1	172.7	-75.6	168.2	0	0	0	111.1	G33 K34 S35 R40 F41 V100 V131 N133 V159 A161 V167 F171	G33-L37 WeakPolarHBondContact O-CG 3.29Å; G33-L37 PolarHBondContact O-N 2.92Å; K34-L37 WeakPolarHBondContact O-CB 3.27Å; K34-L37 PolarHBondContact O-N 3.17Å; K34-L37 VanDerWaalsContact O-N 3.13Å; S35-L37 VanDerWaalsContact C-N 3.35Å; S35-L37 PolarHBondContact O-N 3.45Å; L37-R40 PolarHBondContact O-N 3.26Å; L37-F41 WeakPolarHBondContact O-CB 3.48Å; L37-F41 PolarHBondContact O-N 2.9Å; L37-V100 HydrophobicContact CD1-CG1 3.82Å; L37-V100 HydrophobicContact CD1-CG2 3.98Å; L37-V131 HydrophobicContact CD1-CG1 4.06Å; L37-N133 HydrophobicContact CD1-CB 4.44Å; L37-V159 HydrophobicContact CD1-CG2 4.38Å; L37-V159 HydrophobicContact CD2-CB 4.36Å; L37-V159 HydrophobicContact CD2-CG2 3.65Å; L37-A161 HydrophobicContact CD2-CB 3.8Å; L37-A161 HydrophobicContact CG-CB 3.99Å; L37-V167 HydrophobicContact CD2-CG1 4.41Å; L37-V167 HydrophobicContact CD2-CG2 3.81Å; L37-F171 HydrophobicContact CB-CE2 3.97Å; L37-F171 HydrophobicContact CB-CZ 4.1Å; L37-F171 WeakPolarHBondContact O-CE2 3.44Å
38	M	92.1	Very high	80.7	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.1	-50.8	177.5	-64.2	-173.8	-175.8	0	0	111.8	C26 K34 S35 R40 F41 L42 Y59 F74 D76 F171	C26-M38 HydrophobicContact CB-CE 3.59Å; C26-M38 WeakPolarHBondContact SG-CE 3.49Å; K34-M38 PolarHBondContact O-N 3.38Å; K34-M38 VanDerWaalsContact O-N 3.16Å; S35-M38 PolarHBondContact O-N 3.49Å; M38-R40 VanDerWaalsContact C-N 3.26Å; M38-R40 PolarHBondContact O-N 2.96Å; M38-F41 PolarHBondContact O-N 3.26Å; M38-F41 VanDerWaalsContact O-N 3.11Å; M38-L42 HydrophobicContact CB-CD1 4.44Å; M38-L42 WeakPolarHBondContact O-CB 3.48Å; M38-L42 WeakPolarHBondContact O-CD1 3.26Å; M38-L42 WeakPolarHBondContact O-CG 3.4Å; M38-L42 PolarHBondContact O-N 3.12Å; M38-Y59 HydrophobicContact CB-CD1 4.36Å; M38-Y59 HydrophobicContact CB-CD2 4.19Å; M38-Y59 HydrophobicContact CB-CE1 4.42Å; M38-Y59 HydrophobicContact CB-CE2 4.22Å; M38-Y59 HydrophobicContact CB-CG 4.28Å; M38-Y59 HydrophobicContact CG-CD2 4.44Å; M38-Y59 HydrophobicContact SD-CD2 3.27Å; M38-Y59 WeakPolarHBondContact SD-CD2 3.49Å; M38-Y59 HydrophobicContact SD-CE2 3.52Å; M38-Y59 VanDerWaalsContact SD-CE2 3.52Å; M38-Y59 HydrophobicContact SD-CG 4.06Å; M38-F74 HydrophobicContact CE-CB 3.84Å; M38-F74 HydrophobicContact SD-CB 3.75Å; M38-D76 HydrophobicContact CE-CB 3.77Å; M38-D76 HydrophobicContact SD-CB 3.64Å; M38-F171 HydrophobicContact CG-CE1 4.41Å; M38-F171 HydrophobicContact CG-CZ 4.09Å
39	E	89.3	Confident	78.6	Confident	74 Å²	74	63.3 Å²	63.3	35%	0.346	34%	0.338	S	S	.	.	H	α-helix	trans	-51.4	-49.5	174.3	-72.1	172.5	-153	0	0	110.2	S35 K36 F41 L42 I43 Y59	S35-E39 WeakPolarHBondContact O-CB 3.37Å; S35-E39 WeakPolarHBondContact O-CG 3.42Å; S35-E39 PolarHBondContact O-N 3.05Å; K36-E39 WeakPolarHBondContact CD-OE2 3.42Å; K36-E39 IonicContact NZ-OE1 2.64Å; K36-E39 PolarHBondContact NZ-OE1 2.7Å; K36-E39 IonicContact NZ-OE2 2.63Å; K36-E39 PolarHBondContact NZ-OE2 3.46Å; E39-F41 VanDerWaalsContact C-N 3.34Å; E39-F41 PolarHBondContact O-N 3.14Å; E39-L42 PolarHBondContact O-N 2.69Å; E39-I43 WeakPolarHBondContact O-CG1 3.45Å; E39-I43 PolarHBondContact O-N 3.04Å; E39-Y59 HydrophobicContact CG-CE1 4.38Å
40	R	89.6	Confident	76.5	Confident	95 Å²	95	69.4 Å²	69.4	36%	0.358	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-41.1	179.6	176	58.4	69.5	-165.2	7.5	112.9	K36 L37 M38 L42 I43 A161 A162 V167	K36-R40 WeakPolarHBondContact O-CB 3.27Å; K36-R40 PolarHBondContact O-N 2.94Å; L37-R40 PolarHBondContact O-N 3.26Å; M38-R40 VanDerWaalsContact C-N 3.26Å; M38-R40 PolarHBondContact O-N 2.96Å; R40-L42 VanDerWaalsContact C-N 3.33Å; R40-I43 VanDerWaalsContact NH1-CD1 3.31Å; R40-A161 PolarHBondContact NE-O 3.28Å; R40-A162 PolarHBondContact NH2-O 3.11Å; R40-V167 HydrophobicContact CB-CG1 4.31Å; R40-V167 HydrophobicContact CG-CB 4.2Å; R40-V167 HydrophobicContact CG-CG1 3.95Å; R40-V167 HydrophobicContact CG-CG2 4.1Å
41	F	91.1	Very high	74.6	Confident	17 Å²	17	71.8 Å²	71.8	8%	0.075	38%	0.375	C	S	.	.	H	α-helix	trans	-67.9	-34.1	178.7	176.8	-115.9	0	0	0	112.6	L37 M38 E39 Y61 F74 V167 V168 F171 I175	L37-F41 WeakPolarHBondContact O-CB 3.48Å; L37-F41 PolarHBondContact O-N 2.9Å; M38-F41 PolarHBondContact O-N 3.26Å; M38-F41 VanDerWaalsContact O-N 3.11Å; E39-F41 VanDerWaalsContact C-N 3.34Å; E39-F41 PolarHBondContact O-N 3.14Å; F41-Y61 AromaticContact CE1-CD1 3.78Å; F41-Y61 HydrophobicContact CE1-CD1 3.78Å; F41-Y61 HydrophobicContact CE1-CD2 4.25Å; F41-Y61 AromaticContact CE1-CE1 3.82Å; F41-Y61 HydrophobicContact CE1-CE1 3.82Å; F41-Y61 HydrophobicContact CE1-CE2 4.3Å; F41-Y61 HydrophobicContact CE1-CG 4Å; F41-Y61 HydrophobicContact CZ-CD1 4.12Å; F41-Y61 AromaticContact CZ-CE1 3.67Å; F41-Y61 HydrophobicContact CZ-CE1 3.67Å; F41-Y61 HydrophobicContact CZ-CE2 4.36Å; F41-Y61 AromaticContact CZ-CZ 3.84Å; F41-F74 HydrophobicContact CD1-CE2 4.02Å; F41-F74 HydrophobicContact CD1-CZ 4.15Å; F41-F74 AromaticContact CE1-CE2 3.79Å; F41-F74 HydrophobicContact CE1-CE2 3.79Å; F41-F74 AromaticContact CE1-CZ 3.81Å; F41-F74 HydrophobicContact CE1-CZ 3.81Å; F41-V167 HydrophobicContact CB-CG1 4.03Å; F41-V168 HydrophobicContact CD2-CG2 4.44Å; F41-V168 HydrophobicContact CE2-CG1 4.45Å; F41-F171 HydrophobicContact CB-CD2 3.54Å; F41-F171 HydrophobicContact CB-CE2 3.69Å; F41-F171 HydrophobicContact CB-CG 4.05Å; F41-F171 HydrophobicContact CB-CZ 4.31Å; F41-F171 HydrophobicContact CD1-CB 3.98Å; F41-F171 AromaticContact CD1-CD1 3.96Å; F41-F171 HydrophobicContact CD1-CD1 3.96Å; F41-F171 HydrophobicContact CD1-CD2 4.19Å; F41-F171 HydrophobicContact CD1-CE1 4.49Å; F41-F171 AromaticContact CD1-CG 3.8Å; F41-F171 HydrophobicContact CD1-CG 3.8Å; F41-F171 HydrophobicContact CD2-CB 3.52Å; F41-F171 AromaticContact CD2-CD2 3.87Å; F41-F171 HydrophobicContact CD2-CD2 3.87Å; F41-F171 AromaticContact CD2-CG 3.84Å; F41-F171 HydrophobicContact CD2-CG 3.84Å; F41-F171 HydrophobicContact CE1-CB 3.94Å; F41-F171 HydrophobicContact CE1-CD1 4.34Å; F41-F171 HydrophobicContact CE1-CG 4.21Å; F41-F171 HydrophobicContact CE2-CB 3.47Å; F41-F171 VanDerWaalsContact CE2-CB 3.47Å; F41-F171 HydrophobicContact CE2-CG 4.24Å; F41-F171 HydrophobicContact CG-CB 3.78Å; F41-F171 HydrophobicContact CG-CD1 4.2Å; F41-F171 AromaticContact CG-CD2 3.59Å; F41-F171 HydrophobicContact CG-CD2 3.59Å; F41-F171 HydrophobicContact CG-CE2 4.18Å; F41-F171 AromaticContact CG-CG 3.6Å; F41-F171 HydrophobicContact CG-CG 3.6Å; F41-F171 HydrophobicContact CZ-CB 3.69Å; F41-F171 HydrophobicContact CZ-CG 4.42Å; F41-I175 HydrophobicContact CE1-CD1 4.29Å; F41-I175 HydrophobicContact CZ-CD1 4.04Å
42	L	85.6	Confident	72.2	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.026	39%	0.388	C	S	.	.	H	α-helix	trans	-93.9	-3	-170.7	-61.2	169.6	0	0	0	114.3	M38 E39 R40 D44 G45 Y46 Y59 Y61 F74	M38-L42 HydrophobicContact CB-CD1 4.44Å; M38-L42 WeakPolarHBondContact O-CB 3.48Å; M38-L42 WeakPolarHBondContact O-CD1 3.26Å; M38-L42 WeakPolarHBondContact O-CG 3.4Å; M38-L42 PolarHBondContact O-N 3.12Å; E39-L42 PolarHBondContact O-N 2.69Å; R40-L42 VanDerWaalsContact C-N 3.33Å; L42-D44 PolarHBondContact O-N 2.9Å; L42-G45 PolarHBondContact O-N 2.99Å; L42-G45 VanDerWaalsContact O-N 3.13Å; L42-Y46 HydrophobicContact CB-CD2 4.25Å; L42-Y46 HydrophobicContact CB-CG 4.38Å; L42-Y46 HydrophobicContact CD1-CD2 4.2Å; L42-Y46 HydrophobicContact CD1-CE2 4.14Å; L42-Y46 WeakPolarHBondContact O-CB 3.45Å; L42-Y59 VanDerWaalsContact CD1-CB 3.4Å; L42-Y59 HydrophobicContact CD1-CD1 3.47Å; L42-Y59 VanDerWaalsContact CD1-CD1 3.47Å; L42-Y59 HydrophobicContact CD1-CG 3.76Å; L42-Y61 HydrophobicContact CD2-CD2 3.58Å; L42-Y61 HydrophobicContact CD2-CG 3.81Å; L42-F74 HydrophobicContact CD2-CE2 4.42Å
43	I	71.2	Confident	69.7	Low	103 Å²	103	78.2 Å²	78.2	53%	0.528	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-30.2	-174.7	-91.5	165.1	0	0	0	113.9	E39 R40	E39-I43 WeakPolarHBondContact O-CG1 3.45Å; E39-I43 PolarHBondContact O-N 3.04Å; R40-I43 VanDerWaalsContact NH1-CD1 3.31Å
44	D	54.2	Low	67.6	Low	164 Å²	164	86.6 Å²	86.6	88%	0.877	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	9.8	-176.2	-70.4	-25.7	0	0	0	115.5	L42	L42-D44 PolarHBondContact O-N 2.9Å
45	G	51.9	Low	66.2	Low	75 Å²	75	88.4 Å²	88.4	77%	0.773	46%	0.458	S	S	*	.	S	Bend	trans	-167.9	28.3	-177.8	0	0	0	0	0	118.8	L42	L42-G45 PolarHBondContact O-N 2.99Å; L42-G45 VanDerWaalsContact O-N 3.13Å
46	Y	52.7	Low	65.4	Low	74 Å²	74	87.5 Å²	87.5	29%	0.29	45%	0.45	S	S	.	.			trans	-101.5	146.8	-161.9	-172.8	-124.6	0	0	0	117.5	L42 P48 Y59	L42-Y46 HydrophobicContact CB-CD2 4.25Å; L42-Y46 HydrophobicContact CB-CG 4.38Å; L42-Y46 HydrophobicContact CD1-CD2 4.2Å; L42-Y46 HydrophobicContact CD1-CE2 4.14Å; L42-Y46 WeakPolarHBondContact O-CB 3.45Å; Y46-P48 HydrophobicContact CD1-CB 4.27Å; Y46-P48 VanDerWaalsContact CD1-CD 3.41Å; Y46-P48 HydrophobicContact CD1-CG 3.91Å; Y46-P48 HydrophobicContact CE1-CB 3.26Å; Y46-P48 HydrophobicContact CE1-CG 3.3Å; Y46-P48 HydrophobicContact CE2-CB 4.5Å; Y46-P48 VanDerWaalsContact CZ-CB 3.41Å; Y46-P48 VanDerWaalsContact CZ-N 3.34Å; Y46-P48 WeakPolarHBondContact OH-CA 3.29Å; Y46-P48 WeakPolarHBondContact OH-CB 3.46Å; Y46-Y59 HydrophobicContact CE1-CD1 4.34Å; Y46-Y59 HydrophobicContact CE1-CE1 4.49Å; Y46-Y59 AromaticContact CE2-CD1 3.76Å; Y46-Y59 HydrophobicContact CE2-CD1 3.76Å; Y46-Y59 HydrophobicContact CE2-CG 4.46Å; Y46-Y59 AromaticContact CZ-CD1 3.45Å; Y46-Y59 VanDerWaalsContact CZ-CD1 3.45Å; Y46-Y59 AromaticContact CZ-CE1 3.94Å; Y46-Y59 WeakPolarHBondContact OH-CD1 3.47Å; Y46-Y59 VanDerWaalsContact OH-CE1 3.27Å; Y46-Y59 WeakPolarHBondContact OH-CE1 3.47Å
47	R	45.8	Very low	64.9	Low	219 Å²	219	83 Å²	83	83%	0.826	43%	0.432	S	S	*	.			trans	-129.1	117.7	151.5	-73.9	-174.1	179.6	-177.4	0.5	109.5	Q49	R47-Q49 PolarHBondContact O-N 3.25Å
48	P	49.4	Very low	64.6	Low	87 Å²	87	83.7 Å²	83.7	57%	0.565	44%	0.436	S	S	*	.			trans	-66.6	129	174.2	9.8	-7.3	0	0	0	112.7	Y46	Y46-P48 HydrophobicContact CD1-CB 4.27Å; Y46-P48 VanDerWaalsContact CD1-CD 3.41Å; Y46-P48 HydrophobicContact CD1-CG 3.91Å; Y46-P48 HydrophobicContact CE1-CB 3.26Å; Y46-P48 HydrophobicContact CE1-CG 3.3Å; Y46-P48 HydrophobicContact CE2-CB 4.5Å; Y46-P48 VanDerWaalsContact CZ-CB 3.41Å; Y46-P48 VanDerWaalsContact CZ-N 3.34Å; Y46-P48 WeakPolarHBondContact OH-CA 3.29Å; Y46-P48 WeakPolarHBondContact OH-CB 3.46Å
49	Q	49.2	Very low	64.4	Low	103 Å²	103	84.5 Å²	84.5	48%	0.481	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-111.4	88.3	160.3	-159.3	170.7	35	0	0	107.7	R47 L51	R47-Q49 PolarHBondContact O-N 3.25Å; Q49-L51 PolarHBondContact O-N 2.96Å
50	Q	46.9	Very low	64.4	Low	146 Å²	146	84 Å²	84	68%	0.682	44%	0.436	S	S	*	.			trans	-68.7	121.1	165	-73.7	-155.7	-37.2	0	0	108	S52 T57	Q50-S52 PolarHBondContact O-N 3.11Å; Q50-T57 HydrophobicContact CG-CG2 4.48Å
51	L	48.5	Very low	64.4	Low	95 Å²	95	82.2 Å²	82.2	50%	0.497	43%	0.429	S	S	.	.			trans	-68.5	122.5	163.2	-65.6	171.3	0	0	0	106.2	Q49 T53	Q49-L51 PolarHBondContact O-N 2.96Å; L51-T53 PolarHBondContact O-N 2.96Å
52	S	39.2	Very low	64.4	Low	120 Å²	120	85.3 Å²	85.3	84%	0.839	45%	0.447	S	S	*	.	S	Bend	trans	-63.4	-4.9	-169.8	60	0	0	0	0	114.5	Q50	Q50-S52 PolarHBondContact O-N 3.11Å
53	T	42.7	Very low	64.7	Low	83 Å²	83	86.6 Å²	86.6	51%	0.509	46%	0.455	S	S	.	.	S	Bend	trans	-143.9	127.1	-168.3	-27.6	0	0	0	0	107.4	L51	L51-T53 PolarHBondContact O-N 2.96Å
54	Y	49.4	Very low	65.6	Low	191 Å²	191	86.4 Å²	86.4	75%	0.749	46%	0.458	S	S	*	.	S	Bend	trans	92.9	146.3	173.4	-52.9	-77.1	0	0	0	117.7	L56	Y54-L56 PolarHBondContact O-N 3.46Å
55	A	64	Low	67.2	Low	50 Å²	50	79.7 Å²	79.7	41%	0.413	42%	0.423	S	S	.	.	S	Bend	trans	-66.2	43.9	-171.8	0	0	0	0	0	115
56	L	75.1	Confident	68.9	Low	17 Å²	17	82.7 Å²	82.7	9%	0.089	42%	0.421	C	S	.	.			trans	-149.3	128	-174.9	179.3	86.3	0	0	0	108.7	Y54 W75 D76 T77 Y90	Y54-L56 PolarHBondContact O-N 3.46Å; L56-W75 HydrophobicContact CD1-CB 4.25Å; L56-W75 HydrophobicContact CD1-CE3 3.97Å; L56-W75 HydrophobicContact CD2-CD2 3.96Å; L56-W75 HydrophobicContact CD2-CE3 3.15Å; L56-W75 HydrophobicContact CD2-CH2 4.16Å; L56-W75 HydrophobicContact CD2-CZ3 3.26Å; L56-W75 HydrophobicContact CG-CE3 4.12Å; L56-D76 CarbonylContact C-O 3.6Å; L56-D76 WeakPolarHBondContact CA-O 3.45Å; L56-D76 WeakPolarHBondContact CD1-O 3.48Å; L56-T77 HydrophobicContact CD1-CG2 3.9Å; L56-Y90 HydrophobicContact CD2-CD1 4.18Å; L56-Y90 HydrophobicContact CD2-CE1 4.15Å
57	T	81.7	Confident	70.5	Confident	22 Å²	22	90.9 Å²	90.9	14%	0.135	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	129.2	174.2	-54.1	0	0	0	0	110	Q50 Y59 D76	Q50-T57 HydrophobicContact CG-CG2 4.48Å; T57-Y59 HydrophobicContact CG2-CD2 4.01Å; T57-Y59 HydrophobicContact CG2-CE1 4.41Å; T57-Y59 HydrophobicContact CG2-CE2 3.39Å; T57-D76 PolarHBondContact N-O 2.73Å; T57-D76 WeakPolarHBondContact O-CB 3.41Å; T57-D76 PolarHBondContact O-N 3.44Å
58	L	86.6	Confident	72.5	Confident	18 Å²	18	84.3 Å²	84.3	9%	0.094	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.7	174.1	176.7	60.9	0	0	0	109.7	K60 D73 F74 W75	L58-K60 HydrophobicContact CG-CG 4.43Å; L58-D73 HydrophobicContact CD1-CB 3.71Å; L58-F74 WeakPolarHBondContact CA-O 3.39Å; L58-W75 HydrophobicContact CD1-CG 4.43Å
59	Y	87.9	Confident	74.5	Confident	16 Å²	16	81.8 Å²	81.8	6%	0.063	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.8	170.5	-55.2	-109	0	0	0	109.9	M38 E39 L42 Y46 T57 F74 D76	M38-Y59 HydrophobicContact CB-CD1 4.36Å; M38-Y59 HydrophobicContact CB-CD2 4.19Å; M38-Y59 HydrophobicContact CB-CE1 4.42Å; M38-Y59 HydrophobicContact CB-CE2 4.22Å; M38-Y59 HydrophobicContact CB-CG 4.28Å; M38-Y59 HydrophobicContact CG-CD2 4.44Å; M38-Y59 HydrophobicContact SD-CD2 3.27Å; M38-Y59 WeakPolarHBondContact SD-CD2 3.49Å; M38-Y59 HydrophobicContact SD-CE2 3.52Å; M38-Y59 VanDerWaalsContact SD-CE2 3.52Å; M38-Y59 HydrophobicContact SD-CG 4.06Å; E39-Y59 HydrophobicContact CG-CE1 4.38Å; L42-Y59 VanDerWaalsContact CD1-CB 3.4Å; L42-Y59 HydrophobicContact CD1-CD1 3.47Å; L42-Y59 VanDerWaalsContact CD1-CD1 3.47Å; L42-Y59 HydrophobicContact CD1-CG 3.76Å; Y46-Y59 HydrophobicContact CE1-CD1 4.34Å; Y46-Y59 HydrophobicContact CE1-CE1 4.49Å; Y46-Y59 AromaticContact CE2-CD1 3.76Å; Y46-Y59 HydrophobicContact CE2-CD1 3.76Å; Y46-Y59 HydrophobicContact CE2-CG 4.46Å; Y46-Y59 AromaticContact CZ-CD1 3.45Å; Y46-Y59 VanDerWaalsContact CZ-CD1 3.45Å; Y46-Y59 AromaticContact CZ-CE1 3.94Å; Y46-Y59 WeakPolarHBondContact OH-CD1 3.47Å; Y46-Y59 VanDerWaalsContact OH-CE1 3.27Å; Y46-Y59 WeakPolarHBondContact OH-CE1 3.47Å; T57-Y59 HydrophobicContact CG2-CD2 4.01Å; T57-Y59 HydrophobicContact CG2-CE1 4.41Å; T57-Y59 HydrophobicContact CG2-CE2 3.39Å; Y59-F74 PolarHBondContact N-O 2.84Å; Y59-F74 PolarHBondContact O-N 2.93Å; Y59-D76 HydrophobicContact CD2-CB 4.25Å; Y59-D76 HydrophobicContact CE2-CB 3.69Å
60	K	89.9	Confident	76.5	Confident	65 Å²	65	77 Å²	77	28%	0.283	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	136.8	177.2	-66.2	-167.9	170.9	-171.7	0	110.7	Y16 L58 L71 V72	Y16-K60 HydrophobicContact CE1-CD 4.08Å; L58-K60 HydrophobicContact CG-CG 4.43Å; K60-L71 HydrophobicContact CB-CD1 4.01Å; K60-L71 HydrophobicContact CD-CD1 4.27Å; K60-L71 HydrophobicContact CG-CD1 4.34Å; K60-V72 CarbonylContact C-O 3.55Å; K60-V72 WeakPolarHBondContact CA-O 3.45Å
