A0A077ZHF8_TRITR Loading...

UPF0066 and Lipoprotein 9 domain containing prote in

AlphaFold DB , UniProt , Accession A0A077ZHF8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 603 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	52.2	Low	44.6	Very low	255 Å²	255	160.2 Å²	160.2	100%	1.256	86%	0.855	S	S	*	*				0	118.4	0	-71.7	-180	-165.8	0	0	107.8
2	A	41.1	Very low	44.8	Very low	89 Å²	89	153.8 Å²	153.8	74%	0.736	86%	0.856	S	S	*	*			trans	-97.4	142.6	-177.2	0	0	0	0	0	109.6
3	F	54.5	Low	44.6	Very low	206 Å²	206	149.1 Å²	149.1	90%	0.904	85%	0.849	S	S	*	*			trans	-159.1	110.4	147.7	-104.4	-76.6	0	0	0	110
4	K	34.8	Very low	44.4	Very low	193 Å²	193	150.7 Å²	150.7	84%	0.839	85%	0.853	S	S	*	*			trans	-93.2	146.9	156	-73.6	-177.8	172.8	-178.2	0	107
5	F	50	Low	44.4	Very low	168 Å²	168	151.6 Å²	151.6	74%	0.737	85%	0.852	S	S	*	*			trans	179.8	107.6	144.2	-95.3	-70.1	0	0	0	108.3
6	K	42.4	Very low	44.1	Very low	172 Å²	172	146.9 Å²	146.9	75%	0.748	85%	0.848	S	S	*	*				84.2	103.7	104	-83.2	-167.8	-168.5	175.8	0	116.2
7	T	39.1	Very low	43.8	Very low	125 Å²	125	144.1 Å²	144.1	77%	0.767	84%	0.839	S	S	*	*			trans	20.4	123.5	132	41.1	0	0	0	0	120.3
8	F	51	Low	43.9	Very low	214 Å²	214	145.9 Å²	145.9	94%	0.939	84%	0.844	S	S	*	*			trans	-135.7	129	138.7	-109	-87.3	0	0	0	109.3
9	A	41	Very low	43.8	Very low	95 Å²	95	141.7 Å²	141.7	79%	0.785	83%	0.828	S	S	*	*			trans	-100	139.6	175	0	0	0	0	0	109.5
10	A	42.1	Very low	43.6	Very low	98 Å²	98	144.2 Å²	144.2	81%	0.81	84%	0.836	S	S	*	*			trans	-161.8	97.3	155.9	0	0	0	0	0	111.3
11	V	42.3	Very low	43.8	Very low	147 Å²	147	142.3 Å²	142.3	89%	0.891	83%	0.827	S	S	*	*			trans	38.3	107.5	135.7	-169.6	0	0	0	0	118.7
12	G	47.6	Very low	43	Very low	83 Å²	83	133.8 Å²	133.8	86%	0.856	80%	0.804	S	S	*	*			trans	-135.6	102.4	149.7	0	0	0	0	0	108.5
13	A	41.3	Very low	42.7	Very low	93 Å²	93	135.4 Å²	135.4	77%	0.769	81%	0.809	S	S	*	*			trans	-84.9	124.3	177.3	0	0	0	0	0	109.9
14	L	42.9	Very low	41.6	Very low	172 Å²	172	129.4 Å²	129.4	90%	0.901	81%	0.805	S	S	*	*			trans	-148.8	126.5	152.1	-123.2	133.9	0	0	0	110.9
15	I	43.6	Very low	41.7	Very low	164 Å²	164	129.1 Å²	129.1	84%	0.841	81%	0.807	S	S	*	*			trans	-59	141.5	-176.1	-68.6	152.9	0	0	0	112.3
16	G	39.7	Very low	41.4	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	81%	0.812	S	S	*	*			trans	-178.8	58	173.6	0	0	0	0	0	114
17	S	38.2	Very low	41.8	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	82%	0.82	S	S	*	*			trans	-75.7	124.4	161.4	37.4	0	0	0	0	109.7
18	L	45.9	Very low	43	Very low	176 Å²	176	129.7 Å²	129.7	92%	0.921	81%	0.809	S	S	*	*			trans	160.3	138.1	158.9	-110.2	96.1	0	0	0	106.8
19	A	43.1	Very low	44.4	Very low	66 Å²	66	123.8 Å²	123.8	55%	0.545	79%	0.787	S	S	.	*			cis	-164.1	140.6	-14.7	0	0	0	0	0	103.6	V21	A19-V21 VanDerWaalsContact C-N 3.31Å; A19-V21 HydrophobicContact CB-CG2 3.73Å; A19-V21 PolarHBondContact O-N 2.78Å
20	L	38.7	Very low	46.5	Very low	191 Å²	191	122.3 Å²	122.3	100%	1	77%	0.77	S	S	*	*			trans	-60.7	97.4	158	-94.5	142.5	0	0	0	106.9
21	V	47.4	Very low	48.9	Very low	106 Å²	106	120.8 Å²	120.8	64%	0.642	75%	0.748	S	S	*	*			trans	-113.1	94.4	172.2	-179.6	0	0	0	0	107.2	A19 C23	A19-V21 VanDerWaalsContact C-N 3.31Å; A19-V21 HydrophobicContact CB-CG2 3.73Å; A19-V21 PolarHBondContact O-N 2.78Å; V21-C23 HydrophobicContact CG1-CB 3.81Å
22	G	36.8	Very low	51.5	Low	75 Å²	75	116 Å²	116	77%	0.773	72%	0.716	S	S	*	*			trans	-70.9	122.7	144	0	0	0	0	0	106.8
23	C	33.6	Very low	53.9	Low	124 Å²	124	112.1 Å²	112.1	84%	0.838	68%	0.675	S	S	*	*			trans	-165	122.9	162.5	-95	0	0	0	0	107.5	V21	V21-C23 HydrophobicContact CG1-CB 3.81Å
24	G	31.7	Very low	56.6	Low	80 Å²	80	110.9 Å²	110.9	83%	0.825	65%	0.652	S	S	*	*			trans	-179.1	30.2	176.1	0	0	0	0	0	110
25	Q	37.6	Very low	59.3	Low	187 Å²	187	102.7 Å²	102.7	87%	0.874	61%	0.61	S	S	*	*	S	Bend	trans	-91.5	116	152.7	-84.8	178.5	-46	0	0	103.7	E27	Q25-E27 PolarHBondContact O-N 3.37Å
26	D	43.3	Very low	61.9	Low	158 Å²	158	94.9 Å²	94.9	85%	0.845	57%	0.57	S	S	*	*			trans	-47.2	113.2	167.6	-71.3	-48.6	0	0	0	107.6	K28	D26-K28 VanDerWaalsContact C-N 3.32Å; D26-K28 PolarHBondContact O-N 2.8Å
27	E	50.2	Low	64.6	Low	197 Å²	197	91.2 Å²	91.2	92%	0.921	53%	0.532	S	S	*	.			trans	-59.3	100.9	173.3	-110.8	-175.1	164.6	0	0	106.4	Q25 D29	Q25-E27 PolarHBondContact O-N 3.37Å; E27-D29 PolarHBondContact O-N 3.28Å
28	K	64.2	Low	67.3	Low	121 Å²	121	86.5 Å²	86.5	53%	0.526	50%	0.499	S	S	.	.			trans	-59.6	122.7	173.2	-77.1	-168.9	171.3	-167.8	0	107.3	D26 P30 D82	D26-K28 VanDerWaalsContact C-N 3.32Å; D26-K28 PolarHBondContact O-N 2.8Å; K28-P30 VanDerWaalsContact O-CD 3.31Å; K28-P30 WeakPolarHBondContact O-CD 3.49Å; K28-D82 IonicContact NZ-OD1 3.63Å; K28-D82 PolarHBondContact NZ-OD1 3.05Å
29	D	81.5	Confident	69.5	Low	91 Å²	91	80.1 Å²	80.1	49%	0.487	47%	0.467	S	S	.	.			trans	-50.9	113.8	174.8	177.9	-0.6	0	0	0	109.3	E27 N31 H32	E27-D29 PolarHBondContact O-N 3.28Å; D29-N31 PolarHBondContact O-N 3.19Å; D29-N31 WeakPolarHBondContact OD1-CB 3.47Å; D29-N31 PolarHBondContact OD1-N 3.09Å; D29-H32 HydrophobicContact CB-CB 4.12Å; D29-H32 PolarHBondContact O-N 2.91Å; D29-H32 VanDerWaalsContact O-N 3.07Å
30	P	85	Confident	71.7	Confident	64 Å²	64	77.8 Å²	77.8	42%	0.416	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-6.2	-177.7	29.3	-36.1	0	0	0	112.7	K28 N242	K28-P30 VanDerWaalsContact O-CD 3.31Å; K28-P30 WeakPolarHBondContact O-CD 3.49Å; P30-N242 WeakPolarHBondContact O-CB 3.45Å
31	N	92.5	Very high	74.2	Confident	66 Å²	66	69.1 Å²	69.1	35%	0.353	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	14.9	176.4	-57.9	-52.1	0	0	0	113.2	D29 D60 K245	D29-N31 PolarHBondContact O-N 3.19Å; D29-N31 WeakPolarHBondContact OD1-CB 3.47Å; D29-N31 PolarHBondContact OD1-N 3.09Å; N31-D60 WeakPolarHBondContact O-CB 3.16Å; N31-D60 PolarHBondContact O-N 3.31Å; N31-K245 PolarHBondContact OD1-NZ 3.04Å
32	H	97	Very high	76.3	Confident	47 Å²	47	64.1 Å²	64.1	22%	0.218	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.9	170	-178.1	81	0	0	0	111.5	D29 D60 E62 N242	D29-H32 HydrophobicContact CB-CB 4.12Å; D29-H32 PolarHBondContact O-N 2.91Å; D29-H32 VanDerWaalsContact O-N 3.07Å; H32-D60 CarbonylContact C-O 3.57Å; H32-D60 VanDerWaalsContact CA-O 3.3Å; H32-D60 WeakPolarHBondContact CA-O 3.46Å; H32-D60 IonicContact CE1-OD2 2.92Å; H32-D60 IonicContact ND1-OD2 3.75Å; H32-D60 PolarHBondContact ND1-OD2 3.04Å; H32-E62 IonicContact CE1-OE2 3.73Å; H32-E62 IonicContact NE2-OE2 2.6Å; H32-N242 PolarHBondContact O-ND2 2.87Å
33	I	98	Very high	79.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	134.6	174.4	-166.9	177.6	0	0	0	111.3	V35 L59 D60 V61 E62 D82 A83 N242 V243 F246	I33-V35 HydrophobicContact CD1-CG2 4.1Å; I33-V35 HydrophobicContact CG1-CG2 4.06Å; I33-V35 HydrophobicContact CG2-CG2 4.04Å; I33-L59 HydrophobicContact CB-CD1 4.43Å; I33-L59 HydrophobicContact CG2-CD1 4.06Å; I33-L59 HydrophobicContact CG2-CD2 3.82Å; I33-L59 HydrophobicContact CG2-CG 4.06Å; I33-D60 PolarHBondContact N-O 2.76Å; I33-V61 HydrophobicContact CG2-CB 4.18Å; I33-V61 HydrophobicContact CG2-CG1 4.17Å; I33-V61 HydrophobicContact CG2-CG2 3.78Å; I33-V61 CarbonylContact O-C 3.58Å; I33-V61 WeakPolarHBondContact O-CA 3.42Å; I33-E62 PolarHBondContact O-N 2.85Å; I33-D82 HydrophobicContact CD1-CB 4.31Å; I33-D82 HydrophobicContact CG1-CB 3.59Å; I33-A83 HydrophobicContact CD1-CB 4.23Å; I33-N242 HydrophobicContact CB-CB 4.21Å; I33-V243 HydrophobicContact CD1-CG2 3.99Å; I33-F246 HydrophobicContact CD1-CB 4.11Å; I33-F246 HydrophobicContact CD1-CG 4.47Å
34	K	98.2	Very high	82	Confident	67 Å²	67	61.7 Å²	61.7	29%	0.291	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	123.6	170.3	-62.4	-172.6	-177.2	-120.5	0	110.8	E62 I81 D82 A83	K34-E62 CarbonylContact C-O 3.53Å; K34-E62 WeakPolarHBondContact CA-O 3.49Å; K34-E62 VanDerWaalsContact CE-OE2 3.24Å; K34-E62 WeakPolarHBondContact CE-OE2 3.31Å; K34-E62 HydrophobicContact CG-CB 4.15Å; K34-E62 HydrophobicContact CG-CG 4.46Å; K34-E62 IonicContact NZ-OE1 3.68Å; K34-E62 PolarHBondContact NZ-OE1 3.27Å; K34-E62 IonicContact NZ-OE2 3.56Å; K34-E62 PolarHBondContact NZ-OE2 2.95Å; K34-I81 HydrophobicContact CB-CB 4.29Å; K34-I81 HydrophobicContact CB-CG2 4.26Å; K34-D82 PolarHBondContact N-OD2 3.44Å; K34-D82 PolarHBondContact O-N 3.26Å; K34-A83 PolarHBondContact O-N 2.55Å; K34-A83 VanDerWaalsContact O-N 3.16Å
35	V	98.6	Very high	85	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.2	-176.1	-173.9	0	0	0	0	111.7	I33 V37 V61 E62 L63 V64 A83 F246	I33-V35 HydrophobicContact CD1-CG2 4.1Å; I33-V35 HydrophobicContact CG1-CG2 4.06Å; I33-V35 HydrophobicContact CG2-CG2 4.04Å; V35-V37 HydrophobicContact CG1-CG1 4.2Å; V35-V61 HydrophobicContact CB-CG1 4.31Å; V35-V61 HydrophobicContact CG2-CG1 3.87Å; V35-E62 PolarHBondContact N-O 3.47Å; V35-L63 HydrophobicContact CB-CD2 4.24Å; V35-L63 WeakPolarHBondContact O-CA 3.28Å; V35-V64 PolarHBondContact O-N 2.91Å; V35-A83 CarbonylContact C-O 3.57Å; V35-A83 VanDerWaalsContact CA-O 3.3Å; V35-A83 WeakPolarHBondContact CA-O 3.34Å; V35-A83 HydrophobicContact CG1-CB 4.48Å; V35-A83 HydrophobicContact CG2-CB 4.36Å; V35-F246 HydrophobicContact CB-CE1 4.42Å; V35-F246 HydrophobicContact CB-CZ 4.17Å; V35-F246 HydrophobicContact CG1-CE1 3.72Å; V35-F246 HydrophobicContact CG1-CZ 3.67Å; V35-F246 HydrophobicContact CG2-CD1 4.13Å; V35-F246 HydrophobicContact CG2-CD2 4.23Å; V35-F246 HydrophobicContact CG2-CE1 3.91Å; V35-F246 HydrophobicContact CG2-CE2 4.02Å; V35-F246 HydrophobicContact CG2-CG 4.28Å; V35-F246 HydrophobicContact CG2-CZ 3.85Å
36	G	98.2	Very high	87.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.8	173.9	0	0	0	0	0	113	V64 A83 N84 A85	G36-V64 CarbonylContact C-O 3.59Å; G36-V64 VanDerWaalsContact CA-O 3.28Å; G36-V64 WeakPolarHBondContact CA-O 3.45Å; G36-A83 PolarHBondContact N-O 3.05Å; G36-N84 CarbonylContact O-C 3.52Å; G36-N84 WeakPolarHBondContact O-CA 3.31Å; G36-N84 WeakPolarHBondContact O-CB 3.35Å; G36-A85 PolarHBondContact O-N 3.1Å
37	V	97.4	Very high	90.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	158.6	178.9	-61.9	0	0	0	0	111.4	V35 Q43 A46 L63 V64 T65 F66	V35-V37 HydrophobicContact CG1-CG1 4.2Å; V37-Q43 HydrophobicContact CG2-CB 4.37Å; V37-Q43 HydrophobicContact CG2-CG 4.4Å; V37-A46 HydrophobicContact CB-CB 4.41Å; V37-A46 HydrophobicContact CG1-CB 3.75Å; V37-A46 HydrophobicContact CG2-CB 4.48Å; V37-L63 HydrophobicContact CG1-CD2 4.3Å; V37-L63 HydrophobicContact CG2-CB 4.42Å; V37-V64 PolarHBondContact N-O 2.69Å; V37-T65 HydrophobicContact CG2-CG2 4.34Å; V37-T65 CarbonylContact O-C 3.57Å; V37-T65 WeakPolarHBondContact O-CA 3.18Å; V37-F66 PolarHBondContact O-N 3.15Å
38	I	94.7	Very high	92.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	134.5	177	-57.1	-69.9	0	0	0	109.9	Q43 F66 D68 Y69 P72 F86 T204 Y205	I38-Q43 PolarHBondContact O-N 3.25Å; I38-F66 WeakPolarHBondContact CA-O 3.22Å; I38-F66 HydrophobicContact CD1-CB 4.14Å; I38-D68 WeakPolarHBondContact CD1-O 3.01Å; I38-Y69 HydrophobicContact CD1-CD1 3.84Å; I38-Y69 HydrophobicContact CD1-CE1 4.15Å; I38-Y69 HydrophobicContact CG1-CD1 4.19Å; I38-Y69 HydrophobicContact CG1-CE1 4.04Å; I38-P72 HydrophobicContact CD1-CG 4.18Å; I38-F86 HydrophobicContact CD1-CB 4.3Å; I38-F86 HydrophobicContact CD1-CD2 4.09Å; I38-F86 HydrophobicContact CD1-CG 4.37Å; I38-F86 HydrophobicContact CG1-CB 3.56Å; I38-F86 HydrophobicContact CG1-CD2 4.08Å; I38-F86 HydrophobicContact CG1-CG 4.13Å; I38-T204 HydrophobicContact CB-CG2 3.93Å; I38-T204 HydrophobicContact CG2-CG2 3.55Å; I38-Y205 HydrophobicContact CG2-CE1 4.3Å
39	V	91.8	Very high	94.3	Very high	41 Å²	41	32.3 Å²	32.3	25%	0.248	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	139.7	176.2	173.8	0	0	0	0	110.8	T65 F66 N67 Q208	V39-T65 HydrophobicContact CG2-CG2 4.29Å; V39-F66 PolarHBondContact N-O 2.98Å; V39-N67 WeakPolarHBondContact CB-OD1 3.02Å; V39-N67 WeakPolarHBondContact CG2-OD1 3.41Å; V39-Q208 PolarHBondContact O-NE2 3.43Å
40	G	89.2	Confident	95.1	Very high	18 Å²	18	31.3 Å²	31.3	19%	0.186	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	115.5	-139.9	175.7	0	0	0	0	0	112.6	E42 Q43 Q44	G40-E42 VanDerWaalsContact C-N 3.32Å; G40-E42 PolarHBondContact O-N 3.41Å; G40-Q43 WeakPolarHBondContact O-CB 3.47Å; G40-Q43 PolarHBondContact O-N 3.02Å; G40-Q44 PolarHBondContact O-N 3.16Å
41	A	91.2	Very high	95.7	Very high	8 Å²	8	34.8 Å²	34.8	7%	0.066	17%	0.174	C	C	.	.	H	α-helix	trans	-58.8	-39.5	-176.2	0	0	0	0	0	113.2	Q43 Q44 V45 S207 V262 F263	A41-Q43 PolarHBondContact O-N 2.94Å; A41-Q44 PolarHBondContact O-N 3.41Å; A41-V45 WeakPolarHBondContact O-CG2 3.34Å; A41-V45 PolarHBondContact O-N 2.84Å; A41-V45 VanDerWaalsContact O-N 3.14Å; A41-S207 VanDerWaalsContact CB-OG 3.28Å; A41-S207 WeakPolarHBondContact CB-OG 3.38Å; A41-V262 HydrophobicContact CB-CG1 3.6Å; A41-F263 HydrophobicContact CB-CD1 4.16Å; A41-F263 HydrophobicContact CB-CE1 3.47Å; A41-F263 VanDerWaalsContact CB-CE1 3.47Å; A41-F263 HydrophobicContact CB-CE2 3.99Å; A41-F263 HydrophobicContact CB-CZ 3.38Å
42	E	91.7	Very high	96	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-36.4	177.8	-69.3	-171.3	-138.7	0	0	112.9	G40 V45 A46 Y112 T204 F263	G40-E42 VanDerWaalsContact C-N 3.32Å; G40-E42 PolarHBondContact O-N 3.41Å; E42-V45 PolarHBondContact O-N 2.88Å; E42-A46 WeakPolarHBondContact O-CB 3.43Å; E42-A46 PolarHBondContact O-N 2.95Å; E42-Y112 HydrophobicContact CG-CE2 3.8Å; E42-T204 HydrophobicContact CG-CG2 4.09Å; E42-T204 VanDerWaalsContact OE1-CB 3.31Å; E42-T204 WeakPolarHBondContact OE1-CB 3.41Å; E42-T204 WeakPolarHBondContact OE1-CG2 3.33Å; E42-T204 PolarHBondContact OE1-OG1 3.3Å; E42-F263 HydrophobicContact CG-CZ 3.88Å
43	Q	94.9	Very high	96	Very high	47 Å²	47	30 Å²	30	22%	0.22	15%	0.15	C	C	.	.	H	α-helix	trans	-60	-44.5	171.6	-179.2	-169.6	-26.2	0	0	111.2	V37 I38 G40 A41 V45 A46 E47 T65	V37-Q43 HydrophobicContact CG2-CB 4.37Å; V37-Q43 HydrophobicContact CG2-CG 4.4Å; I38-Q43 PolarHBondContact O-N 3.25Å; G40-Q43 WeakPolarHBondContact O-CB 3.47Å; G40-Q43 PolarHBondContact O-N 3.02Å; A41-Q43 PolarHBondContact O-N 2.94Å; Q43-V45 VanDerWaalsContact C-N 3.3Å; Q43-V45 PolarHBondContact O-N 3.16Å; Q43-A46 CarbonylContact O-C 3.46Å; Q43-A46 WeakPolarHBondContact O-CA 3.31Å; Q43-A46 WeakPolarHBondContact O-CB 3.5Å; Q43-A46 PolarHBondContact O-N 3.26Å; Q43-A46 VanDerWaalsContact O-N 3.08Å; Q43-E47 HydrophobicContact CG-CG 4.49Å; Q43-E47 PolarHBondContact NE2-OE1 2.91Å; Q43-E47 WeakPolarHBondContact O-CG 3.3Å; Q43-E47 PolarHBondContact O-N 2.73Å; Q43-T65 HydrophobicContact CG-CG2 4.18Å
44	Q	94.4	Very high	96	Very high	100 Å²	100	35 Å²	35	47%	0.467	17%	0.171	S	C	.	.	H	α-helix	trans	-62.1	-38	178.6	-65.3	175.5	18.1	0	0	112.1	G40 A41 E47 V48 V262	G40-Q44 PolarHBondContact O-N 3.16Å; A41-Q44 PolarHBondContact O-N 3.41Å; Q44-E47 PolarHBondContact O-N 3.25Å; Q44-V48 PolarHBondContact O-N 3.27Å; Q44-V262 HydrophobicContact CB-CG1 4.33Å; Q44-V262 HydrophobicContact CB-CG2 4.2Å
45	V	95.7	Very high	96	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-41.3	173.3	176.4	0	0	0	0	110.9	A41 E42 Q43 E47 V48 A49 F110 Y250 V255 A259 V262 F263	A41-V45 WeakPolarHBondContact O-CG2 3.34Å; A41-V45 PolarHBondContact O-N 2.84Å; A41-V45 VanDerWaalsContact O-N 3.14Å; E42-V45 PolarHBondContact O-N 2.88Å; Q43-V45 VanDerWaalsContact C-N 3.3Å; Q43-V45 PolarHBondContact O-N 3.16Å; V45-E47 PolarHBondContact O-N 2.92Å; V45-V48 PolarHBondContact O-N 3.27Å; V45-A49 PolarHBondContact O-N 2.96Å; V45-F110 HydrophobicContact CG1-CE2 3.87Å; V45-Y250 HydrophobicContact CG1-CE1 4.31Å; V45-V255 HydrophobicContact CG1-CG1 3.63Å; V45-A259 HydrophobicContact CG1-CB 4.06Å; V45-A259 HydrophobicContact CG2-CB 3.94Å; V45-V262 HydrophobicContact CG2-CB 4.23Å; V45-V262 HydrophobicContact CG2-CG1 4.38Å; V45-V262 HydrophobicContact CG2-CG2 4.39Å; V45-F263 HydrophobicContact CG2-CD2 4.35Å; V45-F263 HydrophobicContact CG2-CE2 3.9Å