61	Y	89.8	Confident	78.7	Confident	56 Å²	56	70.6 Å²	70.6	22%	0.22	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	116.5	179	175.9	-110.5	0	0	0	110.9	F41 L42 T63 V72 F74 I175	F41-Y61 AromaticContact CE1-CD1 3.78Å; F41-Y61 HydrophobicContact CE1-CD1 3.78Å; F41-Y61 HydrophobicContact CE1-CD2 4.25Å; F41-Y61 AromaticContact CE1-CE1 3.82Å; F41-Y61 HydrophobicContact CE1-CE1 3.82Å; F41-Y61 HydrophobicContact CE1-CE2 4.3Å; F41-Y61 HydrophobicContact CE1-CG 4Å; F41-Y61 HydrophobicContact CZ-CD1 4.12Å; F41-Y61 AromaticContact CZ-CE1 3.67Å; F41-Y61 HydrophobicContact CZ-CE1 3.67Å; F41-Y61 HydrophobicContact CZ-CE2 4.36Å; F41-Y61 AromaticContact CZ-CZ 3.84Å; L42-Y61 HydrophobicContact CD2-CD2 3.58Å; L42-Y61 HydrophobicContact CD2-CG 3.81Å; Y61-T63 HydrophobicContact CD1-CG2 4.21Å; Y61-T63 VanDerWaalsContact CE1-CB 3.44Å; Y61-T63 HydrophobicContact CE1-CG2 3.82Å; Y61-V72 HydrophobicContact CD1-CB 4.3Å; Y61-V72 HydrophobicContact CD1-CG2 4.17Å; Y61-V72 PolarHBondContact N-O 3.23Å; Y61-V72 WeakPolarHBondContact O-CB 3.38Å; Y61-V72 PolarHBondContact O-N 2.85Å; Y61-F74 HydrophobicContact CD1-CE2 4.32Å; Y61-F74 HydrophobicContact CG-CE2 4.31Å; Y61-I175 HydrophobicContact CD1-CD1 4.07Å; Y61-I175 HydrophobicContact CE1-CD1 3.97Å
62	N	90.8	Very high	80.9	Confident	83 Å²	83	66.1 Å²	66.1	44%	0.444	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	131.2	174.9	-70.4	-14.4	0	0	0	109.7	K15 V70 L71	K15-N62 PolarHBondContact O-ND2 2.96Å; N62-V70 WeakPolarHBondContact CA-O 3.38Å; N62-L71 WeakPolarHBondContact OD1-CD1 3.41Å
63	T	91.1	Very high	83.5	Confident	31 Å²	31	61 Å²	61	19%	0.19	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	163.5	175.6	-170.7	0	0	0	0	110.5	Y61 I65 V70 V72 I175	Y61-T63 HydrophobicContact CD1-CG2 4.21Å; Y61-T63 VanDerWaalsContact CE1-CB 3.44Å; Y61-T63 HydrophobicContact CE1-CG2 3.82Å; T63-I65 HydrophobicContact CG2-CD1 4.15Å; T63-I65 HydrophobicContact CG2-CG1 4.19Å; T63-V70 HydrophobicContact CG2-CB 4.15Å; T63-V70 PolarHBondContact N-O 3.46Å; T63-V70 WeakPolarHBondContact O-CA 3.38Å; T63-V70 PolarHBondContact O-N 3.04Å; T63-V72 HydrophobicContact CG2-CG2 4.1Å; T63-I175 HydrophobicContact CG2-CG2 4.49Å
64	T	90.5	Very high	85.9	Confident	99 Å²	99	57.1 Å²	57.1	61%	0.607	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.5	171.2	-51.5	0	0	0	0	109.6	K68	T64-K68 VanDerWaalsContact CA-O 3.27Å; T64-K68 WeakPolarHBondContact CA-O 3.43Å; T64-K68 WeakPolarHBondContact CG2-O 3.22Å
65	I	88.6	Confident	87.8	Confident	24 Å²	24	50.5 Å²	50.5	12%	0.123	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	127.5	174.8	-63.4	176.4	0	0	0	107.5	T63 R67 K68 V70 I175 M179	T63-I65 HydrophobicContact CG2-CD1 4.15Å; T63-I65 HydrophobicContact CG2-CG1 4.19Å; I65-R67 PolarHBondContact O-N 2.96Å; I65-R67 VanDerWaalsContact O-N 3.14Å; I65-K68 PolarHBondContact N-O 3.41Å; I65-K68 WeakPolarHBondContact O-CB 3.44Å; I65-K68 PolarHBondContact O-N 3.41Å; I65-V70 HydrophobicContact CB-CG2 4.16Å; I65-V70 HydrophobicContact CG1-CG2 4.47Å; I65-I175 HydrophobicContact CD1-CB 4.21Å; I65-I175 HydrophobicContact CD1-CG2 3.31Å; I65-M179 HydrophobicContact CD1-CG 3.98Å
66	D	87.1	Confident	88.9	Confident	138 Å²	138	48.1 Å²	48.1	74%	0.738	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	40.7	-178.3	-55.6	-35.8	0	0	0	113.5	K68	D66-K68 PolarHBondContact O-N 2.96Å
67	R	86.7	Confident	88.9	Confident	245 Å²	245	47.7 Å²	47.7	93%	0.925	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	9.2	-177.3	-49.1	178.6	-172.5	176.8	2	115.5	I65	I65-R67 PolarHBondContact O-N 2.96Å; I65-R67 VanDerWaalsContact O-N 3.14Å
68	K	87.1	Confident	88.1	Confident	82 Å²	82	48.5 Å²	48.5	36%	0.357	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	138.9	171.9	-63.2	-175.3	174.9	-172.2	0	110.8	D19 E20 T64 I65 D66	D19-K68 HydrophobicContact CB-CB 4.45Å; D19-K68 WeakPolarHBondContact OD2-CA 3.41Å; E20-K68 HydrophobicContact CG-CD 4.41Å; T64-K68 VanDerWaalsContact CA-O 3.27Å; T64-K68 WeakPolarHBondContact CA-O 3.43Å; T64-K68 WeakPolarHBondContact CG2-O 3.22Å; I65-K68 PolarHBondContact N-O 3.41Å; I65-K68 WeakPolarHBondContact O-CB 3.44Å; I65-K68 PolarHBondContact O-N 3.41Å; D66-K68 PolarHBondContact O-N 2.96Å
69	A	90.9	Very high	86.6	Confident	34 Å²	34	49 Å²	49	28%	0.281	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126.4	169.6	0	0	0	0	0	109.3	D19 E20	D19-A69 PolarHBondContact N-O 3Å; D19-A69 PolarHBondContact OD2-N 3.01Å; E20-A69 PolarHBondContact N-O 3.13Å; E20-A69 VanDerWaalsContact N-O 3.12Å
70	V	92.1	Very high	85.1	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.3	-176.6	-175.8	0	0	0	0	109.7	E20 V22 N62 T63 I65 V72 M179	E20-V70 HydrophobicContact CB-CG2 4.39Å; E20-V70 CarbonylContact O-C 3.56Å; E20-V70 VanDerWaalsContact O-CA 3.29Å; E20-V70 WeakPolarHBondContact O-CA 3.48Å; V22-V70 HydrophobicContact CG2-CG1 3.85Å; N62-V70 WeakPolarHBondContact CA-O 3.38Å; T63-V70 HydrophobicContact CG2-CB 4.15Å; T63-V70 PolarHBondContact N-O 3.46Å; T63-V70 WeakPolarHBondContact O-CA 3.38Å; T63-V70 PolarHBondContact O-N 3.04Å; I65-V70 HydrophobicContact CB-CG2 4.16Å; I65-V70 HydrophobicContact CG1-CG2 4.47Å; V70-V72 HydrophobicContact CG1-CG2 4.02Å; V70-M179 HydrophobicContact CB-SD 4.37Å; V70-M179 HydrophobicContact CG1-CE 4.43Å; V70-M179 HydrophobicContact CG1-CG 4.39Å; V70-M179 HydrophobicContact CG1-SD 3.56Å; V70-M179 VanDerWaalsContact CG1-SD 3.56Å; V70-M179 HydrophobicContact CG2-CE 3.58Å; V70-M179 HydrophobicContact CG2-SD 3.81Å
71	L	93.6	Very high	83.4	Confident	12 Å²	12	51.4 Å²	51.4	6%	0.063	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.4	166.6	173.3	62.1	0	0	0	109.1	A18 E20 Q21 V22 K60 N62	A18-L71 HydrophobicContact CB-CB 3.56Å; E20-L71 PolarHBondContact O-N 2.77Å; Q21-L71 CarbonylContact C-O 3.57Å; Q21-L71 VanDerWaalsContact CA-O 3.26Å; Q21-L71 WeakPolarHBondContact CA-O 3.33Å; Q21-L71 HydrophobicContact CG-CB 4.37Å; Q21-L71 HydrophobicContact CG-CD2 4.24Å; Q21-L71 HydrophobicContact CG-CG 4.23Å; V22-L71 PolarHBondContact N-O 2.9Å; K60-L71 HydrophobicContact CB-CD1 4.01Å; K60-L71 HydrophobicContact CD-CD1 4.27Å; K60-L71 HydrophobicContact CG-CD1 4.34Å; N62-L71 WeakPolarHBondContact OD1-CD1 3.41Å
72	V	94.3	Very high	81.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.3	176.7	-173.5	0	0	0	0	109.7	V22 I24 K60 Y61 T63 V70 F74 I175	V22-V72 HydrophobicContact CG2-CB 4.29Å; V22-V72 HydrophobicContact CG2-CG1 4.2Å; V22-V72 HydrophobicContact CG2-CG2 3.84Å; V22-V72 CarbonylContact O-C 3.51Å; V22-V72 WeakPolarHBondContact O-CA 3.48Å; I24-V72 HydrophobicContact CD1-CG1 3.76Å; I24-V72 HydrophobicContact CG1-CG1 4.21Å; K60-V72 CarbonylContact C-O 3.55Å; K60-V72 WeakPolarHBondContact CA-O 3.45Å; Y61-V72 HydrophobicContact CD1-CB 4.3Å; Y61-V72 HydrophobicContact CD1-CG2 4.17Å; Y61-V72 PolarHBondContact N-O 3.23Å; Y61-V72 WeakPolarHBondContact O-CB 3.38Å; Y61-V72 PolarHBondContact O-N 2.85Å; T63-V72 HydrophobicContact CG2-CG2 4.1Å; V70-V72 HydrophobicContact CG1-CG2 4.02Å; V72-F74 HydrophobicContact CB-CE2 4.17Å; V72-F74 HydrophobicContact CB-CZ 4.39Å; V72-F74 HydrophobicContact CG1-CD1 4.24Å; V72-F74 HydrophobicContact CG1-CD2 4.04Å; V72-F74 HydrophobicContact CG1-CE1 3.81Å; V72-F74 HydrophobicContact CG1-CE2 3.6Å; V72-F74 HydrophobicContact CG1-CG 4.35Å; V72-F74 HydrophobicContact CG1-CZ 3.48Å; V72-F74 VanDerWaalsContact CG1-CZ 3.48Å; V72-I175 HydrophobicContact CG1-CG1 4.2Å; V72-I175 HydrophobicContact CG2-CD1 4.19Å; V72-I175 HydrophobicContact CG2-CG1 4.15Å; V72-I175 HydrophobicContact CG2-CG2 3.67Å
73	D	93.4	Very high	79.9	Confident	14 Å²	14	61 Å²	61	8%	0.075	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	106.3	172.9	-80.1	-6.1	0	0	0	109.8	Q21 V22 K23 I24 L58	Q21-D73 PolarHBondContact NE2-OD2 2.77Å; V22-D73 PolarHBondContact O-N 3.04Å; K23-D73 CarbonylContact C-O 3.54Å; K23-D73 WeakPolarHBondContact CA-O 3.16Å; K23-D73 HydrophobicContact CB-CB 4.48Å; I24-D73 PolarHBondContact N-O 2.79Å; L58-D73 HydrophobicContact CD1-CB 3.71Å
74	F	92.5	Very high	78.4	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.9	171.8	-63.5	-73.7	0	0	0	111	I24 M38 F41 L42 L58 Y59 Y61 V72 F171 I175	I24-F74 HydrophobicContact CB-CD1 3.81Å; I24-F74 HydrophobicContact CB-CE1 4.01Å; I24-F74 HydrophobicContact CD1-CD1 4.36Å; I24-F74 HydrophobicContact CD1-CE1 3.68Å; I24-F74 HydrophobicContact CD1-CZ 4.36Å; I24-F74 HydrophobicContact CG1-CE1 4.37Å; I24-F74 HydrophobicContact CG2-CD1 4.05Å; I24-F74 HydrophobicContact CG2-CE1 4.15Å; I24-F74 WeakPolarHBondContact O-CA 3.41Å; M38-F74 HydrophobicContact CE-CB 3.84Å; M38-F74 HydrophobicContact SD-CB 3.75Å; F41-F74 HydrophobicContact CD1-CE2 4.02Å; F41-F74 HydrophobicContact CD1-CZ 4.15Å; F41-F74 AromaticContact CE1-CE2 3.79Å; F41-F74 HydrophobicContact CE1-CE2 3.79Å; F41-F74 AromaticContact CE1-CZ 3.81Å; F41-F74 HydrophobicContact CE1-CZ 3.81Å; L42-F74 HydrophobicContact CD2-CE2 4.42Å; L58-F74 WeakPolarHBondContact CA-O 3.39Å; Y59-F74 PolarHBondContact N-O 2.84Å; Y59-F74 PolarHBondContact O-N 2.93Å; Y61-F74 HydrophobicContact CD1-CE2 4.32Å; Y61-F74 HydrophobicContact CG-CE2 4.31Å; V72-F74 HydrophobicContact CB-CE2 4.17Å; V72-F74 HydrophobicContact CB-CZ 4.39Å; V72-F74 HydrophobicContact CG1-CD1 4.24Å; V72-F74 HydrophobicContact CG1-CD2 4.04Å; V72-F74 HydrophobicContact CG1-CE1 3.81Å; V72-F74 HydrophobicContact CG1-CE2 3.6Å; V72-F74 HydrophobicContact CG1-CG 4.35Å; V72-F74 HydrophobicContact CG1-CZ 3.48Å; V72-F74 VanDerWaalsContact CG1-CZ 3.48Å; F74-F171 HydrophobicContact CD1-CD1 4.21Å; F74-F171 AromaticContact CD1-CE1 3.91Å; F74-F171 HydrophobicContact CD1-CE1 3.91Å; F74-F171 AromaticContact CE1-CD1 3.42Å; F74-F171 HydrophobicContact CE1-CD1 3.42Å; F74-F171 VanDerWaalsContact CE1-CD1 3.42Å; F74-F171 AromaticContact CE1-CE1 3.6Å; F74-F171 HydrophobicContact CE1-CE1 3.6Å; F74-F171 AromaticContact CZ-CD1 3.6Å; F74-F171 HydrophobicContact CZ-CD1 3.6Å; F74-F171 HydrophobicContact CZ-CE1 4.05Å; F74-I175 HydrophobicContact CZ-CD1 4.06Å; F74-I175 HydrophobicContact CZ-CG1 4.11Å
75	W	90.6	Very high	77.4	Confident	52 Å²	52	66.5 Å²	66.5	20%	0.197	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	103.3	-179.4	-75.7	54.9	0	0	0	109.4	K23 I24 I25 C26 L56 L58 Y90	K23-W75 HydrophobicContact CD-CD2 4.13Å; K23-W75 HydrophobicContact CD-CG 4.32Å; K23-W75 HydrophobicContact CD-CZ2 4.23Å; K23-W75 VanDerWaalsContact CE-CE2 3.49Å; K23-W75 HydrophobicContact CG-CG 4.24Å; I24-W75 PolarHBondContact O-N 2.78Å; I25-W75 HydrophobicContact CG2-CB 3.85Å; I25-W75 HydrophobicContact CG2-CG 4.33Å; C26-W75 PolarHBondContact N-O 2.78Å; L56-W75 HydrophobicContact CD1-CB 4.25Å; L56-W75 HydrophobicContact CD1-CE3 3.97Å; L56-W75 HydrophobicContact CD2-CD2 3.96Å; L56-W75 HydrophobicContact CD2-CE3 3.15Å; L56-W75 HydrophobicContact CD2-CH2 4.16Å; L56-W75 HydrophobicContact CD2-CZ3 3.26Å; L56-W75 HydrophobicContact CG-CE3 4.12Å; L58-W75 HydrophobicContact CD1-CG 4.43Å; W75-Y90 HydrophobicContact CE3-CD1 4.47Å; W75-Y90 HydrophobicContact CZ3-CD1 4.02Å
76	D	86.7	Confident	76.8	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	108.8	176.7	-175.2	21.2	0	0	0	111	K34 S35 M38 L56 T57 Y59 A78	K34-D76 WeakPolarHBondContact CB-OD1 3.33Å; S35-D76 WeakPolarHBondContact CA-OD2 3.48Å; S35-D76 WeakPolarHBondContact CB-OD2 3.11Å; S35-D76 PolarHBondContact OG-OD2 3.1Å; M38-D76 HydrophobicContact CE-CB 3.77Å; M38-D76 HydrophobicContact SD-CB 3.64Å; L56-D76 CarbonylContact C-O 3.6Å; L56-D76 WeakPolarHBondContact CA-O 3.45Å; L56-D76 WeakPolarHBondContact CD1-O 3.48Å; T57-D76 PolarHBondContact N-O 2.73Å; T57-D76 WeakPolarHBondContact O-CB 3.41Å; T57-D76 PolarHBondContact O-N 3.44Å; Y59-D76 HydrophobicContact CD2-CB 4.25Å; Y59-D76 HydrophobicContact CE2-CB 3.69Å; D76-A78 VanDerWaalsContact C-N 3.26Å; D76-A78 PolarHBondContact O-N 3.34Å; D76-A78 VanDerWaalsContact O-N 3.12Å
77	T	75	Confident	76.5	Confident	8 Å²	8	64.1 Å²	64.1	5%	0.049	30%	0.303	C	S	.	.			trans	-88.4	37.9	-167.3	58.9	0	0	0	0	113.9	C26 L27 K34 L56 G79 M86	C26-T77 WeakPolarHBondContact O-CB 3.37Å; C26-T77 VanDerWaalsContact O-CG2 3.22Å; C26-T77 WeakPolarHBondContact O-CG2 3.35Å; C26-T77 PolarHBondContact O-OG1 3.49Å; L27-T77 HydrophobicContact CD2-CG2 4.31Å; K34-T77 WeakPolarHBondContact CE-OG1 3.43Å; L56-T77 HydrophobicContact CD1-CG2 3.9Å; T77-G79 PolarHBondContact O-N 3Å; T77-M86 WeakPolarHBondContact CB-SD 3.27Å; T77-M86 HydrophobicContact CG2-CE 3.54Å; T77-M86 HydrophobicContact CG2-SD 3.36Å; T77-M86 WeakPolarHBondContact CG2-SD 3.27Å
78	A	65.3	Low	76.3	Confident	38 Å²	38	55.1 Å²	55.1	31%	0.314	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	129.8	-173	0	0	0	0	0	113.9	D76	D76-A78 VanDerWaalsContact C-N 3.26Å; D76-A78 PolarHBondContact O-N 3.34Å; D76-A78 VanDerWaalsContact O-N 3.12Å
79	G	55.6	Low	76	Confident	29 Å²	29	54.1 Å²	54.1	30%	0.299	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	11.6	150.5	0	0	0	0	0	119.1	T77 E81	T77-G79 PolarHBondContact O-N 3Å; G79-E81 VanDerWaalsContact C-N 3.31Å; G79-E81 WeakPolarHBondContact CA-OE2 2.96Å; G79-E81 PolarHBondContact O-N 2.97Å
80	Q	55	Low	75.7	Confident	35 Å²	35	53.8 Å²	53.8	16%	0.164	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-87.5	16.9	173.9	-77.3	-142.2	-14.4	0	0	115.1	R82 F83 S85	Q80-R82 PolarHBondContact O-N 3.38Å; Q80-F83 HydrophobicContact CG-CD2 4.21Å; Q80-F83 PolarHBondContact O-N 3.34Å; Q80-S85 PolarHBondContact OE1-O 3.17Å
81	E	54.9	Low	75.5	Confident	97 Å²	97	53.7 Å²	53.7	45%	0.453	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-56.6	-22.5	170.7	60.6	-88.1	-160.7	0	0	113.5	S30 G79 F83	S30-E81 WeakPolarHBondContact CB-OE1 3.41Å; S30-E81 WeakPolarHBondContact CB-OE2 3.47Å; S30-E81 PolarHBondContact OG-OE1 3.43Å; G79-E81 VanDerWaalsContact C-N 3.31Å; G79-E81 WeakPolarHBondContact CA-OE2 2.96Å; G79-E81 PolarHBondContact O-N 2.97Å; E81-F83 VanDerWaalsContact C-N 3.27Å; E81-F83 PolarHBondContact O-N 3.5Å
82	R	52.9	Low	75.1	Confident	206 Å²	206	57.1 Å²	57.1	78%	0.777	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-72.3	-18.6	176.6	-66	-167.9	-68.4	-160.7	-1.1	113.7	Q80	Q80-R82 PolarHBondContact O-N 3.38Å
83	F	54.7	Low	74.8	Confident	135 Å²	135	60.8 Å²	60.8	59%	0.592	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-109.6	6.9	-173.8	-64.8	-70.4	0	0	0	114.1	Q80 E81 S85	Q80-F83 HydrophobicContact CG-CD2 4.21Å; Q80-F83 PolarHBondContact O-N 3.34Å; E81-F83 VanDerWaalsContact C-N 3.27Å; E81-F83 PolarHBondContact O-N 3.5Å; F83-S85 PolarHBondContact O-N 3.35Å
84	Q	59	Low	74.8	Confident	187 Å²	187	60.1 Å²	60.1	87%	0.874	30%	0.298	S	S	*	.	S	Bend	trans	62.5	-16	176.8	-57.1	178.9	4.5	0	0	116.1
85	S	68.6	Low	75	Confident	58 Å²	58	61.3 Å²	61.3	41%	0.406	30%	0.304	S	S	.	.	S	Bend	trans	-153.5	164.1	172.2	59.6	0	0	0	0	110.6	Q80 F83	Q80-S85 PolarHBondContact OE1-O 3.17Å; F83-S85 PolarHBondContact O-N 3.35Å
86	M	76.6	Confident	75.4	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.02	30%	0.295	C	S	.	.			trans	-84.9	154.8	170.3	-77.3	-142	-56.2	0	0	111.9	L27 T77 Y90 Y91 W115 E118	L27-M86 HydrophobicContact CD2-CE 3.4Å; L27-M86 VanDerWaalsContact CD2-CE 3.4Å; L27-M86 HydrophobicContact CD2-SD 4.41Å; T77-M86 WeakPolarHBondContact CB-SD 3.27Å; T77-M86 HydrophobicContact CG2-CE 3.54Å; T77-M86 HydrophobicContact CG2-SD 3.36Å; T77-M86 WeakPolarHBondContact CG2-SD 3.27Å; M86-Y90 HydrophobicContact CB-CD2 4.08Å; M86-Y90 HydrophobicContact CE-CD2 4.28Å; M86-Y90 HydrophobicContact CG-CD2 4.41Å; M86-Y90 HydrophobicContact SD-CD2 3.72Å; M86-Y91 HydrophobicContact CB-CE2 3.81Å; M86-Y91 HydrophobicContact CE-CE1 3.85Å; M86-Y91 HydrophobicContact CE-CE2 4.04Å; M86-W115 HydrophobicContact CG-CZ3 4.26Å; M86-E118 PolarHBondContact N-OE1 3.49Å
87	H	81.3	Confident	75.9	Confident	108 Å²	108	58.8 Å²	58.8	50%	0.5	29%	0.294	S	S	.	.			trans	-61	130.1	170.2	-168.2	-89.9	0	0	0	110.6	S89 Y90	H87-S89 WeakPolarHBondContact ND1-CB 3.16Å; H87-S89 PolarHBondContact ND1-N 3.04Å; H87-S89 PolarHBondContact ND1-OG 3.31Å; H87-S89 PolarHBondContact O-N 3.28Å; H87-Y90 HydrophobicContact CB-CD2 4.1Å; H87-Y90 HydrophobicContact CB-CE2 3.89Å; H87-Y90 WeakPolarHBondContact O-CB 3.08Å; H87-Y90 PolarHBondContact O-N 3.49Å
88	P	81.4	Confident	77	Confident	56 Å²	56	58.5 Å²	58.5	36%	0.364	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-50.4	-34.7	-176.3	-33.8	38	0	0	0	115.2	Y90 Y91 Y122	P88-Y90 PolarHBondContact O-N 2.81Å; P88-Y90 VanDerWaalsContact O-N 3.08Å; P88-Y91 PolarHBondContact O-N 3.11Å; P88-Y122 HydrophobicContact CB-CD1 4.09Å; P88-Y122 HydrophobicContact CB-CE1 3.52Å; P88-Y122 HydrophobicContact CG-CE1 3.83Å
89	S	81.8	Confident	78.5	Confident	60 Å²	60	56.7 Å²	56.7	42%	0.42	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-60.5	-20.1	179.5	68.6	0	0	0	0	113.9	H87 Y91 H92	H87-S89 WeakPolarHBondContact ND1-CB 3.16Å; H87-S89 PolarHBondContact ND1-N 3.04Å; H87-S89 PolarHBondContact ND1-OG 3.31Å; H87-S89 PolarHBondContact O-N 3.28Å; S89-Y91 VanDerWaalsContact C-N 3.34Å; S89-H92 VanDerWaalsContact O-CB 3.29Å; S89-H92 WeakPolarHBondContact O-CB 3.37Å; S89-H92 PolarHBondContact O-N 3.38Å
90	Y	84.7	Confident	80.5	Confident	28 Å²	28	55.3 Å²	55.3	11%	0.11	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-72.1	-29.6	176.9	-60.5	-27.2	0	0	0	112.5	K23 L56 W75 M86 H87 P88	K23-Y90 VanDerWaalsContact CE-O 3.28Å; K23-Y90 WeakPolarHBondContact CE-O 3.44Å; K23-Y90 PolarHBondContact NZ-O 2.97Å; L56-Y90 HydrophobicContact CD2-CD1 4.18Å; L56-Y90 HydrophobicContact CD2-CE1 4.15Å; W75-Y90 HydrophobicContact CE3-CD1 4.47Å; W75-Y90 HydrophobicContact CZ3-CD1 4.02Å; M86-Y90 HydrophobicContact CB-CD2 4.08Å; M86-Y90 HydrophobicContact CE-CD2 4.28Å; M86-Y90 HydrophobicContact CG-CD2 4.41Å; M86-Y90 HydrophobicContact SD-CD2 3.72Å; H87-Y90 HydrophobicContact CB-CD2 4.1Å; H87-Y90 HydrophobicContact CB-CE2 3.89Å; H87-Y90 WeakPolarHBondContact O-CB 3.08Å; H87-Y90 PolarHBondContact O-N 3.49Å; P88-Y90 PolarHBondContact O-N 2.81Å; P88-Y90 VanDerWaalsContact O-N 3.08Å
91	Y	88.5	Confident	82.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-23.1	175.8	-60.4	-75.4	0	0	0	113.1	I25 L27 M86 P88 S89 K93 A94 E118 L119 Y122 R123	I25-Y91 HydrophobicContact CD1-CD1 3.67Å; I25-Y91 HydrophobicContact CD1-CE1 4.12Å; L27-Y91 HydrophobicContact CD1-CE1 3.94Å; L27-Y91 HydrophobicContact CD2-CE1 4.02Å; M86-Y91 HydrophobicContact CB-CE2 3.81Å; M86-Y91 HydrophobicContact CE-CE1 3.85Å; M86-Y91 HydrophobicContact CE-CE2 4.04Å; P88-Y91 PolarHBondContact O-N 3.11Å; S89-Y91 VanDerWaalsContact C-N 3.34Å; Y91-K93 PolarHBondContact O-N 3.23Å; Y91-A94 VanDerWaalsContact O-CB 3.24Å; Y91-A94 WeakPolarHBondContact O-CB 3.43Å; Y91-A94 PolarHBondContact O-N 3.44Å; Y91-A94 VanDerWaalsContact O-N 3.09Å; Y91-E118 HydrophobicContact CE2-CG 4.22Å; Y91-E118 WeakPolarHBondContact CE2-OE1 3.18Å; Y91-E118 PolarHBondContact OH-OE1 2.9Å; Y91-L119 HydrophobicContact CD1-CD1 3.66Å; Y91-L119 HydrophobicContact CE1-CB 4.4Å; Y91-L119 HydrophobicContact CE1-CD1 4.01Å; Y91-Y122 AromaticContact CD2-CD2 3.43Å; Y91-Y122 HydrophobicContact CD2-CD2 3.43Å; Y91-Y122 VanDerWaalsContact CD2-CD2 3.43Å; Y91-Y122 AromaticContact CD2-CE2 3.99Å; Y91-Y122 HydrophobicContact CD2-CE2 3.99Å; Y91-Y122 AromaticContact CD2-CG 3.92Å; Y91-Y122 HydrophobicContact CD2-CG 3.92Å; Y91-Y122 AromaticContact CE2-CD2 3.82Å; Y91-Y122 HydrophobicContact CE2-CD2 3.82Å; Y91-Y122 HydrophobicContact CE2-CE2 4.06Å; Y91-Y122 AromaticContact CG-CD2 3.9Å; Y91-Y122 HydrophobicContact CG-CD2 3.9Å; Y91-Y122 HydrophobicContact CG-CG 4.13Å; Y91-R123 WeakPolarHBondContact O-CG 3.25Å
92	H	85	Confident	84.5	Confident	83 Å²	83	49.3 Å²	49.3	38%	0.384	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	134	-178.1	-171.9	80.9	0	0	0	112.3	K23 S89 A94 M193	K23-H92 WeakPolarHBondContact CE-O 3.41Å; K23-H92 PolarHBondContact NZ-O 2.93Å; S89-H92 VanDerWaalsContact O-CB 3.29Å; S89-H92 WeakPolarHBondContact O-CB 3.37Å; S89-H92 PolarHBondContact O-N 3.38Å; H92-A94 PolarHBondContact O-N 3.04Å; H92-A94 VanDerWaalsContact O-N 3.13Å; H92-M193 WeakPolarHBondContact CE1-CE 3.16Å; H92-M193 PolarHBondContact CE1-SD 3.24Å; H92-M193 WeakPolarHBondContact NE2-CE 3.33Å
93	K	87.2	Confident	86.6	Confident	77 Å²	77	40.4 Å²	40.4	34%	0.335	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	21.6	-176.8	-63.9	178	-178.9	-170.2	0	114.7	K23 Y91 H95 M193 E197	K23-K93 WeakPolarHBondContact CB-O 3.35Å; Y91-K93 PolarHBondContact O-N 3.23Å; K93-H95 PolarHBondContact O-CE1 3.19Å; K93-H95 PolarHBondContact O-ND1 3.18Å; K93-M193 HydrophobicContact CD-CE 4.34Å; K93-M193 HydrophobicContact CG-CE 4.24Å; K93-E197 WeakPolarHBondContact CE-OE1 3.31Å; K93-E197 IonicContact NZ-OE1 2.98Å; K93-E197 PolarHBondContact NZ-OE1 2.99Å
94	A	94.1	Very high	88.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.			trans	-70.6	136.2	170.8	0	0	0	0	0	110.1	I25 Y91 H92 R123 I126	I25-A94 HydrophobicContact CD1-CB 3.97Å; I25-A94 HydrophobicContact CG1-CB 3.95Å; I25-A94 HydrophobicContact CG2-CB 3.98Å; Y91-A94 VanDerWaalsContact O-CB 3.24Å; Y91-A94 WeakPolarHBondContact O-CB 3.43Å; Y91-A94 PolarHBondContact O-N 3.44Å; Y91-A94 VanDerWaalsContact O-N 3.09Å; H92-A94 PolarHBondContact O-N 3.04Å; H92-A94 VanDerWaalsContact O-N 3.13Å; A94-R123 HydrophobicContact CB-CG 4.42Å; A94-R123 PolarHBondContact O-NE 3.18Å; A94-R123 PolarHBondContact O-NH2 3.42Å; A94-I126 HydrophobicContact CB-CD1 3.98Å; A94-I126 VanDerWaalsContact O-CG2 3.25Å; A94-I126 WeakPolarHBondContact O-CG2 3.3Å
95	H	96.8	Very high	90.4	Very high	26 Å²	26	35.5 Å²	35.5	12%	0.12	18%	0.179	C	C	.	.			trans	-107.4	-18.8	-178.9	-58.3	82.7	0	0	0	112.1	V22 K23 K93 P127 A178	V22-H95 HydrophobicContact CB-CB 4.41Å; V22-H95 HydrophobicContact CG1-CB 4.47Å; K23-H95 PolarHBondContact N-ND1 3.04Å; K23-H95 PolarHBondContact O-N 3.27Å; K93-H95 PolarHBondContact O-CE1 3.19Å; K93-H95 PolarHBondContact O-ND1 3.18Å; H95-P127 VanDerWaalsContact O-CD 3.27Å; H95-P127 WeakPolarHBondContact O-CD 3.2Å; H95-P127 WeakPolarHBondContact O-CG 3.4Å; H95-A178 HydrophobicContact CB-CB 4.04Å
96	A	97.9	Very high	91.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	163.1	169	0	0	0	0	0	110.9	I24 I25 P127 T174 A178	I24-A96 WeakPolarHBondContact CA-O 3.36Å; I24-A96 HydrophobicContact CG1-CB 4.32Å; I25-A96 PolarHBondContact N-O 2.98Å; I25-A96 VanDerWaalsContact N-O 3.09Å; A96-P127 CarbonylContact C-O 3.37Å; A96-P127 VanDerWaalsContact CA-O 3.25Å; A96-P127 WeakPolarHBondContact CA-O 3.4Å; A96-P127 HydrophobicContact CB-CG 3.97Å; A96-T174 HydrophobicContact CB-CG2 3.93Å; A96-A178 HydrophobicContact CB-CB 3.71Å
97	C	97.4	Very high	92.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.2	174.3	-178.5	0	0	0	0	112.7	I25 L27 L119 I126 P127 C128 V129	I25-C97 HydrophobicContact CD1-CB 4.29Å; I25-C97 HydrophobicContact CG1-CB 3.95Å; I25-C97 CarbonylContact O-C 3.55Å; I25-C97 WeakPolarHBondContact O-CA 3.12Å; L27-C97 VanDerWaalsContact CD1-SG 3.52Å; C97-L119 HydrophobicContact CB-CD2 3.59Å; C97-I126 HydrophobicContact CB-CD1 4.11Å; C97-P127 PolarHBondContact N-O 3.3Å; C97-C128 HydrophobicContact CB-CB 4.46Å; C97-C128 CarbonylContact O-C 3.52Å; C97-C128 VanDerWaalsContact O-CA 3.3Å; C97-C128 WeakPolarHBondContact O-CA 3.37Å; C97-V129 PolarHBondContact O-N 2.94Å
98	I	97.9	Very high	93.2	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	110.9	169	-56.9	175	0	0	0	108	I24 I25 C26 L27 V100 V129 V131 M170 F171 T174	I24-I98 HydrophobicContact CG2-CD1 3.9Å; I24-I98 HydrophobicContact CG2-CG1 3.92Å; I25-I98 PolarHBondContact O-N 2.82Å; C26-I98 CarbonylContact C-O 3.58Å; C26-I98 VanDerWaalsContact CA-O 3.32Å; C26-I98 WeakPolarHBondContact CA-O 3.33Å; L27-I98 PolarHBondContact N-O 2.86Å; I98-V100 HydrophobicContact CG2-CG2 3.81Å; I98-V129 HydrophobicContact CB-CG2 4.19Å; I98-V129 HydrophobicContact CG1-CG2 3.91Å; I98-V129 HydrophobicContact CG2-CG2 4.12Å; I98-V131 HydrophobicContact CG2-CB 4.33Å; I98-V131 HydrophobicContact CG2-CG2 3.51Å; I98-M170 HydrophobicContact CD1-CE 4.38Å; I98-M170 HydrophobicContact CD1-SD 3.94Å; I98-M170 HydrophobicContact CG1-SD 4.36Å; I98-M170 HydrophobicContact CG2-CE 4.33Å; I98-M170 HydrophobicContact CG2-SD 4.09Å; I98-F171 HydrophobicContact CD1-CD1 3.86Å; I98-F171 HydrophobicContact CD1-CE1 3.6Å; I98-F171 HydrophobicContact CD1-CZ 4.29Å; I98-T174 HydrophobicContact CD1-CG2 4.11Å; I98-T174 HydrophobicContact CG1-CG2 3.75Å
99	M	96.8	Very high	94	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	112.3	177.9	-66.2	-169.6	-71.4	0	0	110.7	L27 L112 Y116 C128 V129 V130 V131 F148 L154	L27-M99 HydrophobicContact CB-CG 4.48Å; M99-L112 HydrophobicContact CB-CD2 4.12Å; M99-Y116 HydrophobicContact CE-CD2 3.59Å; M99-Y116 HydrophobicContact CE-CE2 4.24Å; M99-Y116 HydrophobicContact CE-CG 4.34Å; M99-Y116 HydrophobicContact SD-CD2 3.82Å; M99-Y116 HydrophobicContact SD-CG 4.31Å; M99-C128 HydrophobicContact CE-CB 4.1Å; M99-V129 PolarHBondContact N-O 2.79Å; M99-V130 HydrophobicContact CE-CG2 3.99Å; M99-V130 CarbonylContact O-C 3.57Å; M99-V130 WeakPolarHBondContact O-CA 3.45Å; M99-V131 PolarHBondContact O-N 3.46Å; M99-F148 HydrophobicContact CE-CE1 3.9Å; M99-F148 HydrophobicContact CE-CZ 4.33Å; M99-L154 HydrophobicContact CE-CD1 3.35Å
100	V	97.3	Very high	94.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.9	-171.2	-169.2	0	0	0	0	111	L27 G28 V32 K34 L37 I98 V131 N133	L27-V100 PolarHBondContact O-N 2.82Å; G28-V100 WeakPolarHBondContact CA-O 3.49Å; V32-V100 HydrophobicContact CB-CG1 4.25Å; V32-V100 HydrophobicContact CG2-CB 3.89Å; V32-V100 HydrophobicContact CG2-CG1 3.81Å; K34-V100 HydrophobicContact CG-CB 4.16Å; K34-V100 HydrophobicContact CG-CG2 4.11Å; L37-V100 HydrophobicContact CD1-CG1 3.82Å; L37-V100 HydrophobicContact CD1-CG2 3.98Å; I98-V100 HydrophobicContact CG2-CG2 3.81Å; V100-V131 WeakPolarHBondContact CA-O 3.35Å; V100-V131 HydrophobicContact CG1-CB 4.45Å; V100-V131 HydrophobicContact CG1-CG1 4.31Å; V100-V131 HydrophobicContact CG2-CB 4.19Å; V100-N133 HydrophobicContact CG1-CB 3.85Å
101	F	97.4	Very high	95.1	Very high	1 Å²	1	42.4 Å²	42.4	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	159.6	166.6	75.3	-84	0	0	0	111.3	V103 Y109 L112 V130 V131 A132 N133 F146 L156	F101-V103 HydrophobicContact CE2-CG1 3.97Å; F101-V103 HydrophobicContact CZ-CG1 4.44Å; F101-Y109 HydrophobicContact CD1-CD2 4.09Å; F101-Y109 HydrophobicContact CD2-CD2 4.09Å; F101-Y109 HydrophobicContact CD2-CG 4.34Å; F101-Y109 AromaticContact CE1-CD2 3.91Å; F101-Y109 HydrophobicContact CE1-CD2 3.91Å; F101-Y109 HydrophobicContact CE1-CE2 4.46Å; F101-Y109 AromaticContact CE2-CD2 3.93Å; F101-Y109 HydrophobicContact CE2-CD2 3.93Å; F101-Y109 HydrophobicContact CE2-CG 4.34Å; F101-Y109 HydrophobicContact CG-CD2 4.15Å; F101-Y109 AromaticContact CZ-CD2 3.82Å; F101-Y109 HydrophobicContact CZ-CD2 3.82Å; F101-Y109 HydrophobicContact CZ-CE2 4.43Å; F101-L112 HydrophobicContact CB-CD1 4.29Å; F101-L112 HydrophobicContact CB-CD2 4.26Å; F101-L112 HydrophobicContact CB-CG 4.34Å; F101-L112 HydrophobicContact CD1-CD1 3.71Å; F101-L112 HydrophobicContact CE1-CD1 4.35Å; F101-L112 HydrophobicContact CG-CD1 4.22Å; F101-V130 HydrophobicContact CD1-CG1 4.13Å; F101-V130 HydrophobicContact CE1-CG1 3.93Å; F101-V131 VanDerWaalsContact CD1-O 3.29Å; F101-V131 WeakPolarHBondContact CD1-O 3.28Å; F101-V131 PolarHBondContact N-O 2.91Å; F101-A132 HydrophobicContact CD1-CB 4.5Å; F101-A132 HydrophobicContact CE1-CB 3.59Å; F101-A132 HydrophobicContact CE2-CB 4.13Å; F101-A132 HydrophobicContact CZ-CB 3.37Å; F101-N133 PolarHBondContact O-N 3.42Å; F101-F146 HydrophobicContact CE2-CD1 4.03Å; F101-F146 AromaticContact CE2-CE1 3.55Å; F101-F146 HydrophobicContact CE2-CE1 3.55Å; F101-F146 HydrophobicContact CE2-CZ 4.08Å; F101-F146 AromaticContact CZ-CD1 3.61Å; F101-F146 HydrophobicContact CZ-CD1 3.61Å; F101-F146 AromaticContact CZ-CE1 3.53Å; F101-F146 HydrophobicContact CZ-CE1 3.53Å; F101-F146 HydrophobicContact CZ-CE2 4.49Å; F101-F146 HydrophobicContact CZ-CG 4.12Å; F101-F146 AromaticContact CZ-CZ 3.99Å; F101-F146 HydrophobicContact CZ-CZ 3.99Å; F101-L156 HydrophobicContact CE1-CD1 4.31Å
102	D	97.3	Very high	95.4	Very high	5 Å²	5	42.4 Å²	42.4	3%	0.027	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	119.3	176.4	178.9	-14.9	0	0	0	109.3	V32 Q104 R105 T108 K134	V32-D102 HydrophobicContact CB-CB 4.31Å; V32-D102 HydrophobicContact CG1-CB 4.13Å; D102-Q104 PolarHBondContact O-N 3Å; D102-Q104 VanDerWaalsContact O-N 3.13Å; D102-Q104 VanDerWaalsContact OD1-CB 3.31Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.19Å; D102-Q104 PolarHBondContact OD1-N 3.42Å; D102-R105 HydrophobicContact CB-CB 4.15Å; D102-R105 CarbonylContact O-C 3.16Å; D102-R105 PolarHBondContact O-N 3.42Å; D102-R105 WeakPolarHBondContact OD2-CD 3.4Å; D102-T108 HydrophobicContact CB-CG2 4.49Å; D102-T108 PolarHBondContact N-OG1 3.15Å; D102-T108 PolarHBondContact O-OG1 3.04Å; D102-K134 WeakPolarHBondContact OD2-CD 3.1Å; D102-K134 WeakPolarHBondContact OD2-CE 3.39Å; D102-K134 IonicContact OD2-NZ 2.72Å; D102-K134 PolarHBondContact OD2-NZ 2.63Å
103	V	97.9	Very high	96	Very high	20 Å²	20	41.7 Å²	41.7	12%	0.121	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.1	-178.2	-63.4	0	0	0	0	113.9	F101 A132 N133 K134 I135 V141	F101-V103 HydrophobicContact CE2-CG1 3.97Å; F101-V103 HydrophobicContact CZ-CG1 4.44Å; V103-A132 HydrophobicContact CG1-CB 3.71Å; V103-N133 WeakPolarHBondContact CG1-O 3.43Å; V103-N133 VanDerWaalsContact CG2-O 3.32Å; V103-N133 WeakPolarHBondContact CG2-O 3.29Å; V103-N133 PolarHBondContact N-O 2.85Å; V103-N133 VanDerWaalsContact N-O 3.09Å; V103-K134 HydrophobicContact CG2-CB 4.43Å; V103-K134 VanDerWaalsContact CG2-O 3.27Å; V103-K134 WeakPolarHBondContact CG2-O 3.07Å; V103-I135 HydrophobicContact CG1-CG2 4.22Å; V103-V141 HydrophobicContact CB-CB 4.42Å; V103-V141 HydrophobicContact CB-CG1 4.24Å; V103-V141 HydrophobicContact CB-CG2 3.69Å; V103-V141 HydrophobicContact CG1-CG1 4.13Å; V103-V141 HydrophobicContact CG1-CG2 3.85Å; V103-V141 HydrophobicContact CG2-CG1 4.19Å; V103-V141 HydrophobicContact CG2-CG2 4.39Å
104	Q	96.4	Very high	96.2	Very high	124 Å²	124	43 Å²	43	58%	0.579	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-19.2	177.4	-55.8	179.9	63.1	0	0	111.9	D102 A137	D102-Q104 PolarHBondContact O-N 3Å; D102-Q104 VanDerWaalsContact O-N 3.13Å; D102-Q104 VanDerWaalsContact OD1-CB 3.31Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.19Å; D102-Q104 PolarHBondContact OD1-N 3.42Å; Q104-A137 HydrophobicContact CG-CB 3.98Å
105	R	95.9	Very high	96.2	Very high	94 Å²	94	44.4 Å²	44.4	36%	0.355	21%	0.209	S	C	.	.			trans	-117.7	90.8	-175.3	-66.5	173.3	57.9	-153.6	-4.3	111.4	S30 D102 I107 T108	S30-R105 PolarHBondContact O-NH1 2.95Å; D102-R105 HydrophobicContact CB-CB 4.15Å; D102-R105 CarbonylContact O-C 3.16Å; D102-R105 PolarHBondContact O-N 3.42Å; D102-R105 WeakPolarHBondContact OD2-CD 3.4Å; R105-I107 PolarHBondContact O-N 3.12Å; R105-T108 HydrophobicContact CB-CG2 3.77Å; R105-T108 WeakPolarHBondContact O-CB 3.12Å; R105-T108 PolarHBondContact O-N 3.45Å; R105-T108 PolarHBondContact O-OG1 3Å
106	K	95.6	Very high	96.1	Very high	158 Å²	158	44.5 Å²	44.5	69%	0.687	21%	0.208	S	C	*	.	H	α-helix	trans	-49.8	-33.7	-179	-173.5	175.9	-177.6	176.5	0	114.7	T108 Y109 K110	K106-T108 VanDerWaalsContact C-N 3.3Å; K106-T108 PolarHBondContact O-N 3.4Å; K106-Y109 PolarHBondContact O-N 3.15Å; K106-K110 PolarHBondContact O-N 2.96Å
107	I	95	Very high	96	Very high	89 Å²	89	48 Å²	48	46%	0.456	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-38.2	178.8	-171.2	59	0	0	0	112.1	R105 Y109 K110 N111	R105-I107 PolarHBondContact O-N 3.12Å; I107-Y109 VanDerWaalsContact C-N 3.26Å; I107-Y109 PolarHBondContact O-N 3.14Å; I107-K110 HydrophobicContact CD1-CD 4.45Å; I107-K110 WeakPolarHBondContact O-CB 3.38Å; I107-K110 PolarHBondContact O-N 3Å; I107-N111 PolarHBondContact O-N 2.91Å