46	A	97	Very high	95.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.4	-31.5	177.2	0	0	0	0	0	113.4	V37 E42 Q43 V48 A49 Q50 L63 Y250	V37-A46 HydrophobicContact CB-CB 4.41Å; V37-A46 HydrophobicContact CG1-CB 3.75Å; V37-A46 HydrophobicContact CG2-CB 4.48Å; E42-A46 WeakPolarHBondContact O-CB 3.43Å; E42-A46 PolarHBondContact O-N 2.95Å; Q43-A46 CarbonylContact O-C 3.46Å; Q43-A46 WeakPolarHBondContact O-CA 3.31Å; Q43-A46 WeakPolarHBondContact O-CB 3.5Å; Q43-A46 PolarHBondContact O-N 3.26Å; Q43-A46 VanDerWaalsContact O-N 3.08Å; A46-V48 VanDerWaalsContact C-N 3.32Å; A46-A49 CarbonylContact O-C 3.58Å; A46-A49 WeakPolarHBondContact O-CB 3.41Å; A46-A49 PolarHBondContact O-N 3.24Å; A46-Q50 WeakPolarHBondContact O-CB 3.49Å; A46-Q50 PolarHBondContact O-N 2.88Å; A46-L63 HydrophobicContact CB-CD1 4.02Å; A46-L63 HydrophobicContact CB-CD2 4Å; A46-Y250 HydrophobicContact CB-CE2 4.17Å
47	E	98	Very high	95.8	Very high	80 Å²	80	45.7 Å²	45.7	37%	0.374	22%	0.222	S	C	.	.	H	α-helix	trans	-64	-37	172.7	-74.4	166.4	-176.9	0	0	111.3	Q43 Q44 V45 Q50 K51 L63	Q43-E47 HydrophobicContact CG-CG 4.49Å; Q43-E47 PolarHBondContact NE2-OE1 2.91Å; Q43-E47 WeakPolarHBondContact O-CG 3.3Å; Q43-E47 PolarHBondContact O-N 2.73Å; Q44-E47 PolarHBondContact O-N 3.25Å; V45-E47 PolarHBondContact O-N 2.92Å; E47-Q50 WeakPolarHBondContact O-CB 3.23Å; E47-Q50 PolarHBondContact O-N 2.86Å; E47-K51 PolarHBondContact O-N 2.92Å; E47-L63 HydrophobicContact CB-CD1 4.48Å; E47-L63 HydrophobicContact CG-CD1 3.78Å
48	V	97.7	Very high	95.8	Very high	47 Å²	47	47.7 Å²	47.7	29%	0.285	24%	0.243	S	C	.	.	H	α-helix	trans	-66.9	-42.1	171	-179.9	0	0	0	0	110.7	Q44 V45 A46 Q50 K51 V52 V255 A258	Q44-V48 PolarHBondContact O-N 3.27Å; V45-V48 PolarHBondContact O-N 3.27Å; A46-V48 VanDerWaalsContact C-N 3.32Å; V48-Q50 VanDerWaalsContact C-N 3.34Å; V48-Q50 PolarHBondContact O-N 2.95Å; V48-K51 PolarHBondContact O-N 2.97Å; V48-V52 HydrophobicContact CG1-CG2 4.41Å; V48-V52 WeakPolarHBondContact O-CG2 3.33Å; V48-V52 PolarHBondContact O-N 2.85Å; V48-V255 HydrophobicContact CG1-CG2 4.05Å; V48-A258 HydrophobicContact CB-CB 3.99Å; V48-A258 HydrophobicContact CG1-CB 3.93Å; V48-A258 HydrophobicContact CG2-CB 3.71Å
49	A	97.8	Very high	95.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-39.3	175.3	0	0	0	0	0	112.4	V45 A46 V52 A53 F246 Y250 V255	V45-A49 PolarHBondContact O-N 2.96Å; A46-A49 CarbonylContact O-C 3.58Å; A46-A49 WeakPolarHBondContact O-CB 3.41Å; A46-A49 PolarHBondContact O-N 3.24Å; A49-V52 PolarHBondContact O-N 3.3Å; A49-A53 WeakPolarHBondContact O-CB 3.46Å; A49-A53 PolarHBondContact O-N 3.17Å; A49-F246 HydrophobicContact CB-CE2 4.41Å; A49-Y250 HydrophobicContact CB-CD2 3.39Å; A49-Y250 HydrophobicContact CB-CE2 3.95Å; A49-Y250 HydrophobicContact CB-CG 3.97Å; A49-V255 HydrophobicContact CB-CG1 4.35Å; A49-V255 HydrophobicContact CB-CG2 3.8Å
50	Q	98.2	Very high	96.2	Very high	70 Å²	70	49 Å²	49	33%	0.327	25%	0.249	S	C	.	.	H	α-helix	trans	-58.7	-45.5	172.1	167.2	-173.3	53	0	0	110.8	A46 E47 V48 A53 K54 V61 L63	A46-Q50 WeakPolarHBondContact O-CB 3.49Å; A46-Q50 PolarHBondContact O-N 2.88Å; E47-Q50 WeakPolarHBondContact O-CB 3.23Å; E47-Q50 PolarHBondContact O-N 2.86Å; V48-Q50 VanDerWaalsContact C-N 3.34Å; V48-Q50 PolarHBondContact O-N 2.95Å; Q50-A53 WeakPolarHBondContact O-CB 3.24Å; Q50-A53 PolarHBondContact O-N 3.37Å; Q50-K54 PolarHBondContact O-N 2.62Å; Q50-V61 HydrophobicContact CB-CB 4.04Å; Q50-V61 HydrophobicContact CB-CG1 4.35Å; Q50-V61 HydrophobicContact CG-CB 4Å; Q50-V61 PolarHBondContact NE2-O 3.34Å; Q50-L63 HydrophobicContact CB-CD1 4.41Å
51	K	98	Very high	96.6	Very high	137 Å²	137	48.3 Å²	48.3	60%	0.596	24%	0.241	S	C	*	.	H	α-helix	trans	-63.2	-48	176.2	-174.5	179.2	177.8	-174.7	0	112.1	E47 V48 A53 K54 D55	E47-K51 PolarHBondContact O-N 2.92Å; V48-K51 PolarHBondContact O-N 2.97Å; K51-A53 VanDerWaalsContact C-N 3.28Å; K51-A53 PolarHBondContact O-N 3.35Å; K51-K54 PolarHBondContact O-N 3.36Å; K51-D55 WeakPolarHBondContact CE-OD2 3.38Å; K51-D55 WeakPolarHBondContact CG-OD2 3.41Å; K51-D55 WeakPolarHBondContact O-CB 3.34Å; K51-D55 VanDerWaalsContact O-CG 3.3Å; K51-D55 PolarHBondContact O-N 2.67Å
52	V	98	Very high	97	Very high	11 Å²	11	51.7 Å²	51.7	7%	0.067	26%	0.255	C	S	.	.	H	α-helix	trans	-60.9	-39.2	176.9	174.7	0	0	0	0	111.2	V48 A49 D55 K56 Y57 A249 E254 V255	V48-V52 HydrophobicContact CG1-CG2 4.41Å; V48-V52 WeakPolarHBondContact O-CG2 3.33Å; V48-V52 PolarHBondContact O-N 2.85Å; A49-V52 PolarHBondContact O-N 3.3Å; V52-D55 PolarHBondContact O-N 3.27Å; V52-K56 HydrophobicContact CG1-CD 3.88Å; V52-K56 HydrophobicContact CG1-CG 4.27Å; V52-K56 WeakPolarHBondContact O-CB 3.34Å; V52-K56 PolarHBondContact O-N 2.73Å; V52-Y57 HydrophobicContact CG1-CE2 4.46Å; V52-A249 HydrophobicContact CB-CB 4.32Å; V52-A249 HydrophobicContact CG1-CB 3.99Å; V52-E254 HydrophobicContact CG2-CB 3.97Å; V52-V255 HydrophobicContact CG2-CG2 4.23Å
53	A	98.1	Very high	97.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-44.8	176.6	0	0	0	0	0	111.8	A49 Q50 K51 Y57 G58 L59 V61 A249	A49-A53 WeakPolarHBondContact O-CB 3.46Å; A49-A53 PolarHBondContact O-N 3.17Å; Q50-A53 WeakPolarHBondContact O-CB 3.24Å; Q50-A53 PolarHBondContact O-N 3.37Å; K51-A53 VanDerWaalsContact C-N 3.28Å; K51-A53 PolarHBondContact O-N 3.35Å; A53-Y57 CarbonylContact O-C 3.52Å; A53-Y57 WeakPolarHBondContact O-CA 3.38Å; A53-Y57 WeakPolarHBondContact O-CB 3.49Å; A53-Y57 PolarHBondContact O-N 2.77Å; A53-Y57 VanDerWaalsContact O-N 3.11Å; A53-G58 PolarHBondContact O-N 3.3Å; A53-L59 CarbonylContact C-O 3.56Å; A53-L59 HydrophobicContact CB-CB 4.12Å; A53-L59 HydrophobicContact CB-CD2 4.12Å; A53-L59 HydrophobicContact CB-CG 4.41Å; A53-L59 PolarHBondContact O-N 3.45Å; A53-V61 HydrophobicContact CB-CG2 3.53Å; A53-A249 HydrophobicContact CB-CB 3.73Å
54	K	98	Very high	97.4	Very high	105 Å²	105	53 Å²	53	46%	0.457	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-51.2	176.2	-164.8	69.2	169.3	-164.9	0	111.8	Q50 K51 G58 L59 D60	Q50-K54 PolarHBondContact O-N 2.62Å; K51-K54 PolarHBondContact O-N 3.36Å; K54-G58 WeakPolarHBondContact O-CA 3.49Å; K54-G58 PolarHBondContact O-N 3.22Å; K54-G58 VanDerWaalsContact O-N 3.14Å; K54-L59 WeakPolarHBondContact CA-O 3.27Å; K54-L59 PolarHBondContact N-O 2.94Å; K54-D60 IonicContact NZ-OD1 3.45Å; K54-D60 PolarHBondContact NZ-OD1 3.24Å
55	D	97.4	Very high	97.5	Very high	114 Å²	114	51.5 Å²	51.5	61%	0.61	26%	0.263	S	S	*	.	H	α-helix	trans	-70.7	-39.6	-170.7	-68.9	-12.7	0	0	0	112.6	K51 V52	K51-D55 WeakPolarHBondContact CE-OD2 3.38Å; K51-D55 WeakPolarHBondContact CG-OD2 3.41Å; K51-D55 WeakPolarHBondContact O-CB 3.34Å; K51-D55 VanDerWaalsContact O-CG 3.3Å; K51-D55 PolarHBondContact O-N 2.67Å; V52-D55 PolarHBondContact O-N 3.27Å
56	K	97.1	Very high	97.4	Very high	106 Å²	106	52.7 Å²	52.7	46%	0.461	27%	0.268	S	S	.	.	H	α-helix	trans	-97.1	-29.7	-175.4	-65	-170.4	-178.3	176.2	0	114.4	V52 E254	V52-K56 HydrophobicContact CG1-CD 3.88Å; V52-K56 HydrophobicContact CG1-CG 4.27Å; V52-K56 WeakPolarHBondContact O-CB 3.34Å; V52-K56 PolarHBondContact O-N 2.73Å; K56-E254 VanDerWaalsContact CE-OE1 3.28Å; K56-E254 WeakPolarHBondContact CE-OE1 3.46Å; K56-E254 IonicContact NZ-OE1 3.59Å; K56-E254 PolarHBondContact NZ-OE1 2.81Å; K56-E254 IonicContact NZ-OE2 2.73Å; K56-E254 PolarHBondContact NZ-OE2 3.41Å
57	Y	96.4	Very high	97.2	Very high	72 Å²	72	57.6 Å²	57.6	28%	0.282	29%	0.294	S	S	.	.	H	α-helix	trans	-123.2	-1	-169.7	-53.3	-80.7	0	0	0	113.8	V52 A53 L59 K245 Q248 A249	V52-Y57 HydrophobicContact CG1-CE2 4.46Å; A53-Y57 CarbonylContact O-C 3.52Å; A53-Y57 WeakPolarHBondContact O-CA 3.38Å; A53-Y57 WeakPolarHBondContact O-CB 3.49Å; A53-Y57 PolarHBondContact O-N 2.77Å; A53-Y57 VanDerWaalsContact O-N 3.11Å; Y57-L59 PolarHBondContact O-N 2.65Å; Y57-K245 HydrophobicContact CD1-CG 4.32Å; Y57-K245 HydrophobicContact CG-CB 4.27Å; Y57-K245 HydrophobicContact CG-CG 4.35Å; Y57-Q248 HydrophobicContact CE1-CB 4.08Å; Y57-Q248 HydrophobicContact CE2-CB 4.28Å; Y57-Q248 WeakPolarHBondContact OH-CB 3.37Å; Y57-A249 HydrophobicContact CD2-CB 4Å; Y57-A249 HydrophobicContact CE2-CB 3.85Å
58	G	96.6	Very high	96.9	Very high	43 Å²	43	55.6 Å²	55.6	44%	0.443	29%	0.286	S	S	.	.			trans	63.7	18.3	-176.2	0	0	0	0	0	113.6	A53 K54	A53-G58 PolarHBondContact O-N 3.3Å; K54-G58 WeakPolarHBondContact O-CA 3.49Å; K54-G58 PolarHBondContact O-N 3.22Å; K54-G58 VanDerWaalsContact O-N 3.14Å
59	L	97.9	Very high	96.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.276	C	S	.	.			trans	-89.9	123.4	-175	178.7	69.8	0	0	0	110.6	I33 A53 K54 Y57 V61 N242 K245 F246	I33-L59 HydrophobicContact CB-CD1 4.43Å; I33-L59 HydrophobicContact CG2-CD1 4.06Å; I33-L59 HydrophobicContact CG2-CD2 3.82Å; I33-L59 HydrophobicContact CG2-CG 4.06Å; A53-L59 CarbonylContact C-O 3.56Å; A53-L59 HydrophobicContact CB-CB 4.12Å; A53-L59 HydrophobicContact CB-CD2 4.12Å; A53-L59 HydrophobicContact CB-CG 4.41Å; A53-L59 PolarHBondContact O-N 3.45Å; K54-L59 WeakPolarHBondContact CA-O 3.27Å; K54-L59 PolarHBondContact N-O 2.94Å; Y57-L59 PolarHBondContact O-N 2.65Å; L59-V61 HydrophobicContact CD2-CG2 3.89Å; L59-V61 HydrophobicContact CG-CG2 3.98Å; L59-N242 HydrophobicContact CD1-CB 3.68Å; L59-N242 WeakPolarHBondContact CD2-O 3.19Å; L59-K245 HydrophobicContact CB-CB 4.4Å; L59-K245 HydrophobicContact CB-CD 4.44Å; L59-K245 HydrophobicContact CD2-CB 3.85Å; L59-F246 HydrophobicContact CD2-CB 3.82Å
60	D	97.5	Very high	96.2	Very high	70 Å²	70	57.4 Å²	57.4	37%	0.374	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	108	170.9	-158	56.8	0	0	0	110.4	N31 H32 I33 K54	N31-D60 WeakPolarHBondContact O-CB 3.16Å; N31-D60 PolarHBondContact O-N 3.31Å; H32-D60 CarbonylContact C-O 3.57Å; H32-D60 VanDerWaalsContact CA-O 3.3Å; H32-D60 WeakPolarHBondContact CA-O 3.46Å; H32-D60 IonicContact CE1-OD2 2.92Å; H32-D60 IonicContact ND1-OD2 3.75Å; H32-D60 PolarHBondContact ND1-OD2 3.04Å; I33-D60 PolarHBondContact N-O 2.76Å; K54-D60 IonicContact NZ-OD1 3.45Å; K54-D60 PolarHBondContact NZ-OD1 3.24Å
61	V	98.2	Very high	95.9	Very high	3 Å²	3	57.7 Å²	57.7	2%	0.018	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	119.7	178.7	-178.2	0	0	0	0	108.8	I33 V35 Q50 A53 L59 L63 F246	I33-V61 HydrophobicContact CG2-CB 4.18Å; I33-V61 HydrophobicContact CG2-CG1 4.17Å; I33-V61 HydrophobicContact CG2-CG2 3.78Å; I33-V61 CarbonylContact O-C 3.58Å; I33-V61 WeakPolarHBondContact O-CA 3.42Å; V35-V61 HydrophobicContact CB-CG1 4.31Å; V35-V61 HydrophobicContact CG2-CG1 3.87Å; Q50-V61 HydrophobicContact CB-CB 4.04Å; Q50-V61 HydrophobicContact CB-CG1 4.35Å; Q50-V61 HydrophobicContact CG-CB 4Å; Q50-V61 PolarHBondContact NE2-O 3.34Å; A53-V61 HydrophobicContact CB-CG2 3.53Å; L59-V61 HydrophobicContact CD2-CG2 3.89Å; L59-V61 HydrophobicContact CG-CG2 3.98Å; V61-L63 HydrophobicContact CG1-CD2 3.8Å; V61-L63 HydrophobicContact CG1-CG 4.41Å; V61-F246 HydrophobicContact CG1-CD2 4.15Å; V61-F246 HydrophobicContact CG1-CE2 3.88Å; V61-F246 HydrophobicContact CG2-CD2 3.8Å; V61-F246 HydrophobicContact CG2-CE2 4.23Å
62	E	97.9	Very high	95.9	Very high	78 Å²	78	51.2 Å²	51.2	36%	0.364	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	114	168.5	178.8	-173	144.1	0	0	109	H32 I33 K34 V35	H32-E62 IonicContact CE1-OE2 3.73Å; H32-E62 IonicContact NE2-OE2 2.6Å; I33-E62 PolarHBondContact O-N 2.85Å; K34-E62 CarbonylContact C-O 3.53Å; K34-E62 WeakPolarHBondContact CA-O 3.49Å; K34-E62 VanDerWaalsContact CE-OE2 3.24Å; K34-E62 WeakPolarHBondContact CE-OE2 3.31Å; K34-E62 HydrophobicContact CG-CB 4.15Å; K34-E62 HydrophobicContact CG-CG 4.46Å; K34-E62 IonicContact NZ-OE1 3.68Å; K34-E62 PolarHBondContact NZ-OE1 3.27Å; K34-E62 IonicContact NZ-OE2 3.56Å; K34-E62 PolarHBondContact NZ-OE2 2.95Å; V35-E62 PolarHBondContact N-O 3.47Å
63	L	98.1	Very high	95.9	Very high	34 Å²	34	50.7 Å²	50.7	18%	0.178	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.8	177.9	-61.9	178.4	0	0	0	110.5	V35 V37 A46 E47 Q50 V61	V35-L63 HydrophobicContact CB-CD2 4.24Å; V35-L63 WeakPolarHBondContact O-CA 3.28Å; V37-L63 HydrophobicContact CG1-CD2 4.3Å; V37-L63 HydrophobicContact CG2-CB 4.42Å; A46-L63 HydrophobicContact CB-CD1 4.02Å; A46-L63 HydrophobicContact CB-CD2 4Å; E47-L63 HydrophobicContact CB-CD1 4.48Å; E47-L63 HydrophobicContact CG-CD1 3.78Å; Q50-L63 HydrophobicContact CB-CD1 4.41Å; V61-L63 HydrophobicContact CG1-CD2 3.8Å; V61-L63 HydrophobicContact CG1-CG 4.41Å
64	V	97.5	Very high	95.7	Very high	43 Å²	43	53.6 Å²	53.6	26%	0.261	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115	174.3	-177.2	0	0	0	0	108.6	V35 G36 V37 F66 I81	V35-V64 PolarHBondContact O-N 2.91Å; G36-V64 CarbonylContact C-O 3.59Å; G36-V64 VanDerWaalsContact CA-O 3.28Å; G36-V64 WeakPolarHBondContact CA-O 3.45Å; V37-V64 PolarHBondContact N-O 2.69Å; V64-F66 HydrophobicContact CB-CE2 4.21Å; V64-F66 HydrophobicContact CG1-CE2 3.79Å; V64-F66 HydrophobicContact CG1-CZ 3.88Å; V64-F66 WeakPolarHBondContact O-CD2 3.42Å; V64-F66 WeakPolarHBondContact O-CE2 3.44Å; V64-I81 HydrophobicContact CB-CG2 3.84Å; V64-I81 HydrophobicContact CG1-CG2 4.19Å; V64-I81 HydrophobicContact CG2-CG2 3.72Å
65	T	96.7	Very high	95.7	Very high	68 Å²	68	49.1 Å²	49.1	42%	0.417	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.6	-171.9	60.1	0	0	0	0	112.7	V37 V39 Q43	V37-T65 HydrophobicContact CG2-CG2 4.34Å; V37-T65 CarbonylContact O-C 3.57Å; V37-T65 WeakPolarHBondContact O-CA 3.18Å; V39-T65 HydrophobicContact CG2-CG2 4.29Å; Q43-T65 HydrophobicContact CG-CG2 4.18Å
66	F	94.4	Very high	95.7	Very high	25 Å²	25	43.7 Å²	43.7	11%	0.11	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	155	176.2	-62.2	-91.3	0	0	0	111.2	V37 I38 V39 V64 L71 P72 A75 I81	V37-F66 PolarHBondContact O-N 3.15Å; I38-F66 WeakPolarHBondContact CA-O 3.22Å; I38-F66 HydrophobicContact CD1-CB 4.14Å; V39-F66 PolarHBondContact N-O 2.98Å; V64-F66 HydrophobicContact CB-CE2 4.21Å; V64-F66 HydrophobicContact CG1-CE2 3.79Å; V64-F66 HydrophobicContact CG1-CZ 3.88Å; V64-F66 WeakPolarHBondContact O-CD2 3.42Å; V64-F66 WeakPolarHBondContact O-CE2 3.44Å; F66-L71 HydrophobicContact CD1-CB 3.59Å; F66-L71 HydrophobicContact CE1-CB 3.88Å; F66-P72 HydrophobicContact CB-CG 3.75Å; F66-P72 HydrophobicContact CD1-CG 4.14Å; F66-P72 HydrophobicContact CD2-CB 4.11Å; F66-P72 HydrophobicContact CD2-CG 3.89Å; F66-P72 HydrophobicContact CE2-CB 4.34Å; F66-P72 HydrophobicContact CG-CB 4.31Å; F66-P72 HydrophobicContact CG-CG 3.66Å; F66-A75 HydrophobicContact CE1-CB 4.07Å; F66-A75 HydrophobicContact CZ-CB 3.67Å; F66-I81 HydrophobicContact CE2-CD1 4.07Å; F66-I81 HydrophobicContact CZ-CD1 4.26Å
67	N	92.7	Very high	95.7	Very high	103 Å²	103	40.9 Å²	40.9	55%	0.551	23%	0.228	S	C	*	.	S	Bend	trans	-111	2.4	-179	-67.3	-52.5	0	0	0	113.1	V39 P185 Y205	V39-N67 WeakPolarHBondContact CB-OD1 3.02Å; V39-N67 WeakPolarHBondContact CG2-OD1 3.41Å; N67-P185 VanDerWaalsContact O-CG 3.31Å; N67-P185 WeakPolarHBondContact O-CG 3.44Å; N67-Y205 PolarHBondContact O-OH 2.87Å
68	D	90.1	Very high	95.7	Very high	39 Å²	39	43.9 Å²	43.9	21%	0.209	24%	0.243	C	C	.	.	S	Bend	trans	-145.7	169.6	-177.4	69.2	87.4	0	0	0	110.5	I38 V70 L71 P72 P185 Y205	I38-D68 WeakPolarHBondContact CD1-O 3.01Å; D68-V70 WeakPolarHBondContact OD1-CA 3.45Å; D68-V70 WeakPolarHBondContact OD1-CB 3.37Å; D68-V70 PolarHBondContact OD1-N 2.88Å; D68-L71 PolarHBondContact OD1-N 3.28Å; D68-L71 VanDerWaalsContact OD2-CD1 3.28Å; D68-L71 WeakPolarHBondContact OD2-CD1 3.47Å; D68-L71 WeakPolarHBondContact OD2-CG 3.4Å; D68-P72 WeakPolarHBondContact O-CD 3.44Å; D68-P72 WeakPolarHBondContact O-CG 3.15Å; D68-P185 HydrophobicContact CB-CG 4.31Å; D68-Y205 WeakPolarHBondContact CA-OH 3.41Å
69	Y	92.5	Very high	95.6	Very high	19 Å²	19	43.5 Å²	43.5	8%	0.075	24%	0.239	C	C	.	.	S	Bend	trans	-91.4	-8.8	-176.7	-67.3	-22.7	0	0	0	114.7	I38 F86 Y91 A184 T204 Y205	I38-Y69 HydrophobicContact CD1-CD1 3.84Å; I38-Y69 HydrophobicContact CD1-CE1 4.15Å; I38-Y69 HydrophobicContact CG1-CD1 4.19Å; I38-Y69 HydrophobicContact CG1-CE1 4.04Å; Y69-F86 AromaticContact CD1-CD2 3.58Å; Y69-F86 HydrophobicContact CD1-CD2 3.58Å; Y69-F86 AromaticContact CD1-CE2 3.8Å; Y69-F86 HydrophobicContact CD1-CE2 3.8Å; Y69-F86 HydrophobicContact CE1-CD2 4.12Å; Y69-F86 HydrophobicContact CG-CD2 4.29Å; Y69-F86 HydrophobicContact CG-CE2 4.06Å; Y69-F86 WeakPolarHBondContact O-CE2 3.29Å; Y69-F86 WeakPolarHBondContact O-CZ 3.24Å; Y69-Y91 VanDerWaalsContact C-OH 3.31Å; Y69-Y91 WeakPolarHBondContact CB-OH 3.47Å; Y69-Y91 HydrophobicContact CD2-CE2 4.48Å; Y69-Y91 PolarHBondContact O-OH 3.34Å; Y69-A184 HydrophobicContact CD2-CB 4.2Å; Y69-A184 HydrophobicContact CE2-CB 3.91Å; Y69-T204 PolarHBondContact OH-OG1 3.15Å; Y69-Y205 HydrophobicContact CD1-CE2 4.4Å; Y69-Y205 WeakPolarHBondContact CD1-OH 3.39Å; Y69-Y205 HydrophobicContact CD2-CE2 4.37Å; Y69-Y205 AromaticContact CE1-CE2 3.76Å; Y69-Y205 HydrophobicContact CE1-CE2 3.76Å; Y69-Y205 AromaticContact CE1-CZ 3.88Å; Y69-Y205 WeakPolarHBondContact CE1-OH 3.48Å; Y69-Y205 AromaticContact CE2-CE2 3.7Å; Y69-Y205 HydrophobicContact CE2-CE2 3.7Å; Y69-Y205 AromaticContact CZ-CE2 3.37Å; Y69-Y205 AromaticContact CZ-CZ 4Å; Y69-Y205 WeakPolarHBondContact OH-CE2 3.43Å
70	V	88.7	Confident	95.5	Very high	66 Å²	66	48.5 Å²	48.5	40%	0.4	27%	0.265	S	S	.	.	S	Bend	trans	-87.5	-51.1	-175.1	-179.9	0	0	0	0	111.2	D68 N73	D68-V70 WeakPolarHBondContact OD1-CA 3.45Å; D68-V70 WeakPolarHBondContact OD1-CB 3.37Å; D68-V70 PolarHBondContact OD1-N 2.88Å; V70-N73 PolarHBondContact O-N 3.08Å
71	L	93.3	Very high	95.6	Very high	76 Å²	76	45.2 Å²	45.2	40%	0.398	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-35.3	-174.6	-66.9	-177.9	0	0	0	115.4	F66 D68 N73 E74 A75	F66-L71 HydrophobicContact CD1-CB 3.59Å; F66-L71 HydrophobicContact CE1-CB 3.88Å; D68-L71 PolarHBondContact OD1-N 3.28Å; D68-L71 VanDerWaalsContact OD2-CD1 3.28Å; D68-L71 WeakPolarHBondContact OD2-CD1 3.47Å; D68-L71 WeakPolarHBondContact OD2-CG 3.4Å; L71-N73 VanDerWaalsContact C-N 3.34Å; L71-N73 PolarHBondContact O-N 3.12Å; L71-E74 PolarHBondContact O-N 2.91Å; L71-A75 WeakPolarHBondContact O-CB 3.11Å; L71-A75 PolarHBondContact O-N 2.8Å
72	P	96.6	Very high	95.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.3	-36.9	-178.8	-22.3	30.4	0	0	0	114.2	I38 F66 D68 L76 N84 F86	I38-P72 HydrophobicContact CD1-CG 4.18Å; F66-P72 HydrophobicContact CB-CG 3.75Å; F66-P72 HydrophobicContact CD1-CG 4.14Å; F66-P72 HydrophobicContact CD2-CB 4.11Å; F66-P72 HydrophobicContact CD2-CG 3.89Å; F66-P72 HydrophobicContact CE2-CB 4.34Å; F66-P72 HydrophobicContact CG-CB 4.31Å; F66-P72 HydrophobicContact CG-CG 3.66Å; D68-P72 WeakPolarHBondContact O-CD 3.44Å; D68-P72 WeakPolarHBondContact O-CG 3.15Å; P72-L76 VanDerWaalsContact O-CB 3.3Å; P72-L76 WeakPolarHBondContact O-CB 3.41Å; P72-L76 PolarHBondContact O-N 3.39Å; P72-N84 HydrophobicContact CB-CB 4.42Å; P72-N84 PolarHBondContact O-ND2 3.37Å; P72-F86 HydrophobicContact CB-CD1 3.82Å; P72-F86 HydrophobicContact CB-CE1 3.5Å; P72-F86 VanDerWaalsContact CB-CE1 3.5Å; P72-F86 HydrophobicContact CB-CG 4.49Å; P72-F86 HydrophobicContact CB-CZ 3.91Å; P72-F86 HydrophobicContact CG-CD1 4.24Å; P72-F86 HydrophobicContact CG-CD2 4.47Å; P72-F86 HydrophobicContact CG-CE1 4.06Å; P72-F86 HydrophobicContact CG-CE2 4.29Å; P72-F86 HydrophobicContact CG-CG 4.45Å; P72-F86 HydrophobicContact CG-CZ 4.06Å
73	N	97.8	Very high	95.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-76	-34.8	177.9	-82.1	-21.9	0	0	0	112.2	V70 L71 L76 S77 N84 Q87 Y101 L103	V70-N73 PolarHBondContact O-N 3.08Å; L71-N73 VanDerWaalsContact C-N 3.34Å; L71-N73 PolarHBondContact O-N 3.12Å; N73-L76 PolarHBondContact O-N 2.98Å; N73-S77 VanDerWaalsContact O-CB 3.3Å; N73-S77 WeakPolarHBondContact O-CB 3.33Å; N73-S77 PolarHBondContact O-N 3.17Å; N73-N84 PolarHBondContact OD1-ND2 2.8Å; N73-Q87 PolarHBondContact ND2-OE1 3.15Å; N73-Q87 PolarHBondContact OD1-NE2 3.3Å; N73-Y101 HydrophobicContact CB-CD2 4.22Å; N73-Y101 HydrophobicContact CB-CE2 3.86Å; N73-L103 HydrophobicContact CB-CD1 4.03Å
74	E	95.2	Very high	95.6	Very high	61 Å²	61	40.4 Å²	40.4	29%	0.285	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-48.7	173.2	-170.9	-174.2	158.3	0	0	111.1	L71 L76 S77 K78	L71-E74 PolarHBondContact O-N 2.91Å; E74-L76 VanDerWaalsContact C-N 3.34Å; E74-L76 PolarHBondContact O-N 2.9Å; E74-S77 PolarHBondContact O-N 3.41Å; E74-K78 HydrophobicContact CG-CD 4.16Å; E74-K78 WeakPolarHBondContact O-CB 3.21Å; E74-K78 WeakPolarHBondContact O-CG 3.4Å; E74-K78 PolarHBondContact O-N 3.31Å; E74-K78 WeakPolarHBondContact OE1-CE 3.45Å; E74-K78 IonicContact OE1-NZ 3.1Å; E74-K78 PolarHBondContact OE1-NZ 3.19Å
75	A	96.3	Very high	95.6	Very high	12 Å²	12	38.4 Å²	38.4	10%	0.099	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-43.4	176.4	0	0	0	0	0	111.7	F66 L71 K78 G79 D80 I81	F66-A75 HydrophobicContact CE1-CB 4.07Å; F66-A75 HydrophobicContact CZ-CB 3.67Å; L71-A75 WeakPolarHBondContact O-CB 3.11Å; L71-A75 PolarHBondContact O-N 2.8Å; A75-K78 PolarHBondContact O-N 2.8Å; A75-G79 PolarHBondContact O-N 3.36Å; A75-D80 HydrophobicContact CB-CB 4.19Å; A75-D80 PolarHBondContact O-N 2.9Å; A75-I81 HydrophobicContact CB-CD1 4.05Å; A75-I81 HydrophobicContact CB-CG1 4.08Å
76	L	98.2	Very high	95.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-44.8	177.1	179.9	59.9	0	0	0	111.8	P72 N73 E74 K78 G79 I81 D82 N84 L103 V232 R234	P72-L76 VanDerWaalsContact O-CB 3.3Å; P72-L76 WeakPolarHBondContact O-CB 3.41Å; P72-L76 PolarHBondContact O-N 3.39Å; N73-L76 PolarHBondContact O-N 2.98Å; E74-L76 VanDerWaalsContact C-N 3.34Å; E74-L76 PolarHBondContact O-N 2.9Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.43Å; L76-G79 PolarHBondContact O-N 3.35Å; L76-I81 HydrophobicContact CB-CD1 4.08Å; L76-I81 HydrophobicContact CB-CG1 3.9Å; L76-I81 HydrophobicContact CD1-CG1 4.23Å; L76-I81 WeakPolarHBondContact CD1-O 3.26Å; L76-D82 VanDerWaalsContact CD1-C 3.45Å; L76-D82 VanDerWaalsContact CD1-O 3.32Å; L76-D82 WeakPolarHBondContact CD1-O 3.47Å; L76-N84 VanDerWaalsContact CD2-ND2 3.34Å; L76-N84 WeakPolarHBondContact CD2-ND2 3.39Å; L76-L103 HydrophobicContact CB-CD2 4.39Å; L76-L103 HydrophobicContact CD2-CD1 4.13Å; L76-L103 HydrophobicContact CD2-CD2 3.71Å; L76-L103 HydrophobicContact CD2-CG 4.4Å; L76-L103 HydrophobicContact CG-CD2 3.66Å; L76-V232 HydrophobicContact CD2-CB 4.31Å; L76-V232 HydrophobicContact CD2-CG1 3.93Å; L76-V232 WeakPolarHBondContact CD2-O 3.34Å; L76-R234 HydrophobicContact CD1-CG 4.35Å; L76-R234 HydrophobicContact CG-CG 4.35Å; L76-R234 VanDerWaalsContact O-CD 3.24Å; L76-R234 WeakPolarHBondContact O-CD 3.49Å; L76-R234 VanDerWaalsContact O-CG 3.29Å; L76-R234 WeakPolarHBondContact O-CG 3.21Å; L76-R234 PolarHBondContact O-NH1 3.13Å
77	S	97.2	Very high	95.7	Very high	47 Å²	47	34.3 Å²	34.3	33%	0.329	19%	0.189	S	C	.	.	H	α-helix	trans	-66.3	-30.2	179	-173.4	0	0	0	0	112.9	N73 E74 G79 Y101	N73-S77 VanDerWaalsContact O-CB 3.3Å; N73-S77 WeakPolarHBondContact O-CB 3.33Å; N73-S77 PolarHBondContact O-N 3.17Å; E74-S77 PolarHBondContact O-N 3.41Å; S77-G79 VanDerWaalsContact C-N 3.35Å; S77-Y101 VanDerWaalsContact OG-CD1 3.3Å; S77-Y101 WeakPolarHBondContact OG-CD1 3.3Å
78	K	95.3	Very high	95.9	Very high	135 Å²	135	29.7 Å²	29.7	59%	0.587	16%	0.164	S	C	*	.	H	α-helix	trans	-80.6	-13.7	177.1	-75.3	176.7	174.5	176.9	0	114	E74 A75 L76	E74-K78 HydrophobicContact CG-CD 4.16Å; E74-K78 WeakPolarHBondContact O-CB 3.21Å; E74-K78 WeakPolarHBondContact O-CG 3.4Å; E74-K78 PolarHBondContact O-N 3.31Å; E74-K78 WeakPolarHBondContact OE1-CE 3.45Å; E74-K78 IonicContact OE1-NZ 3.1Å; E74-K78 PolarHBondContact OE1-NZ 3.19Å; A75-K78 PolarHBondContact O-N 2.8Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.43Å
79	G	95.9	Very high	96	Very high	35 Å²	35	32.1 Å²	32.1	36%	0.361	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	5.6	-176	0	0	0	0	0	114.5	A75 L76 S77 I81	A75-G79 PolarHBondContact O-N 3.36Å; L76-G79 PolarHBondContact O-N 3.35Å; S77-G79 VanDerWaalsContact C-N 3.35Å; G79-I81 PolarHBondContact O-N 3.06Å
80	D	96.1	Very high	96.2	Very high	104 Å²	104	31.9 Å²	31.9	56%	0.556	17%	0.174	S	C	*	.	S	Bend	trans	-68.7	-25.5	178.9	-62.7	-29.8	0	0	0	112.1	A75	A75-D80 HydrophobicContact CB-CB 4.19Å; A75-D80 PolarHBondContact O-N 2.9Å
81	I	98.2	Very high	96.5	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	-132.4	157.4	170.4	59.8	179.4	0	0	0	109.8	K34 V64 F66 A75 L76 G79 N84 R234	K34-I81 HydrophobicContact CB-CB 4.29Å; K34-I81 HydrophobicContact CB-CG2 4.26Å; V64-I81 HydrophobicContact CB-CG2 3.84Å; V64-I81 HydrophobicContact CG1-CG2 4.19Å; V64-I81 HydrophobicContact CG2-CG2 3.72Å; F66-I81 HydrophobicContact CE2-CD1 4.07Å; F66-I81 HydrophobicContact CZ-CD1 4.26Å; A75-I81 HydrophobicContact CB-CD1 4.05Å; A75-I81 HydrophobicContact CB-CG1 4.08Å; L76-I81 HydrophobicContact CB-CD1 4.08Å; L76-I81 HydrophobicContact CB-CG1 3.9Å; L76-I81 HydrophobicContact CD1-CG1 4.23Å; L76-I81 WeakPolarHBondContact CD1-O 3.26Å; G79-I81 PolarHBondContact O-N 3.06Å; I81-N84 HydrophobicContact CD1-CB 4.11Å; I81-R234 PolarHBondContact O-NH1 3.49Å
82	D	98.2	Very high	96.7	Very high	13 Å²	13	25.7 Å²	25.7	7%	0.07	14%	0.139	C	C	.	.	S	Bend	trans	-94.4	-30.3	-177.6	-64	-60.6	0	0	0	113.4	K28 I33 K34 L76 R234 N237	K28-D82 IonicContact NZ-OD1 3.63Å; K28-D82 PolarHBondContact NZ-OD1 3.05Å; I33-D82 HydrophobicContact CD1-CB 4.31Å; I33-D82 HydrophobicContact CG1-CB 3.59Å; K34-D82 PolarHBondContact N-OD2 3.44Å; K34-D82 PolarHBondContact O-N 3.26Å; L76-D82 VanDerWaalsContact CD1-C 3.45Å; L76-D82 VanDerWaalsContact CD1-O 3.32Å; L76-D82 WeakPolarHBondContact CD1-O 3.47Å; D82-R234 IonicContact OD1-NH2 3.71Å; D82-N237 PolarHBondContact O-ND2 3.04Å
83	A	98.6	Very high	96.6	Very high	1 Å²	1	29 Å²	29	1%	0.008	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	165.4	173.3	0	0	0	0	0	110.5	I33 K34 V35 G36 I231 V232 T233	I33-A83 HydrophobicContact CD1-CB 4.23Å; K34-A83 PolarHBondContact O-N 2.55Å; K34-A83 VanDerWaalsContact O-N 3.16Å; V35-A83 CarbonylContact C-O 3.57Å; V35-A83 VanDerWaalsContact CA-O 3.3Å; V35-A83 WeakPolarHBondContact CA-O 3.34Å; V35-A83 HydrophobicContact CG1-CB 4.48Å; V35-A83 HydrophobicContact CG2-CB 4.36Å; G36-A83 PolarHBondContact N-O 3.05Å; A83-I231 HydrophobicContact CB-CG2 4.35Å; A83-V232 CarbonylContact C-O 3.57Å; A83-V232 WeakPolarHBondContact CA-O 3.43Å; A83-T233 HydrophobicContact CB-CG2 3.85Å
84	N	98.5	Very high	96.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	154.9	162.4	69.6	45.3	0	0	0	111	G36 P72 N73 L76 I81 F86 Q87 I231 V232	G36-N84 CarbonylContact O-C 3.52Å; G36-N84 WeakPolarHBondContact O-CA 3.31Å; G36-N84 WeakPolarHBondContact O-CB 3.35Å; P72-N84 HydrophobicContact CB-CB 4.42Å; P72-N84 PolarHBondContact O-ND2 3.37Å; N73-N84 PolarHBondContact OD1-ND2 2.8Å; L76-N84 VanDerWaalsContact CD2-ND2 3.34Å; L76-N84 WeakPolarHBondContact CD2-ND2 3.39Å; I81-N84 HydrophobicContact CD1-CB 4.11Å; N84-F86 HydrophobicContact CB-CD1 4.08Å; N84-F86 HydrophobicContact CB-CE1 4.4Å; N84-F86 WeakPolarHBondContact OD1-CD1 3.45Å; N84-F86 WeakPolarHBondContact OD1-CE1 3.1Å; N84-Q87 PolarHBondContact OD1-NE2 3.45Å; N84-I231 CarbonylContact O-C 3.59Å; N84-I231 WeakPolarHBondContact O-CA 3.44Å; N84-V232 PolarHBondContact N-O 3.4Å; N84-V232 PolarHBondContact O-N 3.1Å
85	A	97.8	Very high	96.3	Very high	1 Å²	1	28 Å²	28	1%	0.008	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	86.4	178.6	0	0	0	0	0	109.3	G36 L230 I231 Y250	G36-A85 PolarHBondContact O-N 3.1Å; A85-L230 WeakPolarHBondContact CA-O 3.49Å; A85-I231 HydrophobicContact CB-CG1 4.29Å; A85-Y250 HydrophobicContact CB-CE2 4.3Å
86	F	96.3	Very high	96.2	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.013	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	-15.7	-177	83.2	-77.1	0	0	0	116.5	I38 Y69 P72 N84 Y91 N229	I38-F86 HydrophobicContact CD1-CB 4.3Å; I38-F86 HydrophobicContact CD1-CD2 4.09Å; I38-F86 HydrophobicContact CD1-CG 4.37Å; I38-F86 HydrophobicContact CG1-CB 3.56Å; I38-F86 HydrophobicContact CG1-CD2 4.08Å; I38-F86 HydrophobicContact CG1-CG 4.13Å; Y69-F86 AromaticContact CD1-CD2 3.58Å; Y69-F86 HydrophobicContact CD1-CD2 3.58Å; Y69-F86 AromaticContact CD1-CE2 3.8Å; Y69-F86 HydrophobicContact CD1-CE2 3.8Å; Y69-F86 HydrophobicContact CE1-CD2 4.12Å; Y69-F86 HydrophobicContact CG-CD2 4.29Å; Y69-F86 HydrophobicContact CG-CE2 4.06Å; Y69-F86 WeakPolarHBondContact O-CE2 3.29Å; Y69-F86 WeakPolarHBondContact O-CZ 3.24Å; P72-F86 HydrophobicContact CB-CD1 3.82Å; P72-F86 HydrophobicContact CB-CE1 3.5Å; P72-F86 VanDerWaalsContact CB-CE1 3.5Å; P72-F86 HydrophobicContact CB-CG 4.49Å; P72-F86 HydrophobicContact CB-CZ 3.91Å; P72-F86 HydrophobicContact CG-CD1 4.24Å; P72-F86 HydrophobicContact CG-CD2 4.47Å; P72-F86 HydrophobicContact CG-CE1 4.06Å; P72-F86 HydrophobicContact CG-CE2 4.29Å; P72-F86 HydrophobicContact CG-CG 4.45Å; P72-F86 HydrophobicContact CG-CZ 4.06Å; N84-F86 HydrophobicContact CB-CD1 4.08Å; N84-F86 HydrophobicContact CB-CE1 4.4Å; N84-F86 WeakPolarHBondContact OD1-CD1 3.45Å; N84-F86 WeakPolarHBondContact OD1-CE1 3.1Å; F86-Y91 HydrophobicContact CE2-CE1 4.09Å; F86-Y91 HydrophobicContact CZ-CD1 4.44Å; F86-Y91 HydrophobicContact CZ-CE1 4.01Å; F86-N229 PolarHBondContact O-OD1 3.43Å
87	Q	96.6	Very high	95.9	Very high	3 Å²	3	37.5 Å²	37.5	1%	0.014	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	153	-165.6	68.8	-169.5	-55.8	0	0	111.4	N73 N84 Y91 L92 N229 L230 V232	N73-Q87 PolarHBondContact ND2-OE1 3.15Å; N73-Q87 PolarHBondContact OD1-NE2 3.3Å; N84-Q87 PolarHBondContact OD1-NE2 3.45Å; Q87-Y91 HydrophobicContact CB-CD1 3.81Å; Q87-Y91 HydrophobicContact CB-CG 4.32Å; Q87-L92 HydrophobicContact CG-CB 4.49Å; Q87-N229 VanDerWaalsContact C-OD1 3.24Å; Q87-N229 CarbonylContact O-C 3.6Å; Q87-N229 VanDerWaalsContact O-CA 3.26Å; Q87-N229 WeakPolarHBondContact O-CA 3.45Å; Q87-L230 PolarHBondContact O-N 3.12Å; Q87-V232 HydrophobicContact CG-CG2 4.03Å
88	H	95.8	Very high	95.4	Very high	6 Å²	6	39 Å²	39	3%	0.028	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	166.5	172.5	53.5	65.5	0	0	0	112.8	P90 Y91 L92 T140 N141 Y227 V228 N229	H88-P90 WeakPolarHBondContact ND1-CD 3.32Å; H88-Y91 PolarHBondContact CE1-N 3.33Å; H88-Y91 PolarHBondContact ND1-N 3.49Å; H88-Y91 VanDerWaalsContact ND1-N 3.11Å; H88-Y91 WeakPolarHBondContact O-CB 3.36Å; H88-Y91 PolarHBondContact O-N 3.15Å; H88-Y91 VanDerWaalsContact O-N 3.11Å; H88-L92 PolarHBondContact O-N 3.42Å; H88-T140 PolarHBondContact CE1-OG1 2.92Å; H88-N141 PolarHBondContact NE2-OD1 3.37Å; H88-Y227 AromaticContact CE1-CD1 3.7Å; H88-Y227 AromaticContact CG-CD1 3.95Å; H88-Y227 AromaticContact ND1-CD1 3.73Å; H88-Y227 AromaticContact NE2-CD1 3.91Å; H88-V228 WeakPolarHBondContact CA-O 3.45Å; H88-V228 VanDerWaalsContact CB-O 3.28Å; H88-V228 WeakPolarHBondContact CB-O 3.45Å; H88-N229 PolarHBondContact N-OD1 2.95Å