108	T	95.6	Very high	95.8	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-32.9	-178.9	69.1	0	0	0	0	111.8	D29 V32 D102 R105 K106	D29-T108 HydrophobicContact CB-CG2 3.79Å; D29-T108 WeakPolarHBondContact OD2-CA 3.29Å; V32-T108 HydrophobicContact CG1-CG2 3.75Å; D102-T108 HydrophobicContact CB-CG2 4.49Å; D102-T108 PolarHBondContact N-OG1 3.15Å; D102-T108 PolarHBondContact O-OG1 3.04Å; R105-T108 HydrophobicContact CB-CG2 3.77Å; R105-T108 WeakPolarHBondContact O-CB 3.12Å; R105-T108 PolarHBondContact O-N 3.45Å; R105-T108 PolarHBondContact O-OG1 3Å; K106-T108 VanDerWaalsContact C-N 3.3Å; K106-T108 PolarHBondContact O-N 3.4Å
109	Y	97.2	Very high	95.5	Very high	50 Å²	50	49 Å²	49	20%	0.196	24%	0.235	C	C	.	.	H	α-helix	trans	-70	-40.3	171.9	174.9	-104.7	0	0	0	112.6	F101 K106 I107 N111 L112 F146 N147 F148	F101-Y109 HydrophobicContact CD1-CD2 4.09Å; F101-Y109 HydrophobicContact CD2-CD2 4.09Å; F101-Y109 HydrophobicContact CD2-CG 4.34Å; F101-Y109 AromaticContact CE1-CD2 3.91Å; F101-Y109 HydrophobicContact CE1-CD2 3.91Å; F101-Y109 HydrophobicContact CE1-CE2 4.46Å; F101-Y109 AromaticContact CE2-CD2 3.93Å; F101-Y109 HydrophobicContact CE2-CD2 3.93Å; F101-Y109 HydrophobicContact CE2-CG 4.34Å; F101-Y109 HydrophobicContact CG-CD2 4.15Å; F101-Y109 AromaticContact CZ-CD2 3.82Å; F101-Y109 HydrophobicContact CZ-CD2 3.82Å; F101-Y109 HydrophobicContact CZ-CE2 4.43Å; K106-Y109 PolarHBondContact O-N 3.15Å; I107-Y109 VanDerWaalsContact C-N 3.26Å; I107-Y109 PolarHBondContact O-N 3.14Å; Y109-N111 VanDerWaalsContact C-N 3.31Å; Y109-N111 PolarHBondContact O-N 3.44Å; Y109-L112 HydrophobicContact CD2-CD1 3.73Å; Y109-L112 HydrophobicContact CE2-CD1 4.14Å; Y109-L112 WeakPolarHBondContact O-CB 3.34Å; Y109-L112 WeakPolarHBondContact O-CG 3.27Å; Y109-L112 PolarHBondContact O-N 3.33Å; Y109-F146 AromaticContact CD2-CD1 3.77Å; Y109-F146 HydrophobicContact CD2-CD1 3.77Å; Y109-F146 HydrophobicContact CD2-CE1 4.38Å; Y109-F146 HydrophobicContact CE1-CD1 4.4Å; Y109-F146 HydrophobicContact CE2-CB 3.91Å; Y109-F146 AromaticContact CE2-CD1 3.53Å; Y109-F146 HydrophobicContact CE2-CD1 3.53Å; Y109-F146 HydrophobicContact CE2-CG 4.18Å; Y109-F146 HydrophobicContact CG-CD1 4.3Å; Y109-F146 AromaticContact CZ-CD1 3.86Å; Y109-N147 PolarHBondContact OH-N 3.38Å; Y109-F148 HydrophobicContact CE2-CB 3.82Å; Y109-F148 VanDerWaalsContact OH-CB 3.28Å; Y109-F148 WeakPolarHBondContact OH-CB 3.43Å; Y109-F148 PolarHBondContact OH-N 3.02Å
110	K	95.9	Very high	95.4	Very high	121 Å²	121	51.8 Å²	51.8	53%	0.526	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-41.6	177.5	-71.2	-176.4	174.2	-172.4	0	111.3	K106 I107 L112 T113	K106-K110 PolarHBondContact O-N 2.96Å; I107-K110 HydrophobicContact CD1-CD 4.45Å; I107-K110 WeakPolarHBondContact O-CB 3.38Å; I107-K110 PolarHBondContact O-N 3Å; K110-L112 PolarHBondContact O-N 3.31Å; K110-T113 PolarHBondContact O-N 3.23Å; K110-T113 PolarHBondContact O-OG1 3.42Å
111	N	94.4	Very high	95.2	Very high	42 Å²	42	58 Å²	58	23%	0.225	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-14	-178.3	-69.9	-11.3	0	0	0	113.7	D29 I107 Y109 T113 N114 W115	D29-N111 VanDerWaalsContact OD1-CB 3.31Å; D29-N111 WeakPolarHBondContact OD1-CB 3.46Å; D29-N111 PolarHBondContact OD1-ND2 2.93Å; D29-N111 PolarHBondContact OD2-ND2 2.98Å; I107-N111 PolarHBondContact O-N 2.91Å; Y109-N111 VanDerWaalsContact C-N 3.31Å; Y109-N111 PolarHBondContact O-N 3.44Å; N111-T113 PolarHBondContact O-N 3.49Å; N111-T113 VanDerWaalsContact O-N 3.13Å; N111-N114 WeakPolarHBondContact O-CB 3.5Å; N111-N114 PolarHBondContact O-N 3.05Å; N111-W115 PolarHBondContact O-N 3.01Å; N111-W115 VanDerWaalsContact O-N 3.17Å
112	L	95.2	Very high	94.9	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54.1	-31.9	172.5	-67.6	-178.4	0	0	0	112.9	M99 F101 Y109 K110 N114 W115 Y116 V130 F148	M99-L112 HydrophobicContact CB-CD2 4.12Å; F101-L112 HydrophobicContact CB-CD1 4.29Å; F101-L112 HydrophobicContact CB-CD2 4.26Å; F101-L112 HydrophobicContact CB-CG 4.34Å; F101-L112 HydrophobicContact CD1-CD1 3.71Å; F101-L112 HydrophobicContact CE1-CD1 4.35Å; F101-L112 HydrophobicContact CG-CD1 4.22Å; Y109-L112 HydrophobicContact CD2-CD1 3.73Å; Y109-L112 HydrophobicContact CE2-CD1 4.14Å; Y109-L112 WeakPolarHBondContact O-CB 3.34Å; Y109-L112 WeakPolarHBondContact O-CG 3.27Å; Y109-L112 PolarHBondContact O-N 3.33Å; K110-L112 PolarHBondContact O-N 3.31Å; L112-N114 VanDerWaalsContact C-N 3.31Å; L112-N114 PolarHBondContact O-N 3.46Å; L112-W115 PolarHBondContact O-N 3.35Å; L112-Y116 WeakPolarHBondContact O-CB 3.05Å; L112-Y116 PolarHBondContact O-N 3.44Å; L112-V130 HydrophobicContact CD1-CG1 3.9Å; L112-F148 HydrophobicContact CB-CD1 4.15Å; L112-F148 HydrophobicContact CB-CE1 3.96Å; L112-F148 HydrophobicContact CB-CE2 4.36Å; L112-F148 HydrophobicContact CB-CG 4.46Å; L112-F148 HydrophobicContact CB-CZ 4.07Å; L112-F148 HydrophobicContact CD1-CD1 3.97Å; L112-F148 HydrophobicContact CD1-CE1 4.31Å
113	T	95.8	Very high	94.8	Very high	68 Å²	68	61.7 Å²	61.7	42%	0.417	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-43.2	176.2	-49.7	0	0	0	0	111.1	K110 N111 Y116 T117	K110-T113 PolarHBondContact O-N 3.23Å; K110-T113 PolarHBondContact O-OG1 3.42Å; N111-T113 PolarHBondContact O-N 3.49Å; N111-T113 VanDerWaalsContact O-N 3.13Å; T113-Y116 PolarHBondContact O-N 2.82Å; T113-T117 WeakPolarHBondContact O-CB 3.27Å; T113-T117 PolarHBondContact O-N 3.07Å; T113-T117 PolarHBondContact O-OG1 3.01Å
114	N	93.4	Very high	94.5	Very high	103 Å²	103	63.5 Å²	63.5	55%	0.551	30%	0.3	S	S	*	.	H	α-helix	trans	-68.6	-48	-179	-57.9	-7.5	0	0	0	110.3	N111 L112 Y116 T117 E118	N111-N114 WeakPolarHBondContact O-CB 3.5Å; N111-N114 PolarHBondContact O-N 3.05Å; L112-N114 VanDerWaalsContact C-N 3.31Å; L112-N114 PolarHBondContact O-N 3.46Å; N114-Y116 PolarHBondContact O-N 2.91Å; N114-T117 PolarHBondContact O-N 3.49Å; N114-E118 WeakPolarHBondContact O-CB 3.21Å; N114-E118 PolarHBondContact O-N 3.4Å
115	W	93.4	Very high	94.4	Very high	31 Å²	31	62.8 Å²	62.8	12%	0.117	30%	0.297	C	S	.	.	H	α-helix	trans	-56.9	-39.3	176.2	-67.4	117.6	0	0	0	112.5	L27 D29 M86 N111 L112 L119	L27-W115 HydrophobicContact CB-CB 4.4Å; L27-W115 HydrophobicContact CB-CE3 4.44Å; D29-W115 PolarHBondContact OD1-NE1 3.48Å; M86-W115 HydrophobicContact CG-CZ3 4.26Å; N111-W115 PolarHBondContact O-N 3.01Å; N111-W115 VanDerWaalsContact O-N 3.17Å; L112-W115 PolarHBondContact O-N 3.35Å; W115-L119 VanDerWaalsContact O-CB 3.25Å; W115-L119 WeakPolarHBondContact O-CB 3.11Å; W115-L119 PolarHBondContact O-N 3.12Å
116	Y	95.3	Very high	94.4	Very high	27 Å²	27	58.3 Å²	58.3	11%	0.106	28%	0.28	C	S	.	.	H	α-helix	trans	-73.5	-43.2	179.3	-175	-110.4	0	0	0	112.6	M99 L112 T113 N114 L119 R120 F148 Q152 L154	M99-Y116 HydrophobicContact CE-CD2 3.59Å; M99-Y116 HydrophobicContact CE-CE2 4.24Å; M99-Y116 HydrophobicContact CE-CG 4.34Å; M99-Y116 HydrophobicContact SD-CD2 3.82Å; M99-Y116 HydrophobicContact SD-CG 4.31Å; L112-Y116 WeakPolarHBondContact O-CB 3.05Å; L112-Y116 PolarHBondContact O-N 3.44Å; T113-Y116 PolarHBondContact O-N 2.82Å; N114-Y116 PolarHBondContact O-N 2.91Å; Y116-L119 PolarHBondContact O-N 2.99Å; Y116-R120 HydrophobicContact CD1-CG 4.38Å; Y116-R120 HydrophobicContact CD2-CG 4.38Å; Y116-R120 HydrophobicContact CE1-CG 4.07Å; Y116-R120 HydrophobicContact CE2-CG 4.08Å; Y116-R120 VanDerWaalsContact CE2-NE 3.29Å; Y116-R120 WeakPolarHBondContact O-CB 3.41Å; Y116-R120 VanDerWaalsContact O-CG 3.26Å; Y116-R120 WeakPolarHBondContact O-CG 3.34Å; Y116-R120 PolarHBondContact O-N 3.38Å; Y116-R120 PolarHBondContact OH-NE 2.92Å; Y116-R120 PolarHBondContact OH-NH2 2.83Å; Y116-F148 HydrophobicContact CD1-CZ 4.26Å; Y116-F148 AromaticContact CG-CZ 3.93Å; Y116-F148 HydrophobicContact CG-CZ 3.93Å; Y116-Q152 HydrophobicContact CD1-CG 4.24Å; Y116-Q152 HydrophobicContact CE1-CB 4.31Å; Y116-Q152 HydrophobicContact CE1-CG 3.91Å; Y116-Q152 VanDerWaalsContact CE1-OE1 3.25Å; Y116-L154 HydrophobicContact CD2-CD1 4.23Å; Y116-L154 HydrophobicContact CE2-CD1 3.83Å
117	T	95	Very high	94.5	Very high	75 Å²	75	52 Å²	52	46%	0.46	26%	0.255	S	S	.	.	H	α-helix	trans	-58.9	-51.1	175.1	-62.3	0	0	0	0	110.4	T113 N114 L119 R120 E121	T113-T117 WeakPolarHBondContact O-CB 3.27Å; T113-T117 PolarHBondContact O-N 3.07Å; T113-T117 PolarHBondContact O-OG1 3.01Å; N114-T117 PolarHBondContact O-N 3.49Å; T117-L119 VanDerWaalsContact C-N 3.34Å; T117-L119 PolarHBondContact O-N 2.92Å; T117-R120 PolarHBondContact O-N 2.91Å; T117-R120 VanDerWaalsContact O-N 3.12Å; T117-E121 PolarHBondContact O-N 3.03Å
118	E	92.2	Very high	94.6	Very high	21 Å²	21	47.8 Å²	47.8	10%	0.098	23%	0.234	C	C	.	.	H	α-helix	trans	-58.5	-45.5	178.1	-174.3	-176.4	148.7	0	0	111.4	M86 Y91 N114 R120 E121 Y122	M86-E118 PolarHBondContact N-OE1 3.49Å; Y91-E118 HydrophobicContact CE2-CG 4.22Å; Y91-E118 WeakPolarHBondContact CE2-OE1 3.18Å; Y91-E118 PolarHBondContact OH-OE1 2.9Å; N114-E118 WeakPolarHBondContact O-CB 3.21Å; N114-E118 PolarHBondContact O-N 3.4Å; E118-R120 VanDerWaalsContact C-N 3.3Å; E118-R120 PolarHBondContact O-N 3.38Å; E118-E121 WeakPolarHBondContact O-CB 3.35Å; E118-E121 PolarHBondContact O-N 2.97Å; E118-Y122 HydrophobicContact CG-CE2 4.18Å; E118-Y122 VanDerWaalsContact O-CD2 3.23Å; E118-Y122 WeakPolarHBondContact O-CD2 3.16Å
119	L	93.4	Very high	94.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56	-45.5	175.8	173.3	63.3	0	0	0	112.2	I25 L27 Y91 C97 W115 Y116 T117 E121 Y122 R123 I126 C128	I25-L119 HydrophobicContact CD1-CD1 3.67Å; L27-L119 HydrophobicContact CD1-CB 4.03Å; L27-L119 HydrophobicContact CD1-CD1 4.38Å; L27-L119 HydrophobicContact CD1-CD2 4.3Å; L27-L119 HydrophobicContact CD1-CG 4.49Å; Y91-L119 HydrophobicContact CD1-CD1 3.66Å; Y91-L119 HydrophobicContact CE1-CB 4.4Å; Y91-L119 HydrophobicContact CE1-CD1 4.01Å; C97-L119 HydrophobicContact CB-CD2 3.59Å; W115-L119 VanDerWaalsContact O-CB 3.25Å; W115-L119 WeakPolarHBondContact O-CB 3.11Å; W115-L119 PolarHBondContact O-N 3.12Å; Y116-L119 PolarHBondContact O-N 2.99Å; T117-L119 VanDerWaalsContact C-N 3.34Å; T117-L119 PolarHBondContact O-N 2.92Å; L119-E121 PolarHBondContact O-N 3.26Å; L119-Y122 PolarHBondContact O-N 3.22Å; L119-Y122 VanDerWaalsContact O-N 3.14Å; L119-R123 HydrophobicContact CD1-CB 4.16Å; L119-R123 PolarHBondContact O-N 3.5Å; L119-I126 HydrophobicContact CD1-CD1 3.93Å; L119-C128 WeakPolarHBondContact CD2-SG 3.39Å
120	R	94.9	Very high	94.8	Very high	59 Å²	59	45.5 Å²	45.5	22%	0.223	23%	0.225	C	C	.	.	H	α-helix	trans	-70	-19.6	-176.3	-69.9	-62.8	-173	-154.8	-1.1	113	Y116 T117 E118 Y122 P124 I126	Y116-R120 HydrophobicContact CD1-CG 4.38Å; Y116-R120 HydrophobicContact CD2-CG 4.38Å; Y116-R120 HydrophobicContact CE1-CG 4.07Å; Y116-R120 HydrophobicContact CE2-CG 4.08Å; Y116-R120 VanDerWaalsContact CE2-NE 3.29Å; Y116-R120 WeakPolarHBondContact O-CB 3.41Å; Y116-R120 VanDerWaalsContact O-CG 3.26Å; Y116-R120 WeakPolarHBondContact O-CG 3.34Å; Y116-R120 PolarHBondContact O-N 3.38Å; Y116-R120 PolarHBondContact OH-NE 2.92Å; Y116-R120 PolarHBondContact OH-NH2 2.83Å; T117-R120 PolarHBondContact O-N 2.91Å; T117-R120 VanDerWaalsContact O-N 3.12Å; E118-R120 VanDerWaalsContact C-N 3.3Å; E118-R120 PolarHBondContact O-N 3.38Å; R120-Y122 VanDerWaalsContact C-N 3.31Å; R120-P124 WeakPolarHBondContact CD-O 3.24Å; R120-P124 PolarHBondContact NE-O 3.41Å; R120-P124 PolarHBondContact NH1-O 3.28Å; R120-I126 PolarHBondContact NH1-O 3.34Å
121	E	92.8	Very high	95	Very high	131 Å²	131	39.7 Å²	39.7	61%	0.612	20%	0.2	S	C	*	.	H	α-helix	trans	-65.2	-35.4	170.2	-67.3	175.2	-177.2	0	0	112	T117 E118 L119	T117-E121 PolarHBondContact O-N 3.03Å; E118-E121 WeakPolarHBondContact O-CB 3.35Å; E118-E121 PolarHBondContact O-N 2.97Å; L119-E121 PolarHBondContact O-N 3.26Å
122	Y	91.1	Very high	95.2	Very high	78 Å²	78	37.7 Å²	37.7	31%	0.306	19%	0.189	S	C	.	.	H	α-helix	trans	-102.1	-32.3	-175.6	-60.4	-72.4	0	0	0	114	P88 Y91 E118 L119 R120	P88-Y122 HydrophobicContact CB-CD1 4.09Å; P88-Y122 HydrophobicContact CB-CE1 3.52Å; P88-Y122 HydrophobicContact CG-CE1 3.83Å; Y91-Y122 AromaticContact CD2-CD2 3.43Å; Y91-Y122 HydrophobicContact CD2-CD2 3.43Å; Y91-Y122 VanDerWaalsContact CD2-CD2 3.43Å; Y91-Y122 AromaticContact CD2-CE2 3.99Å; Y91-Y122 HydrophobicContact CD2-CE2 3.99Å; Y91-Y122 AromaticContact CD2-CG 3.92Å; Y91-Y122 HydrophobicContact CD2-CG 3.92Å; Y91-Y122 AromaticContact CE2-CD2 3.82Å; Y91-Y122 HydrophobicContact CE2-CD2 3.82Å; Y91-Y122 HydrophobicContact CE2-CE2 4.06Å; Y91-Y122 AromaticContact CG-CD2 3.9Å; Y91-Y122 HydrophobicContact CG-CD2 3.9Å; Y91-Y122 HydrophobicContact CG-CG 4.13Å; E118-Y122 HydrophobicContact CG-CE2 4.18Å; E118-Y122 VanDerWaalsContact O-CD2 3.23Å; E118-Y122 WeakPolarHBondContact O-CD2 3.16Å; L119-Y122 PolarHBondContact O-N 3.22Å; L119-Y122 VanDerWaalsContact O-N 3.14Å; R120-Y122 VanDerWaalsContact C-N 3.31Å
123	R	93.6	Very high	95.3	Very high	5 Å²	5	37.8 Å²	37.8	2%	0.019	19%	0.19	C	C	.	.			trans	-137.9	77.2	-175.8	-66	-58.2	-58.9	-170.9	1.5	109.8	Y91 A94 L119 E125 I126 Y181 D190	Y91-R123 WeakPolarHBondContact O-CG 3.25Å; A94-R123 HydrophobicContact CB-CG 4.42Å; A94-R123 PolarHBondContact O-NE 3.18Å; A94-R123 PolarHBondContact O-NH2 3.42Å; L119-R123 HydrophobicContact CD1-CB 4.16Å; L119-R123 PolarHBondContact O-N 3.5Å; R123-E125 VanDerWaalsContact C-N 3.27Å; R123-E125 PolarHBondContact O-N 2.78Å; R123-I126 HydrophobicContact CB-CB 4.47Å; R123-I126 HydrophobicContact CB-CD1 3.86Å; R123-I126 HydrophobicContact CB-CG1 3.91Å; R123-I126 HydrophobicContact CB-CG2 3.84Å; R123-I126 HydrophobicContact CG-CD1 4.36Å; R123-I126 HydrophobicContact CG-CG2 4.35Å; R123-Y181 PolarHBondContact NH2-OH 2.84Å; R123-D190 IonicContact CZ-OD1 3.17Å; R123-D190 IonicContact NH1-OD1 2.77Å; R123-D190 PolarHBondContact NH1-OD1 2.71Å; R123-D190 VanDerWaalsContact NH2-CG 3.31Å; R123-D190 IonicContact NH2-OD1 2.67Å; R123-D190 PolarHBondContact NH2-OD1 3.1Å; R123-D190 IonicContact NH2-OD2 3.27Å; R123-D190 PolarHBondContact NH2-OD2 3.11Å
124	P	92.5	Very high	95.4	Very high	58 Å²	58	37.2 Å²	37.2	38%	0.377	18%	0.181	S	C	.	.	S	Bend	trans	-64.3	-29.5	-170.5	23.5	-32.6	0	0	0	113.2	R120	R120-P124 WeakPolarHBondContact CD-O 3.24Å; R120-P124 PolarHBondContact NE-O 3.41Å; R120-P124 PolarHBondContact NH1-O 3.28Å
125	E	93.6	Very high	95.6	Very high	109 Å²	109	32.4 Å²	32.4	51%	0.509	16%	0.155	S	C	.	.	S	Bend	trans	-111.2	-8.3	-168.5	-58	-169.2	167.8	0	0	115	R123 Y181 D187	R123-E125 VanDerWaalsContact C-N 3.27Å; R123-E125 PolarHBondContact O-N 2.78Å; E125-Y181 HydrophobicContact CB-CE2 3.96Å; E125-D187 HydrophobicContact CB-CB 4.45Å
126	I	96.6	Very high	95.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.169	C	C	.	.			trans	-63.3	142.8	-173.8	71.7	170.6	0	0	0	111.5	A94 C97 L119 R120 R123 C128 Y181	A94-I126 HydrophobicContact CB-CD1 3.98Å; A94-I126 VanDerWaalsContact O-CG2 3.25Å; A94-I126 WeakPolarHBondContact O-CG2 3.3Å; C97-I126 HydrophobicContact CB-CD1 4.11Å; L119-I126 HydrophobicContact CD1-CD1 3.93Å; R120-I126 PolarHBondContact NH1-O 3.34Å; R123-I126 HydrophobicContact CB-CB 4.47Å; R123-I126 HydrophobicContact CB-CD1 3.86Å; R123-I126 HydrophobicContact CB-CG1 3.91Å; R123-I126 HydrophobicContact CB-CG2 3.84Å; R123-I126 HydrophobicContact CG-CD1 4.36Å; R123-I126 HydrophobicContact CG-CG2 4.35Å; I126-C128 PolarHBondContact O-SG 3.16Å; I126-C128 VanDerWaalsContact O-SG 3.39Å; I126-Y181 HydrophobicContact CB-CE1 4.49Å; I126-Y181 HydrophobicContact CG2-CD1 4.42Å; I126-Y181 HydrophobicContact CG2-CE1 3.69Å; I126-Y181 HydrophobicContact CG2-CE2 4.39Å; I126-Y181 WeakPolarHBondContact CG2-OH 3.43Å
127	P	97.6	Very high	95.8	Very high	24 Å²	24	35.8 Å²	35.8	16%	0.156	19%	0.185	C	C	.	.			trans	-61.3	138.4	173.8	22.9	-33.5	0	0	0	111.3	H95 A96 C97 M177 Y181	H95-P127 VanDerWaalsContact O-CD 3.27Å; H95-P127 WeakPolarHBondContact O-CD 3.2Å; H95-P127 WeakPolarHBondContact O-CG 3.4Å; A96-P127 CarbonylContact C-O 3.37Å; A96-P127 VanDerWaalsContact CA-O 3.25Å; A96-P127 WeakPolarHBondContact CA-O 3.4Å; A96-P127 HydrophobicContact CB-CG 3.97Å; C97-P127 PolarHBondContact N-O 3.3Å; P127-M177 HydrophobicContact CB-CB 3.93Å; P127-M177 HydrophobicContact CB-CE 3.62Å; P127-M177 HydrophobicContact CG-CB 4.04Å; P127-Y181 HydrophobicContact CG-CG 4.37Å
128	C	98	Very high	95.8	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.014	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142	178.8	-59.9	0	0	0	0	110.6	C97 M99 L119 I126 L154 P155	C97-C128 HydrophobicContact CB-CB 4.46Å; C97-C128 CarbonylContact O-C 3.52Å; C97-C128 VanDerWaalsContact O-CA 3.3Å; C97-C128 WeakPolarHBondContact O-CA 3.37Å; M99-C128 HydrophobicContact CE-CB 4.1Å; L119-C128 WeakPolarHBondContact CD2-SG 3.39Å; I126-C128 PolarHBondContact O-SG 3.16Å; I126-C128 VanDerWaalsContact O-SG 3.39Å; C128-L154 HydrophobicContact CB-CD1 4.17Å; C128-L154 HydrophobicContact CB-CD2 4Å; C128-P155 WeakPolarHBondContact O-CD 3.32Å
129	V	98.4	Very high	95.9	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.3	170	-58.7	0	0	0	0	110.2	C97 I98 M99 V131 P155 Y157 M170 T174 M177	C97-V129 PolarHBondContact O-N 2.94Å; I98-V129 HydrophobicContact CB-CG2 4.19Å; I98-V129 HydrophobicContact CG1-CG2 3.91Å; I98-V129 HydrophobicContact CG2-CG2 4.12Å; M99-V129 PolarHBondContact N-O 2.79Å; V129-V131 HydrophobicContact CG2-CG2 4.21Å; V129-P155 HydrophobicContact CG1-CB 4.25Å; V129-P155 HydrophobicContact CG1-CG 4.32Å; V129-Y157 HydrophobicContact CB-CD2 4.15Å; V129-Y157 HydrophobicContact CB-CE2 4.09Å; V129-Y157 HydrophobicContact CG1-CD2 4.49Å; V129-Y157 HydrophobicContact CG1-CE2 3.93Å; V129-M170 HydrophobicContact CG2-SD 4.33Å; V129-T174 HydrophobicContact CG2-CG2 4.43Å; V129-T174 WeakPolarHBondContact CG2-OG1 3.27Å; V129-M177 HydrophobicContact CG1-CE 4.48Å; V129-M177 HydrophobicContact CG1-SD 3.81Å
130	V	98.6	Very high	95.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.7	172.5	-175.6	0	0	0	0	108.7	M99 F101 L112 F148 A149 L154 P155 L156 Y157	M99-V130 HydrophobicContact CE-CG2 3.99Å; M99-V130 CarbonylContact O-C 3.57Å; M99-V130 WeakPolarHBondContact O-CA 3.45Å; F101-V130 HydrophobicContact CD1-CG1 4.13Å; F101-V130 HydrophobicContact CE1-CG1 3.93Å; L112-V130 HydrophobicContact CD1-CG1 3.9Å; V130-F148 HydrophobicContact CG2-CD1 3.99Å; V130-F148 HydrophobicContact CG2-CE1 3.96Å; V130-A149 HydrophobicContact CB-CB 4.08Å; V130-A149 HydrophobicContact CG2-CB 3.83Å; V130-L154 HydrophobicContact CG2-CB 4.08Å; V130-L154 HydrophobicContact CG2-CD1 3.99Å; V130-P155 PolarHBondContact N-O 3.27Å; V130-L156 HydrophobicContact CB-CD1 3.88Å; V130-L156 HydrophobicContact CG1-CD1 3.63Å; V130-L156 CarbonylContact O-C 3.57Å; V130-L156 WeakPolarHBondContact O-CA 3.3Å; V130-Y157 PolarHBondContact O-N 2.76Å
131	V	98.6	Very high	95.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	112.6	-176	179.2	0	0	0	0	110	L37 I98 M99 V100 F101 V129 N133 Y157 V159 M170	L37-V131 HydrophobicContact CD1-CG1 4.06Å; I98-V131 HydrophobicContact CG2-CB 4.33Å; I98-V131 HydrophobicContact CG2-CG2 3.51Å; M99-V131 PolarHBondContact O-N 3.46Å; V100-V131 WeakPolarHBondContact CA-O 3.35Å; V100-V131 HydrophobicContact CG1-CB 4.45Å; V100-V131 HydrophobicContact CG1-CG1 4.31Å; V100-V131 HydrophobicContact CG2-CB 4.19Å; F101-V131 VanDerWaalsContact CD1-O 3.29Å; F101-V131 WeakPolarHBondContact CD1-O 3.28Å; F101-V131 PolarHBondContact N-O 2.91Å; V129-V131 HydrophobicContact CG2-CG2 4.21Å; V131-N133 PolarHBondContact O-N 3.13Å; V131-Y157 CarbonylContact C-O 3.59Å; V131-Y157 WeakPolarHBondContact CA-O 3.33Å; V131-V159 HydrophobicContact CG1-CB 4.3Å; V131-V159 HydrophobicContact CG1-CG1 4.08Å; V131-V159 HydrophobicContact CG1-CG2 3.2Å; V131-M170 HydrophobicContact CG2-CE 4.19Å; V131-M170 HydrophobicContact CG2-CG 3.91Å; V131-M170 HydrophobicContact CG2-SD 3.9Å
132	A	98.5	Very high	95.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	96.1	170.6	0	0	0	0	0	108.7	F101 V103 I135 L156 Y157 F158 V159	F101-A132 HydrophobicContact CD1-CB 4.5Å; F101-A132 HydrophobicContact CE1-CB 3.59Å; F101-A132 HydrophobicContact CE2-CB 4.13Å; F101-A132 HydrophobicContact CZ-CB 3.37Å; V103-A132 HydrophobicContact CG1-CB 3.71Å; A132-I135 WeakPolarHBondContact O-CG2 3.43Å; A132-L156 HydrophobicContact CB-CD1 4.27Å; A132-Y157 PolarHBondContact N-O 2.79Å; A132-F158 HydrophobicContact CB-CD1 3.55Å; A132-F158 HydrophobicContact CB-CE1 3.82Å; A132-F158 HydrophobicContact CB-CG 4.41Å; A132-V159 PolarHBondContact O-N 3.39Å
133	N	98.5	Very high	96.1	Very high	2 Å²	2	44 Å²	44	1%	0.011	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	161.3	-176.9	-169.8	31.3	0	0	0	112.3	V32 L37 V100 F101 V103 V131 V159 A161	V32-N133 PolarHBondContact O-ND2 3.16Å; L37-N133 HydrophobicContact CD1-CB 4.44Å; V100-N133 HydrophobicContact CG1-CB 3.85Å; F101-N133 PolarHBondContact O-N 3.42Å; V103-N133 WeakPolarHBondContact CG1-O 3.43Å; V103-N133 VanDerWaalsContact CG2-O 3.32Å; V103-N133 WeakPolarHBondContact CG2-O 3.29Å; V103-N133 PolarHBondContact N-O 2.85Å; V103-N133 VanDerWaalsContact N-O 3.09Å; V131-N133 PolarHBondContact O-N 3.13Å; N133-V159 CarbonylContact C-O 3.53Å; N133-V159 WeakPolarHBondContact CA-O 3.25Å; N133-V159 HydrophobicContact CB-CG2 4Å; N133-V159 PolarHBondContact OD1-O 3.21Å; N133-A161 PolarHBondContact OD1-N 3.05Å; N133-A161 VanDerWaalsContact OD1-N 3.15Å
134	K	97.9	Very high	96	Very high	55 Å²	55	50.3 Å²	50.3	24%	0.239	25%	0.251	C	S	.	.			trans	70.3	34.6	179.1	-45.6	-170.3	-168.1	169.8	0	114.4	A31 D102 V103 D136 A137 V159	A31-K134 WeakPolarHBondContact O-CE 3.09Å; A31-K134 PolarHBondContact O-NZ 2.91Å; D102-K134 WeakPolarHBondContact OD2-CD 3.1Å; D102-K134 WeakPolarHBondContact OD2-CE 3.39Å; D102-K134 IonicContact OD2-NZ 2.72Å; D102-K134 PolarHBondContact OD2-NZ 2.63Å; V103-K134 HydrophobicContact CG2-CB 4.43Å; V103-K134 VanDerWaalsContact CG2-O 3.27Å; V103-K134 WeakPolarHBondContact CG2-O 3.07Å; K134-D136 VanDerWaalsContact C-OD1 3.27Å; K134-D136 VanDerWaalsContact CA-OD1 3.25Å; K134-D136 WeakPolarHBondContact CA-OD1 3.21Å; K134-D136 PolarHBondContact O-N 2.64Å; K134-A137 PolarHBondContact O-N 2.98Å; K134-V159 PolarHBondContact N-O 3.46Å; K134-V159 VanDerWaalsContact N-O 3.14Å
135	I	98	Very high	95.9	Very high	2 Å²	2	53 Å²	53	1%	0.01	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-66.7	-17.6	178.2	69.5	178.4	0	0	0	113.3	V103 A132 A137 D138 M139 V141 T142 F158 V159 T165	V103-I135 HydrophobicContact CG1-CG2 4.22Å; A132-I135 WeakPolarHBondContact O-CG2 3.43Å; I135-A137 PolarHBondContact O-N 3.18Å; I135-D138 CarbonylContact O-C 3.6Å; I135-D138 PolarHBondContact O-N 3.08Å; I135-D138 VanDerWaalsContact O-N 3.14Å; I135-M139 HydrophobicContact CD1-SD 4.02Å; I135-M139 HydrophobicContact CG1-SD 4.26Å; I135-M139 PolarHBondContact O-N 2.69Å; I135-V141 HydrophobicContact CB-CG1 3.91Å; I135-V141 HydrophobicContact CG2-CG1 3.67Å; I135-T142 HydrophobicContact CD1-CG2 4.24Å; I135-F158 HydrophobicContact CD1-CB 4.01Å; I135-F158 HydrophobicContact CG2-CB 4.08Å; I135-F158 HydrophobicContact CG2-CD1 4.02Å; I135-V159 WeakPolarHBondContact CG1-O 3.29Å; I135-V159 PolarHBondContact N-O 2.63Å; I135-T165 HydrophobicContact CD1-CG2 3.92Å
136	D	96.1	Very high	95.8	Very high	75 Å²	75	49.1 Å²	49.1	40%	0.401	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-57.3	-27.4	174.5	52.3	-75.6	0	0	0	112.7	K134 S160	K134-D136 VanDerWaalsContact C-OD1 3.27Å; K134-D136 VanDerWaalsContact CA-OD1 3.25Å; K134-D136 WeakPolarHBondContact CA-OD1 3.21Å; K134-D136 PolarHBondContact O-N 2.64Å; D136-S160 VanDerWaalsContact CG-OG 3.25Å; D136-S160 VanDerWaalsContact OD1-CB 3.22Å; D136-S160 WeakPolarHBondContact OD1-CB 3.48Å; D136-S160 PolarHBondContact OD1-OG 2.8Å
137	A	95.5	Very high	95.8	Very high	54 Å²	54	52.7 Å²	52.7	45%	0.446	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-72.4	-31.8	177.5	0	0	0	0	0	113.8	Q104 K134 I135	Q104-A137 HydrophobicContact CG-CB 3.98Å; K134-A137 PolarHBondContact O-N 2.98Å; I135-A137 PolarHBondContact O-N 3.18Å
138	D	94.8	Very high	95.8	Very high	62 Å²	62	52.3 Å²	52.3	33%	0.332	26%	0.259	S	S	.	.			trans	-159	97.3	174.8	177.1	15.8	0	0	0	110.2	I135 K140 V141 R144	I135-D138 CarbonylContact O-C 3.6Å; I135-D138 PolarHBondContact O-N 3.08Å; I135-D138 VanDerWaalsContact O-N 3.14Å; D138-K140 PolarHBondContact O-N 2.94Å; D138-K140 WeakPolarHBondContact OD1-CB 3.42Å; D138-K140 WeakPolarHBondContact OD1-CG 3.32Å; D138-K140 PolarHBondContact OD1-N 2.8Å; D138-V141 WeakPolarHBondContact O-CB 3.15Å; D138-V141 WeakPolarHBondContact O-CG1 3.5Å; D138-V141 PolarHBondContact O-N 3.32Å; D138-R144 IonicContact OD2-NH2 3.29Å; D138-R144 PolarHBondContact OD2-NH2 2.55Å
139	M	93.8	Very high	95.7	Very high	99 Å²	99	52.3 Å²	52.3	49%	0.488	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-60.8	-20.8	-178.5	-160.9	64.7	66.5	0	0	113.1	I135 V141 T142	I135-M139 HydrophobicContact CD1-SD 4.02Å; I135-M139 HydrophobicContact CG1-SD 4.26Å; I135-M139 PolarHBondContact O-N 2.69Å; M139-V141 PolarHBondContact O-N 3.04Å; M139-V141 VanDerWaalsContact O-N 3.11Å; M139-T142 WeakPolarHBondContact O-CB 3.22Å; M139-T142 WeakPolarHBondContact O-CG2 3.26Å; M139-T142 PolarHBondContact O-N 2.87Å; M139-T142 VanDerWaalsContact O-N 3.1Å; M139-T142 PolarHBondContact O-OG1 3.09Å; M139-T142 HydrophobicContact SD-CG2 4.01Å
140	K	94.6	Very high	95.5	Very high	160 Å²	160	60.1 Å²	60.1	70%	0.696	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-63	-17.8	175.8	-59.7	175.2	-179.3	174.2	0	112	D138 T142 Q143	D138-K140 PolarHBondContact O-N 2.94Å; D138-K140 WeakPolarHBondContact OD1-CB 3.42Å; D138-K140 WeakPolarHBondContact OD1-CG 3.32Å; D138-K140 PolarHBondContact OD1-N 2.8Å; K140-T142 PolarHBondContact O-N 3.24Å; K140-Q143 PolarHBondContact O-N 3.13Å; K140-Q143 VanDerWaalsContact O-N 3.1Å
141	V	93.6	Very high	95.4	Very high	3 Å²	3	68.1 Å²	68.1	2%	0.018	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-59.7	-27.7	174.3	78	0	0	0	0	112.8	V103 I135 D138 M139 Q143 R144 F146 F158	V103-V141 HydrophobicContact CB-CB 4.42Å; V103-V141 HydrophobicContact CB-CG1 4.24Å; V103-V141 HydrophobicContact CB-CG2 3.69Å; V103-V141 HydrophobicContact CG1-CG1 4.13Å; V103-V141 HydrophobicContact CG1-CG2 3.85Å; V103-V141 HydrophobicContact CG2-CG1 4.19Å; V103-V141 HydrophobicContact CG2-CG2 4.39Å; I135-V141 HydrophobicContact CB-CG1 3.91Å; I135-V141 HydrophobicContact CG2-CG1 3.67Å; D138-V141 WeakPolarHBondContact O-CB 3.15Å; D138-V141 WeakPolarHBondContact O-CG1 3.5Å; D138-V141 PolarHBondContact O-N 3.32Å; M139-V141 PolarHBondContact O-N 3.04Å; M139-V141 VanDerWaalsContact O-N 3.11Å; V141-Q143 PolarHBondContact O-N 2.77Å; V141-R144 WeakPolarHBondContact O-CB 3.47Å; V141-R144 PolarHBondContact O-N 3.26Å; V141-F146 HydrophobicContact CG2-CE2 4.06Å; V141-F146 HydrophobicContact CG2-CZ 3.71Å; V141-F158 WeakPolarHBondContact O-CE1 3.49Å
142	T	94.2	Very high	95.4	Very high	41 Å²	41	72 Å²	72	25%	0.252	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-63.8	-20.5	177.3	61.9	0	0	0	0	113.1	I135 M139 K140 F158	I135-T142 HydrophobicContact CD1-CG2 4.24Å; M139-T142 WeakPolarHBondContact O-CB 3.22Å; M139-T142 WeakPolarHBondContact O-CG2 3.26Å; M139-T142 PolarHBondContact O-N 2.87Å; M139-T142 VanDerWaalsContact O-N 3.1Å; M139-T142 PolarHBondContact O-OG1 3.09Å; M139-T142 HydrophobicContact SD-CG2 4.01Å; K140-T142 PolarHBondContact O-N 3.24Å; T142-F158 HydrophobicContact CG2-CB 3.98Å; T142-F158 HydrophobicContact CG2-CD1 4.14Å; T142-F158 HydrophobicContact CG2-CD2 4.47Å; T142-F158 HydrophobicContact CG2-CG 3.95Å
143	Q	94.1	Very high	95.3	Very high	171 Å²	171	75.2 Å²	75.2	80%	0.799	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-93	-5.1	176.3	-56	-61.1	-17.4	0	0	112.8	K140 V141	K140-Q143 PolarHBondContact O-N 3.13Å; K140-Q143 VanDerWaalsContact O-N 3.1Å; V141-Q143 PolarHBondContact O-N 2.77Å
144	R	91.9	Very high	95.2	Very high	139 Å²	139	76.1 Å²	76.1	53%	0.525	38%	0.384	S	S	.	.	S	Bend	trans	-80.1	146.1	178.5	-62.6	-175.7	-167.7	177.5	5.7	110.2	D138 V141 F146	D138-R144 IonicContact OD2-NH2 3.29Å; D138-R144 PolarHBondContact OD2-NH2 2.55Å; V141-R144 WeakPolarHBondContact O-CB 3.47Å; V141-R144 PolarHBondContact O-N 3.26Å; R144-F146 HydrophobicContact CB-CE2 3.86Å; R144-F146 HydrophobicContact CB-CZ 4.26Å; R144-F146 WeakPolarHBondContact O-CD2 3.44Å
145	N	90.1	Very high	95.2	Very high	114 Å²	114	75.8 Å²	75.8	61%	0.61	39%	0.388	S	S	*	.			trans	-88.5	120.3	177.2	-173.6	13	0	0	0	111.3	N147	N145-N147 PolarHBondContact ND2-OD1 2.94Å; N145-N147 PolarHBondContact OD1-OD1 2.67Å
146	F	93.4	Very high	95.2	Very high	27 Å²	27	78.2 Å²	78.2	12%	0.118	40%	0.4	C	S	.	.			trans	-107.5	89.9	175.2	-66	-85.4	0	0	0	110.1	F101 Y109 V141 R144 F148 L156 F158	F101-F146 HydrophobicContact CE2-CD1 4.03Å; F101-F146 AromaticContact CE2-CE1 3.55Å; F101-F146 HydrophobicContact CE2-CE1 3.55Å; F101-F146 HydrophobicContact CE2-CZ 4.08Å; F101-F146 AromaticContact CZ-CD1 3.61Å; F101-F146 HydrophobicContact CZ-CD1 3.61Å; F101-F146 AromaticContact CZ-CE1 3.53Å; F101-F146 HydrophobicContact CZ-CE1 3.53Å; F101-F146 HydrophobicContact CZ-CE2 4.49Å; F101-F146 HydrophobicContact CZ-CG 4.12Å; F101-F146 AromaticContact CZ-CZ 3.99Å; F101-F146 HydrophobicContact CZ-CZ 3.99Å; Y109-F146 AromaticContact CD2-CD1 3.77Å; Y109-F146 HydrophobicContact CD2-CD1 3.77Å; Y109-F146 HydrophobicContact CD2-CE1 4.38Å; Y109-F146 HydrophobicContact CE1-CD1 4.4Å; Y109-F146 HydrophobicContact CE2-CB 3.91Å; Y109-F146 AromaticContact CE2-CD1 3.53Å; Y109-F146 HydrophobicContact CE2-CD1 3.53Å; Y109-F146 HydrophobicContact CE2-CG 4.18Å; Y109-F146 HydrophobicContact CG-CD1 4.3Å; Y109-F146 AromaticContact CZ-CD1 3.86Å; V141-F146 HydrophobicContact CG2-CE2 4.06Å; V141-F146 HydrophobicContact CG2-CZ 3.71Å; R144-F146 HydrophobicContact CB-CE2 3.86Å; R144-F146 HydrophobicContact CB-CZ 4.26Å; R144-F146 WeakPolarHBondContact O-CD2 3.44Å; F146-F148 PolarHBondContact O-N 3.27Å; F146-F148 VanDerWaalsContact O-N 3.14Å; F146-L156 HydrophobicContact CB-CD2 3.85Å; F146-L156 HydrophobicContact CD2-CD2 4.11Å; F146-L156 HydrophobicContact CG-CD2 4.35Å; F146-F158 AromaticContact CD2-CE1 3.93Å; F146-F158 HydrophobicContact CD2-CE1 3.93Å; F146-F158 AromaticContact CD2-CZ 3.84Å; F146-F158 HydrophobicContact CD2-CZ 3.84Å; F146-F158 AromaticContact CE2-CE1 3.58Å; F146-F158 HydrophobicContact CE2-CE1 3.58Å; F146-F158 AromaticContact CE2-CZ 3.88Å; F146-F158 HydrophobicContact CE2-CZ 3.88Å
147	N	95.5	Very high	95.3	Very high	75 Å²	75	76.6 Å²	76.6	40%	0.401	39%	0.389	S	S	.	.	H	α-helix	trans	-63.4	-19.8	-172.9	-72.2	-35.3	0	0	0	115.1	Y109 N145 K150 K151	Y109-N147 PolarHBondContact OH-N 3.38Å; N145-N147 PolarHBondContact ND2-OD1 2.94Å; N145-N147 PolarHBondContact OD1-OD1 2.67Å; N147-K150 PolarHBondContact O-N 3.12Å; N147-K151 VanDerWaalsContact O-CB 3.31Å; N147-K151 WeakPolarHBondContact O-CB 3.36Å; N147-K151 VanDerWaalsContact O-CG 3.23Å; N147-K151 WeakPolarHBondContact O-CG 3.44Å; N147-K151 PolarHBondContact O-N 3.43Å