89	K	94	Very high	95.1	Very high	90 Å²	90	39.2 Å²	39.2	39%	0.391	19%	0.194	S	C	.	.	H	α-helix	trans	-55.8	-46.6	-176.7	-176.5	62.1	162	68.5	0	113.6	Y91 L92 D93 L230	K89-Y91 VanDerWaalsContact C-N 3.32Å; K89-Y91 PolarHBondContact O-N 3.31Å; K89-L92 PolarHBondContact O-N 2.84Å; K89-D93 IonicContact NZ-OD1 2.55Å; K89-D93 PolarHBondContact NZ-OD1 2.74Å; K89-D93 IonicContact NZ-OD2 2.69Å; K89-D93 PolarHBondContact NZ-OD2 2.87Å; K89-D93 VanDerWaalsContact O-CG 3.27Å; K89-D93 PolarHBondContact O-N 2.98Å; K89-L230 HydrophobicContact CB-CD1 3.87Å; K89-L230 HydrophobicContact CD-CD1 4.04Å
90	P	94.9	Very high	95	Very high	15 Å²	15	40.4 Å²	40.4	10%	0.097	21%	0.206	C	C	.	.	H	α-helix	trans	-57.4	-40.9	174.6	-28	36.7	0	0	0	113.7	H88 D93 Q94 T140 L163 Y227	H88-P90 WeakPolarHBondContact ND1-CD 3.32Å; P90-D93 PolarHBondContact O-N 2.78Å; P90-Q94 WeakPolarHBondContact O-CB 3.39Å; P90-Q94 PolarHBondContact O-N 3.22Å; P90-T140 HydrophobicContact CB-CG2 4.28Å; P90-T140 VanDerWaalsContact O-CG2 3.32Å; P90-T140 WeakPolarHBondContact O-CG2 3.19Å; P90-L163 HydrophobicContact CG-CD1 4.01Å; P90-Y227 HydrophobicContact CB-CD1 4.37Å; P90-Y227 HydrophobicContact CB-CE1 4.19Å; P90-Y227 HydrophobicContact CG-CD1 3.83Å; P90-Y227 HydrophobicContact CG-CE1 3.87Å
91	Y	96	Very high	94.9	Very high	8 Å²	8	37.4 Å²	37.4	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-48.1	176.9	-168.7	-86.4	0	0	0	111.4	Y69 F86 Q87 H88 K89 D93 Q94 Q95 D138 T140	Y69-Y91 VanDerWaalsContact C-OH 3.31Å; Y69-Y91 WeakPolarHBondContact CB-OH 3.47Å; Y69-Y91 HydrophobicContact CD2-CE2 4.48Å; Y69-Y91 PolarHBondContact O-OH 3.34Å; F86-Y91 HydrophobicContact CE2-CE1 4.09Å; F86-Y91 HydrophobicContact CZ-CD1 4.44Å; F86-Y91 HydrophobicContact CZ-CE1 4.01Å; Q87-Y91 HydrophobicContact CB-CD1 3.81Å; Q87-Y91 HydrophobicContact CB-CG 4.32Å; H88-Y91 PolarHBondContact CE1-N 3.33Å; H88-Y91 PolarHBondContact ND1-N 3.49Å; H88-Y91 VanDerWaalsContact ND1-N 3.11Å; H88-Y91 WeakPolarHBondContact O-CB 3.36Å; H88-Y91 PolarHBondContact O-N 3.15Å; H88-Y91 VanDerWaalsContact O-N 3.11Å; K89-Y91 VanDerWaalsContact C-N 3.32Å; K89-Y91 PolarHBondContact O-N 3.31Å; Y91-D93 PolarHBondContact O-N 2.66Å; Y91-Q94 PolarHBondContact O-N 2.8Å; Y91-Q95 HydrophobicContact CD1-CG 3.76Å; Y91-Q95 HydrophobicContact CE1-CG 3.45Å; Y91-Q95 VanDerWaalsContact CE1-CG 3.45Å; Y91-Q95 VanDerWaalsContact O-CG 3.32Å; Y91-Q95 WeakPolarHBondContact O-CG 3.36Å; Y91-Q95 PolarHBondContact O-N 3.42Å; Y91-D138 HydrophobicContact CE2-CB 4.2Å; Y91-T140 WeakPolarHBondContact CD2-OG1 3.49Å
92	L	96.8	Very high	94.9	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-57	-50.8	176.7	178.1	61.3	0	0	0	111.1	Q87 H88 K89 Q94 Q95 L96 L103 A105 L230 V232	Q87-L92 HydrophobicContact CG-CB 4.49Å; H88-L92 PolarHBondContact O-N 3.42Å; K89-L92 PolarHBondContact O-N 2.84Å; L92-Q94 VanDerWaalsContact C-N 3.28Å; L92-Q94 PolarHBondContact O-N 3.32Å; L92-Q95 PolarHBondContact O-N 3.5Å; L92-Q95 VanDerWaalsContact O-N 3.1Å; L92-L96 HydrophobicContact CD1-CD1 4.36Å; L92-L96 HydrophobicContact CD1-CD2 4.37Å; L92-L96 HydrophobicContact CD1-CG 4.15Å; L92-L96 HydrophobicContact CG-CD1 4.12Å; L92-L96 HydrophobicContact CG-CG 4.33Å; L92-L96 VanDerWaalsContact O-CG 3.29Å; L92-L96 WeakPolarHBondContact O-CG 3.28Å; L92-L96 PolarHBondContact O-N 2.72Å; L92-L103 HydrophobicContact CD1-CB 4.1Å; L92-A105 HydrophobicContact CD2-CB 4.17Å; L92-L230 HydrophobicContact CD2-CD1 4.01Å; L92-V232 HydrophobicContact CD1-CG1 3.82Å; L92-V232 HydrophobicContact CD1-CG2 4.37Å; L92-V232 HydrophobicContact CD2-CG1 4.23Å; L92-V232 HydrophobicContact CD2-CG2 3.89Å
93	D	94.9	Very high	94.9	Very high	68 Å²	68	43.9 Å²	43.9	36%	0.364	22%	0.215	S	C	.	.	H	α-helix	trans	-58.7	-40.4	-178.9	-69.7	-20.1	0	0	0	112.3	K89 P90 Y91 K97	K89-D93 IonicContact NZ-OD1 2.55Å; K89-D93 PolarHBondContact NZ-OD1 2.74Å; K89-D93 IonicContact NZ-OD2 2.69Å; K89-D93 PolarHBondContact NZ-OD2 2.87Å; K89-D93 VanDerWaalsContact O-CG 3.27Å; K89-D93 PolarHBondContact O-N 2.98Å; P90-D93 PolarHBondContact O-N 2.78Å; Y91-D93 PolarHBondContact O-N 2.66Å; D93-K97 WeakPolarHBondContact O-CB 3.44Å; D93-K97 PolarHBondContact O-N 3.45Å
94	Q	92.3	Very high	94.8	Very high	24 Å²	24	45.5 Å²	45.5	11%	0.112	23%	0.225	C	C	.	.	H	α-helix	trans	-68.2	-40.3	177	-170.1	59.8	41.5	0	0	111.7	P90 Y91 L92 K97 D98 P139 T140 L164	P90-Q94 WeakPolarHBondContact O-CB 3.39Å; P90-Q94 PolarHBondContact O-N 3.22Å; Y91-Q94 PolarHBondContact O-N 2.8Å; L92-Q94 VanDerWaalsContact C-N 3.28Å; L92-Q94 PolarHBondContact O-N 3.32Å; Q94-K97 PolarHBondContact O-N 2.92Å; Q94-D98 PolarHBondContact NE2-OD1 2.9Å; Q94-D98 PolarHBondContact NE2-OD2 3.02Å; Q94-D98 WeakPolarHBondContact O-CB 3.43Å; Q94-D98 PolarHBondContact O-N 3.37Å; Q94-P139 HydrophobicContact CG-CB 4.28Å; Q94-P139 HydrophobicContact CG-CG 4.35Å; Q94-T140 HydrophobicContact CB-CG2 3.65Å; Q94-T140 HydrophobicContact CG-CG2 4.12Å; Q94-L164 VanDerWaalsContact OE1-CD1 3.29Å
95	Q	93.6	Very high	94.8	Very high	16 Å²	16	47.1 Å²	47.1	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-41	175.7	-69.8	-66.6	-57.2	0	0	112.3	Y91 L92 K97 D98 R99 Y101	Y91-Q95 HydrophobicContact CD1-CG 3.76Å; Y91-Q95 HydrophobicContact CE1-CG 3.45Å; Y91-Q95 VanDerWaalsContact CE1-CG 3.45Å; Y91-Q95 VanDerWaalsContact O-CG 3.32Å; Y91-Q95 WeakPolarHBondContact O-CG 3.36Å; Y91-Q95 PolarHBondContact O-N 3.42Å; L92-Q95 PolarHBondContact O-N 3.5Å; L92-Q95 VanDerWaalsContact O-N 3.1Å; Q95-K97 VanDerWaalsContact C-N 3.3Å; Q95-K97 PolarHBondContact O-N 3.11Å; Q95-D98 PolarHBondContact O-N 3.11Å; Q95-R99 VanDerWaalsContact O-CB 3.31Å; Q95-R99 WeakPolarHBondContact O-CB 3.34Å; Q95-R99 PolarHBondContact O-N 2.84Å; Q95-Y101 HydrophobicContact CB-CD2 4.47Å
96	L	95	Very high	94.8	Very high	49 Å²	49	48.7 Å²	48.7	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-58.9	-44.2	173.6	-65.8	176.2	0	0	0	110.9	L92 G100 Y101 L103	L92-L96 HydrophobicContact CD1-CD1 4.36Å; L92-L96 HydrophobicContact CD1-CD2 4.37Å; L92-L96 HydrophobicContact CD1-CG 4.15Å; L92-L96 HydrophobicContact CG-CD1 4.12Å; L92-L96 HydrophobicContact CG-CG 4.33Å; L92-L96 VanDerWaalsContact O-CG 3.29Å; L92-L96 WeakPolarHBondContact O-CG 3.28Å; L92-L96 PolarHBondContact O-N 2.72Å; L96-G100 VanDerWaalsContact O-CA 3.29Å; L96-G100 WeakPolarHBondContact O-CA 3.34Å; L96-G100 PolarHBondContact O-N 2.9Å; L96-Y101 WeakPolarHBondContact CD2-O 3.2Å; L96-L103 HydrophobicContact CD2-CB 3.95Å; L96-L103 WeakPolarHBondContact CD2-O 3.39Å
97	K	91.7	Very high	94.7	Very high	163 Å²	163	48.7 Å²	48.7	71%	0.709	25%	0.248	S	C	*	.	H	α-helix	trans	-66.1	-44.2	178.1	-176.3	-178.9	176	-175.4	0	113	D93 Q94 Q95	D93-K97 WeakPolarHBondContact O-CB 3.44Å; D93-K97 PolarHBondContact O-N 3.45Å; Q94-K97 PolarHBondContact O-N 2.92Å; Q95-K97 VanDerWaalsContact C-N 3.3Å; Q95-K97 PolarHBondContact O-N 3.11Å
98	D	86.3	Confident	94.6	Very high	78 Å²	78	49.2 Å²	49.2	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-84.3	-28.7	-172.2	-70.5	-15.5	0	0	0	113.6	Q94 Q95	Q94-D98 PolarHBondContact NE2-OD1 2.9Å; Q94-D98 PolarHBondContact NE2-OD2 3.02Å; Q94-D98 WeakPolarHBondContact O-CB 3.43Å; Q94-D98 PolarHBondContact O-N 3.37Å; Q95-D98 PolarHBondContact O-N 3.11Å
99	R	90.3	Very high	94.5	Very high	140 Å²	140	49.3 Å²	49.3	53%	0.528	25%	0.252	S	S	.	.	H	α-helix	trans	-113.6	-12.2	-174.4	-57	-61.2	-173.6	-145.1	3.8	114	Q95 Y101	Q95-R99 VanDerWaalsContact O-CB 3.31Å; Q95-R99 WeakPolarHBondContact O-CB 3.34Å; Q95-R99 PolarHBondContact O-N 2.84Å; R99-Y101 HydrophobicContact CB-CD1 4.04Å; R99-Y101 HydrophobicContact CB-CD2 3.59Å; R99-Y101 HydrophobicContact CB-CE1 3.86Å; R99-Y101 HydrophobicContact CB-CE2 3.39Å; R99-Y101 HydrophobicContact CB-CG 3.91Å; R99-Y101 HydrophobicContact CG-CD2 4.2Å; R99-Y101 HydrophobicContact CG-CE2 3.57Å; R99-Y101 PolarHBondContact O-N 2.91Å
100	G	92.1	Very high	94.4	Very high	60 Å²	60	45.3 Å²	45.3	62%	0.619	24%	0.235	S	C	*	.			trans	65.7	23.8	-177.9	0	0	0	0	0	113.6	L96	L96-G100 VanDerWaalsContact O-CA 3.29Å; L96-G100 WeakPolarHBondContact O-CA 3.34Å; L96-G100 PolarHBondContact O-N 2.9Å
101	Y	95.3	Very high	94.3	Very high	41 Å²	41	45 Å²	45	16%	0.161	23%	0.232	C	C	.	.			trans	-64.7	152.2	178.1	-58.5	-48.5	0	0	0	111.4	N73 S77 Q95 L96 R99 L103	N73-Y101 HydrophobicContact CB-CD2 4.22Å; N73-Y101 HydrophobicContact CB-CE2 3.86Å; S77-Y101 VanDerWaalsContact OG-CD1 3.3Å; S77-Y101 WeakPolarHBondContact OG-CD1 3.3Å; Q95-Y101 HydrophobicContact CB-CD2 4.47Å; L96-Y101 WeakPolarHBondContact CD2-O 3.2Å; R99-Y101 HydrophobicContact CB-CD1 4.04Å; R99-Y101 HydrophobicContact CB-CD2 3.59Å; R99-Y101 HydrophobicContact CB-CE1 3.86Å; R99-Y101 HydrophobicContact CB-CE2 3.39Å; R99-Y101 HydrophobicContact CB-CG 3.91Å; R99-Y101 HydrophobicContact CG-CD2 4.2Å; R99-Y101 HydrophobicContact CG-CE2 3.57Å; R99-Y101 PolarHBondContact O-N 2.91Å; Y101-L103 HydrophobicContact CD2-CD1 4.11Å; Y101-L103 HydrophobicContact CG-CD1 4.26Å
102	K	97	Very high	94	Very high	148 Å²	148	44.8 Å²	44.8	64%	0.643	23%	0.231	S	C	*	.			trans	-102	65.2	173	-63.7	-172.1	179.7	-175.1	0	110.4	R234 E235	K102-R234 WeakPolarHBondContact O-CA 3.46Å; K102-E235 HydrophobicContact CB-CG 4.26Å; K102-E235 PolarHBondContact O-N 3.25Å
103	L	98.3	Very high	93.9	Very high	4 Å²	4	45 Å²	45	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	146.6	-177.8	-53.3	177.5	0	0	0	110.8	N73 L76 L92 L96 Y101 V232 T233 R234	N73-L103 HydrophobicContact CB-CD1 4.03Å; L76-L103 HydrophobicContact CB-CD2 4.39Å; L76-L103 HydrophobicContact CD2-CD1 4.13Å; L76-L103 HydrophobicContact CD2-CD2 3.71Å; L76-L103 HydrophobicContact CD2-CG 4.4Å; L76-L103 HydrophobicContact CG-CD2 3.66Å; L92-L103 HydrophobicContact CD1-CB 4.1Å; L96-L103 HydrophobicContact CD2-CB 3.95Å; L96-L103 WeakPolarHBondContact CD2-O 3.39Å; Y101-L103 HydrophobicContact CD2-CD1 4.11Å; Y101-L103 HydrophobicContact CG-CD1 4.26Å; L103-V232 HydrophobicContact CB-CG1 3.75Å; L103-V232 HydrophobicContact CD1-CG1 4.49Å; L103-T233 CarbonylContact C-O 3.56Å; L103-T233 VanDerWaalsContact CA-O 3.23Å; L103-T233 WeakPolarHBondContact CA-O 3.18Å; L103-R234 HydrophobicContact CD2-CB 4.45Å; L103-R234 HydrophobicContact CD2-CG 3.87Å
104	V	98.2	Very high	93.9	Very high	35 Å²	35	41.7 Å²	41.7	21%	0.212	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.3	-178.4	-68.8	0	0	0	0	111	V106 V232 T233 E235 K238	V104-V106 HydrophobicContact CG2-CG1 4.4Å; V104-V232 WeakPolarHBondContact O-CA 3.27Å; V104-V232 WeakPolarHBondContact O-CG1 3.38Å; V104-T233 PolarHBondContact N-O 2.65Å; V104-T233 PolarHBondContact O-N 2.66Å; V104-E235 HydrophobicContact CG1-CG 3.56Å; V104-E235 HydrophobicContact CG2-CG 4.49Å; V104-K238 HydrophobicContact CG2-CB 3.66Å; V104-K238 HydrophobicContact CG2-CD 4.05Å; V104-K238 HydrophobicContact CG2-CG 4.47Å
105	A	97.9	Very high	94.1	Very high	33 Å²	33	40.6 Å²	40.6	27%	0.273	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	130.3	171.4	0	0	0	0	0	109.9	L92 L230 I231	L92-A105 HydrophobicContact CD2-CB 4.17Å; A105-L230 HydrophobicContact CB-CB 4.47Å; A105-L230 HydrophobicContact CB-CD1 3.86Å; A105-L230 HydrophobicContact CB-CD2 4.36Å; A105-L230 HydrophobicContact CB-CG 4.47Å; A105-I231 WeakPolarHBondContact CA-O 3.37Å
106	V	97.9	Very high	94.3	Very high	35 Å²	35	39.8 Å²	39.8	21%	0.212	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-8.8	179.3	-65.8	0	0	0	0	113.3	V104 I231 T233 K238 V243 V247	V104-V106 HydrophobicContact CG2-CG1 4.4Å; V106-I231 HydrophobicContact CG2-CB 4.06Å; V106-I231 HydrophobicContact CG2-CG2 3.7Å; V106-I231 WeakPolarHBondContact CG2-O 3.24Å; V106-I231 PolarHBondContact N-O 3.27Å; V106-T233 HydrophobicContact CB-CG2 4.48Å; V106-T233 HydrophobicContact CG1-CG2 4.04Å; V106-T233 VanDerWaalsContact CG1-OG1 3.28Å; V106-T233 WeakPolarHBondContact CG1-OG1 3.37Å; V106-T233 HydrophobicContact CG2-CG2 3.63Å; V106-K238 HydrophobicContact CG1-CB 3.81Å; V106-V243 HydrophobicContact CB-CG1 4.28Å; V106-V243 HydrophobicContact CG1-CG1 4.4Å; V106-V243 HydrophobicContact CG2-CG1 3.91Å; V106-V247 HydrophobicContact CB-CG2 4.42Å; V106-V247 HydrophobicContact CG2-CG2 3.89Å
107	G	94.6	Very high	94.5	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.3	164.1	175.2	0	0	0	0	0	112.1	L230 I231	G107-L230 CarbonylContact O-C 3.57Å; G107-L230 VanDerWaalsContact O-CA 3.32Å; G107-L230 WeakPolarHBondContact O-CA 3.43Å; G107-I231 PolarHBondContact N-O 2.93Å; G107-I231 PolarHBondContact O-N 2.94Å
108	N	93.4	Very high	94.8	Very high	15 Å²	15	31 Å²	31	8%	0.08	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.6	170.6	-66.2	-2.3	0	0	0	110.8	V228 L230 Q251 G270 R272	N108-V228 HydrophobicContact CB-CG2 4.1Å; N108-L230 WeakPolarHBondContact OD1-CD2 3.34Å; N108-Q251 PolarHBondContact O-NE2 3.32Å; N108-G270 PolarHBondContact ND2-O 3.23Å; N108-G270 VanDerWaalsContact ND2-O 3.15Å; N108-R272 PolarHBondContact ND2-O 3.49Å
109	T	93.6	Very high	95.3	Very high	8 Å²	8	33.6 Å²	33.6	5%	0.049	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-103.1	169.3	63.1	0	0	0	0	109.9	N229 I231 Y250 G270	T109-N229 PolarHBondContact N-O 3.34Å; T109-N229 WeakPolarHBondContact OG1-CB 3.48Å; T109-N229 PolarHBondContact OG1-O 2.92Å; T109-I231 HydrophobicContact CG2-CD1 4.18Å; T109-I231 HydrophobicContact CG2-CG1 3.61Å; T109-Y250 HydrophobicContact CG2-CD1 3.53Å; T109-Y250 HydrophobicContact CG2-CE1 3.32Å; T109-Y250 HydrophobicContact CG2-CG 4.37Å; T109-G270 PolarHBondContact O-N 3.32Å
110	F	92.6	Very high	95.5	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.026	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.8	-173.7	-52.1	-71.2	0	0	0	111	V45 Y112 N229 Y250 V255 Y256 A259 A267 V268	V45-F110 HydrophobicContact CG1-CE2 3.87Å; F110-Y112 HydrophobicContact CB-CD1 4.26Å; F110-Y112 HydrophobicContact CB-CE1 3.68Å; F110-Y112 HydrophobicContact CD2-CE1 4.33Å; F110-Y112 WeakPolarHBondContact CD2-OH 3.32Å; F110-Y112 HydrophobicContact CG-CE1 4.31Å; F110-N229 WeakPolarHBondContact O-CB 3.44Å; F110-N229 PolarHBondContact O-N 3.45Å; F110-N229 PolarHBondContact O-ND2 2.53Å; F110-Y250 HydrophobicContact CD2-CE1 4.31Å; F110-Y250 HydrophobicContact CE2-CD1 4.38Å; F110-Y250 AromaticContact CE2-CE1 3.75Å; F110-Y250 HydrophobicContact CE2-CE1 3.75Å; F110-V255 HydrophobicContact CE2-CG1 4.19Å; F110-V255 HydrophobicContact CZ-CG1 4.12Å; F110-Y256 HydrophobicContact CD1-CD2 4.25Å; F110-Y256 AromaticContact CE1-CD2 3.69Å; F110-Y256 HydrophobicContact CE1-CD2 3.69Å; F110-Y256 HydrophobicContact CE1-CG 4.46Å; F110-A259 HydrophobicContact CD1-CB 4.38Å; F110-A259 HydrophobicContact CD2-CB 3.95Å; F110-A259 HydrophobicContact CE1-CB 4.14Å; F110-A259 HydrophobicContact CE2-CB 3.62Å; F110-A259 HydrophobicContact CG-CB 4.31Å; F110-A259 HydrophobicContact CZ-CB 3.73Å; F110-A267 HydrophobicContact CB-CB 4.42Å; F110-A267 HydrophobicContact CG-CB 4.46Å; F110-V268 CarbonylContact C-O 3.48Å; F110-V268 VanDerWaalsContact CA-O 3.31Å; F110-V268 WeakPolarHBondContact CA-O 3.4Å
111	V	91.4	Very high	95.7	Very high	7 Å²	7	29.5 Å²	29.5	4%	0.042	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	128.1	160.2	171.7	0	0	0	0	107.3	P113 V228 V268	V111-P113 HydrophobicContact CG1-CG 4.44Å; V111-V228 HydrophobicContact CG2-CB 3.82Å; V111-V228 HydrophobicContact CG2-CG2 4.15Å; V111-V268 HydrophobicContact CB-CB 4.19Å; V111-V268 PolarHBondContact N-O 2.92Å; V111-V268 PolarHBondContact O-N 3.08Å