148	F	97.4	Very high	95.5	Very high	16 Å²	16	75.9 Å²	75.9	7%	0.07	38%	0.376	C	S	.	.	H	α-helix	trans	-59.2	-53.1	-178	173.3	-95.7	0	0	0	111.2	M99 Y109 L112 Y116 V130 F146 K150 K151 Q152 L154	M99-F148 HydrophobicContact CE-CE1 3.9Å; M99-F148 HydrophobicContact CE-CZ 4.33Å; Y109-F148 HydrophobicContact CE2-CB 3.82Å; Y109-F148 VanDerWaalsContact OH-CB 3.28Å; Y109-F148 WeakPolarHBondContact OH-CB 3.43Å; Y109-F148 PolarHBondContact OH-N 3.02Å; L112-F148 HydrophobicContact CB-CD1 4.15Å; L112-F148 HydrophobicContact CB-CE1 3.96Å; L112-F148 HydrophobicContact CB-CE2 4.36Å; L112-F148 HydrophobicContact CB-CG 4.46Å; L112-F148 HydrophobicContact CB-CZ 4.07Å; L112-F148 HydrophobicContact CD1-CD1 3.97Å; L112-F148 HydrophobicContact CD1-CE1 4.31Å; Y116-F148 HydrophobicContact CD1-CZ 4.26Å; Y116-F148 AromaticContact CG-CZ 3.93Å; Y116-F148 HydrophobicContact CG-CZ 3.93Å; V130-F148 HydrophobicContact CG2-CD1 3.99Å; V130-F148 HydrophobicContact CG2-CE1 3.96Å; F146-F148 PolarHBondContact O-N 3.27Å; F146-F148 VanDerWaalsContact O-N 3.14Å; F148-K150 VanDerWaalsContact C-N 3.33Å; F148-K150 PolarHBondContact O-N 2.81Å; F148-K151 PolarHBondContact O-N 3.17Å; F148-Q152 HydrophobicContact CD2-CG 4.33Å; F148-Q152 HydrophobicContact CE1-CG 4.44Å; F148-Q152 HydrophobicContact CE2-CG 3.94Å; F148-Q152 HydrophobicContact CZ-CG 3.99Å; F148-Q152 WeakPolarHBondContact O-CG 3.4Å; F148-Q152 PolarHBondContact O-N 2.83Å; F148-L154 HydrophobicContact CE1-CD1 4.35Å
149	A	95.6	Very high	95.6	Very high	3 Å²	3	73 Å²	73	3%	0.025	36%	0.36	C	S	.	.	H	α-helix	trans	-58.7	-46.1	179.2	0	0	0	0	0	111.1	V130 K151 Q152 G153 L154 L156	V130-A149 HydrophobicContact CB-CB 4.08Å; V130-A149 HydrophobicContact CG2-CB 3.83Å; A149-K151 PolarHBondContact O-N 3.4Å; A149-Q152 CarbonylContact O-C 3.55Å; A149-Q152 PolarHBondContact O-N 3.25Å; A149-G153 PolarHBondContact O-N 2.97Å; A149-L154 PolarHBondContact O-N 2.91Å; A149-L156 HydrophobicContact CB-CB 3.94Å
150	K	95	Very high	95.8	Very high	165 Å²	165	68.2 Å²	68.2	72%	0.717	34%	0.337	S	S	*	.	H	α-helix	trans	-61	-44	177.4	-173.9	176.5	-179.7	177.6	0	112.8	N147 F148 Q152 G153	N147-K150 PolarHBondContact O-N 3.12Å; F148-K150 VanDerWaalsContact C-N 3.33Å; F148-K150 PolarHBondContact O-N 2.81Å; K150-Q152 VanDerWaalsContact C-N 3.3Å; K150-Q152 PolarHBondContact O-N 2.81Å; K150-G153 PolarHBondContact O-N 2.77Å
151	K	97.1	Very high	95.8	Very high	167 Å²	167	61.1 Å²	61.1	73%	0.726	31%	0.308	S	S	*	.	H	α-helix	trans	-63.9	-36.7	179	-78.6	178.8	176.7	-168.7	0	112.2	N147 F148 A149	N147-K151 VanDerWaalsContact O-CB 3.31Å; N147-K151 WeakPolarHBondContact O-CB 3.36Å; N147-K151 VanDerWaalsContact O-CG 3.23Å; N147-K151 WeakPolarHBondContact O-CG 3.44Å; N147-K151 PolarHBondContact O-N 3.43Å; F148-K151 PolarHBondContact O-N 3.17Å; A149-K151 PolarHBondContact O-N 3.4Å
152	Q	97	Very high	95.7	Very high	81 Å²	81	64 Å²	64	38%	0.379	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	0.5	-179.4	-59.4	-57.1	-20	0	0	113.3	Y116 F148 A149 K150 L154	Y116-Q152 HydrophobicContact CD1-CG 4.24Å; Y116-Q152 HydrophobicContact CE1-CB 4.31Å; Y116-Q152 HydrophobicContact CE1-CG 3.91Å; Y116-Q152 VanDerWaalsContact CE1-OE1 3.25Å; F148-Q152 HydrophobicContact CD2-CG 4.33Å; F148-Q152 HydrophobicContact CE1-CG 4.44Å; F148-Q152 HydrophobicContact CE2-CG 3.94Å; F148-Q152 HydrophobicContact CZ-CG 3.99Å; F148-Q152 WeakPolarHBondContact O-CG 3.4Å; F148-Q152 PolarHBondContact O-N 2.83Å; A149-Q152 CarbonylContact O-C 3.55Å; A149-Q152 PolarHBondContact O-N 3.25Å; K150-Q152 VanDerWaalsContact C-N 3.3Å; K150-Q152 PolarHBondContact O-N 2.81Å; Q152-L154 VanDerWaalsContact C-N 3.29Å; Q152-L154 HydrophobicContact CB-CD1 3.8Å; Q152-L154 HydrophobicContact CB-CG 3.69Å; Q152-L154 PolarHBondContact O-N 3.16Å
153	G	96.4	Very high	95.6	Very high	68 Å²	68	66.1 Å²	66.1	70%	0.701	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	27.7	-177.1	0	0	0	0	0	114.1	A149 K150	A149-G153 PolarHBondContact O-N 2.97Å; K150-G153 PolarHBondContact O-N 2.77Å
154	L	97.4	Very high	95.5	Very high	21 Å²	21	59.1 Å²	59.1	11%	0.11	32%	0.316	C	S	.	.			trans	-100.6	142.6	-174.8	-53.9	179.5	0	0	0	111.7	M99 Y116 C128 V130 F148 A149 Q152	M99-L154 HydrophobicContact CE-CD1 3.35Å; Y116-L154 HydrophobicContact CD2-CD1 4.23Å; Y116-L154 HydrophobicContact CE2-CD1 3.83Å; C128-L154 HydrophobicContact CB-CD1 4.17Å; C128-L154 HydrophobicContact CB-CD2 4Å; V130-L154 HydrophobicContact CG2-CB 4.08Å; V130-L154 HydrophobicContact CG2-CD1 3.99Å; F148-L154 HydrophobicContact CE1-CD1 4.35Å; A149-L154 PolarHBondContact O-N 2.91Å; Q152-L154 VanDerWaalsContact C-N 3.29Å; Q152-L154 HydrophobicContact CB-CD1 3.8Å; Q152-L154 HydrophobicContact CB-CG 3.69Å; Q152-L154 PolarHBondContact O-N 3.16Å
155	P	98	Very high	95.6	Very high	49 Å²	49	54.8 Å²	54.8	32%	0.318	31%	0.305	S	S	.	.			trans	-59.4	140.9	168.6	-22.7	33.8	0	0	0	111.8	C128 V129 V130 Y157 M177	C128-P155 WeakPolarHBondContact O-CD 3.32Å; V129-P155 HydrophobicContact CG1-CB 4.25Å; V129-P155 HydrophobicContact CG1-CG 4.32Å; V130-P155 PolarHBondContact N-O 3.27Å; P155-Y157 HydrophobicContact CB-CD2 4.49Å; P155-Y157 HydrophobicContact CB-CE2 3.8Å; P155-M177 HydrophobicContact CG-CE 4.28Å
156	L	98.4	Very high	95.9	Very high	52 Å²	52	53 Å²	53	27%	0.272	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.9	174.2	176.5	65.1	0	0	0	110.3	F101 V130 A132 F146 A149 F158	F101-L156 HydrophobicContact CE1-CD1 4.31Å; V130-L156 HydrophobicContact CB-CD1 3.88Å; V130-L156 HydrophobicContact CG1-CD1 3.63Å; V130-L156 CarbonylContact O-C 3.57Å; V130-L156 WeakPolarHBondContact O-CA 3.3Å; A132-L156 HydrophobicContact CB-CD1 4.27Å; F146-L156 HydrophobicContact CB-CD2 3.85Å; F146-L156 HydrophobicContact CD2-CD2 4.11Å; F146-L156 HydrophobicContact CG-CD2 4.35Å; A149-L156 HydrophobicContact CB-CB 3.94Å; L156-F158 HydrophobicContact CD2-CE2 4.09Å; L156-F158 HydrophobicContact CD2-CZ 3.93Å; L156-F158 HydrophobicContact CG-CE2 4.44Å
157	Y	98.4	Very high	96	Very high	42 Å²	42	51.8 Å²	51.8	17%	0.165	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.3	175.1	-66	-87.5	0	0	0	110.9	V129 V130 V131 A132 P155 M170 E173	V129-Y157 HydrophobicContact CB-CD2 4.15Å; V129-Y157 HydrophobicContact CB-CE2 4.09Å; V129-Y157 HydrophobicContact CG1-CD2 4.49Å; V129-Y157 HydrophobicContact CG1-CE2 3.93Å; V130-Y157 PolarHBondContact O-N 2.76Å; V131-Y157 CarbonylContact C-O 3.59Å; V131-Y157 WeakPolarHBondContact CA-O 3.33Å; A132-Y157 PolarHBondContact N-O 2.79Å; P155-Y157 HydrophobicContact CB-CD2 4.49Å; P155-Y157 HydrophobicContact CB-CE2 3.8Å; Y157-M170 HydrophobicContact CD1-CB 4.08Å; Y157-M170 HydrophobicContact CD1-CG 4.26Å; Y157-M170 HydrophobicContact CD2-CB 4.5Å; Y157-M170 HydrophobicContact CD2-CG 3.81Å; Y157-M170 HydrophobicContact CE2-CG 4.44Å; Y157-M170 HydrophobicContact CG-CB 4.02Å; Y157-M170 HydrophobicContact CG-CG 3.7Å; Y157-E173 WeakPolarHBondContact OH-CB 3.36Å
158	F	98.5	Very high	96	Very high	39 Å²	39	51.8 Å²	51.8	17%	0.171	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	119	167.8	-69.2	-76.2	0	0	0	108.9	A132 I135 V141 T142 F146 L156 N166	A132-F158 HydrophobicContact CB-CD1 3.55Å; A132-F158 HydrophobicContact CB-CE1 3.82Å; A132-F158 HydrophobicContact CB-CG 4.41Å; I135-F158 HydrophobicContact CD1-CB 4.01Å; I135-F158 HydrophobicContact CG2-CB 4.08Å; I135-F158 HydrophobicContact CG2-CD1 4.02Å; V141-F158 WeakPolarHBondContact O-CE1 3.49Å; T142-F158 HydrophobicContact CG2-CB 3.98Å; T142-F158 HydrophobicContact CG2-CD1 4.14Å; T142-F158 HydrophobicContact CG2-CD2 4.47Å; T142-F158 HydrophobicContact CG2-CG 3.95Å; F146-F158 AromaticContact CD2-CE1 3.93Å; F146-F158 HydrophobicContact CD2-CE1 3.93Å; F146-F158 AromaticContact CD2-CZ 3.84Å; F146-F158 HydrophobicContact CD2-CZ 3.84Å; F146-F158 AromaticContact CE2-CE1 3.58Å; F146-F158 HydrophobicContact CE2-CE1 3.58Å; F146-F158 AromaticContact CE2-CZ 3.88Å; F146-F158 HydrophobicContact CE2-CZ 3.88Å; L156-F158 HydrophobicContact CD2-CE2 4.09Å; L156-F158 HydrophobicContact CD2-CZ 3.93Å; L156-F158 HydrophobicContact CG-CE2 4.44Å; F158-N166 VanDerWaalsContact O-CB 3.32Å; F158-N166 WeakPolarHBondContact O-CB 3.48Å; F158-N166 PolarHBondContact O-ND2 2.96Å
159	V	98.3	Very high	95.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	158.4	-174.3	-52.8	0	0	0	0	111.9	L37 V131 A132 N133 K134 I135 T165 N166 V167 M170	L37-V159 HydrophobicContact CD1-CG2 4.38Å; L37-V159 HydrophobicContact CD2-CB 4.36Å; L37-V159 HydrophobicContact CD2-CG2 3.65Å; V131-V159 HydrophobicContact CG1-CB 4.3Å; V131-V159 HydrophobicContact CG1-CG1 4.08Å; V131-V159 HydrophobicContact CG1-CG2 3.2Å; A132-V159 PolarHBondContact O-N 3.39Å; N133-V159 CarbonylContact C-O 3.53Å; N133-V159 WeakPolarHBondContact CA-O 3.25Å; N133-V159 HydrophobicContact CB-CG2 4Å; N133-V159 PolarHBondContact OD1-O 3.21Å; K134-V159 PolarHBondContact N-O 3.46Å; K134-V159 VanDerWaalsContact N-O 3.14Å; I135-V159 WeakPolarHBondContact CG1-O 3.29Å; I135-V159 PolarHBondContact N-O 2.63Å; V159-T165 VanDerWaalsContact CA-O 3.26Å; V159-T165 WeakPolarHBondContact CA-O 3.45Å; V159-T165 WeakPolarHBondContact CB-O 3.35Å; V159-N166 HydrophobicContact CG1-CB 4.06Å; V159-V167 HydrophobicContact CB-CG2 4.42Å; V159-M170 HydrophobicContact CG1-CB 4.19Å; V159-M170 HydrophobicContact CG1-CG 4.44Å
160	S	96.9	Very high	96	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.315	C	S	.	.			trans	-129.7	119	161.6	173.4	0	0	0	0	109.8	D136 A162 D163 G164 T165 V167	D136-S160 VanDerWaalsContact CG-OG 3.25Å; D136-S160 VanDerWaalsContact OD1-CB 3.22Å; D136-S160 WeakPolarHBondContact OD1-CB 3.48Å; D136-S160 PolarHBondContact OD1-OG 2.8Å; S160-A162 PolarHBondContact O-N 2.87Å; S160-A162 WeakPolarHBondContact OG-CB 3.4Å; S160-A162 PolarHBondContact OG-N 3.32Å; S160-A162 VanDerWaalsContact OG-N 3.11Å; S160-D163 WeakPolarHBondContact CB-OD1 3.43Å; S160-D163 PolarHBondContact OG-N 3.44Å; S160-D163 PolarHBondContact OG-OD1 2.58Å; S160-G164 CarbonylContact O-C 3.6Å; S160-G164 WeakPolarHBondContact O-CA 3.22Å; S160-G164 PolarHBondContact O-N 3.26Å; S160-T165 PolarHBondContact N-O 3.09Å; S160-T165 PolarHBondContact O-N 2.92Å; S160-V167 VanDerWaalsContact O-CG2 3.29Å; S160-V167 WeakPolarHBondContact O-CG2 3.36Å
161	A	94.2	Very high	96.1	Very high	10 Å²	10	49.3 Å²	49.3	8%	0.083	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.4	168.4	0	0	0	0	0	112.3	K36 L37 R40 N133	K36-A161 HydrophobicContact CB-CB 3.84Å; L37-A161 HydrophobicContact CD2-CB 3.8Å; L37-A161 HydrophobicContact CG-CB 3.99Å; R40-A161 PolarHBondContact NE-O 3.28Å; N133-A161 PolarHBondContact OD1-N 3.05Å; N133-A161 VanDerWaalsContact OD1-N 3.15Å
162	A	92.4	Very high	96	Very high	65 Å²	65	46.3 Å²	46.3	54%	0.537	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-52.5	-174.5	0	0	0	0	0	111.1	R40 S160	R40-A162 PolarHBondContact NH2-O 3.11Å; S160-A162 PolarHBondContact O-N 2.87Å; S160-A162 WeakPolarHBondContact OG-CB 3.4Å; S160-A162 PolarHBondContact OG-N 3.32Å; S160-A162 VanDerWaalsContact OG-N 3.11Å
163	D	91.1	Very high	96	Very high	85 Å²	85	45.6 Å²	45.6	46%	0.455	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-8.6	-179.3	67.8	22.9	0	0	0	114	S160 T165	S160-D163 WeakPolarHBondContact CB-OD1 3.43Å; S160-D163 PolarHBondContact OG-N 3.44Å; S160-D163 PolarHBondContact OG-OD1 2.58Å; D163-T165 VanDerWaalsContact CG-OG1 3.27Å; D163-T165 WeakPolarHBondContact OD1-CB 3.46Å; D163-T165 PolarHBondContact OD1-N 3.15Å; D163-T165 PolarHBondContact OD1-OG1 3.44Å; D163-T165 PolarHBondContact OD2-OG1 2.8Å
164	G	92.4	Very high	96.1	Very high	24 Å²	24	42.4 Å²	42.4	25%	0.247	23%	0.232	C	C	.	.			trans	89.4	0.4	179.1	0	0	0	0	0	115	S160 N166 V167	S160-G164 CarbonylContact O-C 3.6Å; S160-G164 WeakPolarHBondContact O-CA 3.22Å; S160-G164 PolarHBondContact O-N 3.26Å; G164-N166 PolarHBondContact O-N 2.84Å; G164-N166 VanDerWaalsContact O-N 3.15Å; G164-V167 PolarHBondContact O-N 2.89Å; G164-V167 VanDerWaalsContact O-N 3.14Å
165	T	94.9	Very high	96.1	Very high	48 Å²	48	41.6 Å²	41.6	29%	0.294	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	121.6	-178.2	-63.4	0	0	0	0	111.1	I135 V159 S160 D163 V167	I135-T165 HydrophobicContact CD1-CG2 3.92Å; V159-T165 VanDerWaalsContact CA-O 3.26Å; V159-T165 WeakPolarHBondContact CA-O 3.45Å; V159-T165 WeakPolarHBondContact CB-O 3.35Å; S160-T165 PolarHBondContact N-O 3.09Å; S160-T165 PolarHBondContact O-N 2.92Å; D163-T165 VanDerWaalsContact CG-OG1 3.27Å; D163-T165 WeakPolarHBondContact OD1-CB 3.46Å; D163-T165 PolarHBondContact OD1-N 3.15Å; D163-T165 PolarHBondContact OD1-OG1 3.44Å; D163-T165 PolarHBondContact OD2-OG1 2.8Å; T165-V167 PolarHBondContact O-N 2.79Å
166	N	96.5	Very high	96	Very high	76 Å²	76	44.2 Å²	44.2	41%	0.406	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	4.8	178.7	-64.1	-37.8	0	0	0	116.9	F158 V159 G164 K169 M170	F158-N166 VanDerWaalsContact O-CB 3.32Å; F158-N166 WeakPolarHBondContact O-CB 3.48Å; F158-N166 PolarHBondContact O-ND2 2.96Å; V159-N166 HydrophobicContact CG1-CB 4.06Å; G164-N166 PolarHBondContact O-N 2.84Å; G164-N166 VanDerWaalsContact O-N 3.15Å; N166-K169 PolarHBondContact O-N 2.56Å; N166-M170 WeakPolarHBondContact O-CB 3.3Å; N166-M170 PolarHBondContact O-N 3.43Å
167	V	95.6	Very high	96	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-62.2	-53.9	-175.5	175.8	0	0	0	0	111.2	L37 R40 F41 V159 S160 G164 T165 K169 M170 F171	L37-V167 HydrophobicContact CD2-CG1 4.41Å; L37-V167 HydrophobicContact CD2-CG2 3.81Å; R40-V167 HydrophobicContact CB-CG1 4.31Å; R40-V167 HydrophobicContact CG-CB 4.2Å; R40-V167 HydrophobicContact CG-CG1 3.95Å; R40-V167 HydrophobicContact CG-CG2 4.1Å; F41-V167 HydrophobicContact CB-CG1 4.03Å; V159-V167 HydrophobicContact CB-CG2 4.42Å; S160-V167 VanDerWaalsContact O-CG2 3.29Å; S160-V167 WeakPolarHBondContact O-CG2 3.36Å; G164-V167 PolarHBondContact O-N 2.89Å; G164-V167 VanDerWaalsContact O-N 3.14Å; T165-V167 PolarHBondContact O-N 2.79Å; V167-K169 VanDerWaalsContact C-N 3.3Å; V167-K169 PolarHBondContact O-N 2.93Å; V167-M170 PolarHBondContact O-N 3.07Å; V167-F171 HydrophobicContact CG1-CD2 3.77Å; V167-F171 HydrophobicContact CG1-CE2 3.83Å; V167-F171 WeakPolarHBondContact O-CD2 3.13Å; V167-F171 PolarHBondContact O-N 3.21Å
168	V	93.9	Very high	95.9	Very high	75 Å²	75	42.5 Å²	42.5	46%	0.455	23%	0.226	S	C	.	.	H	α-helix	trans	-59.2	-42.4	-179	176.9	0	0	0	0	111.8	F41 K172	F41-V168 HydrophobicContact CD2-CG2 4.44Å; F41-V168 HydrophobicContact CE2-CG1 4.45Å; V168-K172 HydrophobicContact CG1-CD 4.02Å; V168-K172 HydrophobicContact CG1-CG 4.38Å; V168-K172 WeakPolarHBondContact O-CB 3.44Å; V168-K172 WeakPolarHBondContact O-CG 3.48Å; V168-K172 PolarHBondContact O-N 3.3Å
169	K	95.6	Very high	95.7	Very high	131 Å²	131	40.8 Å²	40.8	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-61.7	-49.8	178.6	-177.7	179.6	178.7	-179.3	0	110.9	N166 V167 F171 K172 E173	N166-K169 PolarHBondContact O-N 2.56Å; V167-K169 VanDerWaalsContact C-N 3.3Å; V167-K169 PolarHBondContact O-N 2.93Å; K169-F171 PolarHBondContact O-N 3.16Å; K169-K172 PolarHBondContact O-N 2.93Å; K169-E173 WeakPolarHBondContact O-CG 3.34Å; K169-E173 PolarHBondContact O-N 3.29Å
170	M	97.9	Very high	95.5	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.7	-51.3	-179.6	-179.3	-80	-66	0	0	111.1	I98 V129 V131 Y157 V159 N166 V167 K172 E173 T174	I98-M170 HydrophobicContact CD1-CE 4.38Å; I98-M170 HydrophobicContact CD1-SD 3.94Å; I98-M170 HydrophobicContact CG1-SD 4.36Å; I98-M170 HydrophobicContact CG2-CE 4.33Å; I98-M170 HydrophobicContact CG2-SD 4.09Å; V129-M170 HydrophobicContact CG2-SD 4.33Å; V131-M170 HydrophobicContact CG2-CE 4.19Å; V131-M170 HydrophobicContact CG2-CG 3.91Å; V131-M170 HydrophobicContact CG2-SD 3.9Å; Y157-M170 HydrophobicContact CD1-CB 4.08Å; Y157-M170 HydrophobicContact CD1-CG 4.26Å; Y157-M170 HydrophobicContact CD2-CB 4.5Å; Y157-M170 HydrophobicContact CD2-CG 3.81Å; Y157-M170 HydrophobicContact CE2-CG 4.44Å; Y157-M170 HydrophobicContact CG-CB 4.02Å; Y157-M170 HydrophobicContact CG-CG 3.7Å; V159-M170 HydrophobicContact CG1-CB 4.19Å; V159-M170 HydrophobicContact CG1-CG 4.44Å; N166-M170 WeakPolarHBondContact O-CB 3.3Å; N166-M170 PolarHBondContact O-N 3.43Å; V167-M170 PolarHBondContact O-N 3.07Å; M170-K172 PolarHBondContact O-N 3.08Å; M170-E173 PolarHBondContact O-N 3.14Å; M170-T174 PolarHBondContact O-N 2.96Å; M170-T174 PolarHBondContact O-OG1 3.03Å