112	Y	91.3	Very high	95.6	Very high	5 Å²	5	36.4 Å²	36.4	2%	0.02	18%	0.177	C	C	.	.			trans	-112	102.1	170.2	-55.7	-55	0	0	0	108.5	E42 F110 I114 R144 N229 F263 A267	E42-Y112 HydrophobicContact CG-CE2 3.8Å; F110-Y112 HydrophobicContact CB-CD1 4.26Å; F110-Y112 HydrophobicContact CB-CE1 3.68Å; F110-Y112 HydrophobicContact CD2-CE1 4.33Å; F110-Y112 WeakPolarHBondContact CD2-OH 3.32Å; F110-Y112 HydrophobicContact CG-CE1 4.31Å; Y112-I114 PolarHBondContact O-N 3.37Å; Y112-R144 PolarHBondContact O-NH2 2.9Å; Y112-N229 VanDerWaalsContact CD2-ND2 3.29Å; Y112-N229 WeakPolarHBondContact CD2-ND2 3.48Å; Y112-F263 HydrophobicContact CD1-CD1 4.31Å; Y112-F263 HydrophobicContact CD1-CD2 4.25Å; Y112-F263 HydrophobicContact CD1-CE1 4.17Å; Y112-F263 HydrophobicContact CD1-CE2 4.11Å; Y112-F263 HydrophobicContact CD1-CG 4.34Å; Y112-F263 HydrophobicContact CD1-CZ 4.05Å; Y112-F263 HydrophobicContact CE1-CD1 4.43Å; Y112-F263 AromaticContact CE1-CD2 3.64Å; Y112-F263 HydrophobicContact CE1-CD2 3.64Å; Y112-F263 HydrophobicContact CE1-CE1 4.18Å; Y112-F263 AromaticContact CE1-CE2 3.33Å; Y112-F263 HydrophobicContact CE1-CE2 3.33Å; Y112-F263 HydrophobicContact CE1-CG 4.18Å; Y112-F263 AromaticContact CE1-CZ 3.61Å; Y112-F263 HydrophobicContact CE1-CZ 3.61Å; Y112-F263 HydrophobicContact CE2-CZ 4.3Å; Y112-F263 AromaticContact CZ-CE2 3.6Å; Y112-F263 AromaticContact CZ-CZ 3.74Å; Y112-A267 HydrophobicContact CD1-CB 4.16Å; Y112-A267 HydrophobicContact CE1-CB 3.81Å
113	P	93.1	Very high	95.5	Very high	7 Å²	7	31.2 Å²	31.2	5%	0.045	16%	0.16	C	C	.	.			trans	-61.2	124.3	-177.5	-25.7	36.3	0	0	0	112.3	V111 T203 P213 V220 E221 G266	V111-P113 HydrophobicContact CG1-CG 4.44Å; P113-T203 PolarHBondContact O-OG1 2.92Å; P113-P213 WeakPolarHBondContact O-CG 3.45Å; P113-V220 HydrophobicContact CB-CG1 3.9Å; P113-E221 HydrophobicContact CB-CB 4.12Å; P113-E221 WeakPolarHBondContact CB-O 3.29Å; P113-G266 WeakPolarHBondContact CD-O 3.32Å
114	I	95.7	Very high	95.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.			trans	-72.1	149.8	173.7	-163.8	167.7	0	0	0	110.1	Y112 P136 R144 L148 V200 I201 E221	Y112-I114 PolarHBondContact O-N 3.37Å; I114-P136 HydrophobicContact CD1-CG 4.36Å; I114-R144 HydrophobicContact CG2-CG 3.91Å; I114-L148 HydrophobicContact CG2-CD2 3.87Å; I114-V200 HydrophobicContact CD1-CG1 3.78Å; I114-V200 HydrophobicContact CG1-CG1 3.8Å; I114-I201 WeakPolarHBondContact CG1-O 3.19Å; I114-E221 HydrophobicContact CG2-CB 4.01Å; I114-E221 WeakPolarHBondContact O-CB 3.37Å; I114-E221 PolarHBondContact O-N 2.89Å
115	A	97.1	Very high	95.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	156.2	-177.5	0	0	0	0	0	112.7	Y117 V200 I201 P213 F219 V220	A115-Y117 HydrophobicContact CB-CD2 4.45Å; A115-Y117 HydrophobicContact CB-CE1 4.44Å; A115-Y117 HydrophobicContact CB-CE2 3.7Å; A115-Y117 VanDerWaalsContact O-CD2 3.31Å; A115-Y117 WeakPolarHBondContact O-CD2 3.23Å; A115-Y117 WeakPolarHBondContact O-CE2 3.13Å; A115-V200 CarbonylContact O-C 3.56Å; A115-V200 WeakPolarHBondContact O-CA 3.37Å; A115-I201 PolarHBondContact O-N 3.11Å; A115-P213 HydrophobicContact CB-CB 3.99Å; A115-P213 HydrophobicContact CB-CG 4.38Å; A115-F219 CarbonylContact C-O 3.47Å; A115-F219 VanDerWaalsContact CA-O 3.24Å; A115-F219 WeakPolarHBondContact CA-O 3.1Å; A115-F219 VanDerWaalsContact CB-O 3.29Å; A115-F219 WeakPolarHBondContact CB-O 3.31Å; A115-V220 HydrophobicContact CB-CB 4.33Å; A115-V220 HydrophobicContact CB-CG1 4.33Å; A115-V220 HydrophobicContact CB-CG2 3.94Å
116	G	98.2	Very high	95.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	130.1	169.4	0	0	0	0	0	111.4	A199 G217 I218 F219	G116-A199 CarbonylContact C-O 3.6Å; G116-A199 WeakPolarHBondContact CA-O 3.39Å; G116-G217 CarbonylContact O-C 3.59Å; G116-G217 WeakPolarHBondContact O-CA 3.3Å; G116-I218 PolarHBondContact O-N 2.88Å; G116-F219 PolarHBondContact N-O 3.2Å
117	Y	98.2	Very high	95	Very high	2 Å²	2	39 Å²	39	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.9	-179.1	-58.8	-87.6	0	0	0	110.7	A115 L191 L198 A199 I201 A206 L211 P213 D216	A115-Y117 HydrophobicContact CB-CD2 4.45Å; A115-Y117 HydrophobicContact CB-CE1 4.44Å; A115-Y117 HydrophobicContact CB-CE2 3.7Å; A115-Y117 VanDerWaalsContact O-CD2 3.31Å; A115-Y117 WeakPolarHBondContact O-CD2 3.23Å; A115-Y117 WeakPolarHBondContact O-CE2 3.13Å; Y117-L191 WeakPolarHBondContact O-CD2 3.29Å; Y117-L198 WeakPolarHBondContact O-CA 3.44Å; Y117-L198 WeakPolarHBondContact O-CD1 3.44Å; Y117-A199 PolarHBondContact N-O 3.07Å; Y117-A199 PolarHBondContact O-N 3.33Å; Y117-I201 HydrophobicContact CD2-CB 3.86Å; Y117-I201 HydrophobicContact CD2-CD1 4.04Å; Y117-I201 HydrophobicContact CD2-CG1 3.82Å; Y117-I201 HydrophobicContact CE2-CB 3.98Å; Y117-I201 HydrophobicContact CE2-CG1 4.46Å; Y117-A206 HydrophobicContact CE2-CB 3.83Å; Y117-L211 HydrophobicContact CD1-CB 4.22Å; Y117-L211 HydrophobicContact CD1-CD1 3.89Å; Y117-L211 HydrophobicContact CE1-CB 3.94Å; Y117-L211 HydrophobicContact CE1-CD1 4.42Å; Y117-L211 HydrophobicContact CG-CD1 4.1Å; Y117-P213 WeakPolarHBondContact OH-CA 3.24Å; Y117-P213 WeakPolarHBondContact OH-CD 3.28Å; Y117-P213 WeakPolarHBondContact OH-CG 3.49Å; Y117-P213 VanDerWaalsContact OH-N 3.15Å; Y117-D216 HydrophobicContact CD1-CB 3.98Å; Y117-D216 WeakPolarHBondContact CD1-O 3.49Å; Y117-D216 HydrophobicContact CE1-CB 4Å
118	S	97.8	Very high	95	Very high	26 Å²	26	46 Å²	46	18%	0.182	22%	0.224	C	C	.	.			trans	-146.5	148.8	170.8	-174.9	0	0	0	0	111.5	K120 I121 A197 I218	S118-K120 PolarHBondContact OG-N 3.41Å; S118-I121 VanDerWaalsContact CB-CG1 3.46Å; S118-I121 WeakPolarHBondContact OG-CG1 3.3Å; S118-I121 PolarHBondContact OG-N 3.48Å; S118-I121 VanDerWaalsContact OG-N 3.09Å; S118-A197 VanDerWaalsContact CB-O 3.26Å; S118-A197 WeakPolarHBondContact CB-O 3.18Å; S118-A197 PolarHBondContact OG-O 2.93Å; S118-I218 VanDerWaalsContact CB-CD1 3.48Å
119	K	96.3	Very high	95.2	Very high	132 Å²	132	51 Å²	51	57%	0.574	25%	0.25	S	S	*	.	S	Bend	trans	-95.2	-6.7	164.4	-68.8	-174.1	-179.5	-177.8	0	113.2	L191 D192	K119-L191 HydrophobicContact CD-CB 4.16Å; K119-L191 HydrophobicContact CG-CB 4.2Å; K119-D192 IonicContact NZ-OD1 3.75Å; K119-D192 PolarHBondContact NZ-OD1 3.06Å; K119-D192 IonicContact NZ-OD2 3.54Å
120	K	95	Very high	95.3	Very high	97 Å²	97	52 Å²	52	42%	0.422	26%	0.262	S	S	.	.	S	Bend	trans	-112.3	-32.7	-170.7	-64.5	-179.1	-171.7	153.9	0	114.1	S118 D193 A194 I196	S118-K120 PolarHBondContact OG-N 3.41Å; K120-D193 PolarHBondContact NZ-O 3.13Å; K120-A194 VanDerWaalsContact NZ-CA 3.35Å; K120-A194 PolarHBondContact NZ-O 2.74Å; K120-I196 WeakPolarHBondContact CE-O 3.37Å; K120-I196 PolarHBondContact NZ-O 3.39Å
121	I	95.9	Very high	95.6	Very high	16 Å²	16	52.5 Å²	52.5	8%	0.082	27%	0.266	C	S	.	.			trans	-118.9	147.3	179.7	59.3	164.9	0	0	0	110.1	S118 E126 L127 L198 I218	S118-I121 VanDerWaalsContact CB-CG1 3.46Å; S118-I121 WeakPolarHBondContact OG-CG1 3.3Å; S118-I121 PolarHBondContact OG-N 3.48Å; S118-I121 VanDerWaalsContact OG-N 3.09Å; I121-E126 WeakPolarHBondContact CA-OE2 3.43Å; I121-E126 HydrophobicContact CB-CB 3.85Å; I121-E126 HydrophobicContact CG2-CB 3.65Å; I121-L127 HydrophobicContact CD1-CB 4.18Å; I121-L127 HydrophobicContact CD1-CD1 3.96Å; I121-L198 HydrophobicContact CD1-CD1 4.5Å; I121-I218 HydrophobicContact CD1-CD1 4.15Å; I121-I218 HydrophobicContact CG1-CD1 3.83Å; I121-I218 WeakPolarHBondContact O-CD1 3.2Å
122	K	94.4	Very high	95.9	Very high	186 Å²	186	54 Å²	54	81%	0.809	27%	0.273	S	S	*	.	S	Bend	trans	-101.5	-20.2	175.2	-62.5	-179.3	-179.5	178.5	0	113	E126	K122-E126 PolarHBondContact N-OE2 3.49Å
123	S	95.5	Very high	96.2	Very high	40 Å²	40	53.8 Å²	53.8	28%	0.28	27%	0.272	S	S	.	.	S	Bend	trans	-141.8	159.2	-178.3	64.2	0	0	0	0	110.7	D125 E126	S123-D125 PolarHBondContact O-N 3.02Å; S123-E126 PolarHBondContact N-OE1 3.04Å; S123-E126 PolarHBondContact O-N 2.85Å; S123-E126 PolarHBondContact OG-OE1 2.9Å
124	L	95.1	Very high	96.5	Very high	36 Å²	36	53.5 Å²	53.5	19%	0.188	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-65.2	-23.4	177.8	-69.2	-177.7	0	0	0	113.1	E126 L127 V152 L154 I218 F219	L124-E126 PolarHBondContact O-N 3.34Å; L124-L127 VanDerWaalsContact O-CB 3.24Å; L124-L127 WeakPolarHBondContact O-CB 3.48Å; L124-L127 PolarHBondContact O-N 3.32Å; L124-V152 HydrophobicContact CD1-CB 3.84Å; L124-V152 HydrophobicContact CD1-CG2 4.02Å; L124-L154 HydrophobicContact CD2-CD1 3.96Å; L124-L154 HydrophobicContact CD2-CD2 4.48Å; L124-I218 HydrophobicContact CD2-CG2 3.82Å; L124-I218 HydrophobicContact CG-CG2 3.92Å; L124-F219 HydrophobicContact CD1-CD1 4.18Å; L124-F219 HydrophobicContact CD2-CD1 3.77Å; L124-F219 HydrophobicContact CD2-CE1 3.81Å; L124-F219 HydrophobicContact CG-CD1 4.31Å
125	D	94.1	Very high	96.6	Very high	147 Å²	147	53.5 Å²	53.5	79%	0.786	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-67.6	-26.2	179.1	-62.2	-27.1	0	0	0	112.4	S123 L127	S123-D125 PolarHBondContact O-N 3.02Å; D125-L127 VanDerWaalsContact C-N 3.27Å; D125-L127 PolarHBondContact O-N 3.23Å
126	E	96.1	Very high	96.5	Very high	86 Å²	86	53.5 Å²	53.5	40%	0.402	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-78.3	-8.8	176.6	-68.1	162.4	-128.9	0	0	113.2	I121 K122 S123 L124 Q128	I121-E126 WeakPolarHBondContact CA-OE2 3.43Å; I121-E126 HydrophobicContact CB-CB 3.85Å; I121-E126 HydrophobicContact CG2-CB 3.65Å; K122-E126 PolarHBondContact N-OE2 3.49Å; S123-E126 PolarHBondContact N-OE1 3.04Å; S123-E126 PolarHBondContact O-N 2.85Å; S123-E126 PolarHBondContact OG-OE1 2.9Å; L124-E126 PolarHBondContact O-N 3.34Å; E126-Q128 PolarHBondContact O-N 2.78Å
127	L	95.5	Very high	96.3	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	29%	0.288	C	S	.	.			trans	-70.4	114.4	-179.5	-168.6	67.3	0	0	0	110.4	I121 L124 D125 L154 K175 L177 A197	I121-L127 HydrophobicContact CD1-CB 4.18Å; I121-L127 HydrophobicContact CD1-CD1 3.96Å; L124-L127 VanDerWaalsContact O-CB 3.24Å; L124-L127 WeakPolarHBondContact O-CB 3.48Å; L124-L127 PolarHBondContact O-N 3.32Å; D125-L127 VanDerWaalsContact C-N 3.27Å; D125-L127 PolarHBondContact O-N 3.23Å; L127-L154 HydrophobicContact CD2-CD1 4.28Å; L127-L154 HydrophobicContact CD2-CD2 3.77Å; L127-K175 HydrophobicContact CB-CD 4.32Å; L127-K175 HydrophobicContact CD2-CD 4.25Å; L127-K175 HydrophobicContact CG-CD 4.39Å; L127-K175 WeakPolarHBondContact O-CE 3.28Å; L127-K175 PolarHBondContact O-NZ 3.09Å; L127-L177 HydrophobicContact CD2-CD1 3.95Å; L127-L177 HydrophobicContact CD2-CD2 3.58Å; L127-L177 HydrophobicContact CD2-CG 4.43Å; L127-L177 HydrophobicContact CG-CD2 3.96Å; L127-A197 HydrophobicContact CD1-CB 3.71Å
128	Q	95.6	Very high	95.9	Very high	149 Å²	149	57.7 Å²	57.7	70%	0.696	29%	0.293	S	S	*	.			trans	-76.5	155.6	-178.7	-63.2	-179.3	-13.6	0	0	112.2	E126 S131	E126-Q128 PolarHBondContact O-N 2.78Å; Q128-S131 PolarHBondContact N-OG 3.36Å; Q128-S131 WeakPolarHBondContact O-CB 3.42Å; Q128-S131 PolarHBondContact O-N 3.3Å; Q128-S131 PolarHBondContact O-OG 3.31Å
129	D	96.5	Very high	95.6	Very high	118 Å²	118	59.3 Å²	59.3	63%	0.631	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	138.7	173.3	-66.5	-3.6	0	0	0	110.9	S131 K175	D129-S131 PolarHBondContact O-N 3.06Å; D129-K175 CarbonylContact C-O 3.51Å; D129-K175 WeakPolarHBondContact CA-O 3.47Å
130	G	96.4	Very high	95.5	Very high	29 Å²	29	53 Å²	53	30%	0.299	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	0.3	-177.2	0	0	0	0	0	115.2	K175 N176	G130-K175 PolarHBondContact N-O 3.28Å; G130-N176 WeakPolarHBondContact CA-O 3.22Å
131	S	97.6	Very high	95.5	Very high	17 Å²	17	48.5 Å²	48.5	12%	0.119	26%	0.256	C	S	.	.			trans	-55.2	145	177.6	-70	0	0	0	0	112.3	Q128 D129 L177 K178	Q128-S131 PolarHBondContact N-OG 3.36Å; Q128-S131 WeakPolarHBondContact O-CB 3.42Å; Q128-S131 PolarHBondContact O-N 3.3Å; Q128-S131 PolarHBondContact O-OG 3.31Å; D129-S131 PolarHBondContact O-N 3.06Å; S131-L177 WeakPolarHBondContact O-CA 3.43Å; S131-K178 PolarHBondContact O-N 3.47Å
132	Q	98	Very high	95.6	Very high	40 Å²	40	48.1 Å²	48.1	19%	0.187	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.8	175	-52.5	-168.5	23	0	0	111	K178 V180 Q195 I196 A197	Q132-K178 CarbonylContact C-O 3.59Å; Q132-K178 VanDerWaalsContact CA-O 3.27Å; Q132-K178 WeakPolarHBondContact CA-O 3.44Å; Q132-K178 HydrophobicContact CB-CB 4.48Å; Q132-K178 HydrophobicContact CG-CB 4.06Å; Q132-K178 HydrophobicContact CG-CD 4.35Å; Q132-V180 HydrophobicContact CB-CG2 4Å; Q132-V180 HydrophobicContact CG-CG2 4.45Å; Q132-V180 VanDerWaalsContact OE1-CG2 3.3Å; Q132-Q195 WeakPolarHBondContact CB-O 3.31Å; Q132-I196 HydrophobicContact CB-CD1 3.78Å; Q132-A197 PolarHBondContact O-N 3.35Å
133	V	98.4	Very high	95.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	114.3	176.4	-178.9	0	0	0	0	108.7	V135 L149 L177 K178 I179 V180 L198	V133-V135 HydrophobicContact CG1-CG1 4.32Å; V133-L149 HydrophobicContact CG1-CD1 4.29Å; V133-L149 HydrophobicContact CG1-CD2 4.25Å; V133-L177 HydrophobicContact CG2-CB 4.38Å; V133-L177 HydrophobicContact CG2-CD1 4.14Å; V133-L177 HydrophobicContact CG2-CD2 4.42Å; V133-K178 PolarHBondContact N-O 2.67Å; V133-I179 HydrophobicContact CB-CD1 4.01Å; V133-I179 CarbonylContact O-C 3.55Å; V133-I179 WeakPolarHBondContact O-CA 3.39Å; V133-V180 PolarHBondContact O-N 2.79Å; V133-L198 CarbonylContact C-O 3.54Å; V133-L198 VanDerWaalsContact CA-O 3.27Å; V133-L198 WeakPolarHBondContact CA-O 3.48Å; V133-L198 HydrophobicContact CG1-CB 4.39Å; V133-L198 HydrophobicContact CG1-CD2 3.86Å; V133-L198 HydrophobicContact CG1-CG 4.26Å; V133-L198 HydrophobicContact CG2-CB 4.3Å; V133-L198 HydrophobicContact CG2-CD2 4.14Å
134	A	98.1	Very high	95.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.6	177.6	0	0	0	0	0	111.1	V180 L182 L187 I196 L198 A199 V200	A134-V180 CarbonylContact C-O 3.54Å; A134-V180 VanDerWaalsContact CA-O 3.25Å; A134-V180 WeakPolarHBondContact CA-O 3.3Å; A134-L182 HydrophobicContact CB-CD1 4.03Å; A134-L187 HydrophobicContact CB-CD2 3.78Å; A134-I196 HydrophobicContact CB-CD1 4.06Å; A134-I196 HydrophobicContact CB-CG1 4.45Å; A134-I196 HydrophobicContact CB-CG2 3.94Å; A134-L198 PolarHBondContact N-O 2.82Å; A134-A199 HydrophobicContact CB-CB 3.93Å; A134-A199 CarbonylContact O-C 3.55Å; A134-A199 VanDerWaalsContact O-CA 3.28Å; A134-A199 WeakPolarHBondContact O-CA 3.35Å; A134-V200 PolarHBondContact O-N 3.5Å
135	V	98.4	Very high	95.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	158.4	177.7	-60.9	0	0	0	0	110.3	V133 L142 L149 I179 V180 E181 L182 V200	V133-V135 HydrophobicContact CG1-CG1 4.32Å; V135-L142 HydrophobicContact CG2-CD1 3.58Å; V135-L149 HydrophobicContact CG1-CD1 4.13Å; V135-I179 HydrophobicContact CB-CG2 4.46Å; V135-I179 HydrophobicContact CG1-CG2 4.18Å; V135-I179 HydrophobicContact CG2-CG2 3.41Å; V135-I179 VanDerWaalsContact CG2-CG2 3.41Å; V135-V180 PolarHBondContact N-O 2.9Å; V135-E181 HydrophobicContact CG2-CG 4.16Å; V135-E181 WeakPolarHBondContact O-CA 3.33Å; V135-L182 PolarHBondContact O-N 2.89Å; V135-V200 HydrophobicContact CG1-CB 4.22Å; V135-V200 HydrophobicContact CG1-CG2 4.15Å
136	P	96	Very high	96.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	143.5	172.3	-19.2	31.8	0	0	0	111.3	I114 N141 L142 S145 L182 A184 L187 V200 N202	I114-P136 HydrophobicContact CD1-CG 4.36Å; P136-N141 HydrophobicContact CB-CB 3.58Å; P136-N141 HydrophobicContact CG-CB 3.84Å; P136-L142 WeakPolarHBondContact O-CA 3.41Å; P136-L142 WeakPolarHBondContact O-CB 3.41Å; P136-S145 WeakPolarHBondContact CD-OG 3.34Å; P136-L182 CarbonylContact C-O 3.56Å; P136-L182 VanDerWaalsContact CA-O 3.29Å; P136-L182 WeakPolarHBondContact CA-O 3.39Å; P136-A184 HydrophobicContact CB-CB 4.45Å; P136-L187 HydrophobicContact CB-CD1 4.13Å; P136-L187 HydrophobicContact CG-CD1 3.59Å; P136-V200 WeakPolarHBondContact CD-O 3.33Å; P136-N202 WeakPolarHBondContact CG-OD1 3.28Å
137	N	92.6	Very high	96.1	Very high	71 Å²	71	27.2 Å²	27.2	38%	0.38	15%	0.15	S	C	.	.			trans	-97.7	-8.2	-178.9	70	-6.7	0	0	0	114.4	E181 L182 E183	N137-E181 HydrophobicContact CB-CB 3.81Å; N137-L182 VanDerWaalsContact CG-C 3.48Å; N137-L182 PolarHBondContact N-O 3.04Å; N137-L182 PolarHBondContact OD1-O 2.88Å; N137-E183 PolarHBondContact ND2-N 2.88Å; N137-E183 WeakPolarHBondContact OD1-CA 3.47Å
138	D	91.5	Very high	96.2	Very high	20 Å²	20	27.5 Å²	27.5	11%	0.107	15%	0.151	C	C	.	.	S	Bend	trans	-70.2	142.3	171	75	-99.3	0	0	0	109.5	Y91 T140 N141 L142	Y91-D138 HydrophobicContact CE2-CB 4.2Å; D138-T140 PolarHBondContact O-N 3.16Å; D138-T140 PolarHBondContact OD2-N 3.16Å; D138-T140 PolarHBondContact OD2-OG1 3.13Å; D138-N141 VanDerWaalsContact CG-ND2 3.27Å; D138-N141 PolarHBondContact O-N 2.8Å; D138-N141 WeakPolarHBondContact OD1-CB 3.46Å; D138-N141 PolarHBondContact OD1-ND2 3.22Å; D138-N141 PolarHBondContact OD2-N 3.31Å; D138-N141 PolarHBondContact OD2-ND2 3.49Å; D138-L142 WeakPolarHBondContact O-CB 3.33Å; D138-L142 PolarHBondContact O-N 3.39Å
139	P	89.6	Confident	96.3	Very high	59 Å²	59	20.4 Å²	20.4	38%	0.383	12%	0.118	S	C	.	.	H	α-helix	trans	-55	-35	-168.4	-28.5	34.4	0	0	0	114.3	Q94 G143	Q94-P139 HydrophobicContact CG-CB 4.28Å; Q94-P139 HydrophobicContact CG-CG 4.35Å; P139-G143 PolarHBondContact O-N 3.16Å
140	T	94.4	Very high	96.4	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-83.3	-40.8	-171.8	67.2	0	0	0	0	112.6	H88 P90 Y91 Q94 D138 G143 R144 L164	H88-T140 PolarHBondContact CE1-OG1 2.92Å; P90-T140 HydrophobicContact CB-CG2 4.28Å; P90-T140 VanDerWaalsContact O-CG2 3.32Å; P90-T140 WeakPolarHBondContact O-CG2 3.19Å; Y91-T140 WeakPolarHBondContact CD2-OG1 3.49Å; Q94-T140 HydrophobicContact CB-CG2 3.65Å; Q94-T140 HydrophobicContact CG-CG2 4.12Å; D138-T140 PolarHBondContact O-N 3.16Å; D138-T140 PolarHBondContact OD2-N 3.16Å; D138-T140 PolarHBondContact OD2-OG1 3.13Å; T140-G143 PolarHBondContact O-N 3.01Å; T140-R144 WeakPolarHBondContact O-CB 3.38Å; T140-R144 PolarHBondContact O-N 3.42Å; T140-L164 HydrophobicContact CG2-CD2 3.47Å; T140-L164 VanDerWaalsContact CG2-CD2 3.47Å
141	N	96.6	Very high	96.4	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-80	-25.7	175.1	-63.2	-61.5	0	0	0	111.9	H88 P136 D138 S145 N202	H88-N141 PolarHBondContact NE2-OD1 3.37Å; P136-N141 HydrophobicContact CB-CB 3.58Å; P136-N141 HydrophobicContact CG-CB 3.84Å; D138-N141 VanDerWaalsContact CG-ND2 3.27Å; D138-N141 PolarHBondContact O-N 2.8Å; D138-N141 WeakPolarHBondContact OD1-CB 3.46Å; D138-N141 PolarHBondContact OD1-ND2 3.22Å; D138-N141 PolarHBondContact OD2-N 3.31Å; D138-N141 PolarHBondContact OD2-ND2 3.49Å; N141-S145 VanDerWaalsContact O-CB 3.3Å; N141-S145 WeakPolarHBondContact O-CB 3.38Å; N141-S145 PolarHBondContact O-N 3.03Å; N141-S145 PolarHBondContact O-OG 3.35Å; N141-N202 PolarHBondContact OD1-ND2 2.63Å; N141-N202 VanDerWaalsContact OD1-ND2 3.09Å
142	L	96.4	Very high	96.3	Very high	9 Å²	9	23.6 Å²	23.6	5%	0.047	12%	0.121	C	C	.	.	H	α-helix	trans	-58.6	-54.1	164.3	176.4	58.6	0	0	0	109.6	V135 P136 D138 R144 S145 L146 V167 E181	V135-L142 HydrophobicContact CG2-CD1 3.58Å; P136-L142 WeakPolarHBondContact O-CA 3.41Å; P136-L142 WeakPolarHBondContact O-CB 3.41Å; D138-L142 WeakPolarHBondContact O-CB 3.33Å; D138-L142 PolarHBondContact O-N 3.39Å; L142-R144 PolarHBondContact O-N 3.43Å; L142-S145 PolarHBondContact O-N 3.4Å; L142-S145 VanDerWaalsContact O-N 3.11Å; L142-L146 HydrophobicContact CD1-CD1 3.99Å; L142-L146 HydrophobicContact CD1-CG 4.09Å; L142-L146 HydrophobicContact CG-CD1 4.07Å; L142-L146 WeakPolarHBondContact O-CG 3.42Å; L142-L146 PolarHBondContact O-N 2.82Å; L142-V167 HydrophobicContact CD1-CG2 4.16Å; L142-E181 HydrophobicContact CD1-CG 4.14Å
143	G	96.9	Very high	96.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-56.4	-48.3	178	0	0	0	0	0	112.6	P139 T140 S145 L146 L147 P165	P139-G143 PolarHBondContact O-N 3.16Å; T140-G143 PolarHBondContact O-N 3.01Å; G143-S145 VanDerWaalsContact C-N 3.32Å; G143-S145 PolarHBondContact O-N 2.98Å; G143-L146 PolarHBondContact O-N 3.29Å; G143-L147 VanDerWaalsContact O-CG 3.31Å; G143-L147 WeakPolarHBondContact O-CG 3.31Å; G143-L147 PolarHBondContact O-N 3.49Å; G143-P165 WeakPolarHBondContact CA-O 3.33Å
144	R	97.2	Very high	96.2	Very high	8 Å²	8	24.5 Å²	24.5	3%	0.03	14%	0.14	C	C	.	.	H	α-helix	trans	-54.5	-45	174.1	-174.8	175.2	-173.7	-167.5	-1.2	112.6	Y112 I114 T140 L142 L148 E221 Y227	Y112-R144 PolarHBondContact O-NH2 2.9Å; I114-R144 HydrophobicContact CG2-CG 3.91Å; T140-R144 WeakPolarHBondContact O-CB 3.38Å; T140-R144 PolarHBondContact O-N 3.42Å; L142-R144 PolarHBondContact O-N 3.43Å; R144-L148 WeakPolarHBondContact O-CB 3.26Å; R144-L148 PolarHBondContact O-N 3.03Å; R144-E221 WeakPolarHBondContact CG-OE2 3.38Å; R144-E221 IonicContact CZ-OE1 2.67Å; R144-E221 IonicContact CZ-OE2 2.75Å; R144-E221 IonicContact NE-OE1 3.92Å; R144-E221 PolarHBondContact NE-OE1 2.91Å; R144-E221 IonicContact NE-OE2 2.83Å; R144-E221 PolarHBondContact NE-OE2 3.48Å; R144-E221 IonicContact NH2-OE1 3.43Å; R144-E221 PolarHBondContact NH2-OE1 3.45Å; R144-E221 IonicContact NH2-OE2 2.62Å; R144-Y227 WeakPolarHBondContact CA-OH 3.38Å; R144-Y227 HydrophobicContact CB-CE1 3.93Å; R144-Y227 HydrophobicContact CB-CE2 3.91Å; R144-Y227 VanDerWaalsContact CD-CD2 3.47Å; R144-Y227 HydrophobicContact CG-CD1 4.45Å; R144-Y227 HydrophobicContact CG-CD2 3.73Å; R144-Y227 HydrophobicContact CG-CE1 4.13Å; R144-Y227 HydrophobicContact CG-CE2 3.39Å; R144-Y227 HydrophobicContact CG-CG 4.27Å; R144-Y227 VanDerWaalsContact NE-CD2 3.25Å
145	S	98.1	Very high	96.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-69.4	-40.4	-179.3	-59.3	0	0	0	0	112	P136 N141 L142 G143 L148 L149 V200	P136-S145 WeakPolarHBondContact CD-OG 3.34Å; N141-S145 VanDerWaalsContact O-CB 3.3Å; N141-S145 WeakPolarHBondContact O-CB 3.38Å; N141-S145 PolarHBondContact O-N 3.03Å; N141-S145 PolarHBondContact O-OG 3.35Å; L142-S145 PolarHBondContact O-N 3.4Å; L142-S145 VanDerWaalsContact O-N 3.11Å; G143-S145 VanDerWaalsContact C-N 3.32Å; G143-S145 PolarHBondContact O-N 2.98Å; S145-L148 PolarHBondContact O-N 3.4Å; S145-L149 VanDerWaalsContact O-CG 3.28Å; S145-L149 WeakPolarHBondContact O-CG 3.36Å; S145-L149 PolarHBondContact O-N 2.86Å; S145-V200 WeakPolarHBondContact OG-CG1 3.43Å
146	L	98.1	Very high	96.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.8	-39.5	176.7	-66.6	176.2	0	0	0	112.1	L142 G143 L148 L149 Q150 I155 L157 P165 T166 V167	L142-L146 HydrophobicContact CD1-CD1 3.99Å; L142-L146 HydrophobicContact CD1-CG 4.09Å; L142-L146 HydrophobicContact CG-CD1 4.07Å; L142-L146 WeakPolarHBondContact O-CG 3.42Å; L142-L146 PolarHBondContact O-N 2.82Å; G143-L146 PolarHBondContact O-N 3.29Å; L146-L148 VanDerWaalsContact C-N 3.3Å; L146-L148 PolarHBondContact O-N 3.09Å; L146-L149 HydrophobicContact CD2-CD1 4.32Å; L146-L149 PolarHBondContact O-N 3.47Å; L146-Q150 WeakPolarHBondContact O-CB 3.18Å; L146-Q150 PolarHBondContact O-N 3.28Å; L146-I155 HydrophobicContact CB-CD1 4.31Å; L146-I155 HydrophobicContact CD2-CD1 3.75Å; L146-L157 HydrophobicContact CB-CD1 4.15Å; L146-L157 HydrophobicContact CB-CD2 4.22Å; L146-P165 HydrophobicContact CB-CG 4.28Å; L146-P165 HydrophobicContact CD1-CB 4.47Å; L146-T166 WeakPolarHBondContact CD1-O 3.32Å; L146-V167 HydrophobicContact CD1-CG2 4.1Å; L146-V167 HydrophobicContact CD2-CG2 4.17Å
147	L	97.1	Very high	96.3	Very high	47 Å²	47	29.1 Å²	29.1	25%	0.246	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-40.6	172.7	-71.2	167.9	0	0	0	111.4	G143 Q150 K151 L157 L163 P165	G143-L147 VanDerWaalsContact O-CG 3.31Å; G143-L147 WeakPolarHBondContact O-CG 3.31Å; G143-L147 PolarHBondContact O-N 3.49Å; L147-Q150 PolarHBondContact O-N 3.19Å; L147-K151 WeakPolarHBondContact O-CB 3.26Å; L147-K151 PolarHBondContact O-N 2.87Å; L147-L157 HydrophobicContact CD2-CD1 4Å; L147-L157 HydrophobicContact CG-CD1 4.45Å; L147-L163 HydrophobicContact CD1-CD2 4.26Å; L147-P165 HydrophobicContact CD1-CG 4.47Å; L147-P165 HydrophobicContact CD2-CG 4.27Å; L147-P165 HydrophobicContact CG-CG 3.95Å
148	L	97.2	Very high	96.5	Very high	8 Å²	8	29.9 Å²	29.9	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-66.5	-44	175.5	-176.2	58.9	0	0	0	112	I114 R144 S145 L146 Q150 K151 V152 V200 F219 E221	I114-L148 HydrophobicContact CG2-CD2 3.87Å; R144-L148 WeakPolarHBondContact O-CB 3.26Å; R144-L148 PolarHBondContact O-N 3.03Å; S145-L148 PolarHBondContact O-N 3.4Å; L146-L148 VanDerWaalsContact C-N 3.3Å; L146-L148 PolarHBondContact O-N 3.09Å; L148-Q150 VanDerWaalsContact C-N 3.29Å; L148-Q150 PolarHBondContact O-N 3.26Å; L148-K151 WeakPolarHBondContact O-CB 3.28Å; L148-K151 PolarHBondContact O-N 3.21Å; L148-K151 VanDerWaalsContact O-N 3.15Å; L148-V152 WeakPolarHBondContact O-CG2 3.29Å; L148-V152 PolarHBondContact O-N 3.42Å; L148-V152 VanDerWaalsContact O-N 3.16Å; L148-V200 HydrophobicContact CD2-CG1 4.35Å; L148-F219 HydrophobicContact CD1-CD2 4.09Å; L148-F219 HydrophobicContact CD2-CD2 3.7Å; L148-F219 HydrophobicContact CD2-CE2 3.67Å; L148-F219 HydrophobicContact CG-CD2 3.64Å; L148-F219 HydrophobicContact CG-CE2 3.68Å; L148-E221 HydrophobicContact CD1-CB 4.47Å; L148-E221 HydrophobicContact CD2-CB 4.49Å
149	L	98.1	Very high	96.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-37.2	175.1	-69.7	175.3	0	0	0	112	V133 V135 S145 L146 V152 G153 L154 I155 I179 V200 F219	V133-L149 HydrophobicContact CG1-CD1 4.29Å; V133-L149 HydrophobicContact CG1-CD2 4.25Å; V135-L149 HydrophobicContact CG1-CD1 4.13Å; S145-L149 VanDerWaalsContact O-CG 3.28Å; S145-L149 WeakPolarHBondContact O-CG 3.36Å; S145-L149 PolarHBondContact O-N 2.86Å; L146-L149 HydrophobicContact CD2-CD1 4.32Å; L146-L149 PolarHBondContact O-N 3.47Å; L149-V152 WeakPolarHBondContact O-CG2 3.33Å; L149-G153 PolarHBondContact O-N 2.89Å; L149-L154 HydrophobicContact CD2-CD1 3.64Å; L149-L154 PolarHBondContact O-N 2.95Å; L149-I155 HydrophobicContact CB-CD1 3.75Å; L149-I155 HydrophobicContact CB-CG1 3.8Å; L149-I155 HydrophobicContact CD1-CD1 4.33Å; L149-I179 HydrophobicContact CD1-CD1 4.04Å; L149-V200 HydrophobicContact CD2-CG2 4.09Å; L149-V200 HydrophobicContact CG-CG2 4.38Å; L149-F219 HydrophobicContact CD2-CE2 4.28Å; L149-F219 HydrophobicContact CD2-CZ 3.75Å
150	Q	97.4	Very high	96.8	Very high	70 Å²	70	37.7 Å²	37.7	33%	0.327	22%	0.218	S	C	.	.	H	α-helix	trans	-63.5	-45.9	172.5	173.6	176	-90.3	0	0	111.6	L146 L147 L148 V152 G153 I155 L157	L146-Q150 WeakPolarHBondContact O-CB 3.18Å; L146-Q150 PolarHBondContact O-N 3.28Å; L147-Q150 PolarHBondContact O-N 3.19Å; L148-Q150 VanDerWaalsContact C-N 3.29Å; L148-Q150 PolarHBondContact O-N 3.26Å; Q150-V152 PolarHBondContact O-N 3.46Å; Q150-G153 PolarHBondContact O-N 2.84Å; Q150-I155 VanDerWaalsContact CA-O 3.3Å; Q150-I155 WeakPolarHBondContact CA-O 3.47Å; Q150-I155 HydrophobicContact CB-CG1 4.34Å; Q150-L157 HydrophobicContact CB-CD1 4.28Å; Q150-L157 HydrophobicContact CB-CG 4.4Å; Q150-L157 VanDerWaalsContact OE1-CB 3.26Å
151	K	96.1	Very high	96.6	Very high	115 Å²	115	39.4 Å²	39.4	50%	0.5	23%	0.229	S	C	.	.	H	α-helix	trans	-59.2	-34.6	-178.1	-172.6	-178.9	-178.9	-175.9	0	112.8	L147 L148 G153 D222	L147-K151 WeakPolarHBondContact O-CB 3.26Å; L147-K151 PolarHBondContact O-N 2.87Å; L148-K151 WeakPolarHBondContact O-CB 3.28Å; L148-K151 PolarHBondContact O-N 3.21Å; L148-K151 VanDerWaalsContact O-N 3.15Å; K151-G153 VanDerWaalsContact C-N 3.3Å; K151-D222 IonicContact NZ-OD1 3.65Å; K151-D222 PolarHBondContact NZ-OD1 3.32Å; K151-D222 IonicContact NZ-OD2 3.63Å; K151-D222 PolarHBondContact NZ-OD2 3.35Å
152	V	96.7	Very high	96.4	Very high	46 Å²	46	41.8 Å²	41.8	28%	0.279	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	9	176.9	-57.8	0	0	0	0	113.6	L124 L148 L149 Q150 L154 F219	L124-V152 HydrophobicContact CD1-CB 3.84Å; L124-V152 HydrophobicContact CD1-CG2 4.02Å; L148-V152 WeakPolarHBondContact O-CG2 3.29Å; L148-V152 PolarHBondContact O-N 3.42Å; L148-V152 VanDerWaalsContact O-N 3.16Å; L149-V152 WeakPolarHBondContact O-CG2 3.33Å; Q150-V152 PolarHBondContact O-N 3.46Å; V152-L154 HydrophobicContact CG2-CB 4.44Å; V152-L154 HydrophobicContact CG2-CD1 3.91Å; V152-L154 HydrophobicContact CG2-CG 3.91Å; V152-L154 PolarHBondContact O-N 3.34Å; V152-F219 HydrophobicContact CG1-CB 3.68Å; V152-F219 HydrophobicContact CG1-CD2 3.99Å; V152-F219 HydrophobicContact CG1-CG 3.85Å; V152-F219 HydrophobicContact CG2-CD1 4.46Å; V152-F219 HydrophobicContact CG2-CD2 4.35Å; V152-F219 HydrophobicContact CG2-CE2 4.49Å; V152-F219 HydrophobicContact CG2-CG 4.34Å
153	G	96.6	Very high	96.2	Very high	52 Å²	52	44.7 Å²	44.7	54%	0.536	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	14.6	173.3	0	0	0	0	0	115.7	L149 Q150 K151	L149-G153 PolarHBondContact O-N 2.89Å; Q150-G153 PolarHBondContact O-N 2.84Å; K151-G153 VanDerWaalsContact C-N 3.3Å
154	L	97.5	Very high	96	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.042	29%	0.286	C	S	.	.	S	Bend	trans	-80.4	-27.8	179.7	-71.3	177.8	0	0	0	113.2	L124 L127 L149 V152 K175 L177 L198 F219	L124-L154 HydrophobicContact CD2-CD1 3.96Å; L124-L154 HydrophobicContact CD2-CD2 4.48Å; L127-L154 HydrophobicContact CD2-CD1 4.28Å; L127-L154 HydrophobicContact CD2-CD2 3.77Å; L149-L154 HydrophobicContact CD2-CD1 3.64Å; L149-L154 PolarHBondContact O-N 2.95Å; V152-L154 HydrophobicContact CG2-CB 4.44Å; V152-L154 HydrophobicContact CG2-CD1 3.91Å; V152-L154 HydrophobicContact CG2-CG 3.91Å; V152-L154 PolarHBondContact O-N 3.34Å; L154-K175 HydrophobicContact CD2-CD 4.41Å; L154-L177 HydrophobicContact CB-CD1 3.97Å; L154-L177 HydrophobicContact CD1-CD1 4.49Å; L154-L177 HydrophobicContact CD2-CD1 4.26Å; L154-L177 HydrophobicContact CG-CD1 4.47Å; L154-L198 HydrophobicContact CD1-CD2 4.21Å; L154-F219 HydrophobicContact CD1-CE1 4.48Å
155	I	98.2	Very high	95.8	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.036	29%	0.285	C	S	.	.			trans	-143.7	168.4	176.7	60.9	177.1	0	0	0	109.4	L146 L149 Q150 L157 V170 E172	L146-I155 HydrophobicContact CB-CD1 4.31Å; L146-I155 HydrophobicContact CD2-CD1 3.75Å; L149-I155 HydrophobicContact CB-CD1 3.75Å; L149-I155 HydrophobicContact CB-CG1 3.8Å; L149-I155 HydrophobicContact CD1-CD1 4.33Å; Q150-I155 VanDerWaalsContact CA-O 3.3Å; Q150-I155 WeakPolarHBondContact CA-O 3.47Å; Q150-I155 HydrophobicContact CB-CG1 4.34Å; I155-L157 HydrophobicContact CD1-CD2 4.21Å; I155-V170 HydrophobicContact CB-CG1 4.05Å; I155-V170 HydrophobicContact CD1-CG2 4.02Å; I155-V170 HydrophobicContact CG2-CG1 4.19Å; I155-E172 CarbonylContact C-O 3.54Å; I155-E172 WeakPolarHBondContact CA-O 3.41Å
156	K	98.3	Very high	95.6	Very high	89 Å²	89	50.5 Å²	50.5	39%	0.387	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135	165.2	-168.9	-177.7	176.8	179.4	0	108.6	V170 V171 E172	K156-V170 CarbonylContact O-C 3.4Å; K156-V170 WeakPolarHBondContact O-CA 3.47Å; K156-V171 HydrophobicContact CB-CG2 3.88Å; K156-V171 HydrophobicContact CD-CG2 3.93Å; K156-V171 HydrophobicContact CG-CG2 3.75Å; K156-V171 WeakPolarHBondContact O-CG2 3.25Å; K156-V171 PolarHBondContact O-N 2.88Å; K156-E172 HydrophobicContact CB-CB 3.79Å; K156-E172 HydrophobicContact CB-CG 4.26Å; K156-E172 HydrophobicContact CD-CB 4.45Å; K156-E172 HydrophobicContact CD-CG 4.07Å; K156-E172 WeakPolarHBondContact CD-OE1 3.29Å; K156-E172 WeakPolarHBondContact CD-OE2 3.4Å; K156-E172 PolarHBondContact N-O 3.37Å; K156-E172 IonicContact NZ-OE1 2.78Å; K156-E172 PolarHBondContact NZ-OE1 2.8Å; K156-E172 IonicContact NZ-OE2 3.35Å; K156-E172 PolarHBondContact O-N 2.84Å