171	F	97.3	Very high	95.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-45	179.7	-84.4	-79.4	0	0	0	112.8	L37 M38 F41 F74 I98 V167 K169 E173 T174 I175	L37-F171 HydrophobicContact CB-CE2 3.97Å; L37-F171 HydrophobicContact CB-CZ 4.1Å; L37-F171 WeakPolarHBondContact O-CE2 3.44Å; M38-F171 HydrophobicContact CG-CE1 4.41Å; M38-F171 HydrophobicContact CG-CZ 4.09Å; F41-F171 HydrophobicContact CB-CD2 3.54Å; F41-F171 HydrophobicContact CB-CE2 3.69Å; F41-F171 HydrophobicContact CB-CG 4.05Å; F41-F171 HydrophobicContact CB-CZ 4.31Å; F41-F171 HydrophobicContact CD1-CB 3.98Å; F41-F171 AromaticContact CD1-CD1 3.96Å; F41-F171 HydrophobicContact CD1-CD1 3.96Å; F41-F171 HydrophobicContact CD1-CD2 4.19Å; F41-F171 HydrophobicContact CD1-CE1 4.49Å; F41-F171 AromaticContact CD1-CG 3.8Å; F41-F171 HydrophobicContact CD1-CG 3.8Å; F41-F171 HydrophobicContact CD2-CB 3.52Å; F41-F171 AromaticContact CD2-CD2 3.87Å; F41-F171 HydrophobicContact CD2-CD2 3.87Å; F41-F171 AromaticContact CD2-CG 3.84Å; F41-F171 HydrophobicContact CD2-CG 3.84Å; F41-F171 HydrophobicContact CE1-CB 3.94Å; F41-F171 HydrophobicContact CE1-CD1 4.34Å; F41-F171 HydrophobicContact CE1-CG 4.21Å; F41-F171 HydrophobicContact CE2-CB 3.47Å; F41-F171 VanDerWaalsContact CE2-CB 3.47Å; F41-F171 HydrophobicContact CE2-CG 4.24Å; F41-F171 HydrophobicContact CG-CB 3.78Å; F41-F171 HydrophobicContact CG-CD1 4.2Å; F41-F171 AromaticContact CG-CD2 3.59Å; F41-F171 HydrophobicContact CG-CD2 3.59Å; F41-F171 HydrophobicContact CG-CE2 4.18Å; F41-F171 AromaticContact CG-CG 3.6Å; F41-F171 HydrophobicContact CG-CG 3.6Å; F41-F171 HydrophobicContact CZ-CB 3.69Å; F41-F171 HydrophobicContact CZ-CG 4.42Å; F74-F171 HydrophobicContact CD1-CD1 4.21Å; F74-F171 AromaticContact CD1-CE1 3.91Å; F74-F171 HydrophobicContact CD1-CE1 3.91Å; F74-F171 AromaticContact CE1-CD1 3.42Å; F74-F171 HydrophobicContact CE1-CD1 3.42Å; F74-F171 VanDerWaalsContact CE1-CD1 3.42Å; F74-F171 AromaticContact CE1-CE1 3.6Å; F74-F171 HydrophobicContact CE1-CE1 3.6Å; F74-F171 AromaticContact CZ-CD1 3.6Å; F74-F171 HydrophobicContact CZ-CD1 3.6Å; F74-F171 HydrophobicContact CZ-CE1 4.05Å; I98-F171 HydrophobicContact CD1-CD1 3.86Å; I98-F171 HydrophobicContact CD1-CE1 3.6Å; I98-F171 HydrophobicContact CD1-CZ 4.29Å; V167-F171 HydrophobicContact CG1-CD2 3.77Å; V167-F171 HydrophobicContact CG1-CE2 3.83Å; V167-F171 WeakPolarHBondContact O-CD2 3.13Å; V167-F171 PolarHBondContact O-N 3.21Å; K169-F171 PolarHBondContact O-N 3.16Å; F171-E173 VanDerWaalsContact C-N 3.33Å; F171-E173 PolarHBondContact O-N 3.21Å; F171-T174 PolarHBondContact O-N 3.39Å; F171-I175 VanDerWaalsContact O-CG1 3.22Å; F171-I175 WeakPolarHBondContact O-CG1 3.32Å; F171-I175 PolarHBondContact O-N 2.92Å
172	K	95.5	Very high	95.2	Very high	105 Å²	105	47.4 Å²	47.4	46%	0.457	25%	0.254	S	S	.	.	H	α-helix	trans	-59.8	-42.4	178.1	-77.2	-174.5	176.8	-176.2	0	112.4	V168 K169 M170 I175 K176	V168-K172 HydrophobicContact CG1-CD 4.02Å; V168-K172 HydrophobicContact CG1-CG 4.38Å; V168-K172 WeakPolarHBondContact O-CB 3.44Å; V168-K172 WeakPolarHBondContact O-CG 3.48Å; V168-K172 PolarHBondContact O-N 3.3Å; K169-K172 PolarHBondContact O-N 2.93Å; M170-K172 PolarHBondContact O-N 3.08Å; K172-I175 PolarHBondContact O-N 3.32Å; K172-K176 WeakPolarHBondContact O-CG 3.42Å; K172-K176 PolarHBondContact O-N 3.24Å; K172-K176 VanDerWaalsContact O-N 3.12Å
173	E	97.5	Very high	95	Very high	66 Å²	66	48.6 Å²	48.6	31%	0.308	25%	0.248	S	C	.	.	H	α-helix	trans	-66.9	-40.9	176.6	-67.2	-56.5	128.4	0	0	111.6	Y157 K169 M170 F171 I175 K176 M177	Y157-E173 WeakPolarHBondContact OH-CB 3.36Å; K169-E173 WeakPolarHBondContact O-CG 3.34Å; K169-E173 PolarHBondContact O-N 3.29Å; M170-E173 PolarHBondContact O-N 3.14Å; F171-E173 VanDerWaalsContact C-N 3.33Å; F171-E173 PolarHBondContact O-N 3.21Å; E173-I175 PolarHBondContact O-N 2.84Å; E173-K176 PolarHBondContact O-N 3.33Å; E173-K176 IonicContact OE1-NZ 2.81Å; E173-K176 PolarHBondContact OE1-NZ 2.92Å; E173-M177 WeakPolarHBondContact O-CG 3.25Å; E173-M177 PolarHBondContact O-N 3.27Å
174	T	98.3	Very high	94.7	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-41.2	174.5	-53.7	0	0	0	0	112.5	I24 A96 I98 V129 M170 F171 K176 M177 A178	I24-T174 HydrophobicContact CD1-CG2 4.17Å; I24-T174 HydrophobicContact CG2-CG2 4.03Å; A96-T174 HydrophobicContact CB-CG2 3.93Å; I98-T174 HydrophobicContact CD1-CG2 4.11Å; I98-T174 HydrophobicContact CG1-CG2 3.75Å; V129-T174 HydrophobicContact CG2-CG2 4.43Å; V129-T174 WeakPolarHBondContact CG2-OG1 3.27Å; M170-T174 PolarHBondContact O-N 2.96Å; M170-T174 PolarHBondContact O-OG1 3.03Å; F171-T174 PolarHBondContact O-N 3.39Å; T174-K176 PolarHBondContact O-N 2.77Å; T174-M177 PolarHBondContact O-N 3.14Å; T174-A178 PolarHBondContact O-N 3.09Å
175	I	97.3	Very high	94	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-42.9	177.7	-59.7	159.2	0	0	0	110.6	V22 I24 F41 Y61 T63 I65 V72 F74 F171 K172 E173 M177 A178 M179	V22-I175 HydrophobicContact CG2-CG2 4.42Å; I24-I175 HydrophobicContact CD1-CB 4.34Å; I24-I175 HydrophobicContact CD1-CG1 3.74Å; F41-I175 HydrophobicContact CE1-CD1 4.29Å; F41-I175 HydrophobicContact CZ-CD1 4.04Å; Y61-I175 HydrophobicContact CD1-CD1 4.07Å; Y61-I175 HydrophobicContact CE1-CD1 3.97Å; T63-I175 HydrophobicContact CG2-CG2 4.49Å; I65-I175 HydrophobicContact CD1-CB 4.21Å; I65-I175 HydrophobicContact CD1-CG2 3.31Å; V72-I175 HydrophobicContact CG1-CG1 4.2Å; V72-I175 HydrophobicContact CG2-CD1 4.19Å; V72-I175 HydrophobicContact CG2-CG1 4.15Å; V72-I175 HydrophobicContact CG2-CG2 3.67Å; F74-I175 HydrophobicContact CZ-CD1 4.06Å; F74-I175 HydrophobicContact CZ-CG1 4.11Å; F171-I175 VanDerWaalsContact O-CG1 3.22Å; F171-I175 WeakPolarHBondContact O-CG1 3.32Å; F171-I175 PolarHBondContact O-N 2.92Å; K172-I175 PolarHBondContact O-N 3.32Å; E173-I175 PolarHBondContact O-N 2.84Å; I175-M177 VanDerWaalsContact C-N 3.33Å; I175-M177 PolarHBondContact O-N 2.81Å; I175-A178 WeakPolarHBondContact O-CB 3.34Å; I175-A178 PolarHBondContact O-N 3.45Å; I175-M179 HydrophobicContact CG2-CG 4.45Å; I175-M179 WeakPolarHBondContact O-CG 3.46Å; I175-M179 PolarHBondContact O-N 2.9Å
176	K	96.1	Very high	93	Very high	105 Å²	105	52.7 Å²	52.7	46%	0.457	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-43.5	175	-70.2	173.1	-173.4	170.9	0	112	K172 E173 T174 M179 S180	K172-K176 WeakPolarHBondContact O-CG 3.42Å; K172-K176 PolarHBondContact O-N 3.24Å; K172-K176 VanDerWaalsContact O-N 3.12Å; E173-K176 PolarHBondContact O-N 3.33Å; E173-K176 IonicContact OE1-NZ 2.81Å; E173-K176 PolarHBondContact OE1-NZ 2.92Å; T174-K176 PolarHBondContact O-N 2.77Å; K176-M179 PolarHBondContact O-N 3.39Å; K176-S180 WeakPolarHBondContact O-CB 3.32Å; K176-S180 PolarHBondContact O-N 2.83Å
177	M	96.9	Very high	92.1	Very high	57 Å²	57	49.2 Å²	49.2	28%	0.281	25%	0.254	S	S	.	.	H	α-helix	trans	-61.1	-44.3	175.8	-67.1	174.4	81.4	0	0	111.5	P127 V129 P155 E173 T174 I175 M179 S180 Y181	P127-M177 HydrophobicContact CB-CB 3.93Å; P127-M177 HydrophobicContact CB-CE 3.62Å; P127-M177 HydrophobicContact CG-CB 4.04Å; V129-M177 HydrophobicContact CG1-CE 4.48Å; V129-M177 HydrophobicContact CG1-SD 3.81Å; P155-M177 HydrophobicContact CG-CE 4.28Å; E173-M177 WeakPolarHBondContact O-CG 3.25Å; E173-M177 PolarHBondContact O-N 3.27Å; T174-M177 PolarHBondContact O-N 3.14Å; I175-M177 VanDerWaalsContact C-N 3.33Å; I175-M177 PolarHBondContact O-N 2.81Å; M177-M179 PolarHBondContact O-N 2.87Å; M177-S180 PolarHBondContact O-N 2.92Å; M177-Y181 WeakPolarHBondContact O-CB 3.43Å; M177-Y181 PolarHBondContact O-N 2.82Å
178	A	96.8	Very high	91.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-44.8	177.6	0	0	0	0	0	112.1	V22 I24 H95 A96 T174 I175 Y181 K182	V22-A178 HydrophobicContact CB-CB 4.29Å; V22-A178 HydrophobicContact CG1-CB 4.42Å; I24-A178 HydrophobicContact CD1-CB 4.22Å; I24-A178 HydrophobicContact CG1-CB 4.15Å; H95-A178 HydrophobicContact CB-CB 4.04Å; A96-A178 HydrophobicContact CB-CB 3.71Å; T174-A178 PolarHBondContact O-N 3.09Å; I175-A178 WeakPolarHBondContact O-CB 3.34Å; I175-A178 PolarHBondContact O-N 3.45Å; A178-Y181 PolarHBondContact O-N 2.77Å; A178-K182 WeakPolarHBondContact O-CB 3.19Å; A178-K182 PolarHBondContact O-N 2.83Å
179	M	95.1	Very high	90.5	Very high	4 Å²	4	56 Å²	56	2%	0.02	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-46.7	176.6	-74.8	-64.6	-65.3	0	0	112	E20 V22 I65 V70 I175 K176 M177 Y181 K182 Q183	E20-M179 HydrophobicContact CB-CE 3.97Å; E20-M179 HydrophobicContact CB-SD 4.35Å; E20-M179 HydrophobicContact CG-CE 4.06Å; V22-M179 HydrophobicContact CB-SD 4.49Å; V22-M179 HydrophobicContact CG1-CG 4.21Å; V22-M179 HydrophobicContact CG1-SD 3.44Å; V22-M179 WeakPolarHBondContact CG1-SD 3.46Å; V22-M179 HydrophobicContact CG2-SD 4.23Å; I65-M179 HydrophobicContact CD1-CG 3.98Å; V70-M179 HydrophobicContact CB-SD 4.37Å; V70-M179 HydrophobicContact CG1-CE 4.43Å; V70-M179 HydrophobicContact CG1-CG 4.39Å; V70-M179 HydrophobicContact CG1-SD 3.56Å; V70-M179 VanDerWaalsContact CG1-SD 3.56Å; V70-M179 HydrophobicContact CG2-CE 3.58Å; V70-M179 HydrophobicContact CG2-SD 3.81Å; I175-M179 HydrophobicContact CG2-CG 4.45Å; I175-M179 WeakPolarHBondContact O-CG 3.46Å; I175-M179 PolarHBondContact O-N 2.9Å; K176-M179 PolarHBondContact O-N 3.39Å; M177-M179 PolarHBondContact O-N 2.87Å; M179-Y181 VanDerWaalsContact C-N 3.3Å; M179-Y181 PolarHBondContact O-N 3.02Å; M179-K182 PolarHBondContact O-N 2.99Å; M179-Q183 WeakPolarHBondContact O-CG 3.17Å; M179-Q183 PolarHBondContact O-N 3.12Å
180	S	93.8	Very high	89.7	Confident	67 Å²	67	50.5 Å²	50.5	47%	0.469	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-40.5	177.5	-175.9	0	0	0	0	111.6	K176 M177 N184	K176-S180 WeakPolarHBondContact O-CB 3.32Å; K176-S180 PolarHBondContact O-N 2.83Å; M177-S180 PolarHBondContact O-N 2.92Å; S180-N184 WeakPolarHBondContact O-CB 3.5Å; S180-N184 PolarHBondContact O-N 3.47Å; S180-N184 PolarHBondContact O-ND2 3.26Å
181	Y	94.1	Very high	88.8	Confident	26 Å²	26	55.7 Å²	55.7	10%	0.102	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-50.1	175.1	175.1	-94.2	0	0	0	110.6	R123 E125 I126 P127 M177 A178 M179 Q183 N184 S185 D187 D190	R123-Y181 PolarHBondContact NH2-OH 2.84Å; E125-Y181 HydrophobicContact CB-CE2 3.96Å; I126-Y181 HydrophobicContact CB-CE1 4.49Å; I126-Y181 HydrophobicContact CG2-CD1 4.42Å; I126-Y181 HydrophobicContact CG2-CE1 3.69Å; I126-Y181 HydrophobicContact CG2-CE2 4.39Å; I126-Y181 WeakPolarHBondContact CG2-OH 3.43Å; P127-Y181 HydrophobicContact CG-CG 4.37Å; M177-Y181 WeakPolarHBondContact O-CB 3.43Å; M177-Y181 PolarHBondContact O-N 2.82Å; A178-Y181 PolarHBondContact O-N 2.77Å; M179-Y181 VanDerWaalsContact C-N 3.3Å; M179-Y181 PolarHBondContact O-N 3.02Å; Y181-Q183 VanDerWaalsContact C-N 3.25Å; Y181-Q183 PolarHBondContact O-N 3.33Å; Y181-N184 PolarHBondContact O-N 3.35Å; Y181-N184 VanDerWaalsContact O-N 3.16Å; Y181-S185 WeakPolarHBondContact O-CA 3.47Å; Y181-S185 WeakPolarHBondContact O-CB 3.29Å; Y181-S185 PolarHBondContact O-N 2.84Å; Y181-D187 WeakPolarHBondContact OH-CB 3.39Å; Y181-D187 PolarHBondContact OH-OD2 3.46Å; Y181-D190 VanDerWaalsContact CE1-OD2 3.27Å; Y181-D190 WeakPolarHBondContact CE1-OD2 3.45Å; Y181-D190 PolarHBondContact OH-OD2 3.13Å
182	K	90.9	Very high	87.9	Confident	56 Å²	56	57.9 Å²	57.9	24%	0.243	29%	0.294	C	S	.	.	H	α-helix	trans	-54.2	-41.3	179.6	-168.4	-179.6	-178	-165.9	0	113	E20 Q21 V22 A178 M179	E20-K182 WeakPolarHBondContact OE2-CE 3.35Å; E20-K182 IonicContact OE2-NZ 2.78Å; E20-K182 PolarHBondContact OE2-NZ 3.15Å; Q21-K182 WeakPolarHBondContact O-CE 3.47Å; Q21-K182 PolarHBondContact O-NZ 2.99Å; V22-K182 HydrophobicContact CG1-CB 4.4Å; V22-K182 HydrophobicContact CG1-CD 3.9Å; A178-K182 WeakPolarHBondContact O-CB 3.19Å; A178-K182 PolarHBondContact O-N 2.83Å; M179-K182 PolarHBondContact O-N 2.99Å
183	Q	87.3	Confident	87	Confident	89 Å²	89	54 Å²	54	42%	0.416	28%	0.278	S	S	.	.	H	α-helix	trans	-75.1	-29.2	-176.9	-70.5	174.9	10.1	0	0	114	M179 Y181	M179-Q183 WeakPolarHBondContact O-CG 3.17Å; M179-Q183 PolarHBondContact O-N 3.12Å; Y181-Q183 VanDerWaalsContact C-N 3.25Å; Y181-Q183 PolarHBondContact O-N 3.33Å
184	N	85.1	Confident	86.2	Confident	120 Å²	120	56.6 Å²	56.6	64%	0.642	29%	0.285	S	S	*	.	H	α-helix	trans	-117.5	-4.1	-170.9	-58.5	-70.8	0	0	0	113.8	S180 Y181 S186	S180-N184 WeakPolarHBondContact O-CB 3.5Å; S180-N184 PolarHBondContact O-N 3.47Å; S180-N184 PolarHBondContact O-ND2 3.26Å; Y181-N184 PolarHBondContact O-N 3.35Å; Y181-N184 VanDerWaalsContact O-N 3.16Å; N184-S186 PolarHBondContact O-N 3.14Å
185	S	77.5	Confident	85.3	Confident	16 Å²	16	61.7 Å²	61.7	11%	0.112	31%	0.308	C	S	.	.			trans	-64.5	126.7	-176.2	176.5	0	0	0	0	110.9	Y181 D187 D190 R194	Y181-S185 WeakPolarHBondContact O-CA 3.47Å; Y181-S185 WeakPolarHBondContact O-CB 3.29Å; Y181-S185 PolarHBondContact O-N 2.84Å; S185-D187 WeakPolarHBondContact OG-CB 3.25Å; S185-D187 PolarHBondContact OG-N 2.77Å; S185-D187 VanDerWaalsContact OG-N 3.08Å; S185-D190 WeakPolarHBondContact CB-OD2 3.41Å; S185-D190 PolarHBondContact OG-OD2 2.74Å; S185-R194 PolarHBondContact O-NH2 3.45Å
186	S	73.6	Confident	84.4	Confident	107 Å²	107	65.6 Å²	65.6	75%	0.748	33%	0.329	S	S	*	.			trans	-106.6	21.1	163.1	63.8	0	0	0	0	111	N184 F188	N184-S186 PolarHBondContact O-N 3.14Å; S186-F188 PolarHBondContact O-N 2.57Å
187	D	78.5	Confident	83.6	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.021	32%	0.324	C	S	.	.			trans	-58.4	127.6	178.2	-173.6	-25.7	0	0	0	108.2	E125 Y181 S185 M189 D190 E191	E125-D187 HydrophobicContact CB-CB 4.45Å; Y181-D187 WeakPolarHBondContact OH-CB 3.39Å; Y181-D187 PolarHBondContact OH-OD2 3.46Å; S185-D187 WeakPolarHBondContact OG-CB 3.25Å; S185-D187 PolarHBondContact OG-N 2.77Å; S185-D187 VanDerWaalsContact OG-N 3.08Å; D187-M189 PolarHBondContact O-N 3.4Å; D187-M189 VanDerWaalsContact O-N 3.16Å; D187-M189 WeakPolarHBondContact OD1-CB 3.46Å; D187-M189 PolarHBondContact OD1-N 3.2Å; D187-D190 HydrophobicContact CB-CB 4.25Å; D187-D190 WeakPolarHBondContact O-CA 3.35Å; D187-D190 WeakPolarHBondContact O-CB 3.23Å; D187-D190 PolarHBondContact O-N 3.49Å; D187-E191 PolarHBondContact O-N 3.19Å
188	F	77.5	Confident	82.7	Confident	141 Å²	141	65.9 Å²	65.9	62%	0.618	33%	0.334	S	S	*	.	H	α-helix	trans	-53	-37.8	178.4	174.5	-103.2	0	0	0	111.6	S186 D190 E191 V192	S186-F188 PolarHBondContact O-N 2.57Å; F188-D190 VanDerWaalsContact C-N 3.28Å; F188-D190 PolarHBondContact O-N 3.19Å; F188-E191 PolarHBondContact O-N 3.1Å; F188-V192 HydrophobicContact CD1-CG2 4.11Å; F188-V192 HydrophobicContact CD2-CG2 4.28Å; F188-V192 HydrophobicContact CE1-CG2 3.65Å; F188-V192 HydrophobicContact CE2-CG2 3.84Å; F188-V192 HydrophobicContact CG-CG2 4.42Å; F188-V192 HydrophobicContact CZ-CG2 3.5Å; F188-V192 VanDerWaalsContact O-CG2 3.3Å; F188-V192 WeakPolarHBondContact O-CG2 3.08Å; F188-V192 PolarHBondContact O-N 2.85Å
189	M	77.3	Confident	81.7	Confident	77 Å²	77	71.5 Å²	71.5	38%	0.379	36%	0.359	S	S	.	.	H	α-helix	trans	-65.1	-33.7	176.5	-68.4	-62	-68.3	0	0	111.6	D187 M193	D187-M189 PolarHBondContact O-N 3.4Å; D187-M189 VanDerWaalsContact O-N 3.16Å; D187-M189 WeakPolarHBondContact OD1-CB 3.46Å; D187-M189 PolarHBondContact OD1-N 3.2Å; M189-M193 WeakPolarHBondContact O-CB 3.44Å; M189-M193 WeakPolarHBondContact O-CG 3.4Å; M189-M193 PolarHBondContact O-N 3.05Å; M189-M193 VanDerWaalsContact O-N 3.16Å