157	L	97.9	Very high	95.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	161.4	177.2	-59.2	167	0	0	0	110.1	L146 L147 Q150 I155 V161 P165 D169 V170 V171	L146-L157 HydrophobicContact CB-CD1 4.15Å; L146-L157 HydrophobicContact CB-CD2 4.22Å; L147-L157 HydrophobicContact CD2-CD1 4Å; L147-L157 HydrophobicContact CG-CD1 4.45Å; Q150-L157 HydrophobicContact CB-CD1 4.28Å; Q150-L157 HydrophobicContact CB-CG 4.4Å; Q150-L157 VanDerWaalsContact OE1-CB 3.26Å; I155-L157 HydrophobicContact CD1-CD2 4.21Å; L157-V161 HydrophobicContact CB-CG2 4.24Å; L157-V161 HydrophobicContact CD1-CG2 4.4Å; L157-P165 HydrophobicContact CD1-CB 3.95Å; L157-P165 HydrophobicContact CD1-CG 3.86Å; L157-P165 HydrophobicContact CD2-CB 4.25Å; L157-D169 CarbonylContact C-O 3.46Å; L157-D169 VanDerWaalsContact CA-O 3.23Å; L157-D169 WeakPolarHBondContact CA-O 3.27Å; L157-D169 HydrophobicContact CD2-CB 4.43Å; L157-V170 HydrophobicContact CD2-CG2 3.81Å; L157-V171 WeakPolarHBondContact O-CG2 3.48Å
158	K	96.8	Very high	95.1	Very high	87 Å²	87	52.1 Å²	52.1	38%	0.378	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-58	147	168.6	-66.2	174.1	-161.3	143.1	0	109.5	V161 L168 D169 V171	K158-V161 HydrophobicContact CB-CG1 3.8Å; K158-V161 WeakPolarHBondContact O-CG1 3.37Å; K158-V161 WeakPolarHBondContact O-CG2 3.5Å; K158-L168 PolarHBondContact NZ-O 3.25Å; K158-D169 HydrophobicContact CD-CB 4.49Å; K158-D169 PolarHBondContact N-O 2.9Å; K158-D169 IonicContact NZ-OD1 2.78Å; K158-D169 PolarHBondContact NZ-OD1 3.49Å; K158-V171 HydrophobicContact CB-CG1 4.14Å; K158-V171 HydrophobicContact CG-CG1 3.3Å
159	D	94.5	Very high	95	Very high	158 Å²	158	53.3 Å²	53.3	85%	0.845	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	145.2	172.4	-62.7	-33.2	0	0	0	110.5	V161	D159-V161 PolarHBondContact O-N 2.55Å
160	G	93.3	Very high	94.9	Very high	84 Å²	84	54.2 Å²	54.2	87%	0.866	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	15.1	173.6	0	0	0	0	0	116.3	G162	G160-G162 PolarHBondContact O-N 3.09Å
161	V	89.9	Confident	94.9	Very high	38 Å²	38	53.2 Å²	53.2	23%	0.23	32%	0.322	C	S	.	.			trans	-68.4	-13.5	-179.7	-69.4	0	0	0	0	115.3	L157 K158 D159 P165 D169	L157-V161 HydrophobicContact CB-CG2 4.24Å; L157-V161 HydrophobicContact CD1-CG2 4.4Å; K158-V161 HydrophobicContact CB-CG1 3.8Å; K158-V161 WeakPolarHBondContact O-CG1 3.37Å; K158-V161 WeakPolarHBondContact O-CG2 3.5Å; D159-V161 PolarHBondContact O-N 2.55Å; V161-P165 HydrophobicContact CB-CB 3.92Å; V161-P165 HydrophobicContact CG1-CB 4.47Å; V161-P165 HydrophobicContact CG2-CB 3.87Å; V161-P165 HydrophobicContact CG2-CG 4.21Å; V161-D169 HydrophobicContact CG1-CB 3.82Å
162	G	92.3	Very high	95	Very high	50 Å²	50	52.6 Å²	52.6	52%	0.515	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	-146.8	-178.6	0	0	0	0	0	113.3	G160	G160-G162 PolarHBondContact O-N 3.09Å
163	L	91.9	Very high	95	Very high	71 Å²	71	52.5 Å²	52.5	37%	0.372	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-4.1	-177.3	-63.2	-178.5	0	0	0	114.5	P90 L147 P226	P90-L163 HydrophobicContact CG-CD1 4.01Å; L147-L163 HydrophobicContact CD1-CD2 4.26Å; L163-P226 HydrophobicContact CD1-CB 4.18Å; L163-P226 HydrophobicContact CD1-CG 4.3Å; L163-P226 HydrophobicContact CD2-CG 3.95Å
164	L	91.9	Very high	95	Very high	71 Å²	71	54.4 Å²	54.4	37%	0.372	32%	0.321	S	S	.	.			trans	-121.6	42	-175.5	-56.2	177.3	0	0	0	113.2	Q94 T140	Q94-L164 VanDerWaalsContact OE1-CD1 3.29Å; T140-L164 HydrophobicContact CG2-CD2 3.47Å; T140-L164 VanDerWaalsContact CG2-CD2 3.47Å
165	P	94.7	Very high	94.9	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	33%	0.331	C	S	.	.			trans	-60.7	150	173.2	23.2	-28.9	0	0	0	110.9	G143 L146 L147 L157 V161 D169	G143-P165 WeakPolarHBondContact CA-O 3.33Å; L146-P165 HydrophobicContact CB-CG 4.28Å; L146-P165 HydrophobicContact CD1-CB 4.47Å; L147-P165 HydrophobicContact CD1-CG 4.47Å; L147-P165 HydrophobicContact CD2-CG 4.27Å; L147-P165 HydrophobicContact CG-CG 3.95Å; L157-P165 HydrophobicContact CD1-CB 3.95Å; L157-P165 HydrophobicContact CD1-CG 3.86Å; L157-P165 HydrophobicContact CD2-CB 4.25Å; V161-P165 HydrophobicContact CB-CB 3.92Å; V161-P165 HydrophobicContact CG1-CB 4.47Å; V161-P165 HydrophobicContact CG2-CB 3.87Å; V161-P165 HydrophobicContact CG2-CG 4.21Å; P165-D169 HydrophobicContact CB-CB 4.39Å
166	T	92.3	Very high	94.9	Very high	58 Å²	58	62 Å²	62	36%	0.356	36%	0.36	S	S	.	.			trans	-110.7	171.7	171.3	68.2	0	0	0	0	110.1	L146 L168 D169	L146-T166 WeakPolarHBondContact CD1-O 3.32Å; T166-L168 PolarHBondContact O-N 2.97Å; T166-L168 VanDerWaalsContact O-N 3.17Å; T166-L168 PolarHBondContact OG1-N 2.86Å; T166-D169 PolarHBondContact N-OD2 2.83Å; T166-D169 WeakPolarHBondContact O-CB 3.32Å; T166-D169 PolarHBondContact O-N 2.99Å; T166-D169 PolarHBondContact OG1-OD2 2.86Å
167	V	92.8	Very high	94.8	Very high	19 Å²	19	58.1 Å²	58.1	12%	0.115	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-65.2	-20.1	176	-171.7	0	0	0	0	112.4	L142 L146 D169 V170 I179 E181	L142-V167 HydrophobicContact CD1-CG2 4.16Å; L146-V167 HydrophobicContact CD1-CG2 4.1Å; L146-V167 HydrophobicContact CD2-CG2 4.17Å; V167-D169 PolarHBondContact O-N 3Å; V167-V170 HydrophobicContact CG1-CG2 4.24Å; V167-V170 WeakPolarHBondContact O-CB 3.33Å; V167-V170 WeakPolarHBondContact O-CG2 3.49Å; V167-V170 PolarHBondContact O-N 2.87Å; V167-I179 HydrophobicContact CG1-CB 4.22Å; V167-I179 HydrophobicContact CG1-CG1 4.19Å; V167-I179 HydrophobicContact CG2-CB 4.16Å; V167-I179 HydrophobicContact CG2-CG2 3.85Å; V167-E181 WeakPolarHBondContact CG2-OE1 3.47Å
168	L	92.2	Very high	94.7	Very high	62 Å²	62	63.9 Å²	63.9	33%	0.325	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-69.5	-12.9	172.6	-56.6	176.4	0	0	0	113	K158 T166 R296	K158-L168 PolarHBondContact NZ-O 3.25Å; T166-L168 PolarHBondContact O-N 2.97Å; T166-L168 VanDerWaalsContact O-N 3.17Å; T166-L168 PolarHBondContact OG1-N 2.86Å; L168-R296 HydrophobicContact CD2-CB 4.5Å
169	D	95.5	Very high	94.7	Very high	32 Å²	32	60.2 Å²	60.2	17%	0.171	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-91.3	-0.1	177.1	-59.7	-51.9	0	0	0	113.3	L157 K158 V161 P165 T166 V167 V171	L157-D169 CarbonylContact C-O 3.46Å; L157-D169 VanDerWaalsContact CA-O 3.23Å; L157-D169 WeakPolarHBondContact CA-O 3.27Å; L157-D169 HydrophobicContact CD2-CB 4.43Å; K158-D169 HydrophobicContact CD-CB 4.49Å; K158-D169 PolarHBondContact N-O 2.9Å; K158-D169 IonicContact NZ-OD1 2.78Å; K158-D169 PolarHBondContact NZ-OD1 3.49Å; V161-D169 HydrophobicContact CG1-CB 3.82Å; P165-D169 HydrophobicContact CB-CB 4.39Å; T166-D169 PolarHBondContact N-OD2 2.83Å; T166-D169 WeakPolarHBondContact O-CB 3.32Å; T166-D169 PolarHBondContact O-N 2.99Å; T166-D169 PolarHBondContact OG1-OD2 2.86Å; V167-D169 PolarHBondContact O-N 3Å; D169-V171 PolarHBondContact O-N 2.74Å
170	V	95.6	Very high	94.8	Very high	19 Å²	19	54.5 Å²	54.5	12%	0.115	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	113.5	174.4	-178.5	0	0	0	0	110.6	I155 K156 L157 V167 E172 N173 K293	I155-V170 HydrophobicContact CB-CG1 4.05Å; I155-V170 HydrophobicContact CD1-CG2 4.02Å; I155-V170 HydrophobicContact CG2-CG1 4.19Å; K156-V170 CarbonylContact O-C 3.4Å; K156-V170 WeakPolarHBondContact O-CA 3.47Å; L157-V170 HydrophobicContact CD2-CG2 3.81Å; V167-V170 HydrophobicContact CG1-CG2 4.24Å; V167-V170 WeakPolarHBondContact O-CB 3.33Å; V167-V170 WeakPolarHBondContact O-CG2 3.49Å; V167-V170 PolarHBondContact O-N 2.87Å; V170-E172 VanDerWaalsContact CG1-O 3.31Å; V170-E172 WeakPolarHBondContact CG1-O 3.42Å; V170-N173 HydrophobicContact CG1-CB 4.1Å; V170-K293 PolarHBondContact O-NZ 3.39Å
171	V	97.6	Very high	94.9	Very high	50 Å²	50	54 Å²	54	30%	0.303	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-38	177.1	-63.5	0	0	0	0	112.9	K156 L157 K158 D169 K293	K156-V171 HydrophobicContact CB-CG2 3.88Å; K156-V171 HydrophobicContact CD-CG2 3.93Å; K156-V171 HydrophobicContact CG-CG2 3.75Å; K156-V171 WeakPolarHBondContact O-CG2 3.25Å; K156-V171 PolarHBondContact O-N 2.88Å; L157-V171 WeakPolarHBondContact O-CG2 3.48Å; K158-V171 HydrophobicContact CB-CG1 4.14Å; K158-V171 HydrophobicContact CG-CG1 3.3Å; D169-V171 PolarHBondContact O-N 2.74Å; V171-K293 VanDerWaalsContact CA-NZ 3.3Å; V171-K293 PolarHBondContact O-NZ 3.45Å
172	E	98	Very high	95	Very high	101 Å²	101	54 Å²	54	47%	0.472	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	137.5	177.3	-58.8	166.9	-153.7	0	0	110	I155 K156 V170	I155-E172 CarbonylContact C-O 3.54Å; I155-E172 WeakPolarHBondContact CA-O 3.41Å; K156-E172 HydrophobicContact CB-CB 3.79Å; K156-E172 HydrophobicContact CB-CG 4.26Å; K156-E172 HydrophobicContact CD-CB 4.45Å; K156-E172 HydrophobicContact CD-CG 4.07Å; K156-E172 WeakPolarHBondContact CD-OE1 3.29Å; K156-E172 WeakPolarHBondContact CD-OE2 3.4Å; K156-E172 PolarHBondContact N-O 3.37Å; K156-E172 IonicContact NZ-OE1 2.78Å; K156-E172 PolarHBondContact NZ-OE1 2.8Å; K156-E172 IonicContact NZ-OE2 3.35Å; K156-E172 PolarHBondContact O-N 2.84Å; V170-E172 VanDerWaalsContact CG1-O 3.31Å; V170-E172 WeakPolarHBondContact CG1-O 3.42Å
173	N	97.3	Very high	94.8	Very high	44 Å²	44	56.4 Å²	56.4	24%	0.235	30%	0.295	C	S	.	.			trans	-141.2	75.3	178.4	-178.4	3.7	0	0	0	108.3	V170 K175 N176 L177	V170-N173 HydrophobicContact CG1-CB 4.1Å; N173-K175 PolarHBondContact O-N 3.43Å; N173-K175 VanDerWaalsContact O-N 3.16Å; N173-N176 PolarHBondContact O-N 3.03Å; N173-N176 PolarHBondContact OD1-N 2.79Å; N173-L177 PolarHBondContact ND2-N 2.8Å; N173-L177 VanDerWaalsContact ND2-N 3.12Å; N173-L177 PolarHBondContact ND2-O 2.93Å; N173-L177 PolarHBondContact OD1-N 2.78Å
174	P	96.6	Very high	94.8	Very high	93 Å²	93	53.2 Å²	53.2	60%	0.604	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.9	-166.4	21.8	-34.1	0	0	0	114
175	K	96.2	Very high	94.9	Very high	54 Å²	54	52 Å²	52	24%	0.235	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	9.1	176.6	-70.3	-178.4	172.4	-72.9	0	113.4	L127 D129 G130 L154 N173 L177	L127-K175 HydrophobicContact CB-CD 4.32Å; L127-K175 HydrophobicContact CD2-CD 4.25Å; L127-K175 HydrophobicContact CG-CD 4.39Å; L127-K175 WeakPolarHBondContact O-CE 3.28Å; L127-K175 PolarHBondContact O-NZ 3.09Å; D129-K175 CarbonylContact C-O 3.51Å; D129-K175 WeakPolarHBondContact CA-O 3.47Å; G130-K175 PolarHBondContact N-O 3.28Å; L154-K175 HydrophobicContact CD2-CD 4.41Å; N173-K175 PolarHBondContact O-N 3.43Å; N173-K175 VanDerWaalsContact O-N 3.16Å; K175-L177 HydrophobicContact CB-CD2 3.66Å; K175-L177 HydrophobicContact CB-CG 3.85Å; K175-L177 HydrophobicContact CD-CD2 4.5Å; K175-L177 PolarHBondContact O-N 2.88Å; K175-L177 VanDerWaalsContact O-N 3.08Å
176	N	96.6	Very high	94.8	Very high	120 Å²	120	56 Å²	56	64%	0.642	29%	0.293	S	S	*	.			trans	47.3	39.1	-175	-79.2	-31.3	0	0	0	113.5	G130 N173	G130-N176 WeakPolarHBondContact CA-O 3.22Å; N173-N176 PolarHBondContact O-N 3.03Å; N173-N176 PolarHBondContact OD1-N 2.79Å
177	L	97.1	Very high	95.1	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.037	28%	0.276	C	S	.	.			trans	-60.5	138.5	-177.1	-57.6	176.8	0	0	0	111	L127 S131 V133 L154 N173 K175 I179	L127-L177 HydrophobicContact CD2-CD1 3.95Å; L127-L177 HydrophobicContact CD2-CD2 3.58Å; L127-L177 HydrophobicContact CD2-CG 4.43Å; L127-L177 HydrophobicContact CG-CD2 3.96Å; S131-L177 WeakPolarHBondContact O-CA 3.43Å; V133-L177 HydrophobicContact CG2-CB 4.38Å; V133-L177 HydrophobicContact CG2-CD1 4.14Å; V133-L177 HydrophobicContact CG2-CD2 4.42Å; L154-L177 HydrophobicContact CB-CD1 3.97Å; L154-L177 HydrophobicContact CD1-CD1 4.49Å; L154-L177 HydrophobicContact CD2-CD1 4.26Å; L154-L177 HydrophobicContact CG-CD1 4.47Å; N173-L177 PolarHBondContact ND2-N 2.8Å; N173-L177 VanDerWaalsContact ND2-N 3.12Å; N173-L177 PolarHBondContact ND2-O 2.93Å; N173-L177 PolarHBondContact OD1-N 2.78Å; K175-L177 HydrophobicContact CB-CD2 3.66Å; K175-L177 HydrophobicContact CB-CG 3.85Å; K175-L177 HydrophobicContact CD-CD2 4.5Å; K175-L177 PolarHBondContact O-N 2.88Å; K175-L177 VanDerWaalsContact O-N 3.08Å; L177-I179 HydrophobicContact CB-CD1 4.39Å
178	K	96.8	Very high	95.2	Very high	123 Å²	123	52.9 Å²	52.9	54%	0.535	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	103.1	174	-66.1	179.7	-177.4	179.8	0	109.1	S131 Q132 V133 V180	S131-K178 PolarHBondContact O-N 3.47Å; Q132-K178 CarbonylContact C-O 3.59Å; Q132-K178 VanDerWaalsContact CA-O 3.27Å; Q132-K178 WeakPolarHBondContact CA-O 3.44Å; Q132-K178 HydrophobicContact CB-CB 4.48Å; Q132-K178 HydrophobicContact CG-CB 4.06Å; Q132-K178 HydrophobicContact CG-CD 4.35Å; V133-K178 PolarHBondContact N-O 2.67Å; K178-V180 PolarHBondContact O-N 3Å
179	I	96.7	Very high	95.3	Very high	10 Å²	10	59 Å²	59	5%	0.051	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	117	177.6	-51.1	-55	0	0	0	109.7	V133 V135 L149 V167 L177 R296	V133-I179 HydrophobicContact CB-CD1 4.01Å; V133-I179 CarbonylContact O-C 3.55Å; V133-I179 WeakPolarHBondContact O-CA 3.39Å; V135-I179 HydrophobicContact CB-CG2 4.46Å; V135-I179 HydrophobicContact CG1-CG2 4.18Å; V135-I179 HydrophobicContact CG2-CG2 3.41Å; V135-I179 VanDerWaalsContact CG2-CG2 3.41Å; L149-I179 HydrophobicContact CD1-CD1 4.04Å; V167-I179 HydrophobicContact CG1-CB 4.22Å; V167-I179 HydrophobicContact CG1-CG1 4.19Å; V167-I179 HydrophobicContact CG2-CB 4.16Å; V167-I179 HydrophobicContact CG2-CG2 3.85Å; L177-I179 HydrophobicContact CB-CD1 4.39Å; I179-R296 PolarHBondContact O-NH1 2.89Å; I179-R296 PolarHBondContact O-NH2 2.83Å
180	V	95.4	Very high	95.4	Very high	38 Å²	38	57.9 Å²	57.9	23%	0.23	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115	178.8	-176.4	0	0	0	0	108.7	Q132 V133 A134 V135 K178 L182 I196	Q132-V180 HydrophobicContact CB-CG2 4Å; Q132-V180 HydrophobicContact CG-CG2 4.45Å; Q132-V180 VanDerWaalsContact OE1-CG2 3.3Å; V133-V180 PolarHBondContact O-N 2.79Å; A134-V180 CarbonylContact C-O 3.54Å; A134-V180 VanDerWaalsContact CA-O 3.25Å; A134-V180 WeakPolarHBondContact CA-O 3.3Å; V135-V180 PolarHBondContact N-O 2.9Å; K178-V180 PolarHBondContact O-N 3Å; V180-L182 HydrophobicContact CG1-CD2 3.96Å; V180-L182 HydrophobicContact CG1-CG 4.06Å; V180-I196 HydrophobicContact CB-CD1 4.16Å; V180-I196 HydrophobicContact CG1-CD1 4.47Å; V180-I196 HydrophobicContact CG2-CD1 3.98Å
181	E	96	Very high	95.5	Very high	73 Å²	73	57.2 Å²	57.2	34%	0.341	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	117.2	-178.1	-61.8	174.7	-141.4	0	0	109.3	V135 N137 L142 V167 R296	V135-E181 HydrophobicContact CG2-CG 4.16Å; V135-E181 WeakPolarHBondContact O-CA 3.33Å; N137-E181 HydrophobicContact CB-CB 3.81Å; L142-E181 HydrophobicContact CD1-CG 4.14Å; V167-E181 WeakPolarHBondContact CG2-OE1 3.47Å; E181-R296 IonicContact OE1-CZ 2.72Å; E181-R296 IonicContact OE1-NH1 2.92Å; E181-R296 PolarHBondContact OE1-NH1 2.95Å
182	L	91	Very high	95.4	Very high	39 Å²	39	60 Å²	60	20%	0.204	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	154.8	-179.4	-60	178.4	0	0	0	110.6	A134 V135 P136 N137 V180 A184 L187	A134-L182 HydrophobicContact CB-CD1 4.03Å; V135-L182 PolarHBondContact O-N 2.89Å; P136-L182 CarbonylContact C-O 3.56Å; P136-L182 VanDerWaalsContact CA-O 3.29Å; P136-L182 WeakPolarHBondContact CA-O 3.39Å; N137-L182 VanDerWaalsContact CG-C 3.48Å; N137-L182 PolarHBondContact N-O 3.04Å; N137-L182 PolarHBondContact OD1-O 2.88Å; V180-L182 HydrophobicContact CG1-CD2 3.96Å; V180-L182 HydrophobicContact CG1-CG 4.06Å; L182-A184 PolarHBondContact O-N 3Å; L182-L187 HydrophobicContact CB-CD2 4.09Å; L182-L187 HydrophobicContact CB-CG 4.46Å; L182-L187 HydrophobicContact CD1-CD2 4.36Å
183	E	88.3	Confident	95.2	Very high	100 Å²	100	58.8 Å²	58.8	47%	0.467	29%	0.294	S	S	.	.			trans	-60.6	138.7	170.5	-64.7	-178.5	157.1	0	0	110	N137 P185 Q186	N137-E183 PolarHBondContact ND2-N 2.88Å; N137-E183 WeakPolarHBondContact OD1-CA 3.47Å; E183-P185 VanDerWaalsContact C-N 3.33Å; E183-P185 VanDerWaalsContact O-N 3.15Å; E183-Q186 HydrophobicContact CB-CG 4.12Å; E183-Q186 WeakPolarHBondContact O-CA 3.29Å; E183-Q186 WeakPolarHBondContact O-CB 3.49Å; E183-Q186 PolarHBondContact O-N 3.1Å; E183-Q186 PolarHBondContact OE2-NE2 2.96Å