190	D	79.4	Confident	80.8	Confident	17 Å²	17	77.3 Å²	77.3	9%	0.091	39%	0.386	C	S	.	.	H	α-helix	trans	-73.8	-35.7	174.8	-71	-21.3	0	0	0	112	R123 Y181 S185 D187 F188 M193 R194	R123-D190 IonicContact CZ-OD1 3.17Å; R123-D190 IonicContact NH1-OD1 2.77Å; R123-D190 PolarHBondContact NH1-OD1 2.71Å; R123-D190 VanDerWaalsContact NH2-CG 3.31Å; R123-D190 IonicContact NH2-OD1 2.67Å; R123-D190 PolarHBondContact NH2-OD1 3.1Å; R123-D190 IonicContact NH2-OD2 3.27Å; R123-D190 PolarHBondContact NH2-OD2 3.11Å; Y181-D190 VanDerWaalsContact CE1-OD2 3.27Å; Y181-D190 WeakPolarHBondContact CE1-OD2 3.45Å; Y181-D190 PolarHBondContact OH-OD2 3.13Å; S185-D190 WeakPolarHBondContact CB-OD2 3.41Å; S185-D190 PolarHBondContact OG-OD2 2.74Å; D187-D190 HydrophobicContact CB-CB 4.25Å; D187-D190 WeakPolarHBondContact O-CA 3.35Å; D187-D190 WeakPolarHBondContact O-CB 3.23Å; D187-D190 PolarHBondContact O-N 3.49Å; F188-D190 VanDerWaalsContact C-N 3.28Å; F188-D190 PolarHBondContact O-N 3.19Å; D190-M193 PolarHBondContact O-N 2.95Å; D190-R194 VanDerWaalsContact O-CG 3.3Å; D190-R194 WeakPolarHBondContact O-CG 3.49Å; D190-R194 PolarHBondContact O-N 3.02Å
191	E	78.8	Confident	79.7	Confident	109 Å²	109	78.9 Å²	78.9	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-63	-50.9	175.2	-172.4	171.9	-153.9	0	0	111.2	D187 F188 M193 R194 E195	D187-E191 PolarHBondContact O-N 3.19Å; F188-E191 PolarHBondContact O-N 3.1Å; E191-M193 PolarHBondContact O-N 3.06Å; E191-R194 PolarHBondContact O-N 2.98Å; E191-R194 VanDerWaalsContact O-N 3.12Å; E191-E195 PolarHBondContact O-N 3.29Å
192	V	79.1	Confident	78.9	Confident	46 Å²	46	83.3 Å²	83.3	28%	0.279	41%	0.41	S	S	.	.	H	α-helix	trans	-55.3	-42.8	174.7	171.4	0	0	0	0	110.9	F188 E195 L196	F188-V192 HydrophobicContact CD1-CG2 4.11Å; F188-V192 HydrophobicContact CD2-CG2 4.28Å; F188-V192 HydrophobicContact CE1-CG2 3.65Å; F188-V192 HydrophobicContact CE2-CG2 3.84Å; F188-V192 HydrophobicContact CG-CG2 4.42Å; F188-V192 HydrophobicContact CZ-CG2 3.5Å; F188-V192 VanDerWaalsContact O-CG2 3.3Å; F188-V192 WeakPolarHBondContact O-CG2 3.08Å; F188-V192 PolarHBondContact O-N 2.85Å; V192-E195 PolarHBondContact O-N 2.85Å; V192-L196 HydrophobicContact CG1-CD1 4.06Å; V192-L196 HydrophobicContact CG1-CG 4.49Å; V192-L196 VanDerWaalsContact O-CG 3.29Å; V192-L196 WeakPolarHBondContact O-CG 3.4Å; V192-L196 PolarHBondContact O-N 3.41Å
193	M	77.3	Confident	78.1	Confident	24 Å²	24	86.6 Å²	86.6	12%	0.118	43%	0.426	C	S	.	.	H	α-helix	trans	-67.9	-37.9	179.7	-73.1	-51.6	-56.7	0	0	113.4	H92 K93 M189 D190 E191 L196 E197	H92-M193 WeakPolarHBondContact CE1-CE 3.16Å; H92-M193 PolarHBondContact CE1-SD 3.24Å; H92-M193 WeakPolarHBondContact NE2-CE 3.33Å; K93-M193 HydrophobicContact CD-CE 4.34Å; K93-M193 HydrophobicContact CG-CE 4.24Å; M189-M193 WeakPolarHBondContact O-CB 3.44Å; M189-M193 WeakPolarHBondContact O-CG 3.4Å; M189-M193 PolarHBondContact O-N 3.05Å; M189-M193 VanDerWaalsContact O-N 3.16Å; D190-M193 PolarHBondContact O-N 2.95Å; E191-M193 PolarHBondContact O-N 3.06Å; M193-L196 PolarHBondContact O-N 2.99Å; M193-L196 HydrophobicContact SD-CD1 4.02Å; M193-E197 WeakPolarHBondContact O-CG 3.35Å; M193-E197 PolarHBondContact O-N 2.97Å
194	R	80.2	Confident	77.4	Confident	119 Å²	119	87.1 Å²	87.1	45%	0.449	43%	0.432	S	S	.	.	H	α-helix	trans	-65.8	-41	174.5	-72.8	176.9	-146.8	-157.4	9.2	111.5	S185 D190 E191 E197 N198	S185-R194 PolarHBondContact O-NH2 3.45Å; D190-R194 VanDerWaalsContact O-CG 3.3Å; D190-R194 WeakPolarHBondContact O-CG 3.49Å; D190-R194 PolarHBondContact O-N 3.02Å; E191-R194 PolarHBondContact O-N 2.98Å; E191-R194 VanDerWaalsContact O-N 3.12Å; R194-E197 PolarHBondContact O-N 2.86Å; R194-N198 WeakPolarHBondContact O-CB 3.4Å; R194-N198 PolarHBondContact O-N 2.88Å; R194-N198 PolarHBondContact O-ND2 2.91Å
195	E	79.4	Confident	76.8	Confident	108 Å²	108	88.1 Å²	88.1	51%	0.505	43%	0.431	S	S	.	.	H	α-helix	trans	-61.5	-47	175.2	-72.5	-170.3	163.8	0	0	111.3	E191 V192 E197 N198 F199	E191-E195 PolarHBondContact O-N 3.29Å; V192-E195 PolarHBondContact O-N 2.85Å; E195-E197 VanDerWaalsContact C-N 3.35Å; E195-E197 PolarHBondContact O-N 3.13Å; E195-N198 WeakPolarHBondContact O-CB 3.37Å; E195-N198 PolarHBondContact O-N 2.81Å; E195-N198 VanDerWaalsContact O-N 3.17Å; E195-F199 WeakPolarHBondContact O-CD2 3.44Å; E195-F199 PolarHBondContact O-N 2.99Å
196	L	77.2	Confident	76.5	Confident	86 Å²	86	91.9 Å²	91.9	45%	0.45	45%	0.45	S	S	.	.	H	α-helix	trans	-59.6	-42.8	177	-70.5	172.9	0	0	0	112.4	V192 M193 N198 F199 E200	V192-L196 HydrophobicContact CG1-CD1 4.06Å; V192-L196 HydrophobicContact CG1-CG 4.49Å; V192-L196 VanDerWaalsContact O-CG 3.29Å; V192-L196 WeakPolarHBondContact O-CG 3.4Å; V192-L196 PolarHBondContact O-N 3.41Å; M193-L196 PolarHBondContact O-N 2.99Å; M193-L196 HydrophobicContact SD-CD1 4.02Å; L196-N198 VanDerWaalsContact C-N 3.34Å; L196-N198 PolarHBondContact O-N 3.43Å; L196-F199 PolarHBondContact O-N 3.22Å; L196-E200 PolarHBondContact O-N 2.96Å
197	E	79.1	Confident	76.4	Confident	75 Å²	75	91.4 Å²	91.4	35%	0.35	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-40.8	175.2	-76.3	175	-179.5	0	0	112.1	K93 M193 R194 E195 E200 L201	K93-E197 WeakPolarHBondContact CE-OE1 3.31Å; K93-E197 IonicContact NZ-OE1 2.98Å; K93-E197 PolarHBondContact NZ-OE1 2.99Å; M193-E197 WeakPolarHBondContact O-CG 3.35Å; M193-E197 PolarHBondContact O-N 2.97Å; R194-E197 PolarHBondContact O-N 2.86Å; E195-E197 VanDerWaalsContact C-N 3.35Å; E195-E197 PolarHBondContact O-N 3.13Å; E197-E200 PolarHBondContact O-N 2.72Å; E197-L201 WeakPolarHBondContact O-CB 3.44Å; E197-L201 VanDerWaalsContact O-CG 3.27Å; E197-L201 WeakPolarHBondContact O-CG 3.31Å; E197-L201 PolarHBondContact O-N 3.27Å
198	N	79.1	Confident	76	Confident	93 Å²	93	94.4 Å²	94.4	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-63.2	-42.9	176	-70.4	-20.6	0	0	0	111.5	R194 E195 L196 E200 L201 E202	R194-N198 WeakPolarHBondContact O-CB 3.4Å; R194-N198 PolarHBondContact O-N 2.88Å; R194-N198 PolarHBondContact O-ND2 2.91Å; E195-N198 WeakPolarHBondContact O-CB 3.37Å; E195-N198 PolarHBondContact O-N 2.81Å; E195-N198 VanDerWaalsContact O-N 3.17Å; L196-N198 VanDerWaalsContact C-N 3.34Å; L196-N198 PolarHBondContact O-N 3.43Å; N198-E200 PolarHBondContact O-N 3.13Å; N198-L201 PolarHBondContact O-N 3.42Å; N198-E202 WeakPolarHBondContact O-CG 3.47Å; N198-E202 PolarHBondContact O-N 3.28Å
199	F	76.3	Confident	75.5	Confident	118 Å²	118	92.4 Å²	92.4	52%	0.518	46%	0.455	S	S	.	.	H	α-helix	trans	-61.4	-42.8	175.8	-82	-67.2	0	0	0	112.6	E195 L196 E202 Q203	E195-F199 WeakPolarHBondContact O-CD2 3.44Å; E195-F199 PolarHBondContact O-N 2.99Å; L196-F199 PolarHBondContact O-N 3.22Å; F199-E202 PolarHBondContact O-N 3.01Å; F199-Q203 WeakPolarHBondContact O-CG 3.34Å; F199-Q203 PolarHBondContact O-N 2.91Å
200	E	74.7	Confident	75	Confident	125 Å²	125	94.4 Å²	94.4	58%	0.584	46%	0.463	S	S	*	.	H	α-helix	trans	-64	-40.3	176.2	-73.8	-179.2	177.9	0	0	111.9	L196 E197 N198 Q203 N204	L196-E200 PolarHBondContact O-N 2.96Å; E197-E200 PolarHBondContact O-N 2.72Å; N198-E200 PolarHBondContact O-N 3.13Å; E200-Q203 PolarHBondContact O-N 3.17Å; E200-N204 WeakPolarHBondContact O-CB 3.19Å; E200-N204 VanDerWaalsContact O-CG 3.27Å; E200-N204 PolarHBondContact O-N 2.9Å; E200-N204 PolarHBondContact O-ND2 3.27Å; E200-N204 VanDerWaalsContact O-ND2 3.11Å
201	L	72.5	Confident	74.3	Confident	101 Å²	101	98.1 Å²	98.1	53%	0.529	49%	0.486	S	S	.	.	H	α-helix	trans	-65.2	-39.9	176.9	-73.3	169.2	0	0	0	112.2	E197 N198 K205	E197-L201 WeakPolarHBondContact O-CB 3.44Å; E197-L201 VanDerWaalsContact O-CG 3.27Å; E197-L201 WeakPolarHBondContact O-CG 3.31Å; E197-L201 PolarHBondContact O-N 3.27Å; N198-L201 PolarHBondContact O-N 3.42Å; L201-K205 WeakPolarHBondContact O-CB 3.26Å; L201-K205 WeakPolarHBondContact O-CG 3.42Å; L201-K205 PolarHBondContact O-N 3.38Å
202	E	76.3	Confident	73.7	Confident	119 Å²	119	95.8 Å²	95.8	56%	0.556	49%	0.486	S	S	*	.	H	α-helix	trans	-63.6	-47.4	175	-74.7	-177.5	171.9	0	0	111.4	N198 F199 N204 K205 D206	N198-E202 WeakPolarHBondContact O-CG 3.47Å; N198-E202 PolarHBondContact O-N 3.28Å; F199-E202 PolarHBondContact O-N 3.01Å; E202-N204 VanDerWaalsContact C-N 3.35Å; E202-N204 PolarHBondContact O-N 3.48Å; E202-K205 PolarHBondContact O-N 2.94Å; E202-D206 PolarHBondContact O-N 3.46Å
203	Q	73.1	Confident	72.8	Confident	124 Å²	124	100.4 Å²	100.4	58%	0.579	51%	0.505	S	S	*	.	H	α-helix	trans	-60.3	-44.2	176.3	-73.3	-175.4	22.2	0	0	112.1	F199 E200 K205 D206 L207	F199-Q203 WeakPolarHBondContact O-CG 3.34Å; F199-Q203 PolarHBondContact O-N 2.91Å; E200-Q203 PolarHBondContact O-N 3.17Å; Q203-K205 VanDerWaalsContact C-N 3.33Å; Q203-K205 PolarHBondContact O-N 3.17Å; Q203-D206 PolarHBondContact O-N 3.32Å; Q203-L207 WeakPolarHBondContact O-CB 3.28Å; Q203-L207 WeakPolarHBondContact O-CD1 3.42Å; Q203-L207 PolarHBondContact O-N 3.39Å
204	N	73.5	Confident	71.9	Confident	101 Å²	101	107.5 Å²	107.5	54%	0.54	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-36.5	178.8	-75.6	-33.9	0	0	0	112.3	E200 E202 S208	E200-N204 WeakPolarHBondContact O-CB 3.19Å; E200-N204 VanDerWaalsContact O-CG 3.27Å; E200-N204 PolarHBondContact O-N 2.9Å; E200-N204 PolarHBondContact O-ND2 3.27Å; E200-N204 VanDerWaalsContact O-ND2 3.11Å; E202-N204 VanDerWaalsContact C-N 3.35Å; E202-N204 PolarHBondContact O-N 3.48Å; N204-S208 WeakPolarHBondContact O-CB 3.31Å; N204-S208 PolarHBondContact O-N 3.32Å; N204-S208 PolarHBondContact O-OG 2.9Å
205	K	72.8	Confident	70.7	Confident	140 Å²	140	105.1 Å²	105.1	61%	0.609	55%	0.547	S	S	*	.	H	α-helix	trans	-63.4	-46.1	172.2	-80.8	177.2	178.9	175	0	111.4	L201 E202 Q203 L207 S208 L209	L201-K205 WeakPolarHBondContact O-CB 3.26Å; L201-K205 WeakPolarHBondContact O-CG 3.42Å; L201-K205 PolarHBondContact O-N 3.38Å; E202-K205 PolarHBondContact O-N 2.94Å; Q203-K205 VanDerWaalsContact C-N 3.33Å; Q203-K205 PolarHBondContact O-N 3.17Å; K205-L207 PolarHBondContact O-N 3.44Å; K205-S208 PolarHBondContact O-N 2.83Å; K205-S208 PolarHBondContact O-OG 3.22Å; K205-L209 WeakPolarHBondContact O-CG 3.48Å; K205-L209 PolarHBondContact O-N 3.29Å
206	D	71.9	Confident	69.4	Low	96 Å²	96	106.8 Å²	106.8	51%	0.513	56%	0.558	S	S	.	*	H	α-helix	trans	-61.5	-43.2	178.2	-76.9	-16.2	0	0	0	112.2	E202 Q203 S208 L209 Q210	E202-D206 PolarHBondContact O-N 3.46Å; Q203-D206 PolarHBondContact O-N 3.32Å; D206-S208 PolarHBondContact O-N 3.17Å; D206-L209 PolarHBondContact O-N 2.84Å; D206-Q210 WeakPolarHBondContact O-CB 3.39Å; D206-Q210 VanDerWaalsContact O-CG 3.29Å; D206-Q210 WeakPolarHBondContact O-CG 3.22Å; D206-Q210 PolarHBondContact O-N 2.94Å
207	L	69.7	Low	68.1	Low	97 Å²	97	111.3 Å²	111.3	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-59.9	-43.8	173.2	-90.1	142.6	0	0	0	112	Q203 K205 Q210 T211	Q203-L207 WeakPolarHBondContact O-CB 3.28Å; Q203-L207 WeakPolarHBondContact O-CD1 3.42Å; Q203-L207 PolarHBondContact O-N 3.39Å; K205-L207 PolarHBondContact O-N 3.44Å; L207-Q210 PolarHBondContact O-N 3.02Å; L207-T211 WeakPolarHBondContact O-CB 3.23Å; L207-T211 PolarHBondContact O-N 3.41Å; L207-T211 PolarHBondContact O-OG1 3.47Å
208	S	70	Confident	66.5	Low	67 Å²	67	113.3 Å²	113.3	47%	0.469	59%	0.594	S	S	.	*	H	α-helix	trans	-65.5	-40.4	178.4	75.1	0	0	0	0	112.5	N204 K205 D206 T211 A212	N204-S208 WeakPolarHBondContact O-CB 3.31Å; N204-S208 PolarHBondContact O-N 3.32Å; N204-S208 PolarHBondContact O-OG 2.9Å; K205-S208 PolarHBondContact O-N 2.83Å; K205-S208 PolarHBondContact O-OG 3.22Å; D206-S208 PolarHBondContact O-N 3.17Å; S208-T211 PolarHBondContact O-N 3.14Å; S208-A212 WeakPolarHBondContact O-CB 3.45Å; S208-A212 PolarHBondContact O-N 2.72Å
209	L	68.3	Low	65.1	Low	99 Å²	99	118.2 Å²	118.2	52%	0.518	61%	0.614	S	S	.	*	H	α-helix	trans	-66	-42.3	177.2	-73	167	0	0	0	111.8	K205 D206 T211 A212 Q213	K205-L209 WeakPolarHBondContact O-CG 3.48Å; K205-L209 PolarHBondContact O-N 3.29Å; D206-L209 PolarHBondContact O-N 2.84Å; L209-T211 VanDerWaalsContact C-N 3.29Å; L209-T211 PolarHBondContact O-N 3.04Å; L209-A212 PolarHBondContact O-N 3.34Å; L209-Q213 WeakPolarHBondContact O-CG 3.47Å; L209-Q213 PolarHBondContact O-N 3.23Å
210	Q	66.7	Low	63.8	Low	118 Å²	118	117.6 Å²	117.6	55%	0.551	62%	0.624	S	S	*	*	H	α-helix	trans	-64.1	-35.1	175.2	-72.4	178.9	21.5	0	0	112.3	D206 L207 K214	D206-Q210 WeakPolarHBondContact O-CB 3.39Å; D206-Q210 VanDerWaalsContact O-CG 3.29Å; D206-Q210 WeakPolarHBondContact O-CG 3.22Å; D206-Q210 PolarHBondContact O-N 2.94Å; L207-Q210 PolarHBondContact O-N 3.02Å; Q210-K214 PolarHBondContact O-N 3.47Å
211	T	65.1	Low	62.7	Low	95 Å²	95	117 Å²	117	58%	0.583	63%	0.634	S	S	*	*	H	α-helix	trans	-73.4	-41.3	178.8	-48.8	0	0	0	0	111.2	L207 S208 L209 Q213 K214 G215	L207-T211 WeakPolarHBondContact O-CB 3.23Å; L207-T211 PolarHBondContact O-N 3.41Å; L207-T211 PolarHBondContact O-OG1 3.47Å; S208-T211 PolarHBondContact O-N 3.14Å; L209-T211 VanDerWaalsContact C-N 3.29Å; L209-T211 PolarHBondContact O-N 3.04Å; T211-Q213 PolarHBondContact O-N 3.04Å; T211-K214 PolarHBondContact O-N 3.32Å; T211-G215 PolarHBondContact O-N 3Å
212	A	66.3	Low	61.2	Low	60 Å²	60	121.1 Å²	121.1	50%	0.496	65%	0.65	S	S	.	*	H	α-helix	trans	-62.9	-40.3	174.9	0	0	0	0	0	112.5	S208 L209 K214 G215	S208-A212 WeakPolarHBondContact O-CB 3.45Å; S208-A212 PolarHBondContact O-N 2.72Å; L209-A212 PolarHBondContact O-N 3.34Å; A212-K214 VanDerWaalsContact C-N 3.32Å; A212-K214 PolarHBondContact O-N 3.31Å; A212-G215 PolarHBondContact O-N 3.44Å
213	Q	59.5	Low	59.8	Low	144 Å²	144	120.8 Å²	120.8	67%	0.673	66%	0.661	S	S	*	*	H	α-helix	trans	-67.5	-29.4	176.8	-72.3	177.2	6.4	0	0	113.4	L209 T211	L209-Q213 WeakPolarHBondContact O-CG 3.47Å; L209-Q213 PolarHBondContact O-N 3.23Å; T211-Q213 PolarHBondContact O-N 3.04Å
214	K	59.2	Low	58.4	Low	173 Å²	173	125 Å²	125	75%	0.752	70%	0.695	S	S	*	*	H	α-helix	trans	-75.4	-25.4	175.1	-80.3	179.2	177.8	174.2	0	113.5	Q210 T211 A212	Q210-K214 PolarHBondContact O-N 3.47Å; T211-K214 PolarHBondContact O-N 3.32Å; A212-K214 VanDerWaalsContact C-N 3.32Å; A212-K214 PolarHBondContact O-N 3.31Å
215	G	53.9	Low	57.6	Low	68 Å²	68	126.2 Å²	126.2	70%	0.701	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-6.3	177.7	0	0	0	0	0	115.5	T211 A212	T211-G215 PolarHBondContact O-N 3Å; A212-G215 PolarHBondContact O-N 3.44Å
216	L	51.9	Low	56.8	Low	143 Å²	143	125.5 Å²	125.5	75%	0.749	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	12.3	-175.3	-96.6	146.7	0	0	0	114.4	P218	L216-P218 WeakPolarHBondContact O-CD 3.47Å
217	K	50.2	Low	56	Low	182 Å²	182	127.1 Å²	127.1	79%	0.791	72%	0.718	S	S	*	*			trans	-73.1	118.9	170.5	-80.4	-171	175.8	-175.2	0	109.3	E219	K217-E219 PolarHBondContact O-N 3.36Å
218	P	46	Very low	55.2	Low	117 Å²	117	128.9 Å²	128.9	76%	0.76	73%	0.731	S	S	*	*			trans	-67	130.9	176	27.5	-31.1	0	0	0	109	L216 S220	L216-P218 WeakPolarHBondContact O-CD 3.47Å; P218-S220 VanDerWaalsContact C-N 3.35Å; P218-S220 PolarHBondContact O-N 3.35Å
219	E	50.3	Low	54.3	Low	196 Å²	196	132.8 Å²	132.8	92%	0.916	75%	0.747	S	S	*	*			trans	-61.1	101.7	162.6	-78.9	-174.3	156.3	0	0	107.4	K217 S221	K217-E219 PolarHBondContact O-N 3.36Å; E219-S221 PolarHBondContact O-N 3Å; E219-S221 VanDerWaalsContact O-N 3.1Å
220	S	47.3	Very low	53.3	Low	105 Å²	105	135 Å²	135	73%	0.734	76%	0.762	S	S	*	*			trans	-66.9	107.3	167.9	52	0	0	0	0	107.8	P218 E222	P218-S220 VanDerWaalsContact C-N 3.35Å; P218-S220 PolarHBondContact O-N 3.35Å; S220-E222 PolarHBondContact O-N 2.89Å
221	S	52	Low	52.4	Low	112 Å²	112	136.2 Å²	136.2	78%	0.783	78%	0.778	S	S	*	*			trans	-53.7	110.2	164.8	52.1	0	0	0	0	110.5	E219	E219-S221 PolarHBondContact O-N 3Å; E219-S221 VanDerWaalsContact O-N 3.1Å
222	E	42.2	Very low	51.4	Low	187 Å²	187	139.4 Å²	139.4	87%	0.874	79%	0.793	S	S	*	*			trans	-102.6	97.2	156.5	-84	-173.2	162.7	0	0	108.3	S220	S220-E222 PolarHBondContact O-N 2.89Å
223	S	45.2	Very low	50.1	Low	112 Å²	112	146 Å²	146	78%	0.783	82%	0.817	S	S	*	*			trans	-75.3	121.2	159.7	49.2	0	0	0	0	109.3
224	V	44.1	Very low	49.3	Very low	213 Å²	213	146.2 Å²	146.2	100%	1.291	83%	0.83	S	S	*	*			trans	-129.5	0	153.4	-177	0	0	0	0	107.9

Retrieved 224 of 224 residues in 111.5 ms (Link to these results)

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