184	A	92.9	Very high	94.9	Very high	4 Å²	4	61 Å²	61	3%	0.033	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-51.3	-40.6	-174.8	0	0	0	0	0	114.8	Y69 P136 L182 Q186 L187 Y205	Y69-A184 HydrophobicContact CD2-CB 4.2Å; Y69-A184 HydrophobicContact CE2-CB 3.91Å; P136-A184 HydrophobicContact CB-CB 4.45Å; L182-A184 PolarHBondContact O-N 3Å; A184-Q186 PolarHBondContact O-N 2.9Å; A184-L187 HydrophobicContact CB-CD1 4.47Å; A184-L187 PolarHBondContact O-N 3.45Å; A184-Y205 HydrophobicContact CB-CD2 3.73Å; A184-Y205 HydrophobicContact CB-CE2 3.42Å; A184-Y205 VanDerWaalsContact CB-CE2 3.42Å; A184-Y205 WeakPolarHBondContact O-CD2 3.24Å
185	P	92.9	Very high	94.7	Very high	45 Å²	45	62.5 Å²	62.5	29%	0.292	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-63.6	-18.3	174.3	-17.7	27.1	0	0	0	115.5	N67 D68 E183 Y205	N67-P185 VanDerWaalsContact O-CG 3.31Å; N67-P185 WeakPolarHBondContact O-CG 3.44Å; D68-P185 HydrophobicContact CB-CG 4.31Å; E183-P185 VanDerWaalsContact C-N 3.33Å; E183-P185 VanDerWaalsContact O-N 3.15Å; P185-Y205 HydrophobicContact CB-CD1 4.25Å; P185-Y205 HydrophobicContact CB-CE1 3.82Å; P185-Y205 HydrophobicContact CG-CE1 3.8Å; P185-Y205 HydrophobicContact CG-CE2 4.2Å; P185-Y205 WeakPolarHBondContact CG-OH 3.35Å
186	Q	94	Very high	94.7	Very high	85 Å²	85	60.2 Å²	60.2	40%	0.397	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-89.4	-19.7	-177.3	-58.8	-177.5	6	0	0	112.6	E183 A184 R189 S190	E183-Q186 HydrophobicContact CB-CG 4.12Å; E183-Q186 WeakPolarHBondContact O-CA 3.29Å; E183-Q186 WeakPolarHBondContact O-CB 3.49Å; E183-Q186 PolarHBondContact O-N 3.1Å; E183-Q186 PolarHBondContact OE2-NE2 2.96Å; A184-Q186 PolarHBondContact O-N 2.9Å; Q186-R189 PolarHBondContact O-N 2.88Å; Q186-R189 VanDerWaalsContact O-N 3.13Å; Q186-S190 PolarHBondContact O-N 3.06Å; Q186-S190 VanDerWaalsContact O-N 3.13Å
187	L	96.9	Very high	94.8	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-39.3	-177.2	-68.8	163	0	0	0	114.3	A134 P136 L182 A184 R189 S190 V200 I201	A134-L187 HydrophobicContact CB-CD2 3.78Å; P136-L187 HydrophobicContact CB-CD1 4.13Å; P136-L187 HydrophobicContact CG-CD1 3.59Å; L182-L187 HydrophobicContact CB-CD2 4.09Å; L182-L187 HydrophobicContact CB-CG 4.46Å; L182-L187 HydrophobicContact CD1-CD2 4.36Å; A184-L187 HydrophobicContact CB-CD1 4.47Å; A184-L187 PolarHBondContact O-N 3.45Å; L187-R189 PolarHBondContact O-N 3.3Å; L187-S190 PolarHBondContact O-N 3.44Å; L187-S190 VanDerWaalsContact O-N 3.1Å; L187-S190 PolarHBondContact O-OG 3.41Å; L187-V200 WeakPolarHBondContact CD1-O 3.25Å; L187-I201 HydrophobicContact CB-CB 4.39Å; L187-I201 HydrophobicContact CB-CD1 4.28Å; L187-I201 HydrophobicContact CB-CG1 3.95Å; L187-I201 HydrophobicContact CB-CG2 4Å
188	P	96.1	Very high	94.8	Very high	11 Å²	11	54.7 Å²	54.7	7%	0.071	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-38.4	173.8	-28.5	36.5	0	0	0	113.5	I201 Y205 I209	P188-I201 HydrophobicContact CG-CG2 4.14Å; P188-Y205 WeakPolarHBondContact CG-O 3.36Å; P188-I209 HydrophobicContact CB-CD1 3.75Å; P188-I209 HydrophobicContact CB-CG1 4.04Å; P188-I209 HydrophobicContact CB-CG2 3.92Å
189	R	95	Very high	94.9	Very high	190 Å²	190	48.8 Å²	48.8	72%	0.717	25%	0.254	S	S	*	.	H	α-helix	trans	-77.1	-26.5	178.6	174.9	175.6	-94.8	180	-7.7	112.4	Q186 L187 L191 D192	Q186-R189 PolarHBondContact O-N 2.88Å; Q186-R189 VanDerWaalsContact O-N 3.13Å; L187-R189 PolarHBondContact O-N 3.3Å; R189-L191 PolarHBondContact O-N 3.12Å; R189-D192 WeakPolarHBondContact O-CB 3.32Å; R189-D192 PolarHBondContact O-N 3.2Å
190	S	96.4	Very high	95	Very high	9 Å²	9	48.3 Å²	48.3	6%	0.063	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-20.9	178.7	79.8	0	0	0	0	112.5	Q186 L187 D192 D193 I196	Q186-S190 PolarHBondContact O-N 3.06Å; Q186-S190 VanDerWaalsContact O-N 3.13Å; L187-S190 PolarHBondContact O-N 3.44Å; L187-S190 VanDerWaalsContact O-N 3.1Å; L187-S190 PolarHBondContact O-OG 3.41Å; S190-D192 PolarHBondContact O-N 3.34Å; S190-D193 VanDerWaalsContact O-CB 3.29Å; S190-D193 WeakPolarHBondContact O-CB 3.23Å; S190-D193 PolarHBondContact O-N 3.18Å; S190-I196 WeakPolarHBondContact O-CB 3.11Å
191	L	96.8	Very high	95.1	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.031	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.3	171.2	-66	175.7	0	0	0	113.8	Y117 K119 R189 A199 I201 I209 L211	Y117-L191 WeakPolarHBondContact O-CD2 3.29Å; K119-L191 HydrophobicContact CD-CB 4.16Å; K119-L191 HydrophobicContact CG-CB 4.2Å; R189-L191 PolarHBondContact O-N 3.12Å; L191-A199 HydrophobicContact CD2-CB 3.8Å; L191-A199 HydrophobicContact CG-CB 4.41Å; L191-I201 HydrophobicContact CD1-CD1 3.75Å; L191-I201 HydrophobicContact CD2-CD1 4.33Å; L191-I201 HydrophobicContact CG-CD1 3.97Å; L191-I209 HydrophobicContact CD1-CD1 3.96Å; L191-L211 HydrophobicContact CD1-CD1 3.6Å
192	D	95.8	Very high	95	Very high	109 Å²	109	43.3 Å²	43.3	58%	0.583	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-11.4	175.4	-65.3	-45.3	0	0	0	113.1	K119 R189 S190 A194	K119-D192 IonicContact NZ-OD1 3.75Å; K119-D192 PolarHBondContact NZ-OD1 3.06Å; K119-D192 IonicContact NZ-OD2 3.54Å; R189-D192 WeakPolarHBondContact O-CB 3.32Å; R189-D192 PolarHBondContact O-N 3.2Å; S190-D192 PolarHBondContact O-N 3.34Å; D192-A194 PolarHBondContact O-N 2.9Å
193	D	94.1	Very high	95.2	Very high	74 Å²	74	41.6 Å²	41.6	40%	0.396	22%	0.217	S	C	.	.			trans	-71.9	126.5	179.6	-170.4	-39.8	0	0	0	110.2	K120 S190 Q195 I196	K120-D193 PolarHBondContact NZ-O 3.13Å; S190-D193 VanDerWaalsContact O-CB 3.29Å; S190-D193 WeakPolarHBondContact O-CB 3.23Å; S190-D193 PolarHBondContact O-N 3.18Å; D193-Q195 PolarHBondContact O-N 3.43Å; D193-Q195 VanDerWaalsContact O-N 3.1Å; D193-Q195 WeakPolarHBondContact OD1-CB 3.29Å; D193-Q195 PolarHBondContact OD1-N 3.21Å; D193-I196 HydrophobicContact CB-CB 4.23Å; D193-I196 HydrophobicContact CB-CG1 3.89Å; D193-I196 PolarHBondContact O-N 3.43Å
194	A	91.3	Very high	95.3	Very high	91 Å²	91	37.1 Å²	37.1	75%	0.752	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.6	179.3	0	0	0	0	0	114	K120 D192	K120-A194 VanDerWaalsContact NZ-CA 3.35Å; K120-A194 PolarHBondContact NZ-O 2.74Å; D192-A194 PolarHBondContact O-N 2.9Å
195	Q	92.9	Very high	95.4	Very high	124 Å²	124	36.9 Å²	36.9	58%	0.579	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-27.4	178.2	-58.3	-168.1	-14.9	0	0	114.3	Q132 D193 A197	Q132-Q195 WeakPolarHBondContact CB-O 3.31Å; D193-Q195 PolarHBondContact O-N 3.43Å; D193-Q195 VanDerWaalsContact O-N 3.1Å; D193-Q195 WeakPolarHBondContact OD1-CB 3.29Å; D193-Q195 PolarHBondContact OD1-N 3.21Å; Q195-A197 PolarHBondContact O-N 3.22Å
196	I	96.1	Very high	95.5	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.031	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.8	-179.3	-61.3	-57.4	0	0	0	109.9	K120 Q132 A134 V180 S190 D193 L198 A199	K120-I196 WeakPolarHBondContact CE-O 3.37Å; K120-I196 PolarHBondContact NZ-O 3.39Å; Q132-I196 HydrophobicContact CB-CD1 3.78Å; A134-I196 HydrophobicContact CB-CD1 4.06Å; A134-I196 HydrophobicContact CB-CG1 4.45Å; A134-I196 HydrophobicContact CB-CG2 3.94Å; V180-I196 HydrophobicContact CB-CD1 4.16Å; V180-I196 HydrophobicContact CG1-CD1 4.47Å; V180-I196 HydrophobicContact CG2-CD1 3.98Å; S190-I196 WeakPolarHBondContact O-CB 3.11Å; D193-I196 HydrophobicContact CB-CB 4.23Å; D193-I196 HydrophobicContact CB-CG1 3.89Å; D193-I196 PolarHBondContact O-N 3.43Å; I196-L198 VanDerWaalsContact CG2-O 3.29Å; I196-L198 WeakPolarHBondContact CG2-O 3.43Å; I196-A199 HydrophobicContact CG2-CB 4.41Å
197	A	97.7	Very high	95.3	Very high	11 Å²	11	32.1 Å²	32.1	9%	0.091	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-28.7	178.3	0	0	0	0	0	112.2	S118 L127 Q132 Q195	S118-A197 VanDerWaalsContact CB-O 3.26Å; S118-A197 WeakPolarHBondContact CB-O 3.18Å; S118-A197 PolarHBondContact OG-O 2.93Å; L127-A197 HydrophobicContact CD1-CB 3.71Å; Q132-A197 PolarHBondContact O-N 3.35Å; Q195-A197 PolarHBondContact O-N 3.22Å
198	L	97.7	Very high	95	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	144.1	-173.7	175.7	78.8	0	0	0	108.4	Y117 I121 V133 A134 L154 I196 I218 F219	Y117-L198 WeakPolarHBondContact O-CA 3.44Å; Y117-L198 WeakPolarHBondContact O-CD1 3.44Å; I121-L198 HydrophobicContact CD1-CD1 4.5Å; V133-L198 CarbonylContact C-O 3.54Å; V133-L198 VanDerWaalsContact CA-O 3.27Å; V133-L198 WeakPolarHBondContact CA-O 3.48Å; V133-L198 HydrophobicContact CG1-CB 4.39Å; V133-L198 HydrophobicContact CG1-CD2 3.86Å; V133-L198 HydrophobicContact CG1-CG 4.26Å; V133-L198 HydrophobicContact CG2-CB 4.3Å; V133-L198 HydrophobicContact CG2-CD2 4.14Å; A134-L198 PolarHBondContact N-O 2.82Å; L154-L198 HydrophobicContact CD1-CD2 4.21Å; I196-L198 VanDerWaalsContact CG2-O 3.29Å; I196-L198 WeakPolarHBondContact CG2-O 3.43Å; L198-I218 HydrophobicContact CD1-CD1 3.93Å; L198-F219 HydrophobicContact CD1-CE1 3.9Å; L198-F219 HydrophobicContact CD2-CE1 3.65Å; L198-F219 HydrophobicContact CD2-CZ 3.92Å; L198-F219 HydrophobicContact CG-CE1 4.3Å
199	A	98.5	Very high	94.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132.2	172.2	0	0	0	0	0	110.7	G116 Y117 A134 L191 I196 I201	G116-A199 CarbonylContact C-O 3.6Å; G116-A199 WeakPolarHBondContact CA-O 3.39Å; Y117-A199 PolarHBondContact N-O 3.07Å; Y117-A199 PolarHBondContact O-N 3.33Å; A134-A199 HydrophobicContact CB-CB 3.93Å; A134-A199 CarbonylContact O-C 3.55Å; A134-A199 VanDerWaalsContact O-CA 3.28Å; A134-A199 WeakPolarHBondContact O-CA 3.35Å; L191-A199 HydrophobicContact CD2-CB 3.8Å; L191-A199 HydrophobicContact CG-CB 4.41Å; I196-A199 HydrophobicContact CG2-CB 4.41Å; A199-I201 HydrophobicContact CB-CD1 4Å; A199-I201 HydrophobicContact CB-CG1 3.88Å
200	V	98.6	Very high	94.5	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	115.6	170.6	-176.2	0	0	0	0	107.8	I114 A115 A134 V135 P136 S145 L148 L149 L187 F219	I114-V200 HydrophobicContact CD1-CG1 3.78Å; I114-V200 HydrophobicContact CG1-CG1 3.8Å; A115-V200 CarbonylContact O-C 3.56Å; A115-V200 WeakPolarHBondContact O-CA 3.37Å; A134-V200 PolarHBondContact O-N 3.5Å; V135-V200 HydrophobicContact CG1-CB 4.22Å; V135-V200 HydrophobicContact CG1-CG2 4.15Å; P136-V200 WeakPolarHBondContact CD-O 3.33Å; S145-V200 WeakPolarHBondContact OG-CG1 3.43Å; L148-V200 HydrophobicContact CD2-CG1 4.35Å; L149-V200 HydrophobicContact CD2-CG2 4.09Å; L149-V200 HydrophobicContact CG-CG2 4.38Å; L187-V200 WeakPolarHBondContact CD1-O 3.25Å; V200-F219 HydrophobicContact CG2-CE2 4.12Å; V200-F219 HydrophobicContact CG2-CZ 3.92Å
201	I	97.8	Very high	94.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.1	-167.2	-44.2	-173.5	0	0	0	110.5	I114 A115 Y117 L187 P188 L191 A199 T203 A206	I114-I201 WeakPolarHBondContact CG1-O 3.19Å; A115-I201 PolarHBondContact O-N 3.11Å; Y117-I201 HydrophobicContact CD2-CB 3.86Å; Y117-I201 HydrophobicContact CD2-CD1 4.04Å; Y117-I201 HydrophobicContact CD2-CG1 3.82Å; Y117-I201 HydrophobicContact CE2-CB 3.98Å; Y117-I201 HydrophobicContact CE2-CG1 4.46Å; L187-I201 HydrophobicContact CB-CB 4.39Å; L187-I201 HydrophobicContact CB-CD1 4.28Å; L187-I201 HydrophobicContact CB-CG1 3.95Å; L187-I201 HydrophobicContact CB-CG2 4Å; P188-I201 HydrophobicContact CG-CG2 4.14Å; L191-I201 HydrophobicContact CD1-CD1 3.75Å; L191-I201 HydrophobicContact CD2-CD1 4.33Å; L191-I201 HydrophobicContact CG-CD1 3.97Å; A199-I201 HydrophobicContact CB-CD1 4Å; A199-I201 HydrophobicContact CB-CG1 3.88Å; I201-T203 PolarHBondContact O-N 2.95Å; I201-A206 HydrophobicContact CB-CB 4.33Å; I201-A206 HydrophobicContact CG2-CB 4.03Å
202	N	95.3	Very high	94.1	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.027	21%	0.209	C	C	.	.			trans	-55.4	136	170.9	-64.7	77.1	0	0	0	110.7	P136 N141 T204 Y205 A206	P136-N202 WeakPolarHBondContact CG-OD1 3.28Å; N141-N202 PolarHBondContact OD1-ND2 2.63Å; N141-N202 VanDerWaalsContact OD1-ND2 3.09Å; N202-T204 PolarHBondContact O-N 3.38Å; N202-T204 VanDerWaalsContact O-N 3.12Å; N202-Y205 HydrophobicContact CB-CD2 4.19Å; N202-Y205 PolarHBondContact O-N 3.38Å; N202-A206 PolarHBondContact O-N 2.95Å
203	T	93.8	Very high	93.9	Very high	4 Å²	4	30 Å²	30	3%	0.025	18%	0.184	C	C	.	.	H	α-helix	trans	-53.7	-37.3	-177.9	-37.6	0	0	0	0	112.4	P113 I201 Y205 A206 S207 P213 F263	P113-T203 PolarHBondContact O-OG1 2.92Å; I201-T203 PolarHBondContact O-N 2.95Å; T203-Y205 VanDerWaalsContact C-N 3.3Å; T203-Y205 PolarHBondContact O-N 3.36Å; T203-A206 PolarHBondContact O-N 3.21Å; T203-S207 VanDerWaalsContact O-CB 3.31Å; T203-S207 WeakPolarHBondContact O-CB 3.35Å; T203-S207 PolarHBondContact O-N 3.39Å; T203-S207 PolarHBondContact O-OG 3.47Å; T203-P213 HydrophobicContact CG2-CG 3.98Å; T203-F263 HydrophobicContact CG2-CD1 3.76Å; T203-F263 HydrophobicContact CG2-CE1 3.99Å
204	T	91.8	Very high	93.7	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-50.4	-48.6	174.8	-39.7	0	0	0	0	111.7	I38 E42 Y69 N202 S207	I38-T204 HydrophobicContact CB-CG2 3.93Å; I38-T204 HydrophobicContact CG2-CG2 3.55Å; E42-T204 HydrophobicContact CG-CG2 4.09Å; E42-T204 VanDerWaalsContact OE1-CB 3.31Å; E42-T204 WeakPolarHBondContact OE1-CB 3.41Å; E42-T204 WeakPolarHBondContact OE1-CG2 3.33Å; E42-T204 PolarHBondContact OE1-OG1 3.3Å; Y69-T204 PolarHBondContact OH-OG1 3.15Å; N202-T204 PolarHBondContact O-N 3.38Å; N202-T204 VanDerWaalsContact O-N 3.12Å; T204-S207 PolarHBondContact O-OG 2.8Å
205	Y	93.8	Very high	93.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-85.7	-33	-178.9	-65.2	-60	0	0	0	113.1	I38 N67 D68 Y69 A184 P185 P188 N202 T203 S207 Q208	I38-Y205 HydrophobicContact CG2-CE1 4.3Å; N67-Y205 PolarHBondContact O-OH 2.87Å; D68-Y205 WeakPolarHBondContact CA-OH 3.41Å; Y69-Y205 HydrophobicContact CD1-CE2 4.4Å; Y69-Y205 WeakPolarHBondContact CD1-OH 3.39Å; Y69-Y205 HydrophobicContact CD2-CE2 4.37Å; Y69-Y205 AromaticContact CE1-CE2 3.76Å; Y69-Y205 HydrophobicContact CE1-CE2 3.76Å; Y69-Y205 AromaticContact CE1-CZ 3.88Å; Y69-Y205 WeakPolarHBondContact CE1-OH 3.48Å; Y69-Y205 AromaticContact CE2-CE2 3.7Å; Y69-Y205 HydrophobicContact CE2-CE2 3.7Å; Y69-Y205 AromaticContact CZ-CE2 3.37Å; Y69-Y205 AromaticContact CZ-CZ 4Å; Y69-Y205 WeakPolarHBondContact OH-CE2 3.43Å; A184-Y205 HydrophobicContact CB-CD2 3.73Å; A184-Y205 HydrophobicContact CB-CE2 3.42Å; A184-Y205 VanDerWaalsContact CB-CE2 3.42Å; A184-Y205 WeakPolarHBondContact O-CD2 3.24Å; P185-Y205 HydrophobicContact CB-CD1 4.25Å; P185-Y205 HydrophobicContact CB-CE1 3.82Å; P185-Y205 HydrophobicContact CG-CE1 3.8Å; P185-Y205 HydrophobicContact CG-CE2 4.2Å; P185-Y205 WeakPolarHBondContact CG-OH 3.35Å; P188-Y205 WeakPolarHBondContact CG-O 3.36Å; N202-Y205 HydrophobicContact CB-CD2 4.19Å; N202-Y205 PolarHBondContact O-N 3.38Å; T203-Y205 VanDerWaalsContact C-N 3.3Å; T203-Y205 PolarHBondContact O-N 3.36Å; Y205-S207 VanDerWaalsContact C-N 3.3Å; Y205-S207 PolarHBondContact O-N 3.03Å; Y205-Q208 WeakPolarHBondContact O-CB 3.48Å; Y205-Q208 PolarHBondContact O-N 3.46Å
206	A	94.3	Very high	93.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-40.9	174.9	0	0	0	0	0	111.5	Y117 I201 N202 T203 Q208 I209 L211	Y117-A206 HydrophobicContact CE2-CB 3.83Å; I201-A206 HydrophobicContact CB-CB 4.33Å; I201-A206 HydrophobicContact CG2-CB 4.03Å; N202-A206 PolarHBondContact O-N 2.95Å; T203-A206 PolarHBondContact O-N 3.21Å; A206-Q208 VanDerWaalsContact C-N 3.25Å; A206-Q208 PolarHBondContact O-N 2.68Å; A206-I209 VanDerWaalsContact O-CG1 3.24Å; A206-I209 WeakPolarHBondContact O-CG1 3.37Å; A206-I209 PolarHBondContact O-N 3.42Å; A206-L211 CarbonylContact C-O 3.57Å; A206-L211 HydrophobicContact CB-CB 4.2Å; A206-L211 PolarHBondContact O-N 2.9Å; A206-L211 VanDerWaalsContact O-N 3.09Å
207	S	90.5	Very high	93.7	Very high	30 Å²	30	31.6 Å²	31.6	21%	0.21	19%	0.194	C	C	.	.	H	α-helix	trans	-63.4	-27.8	179.5	69.7	0	0	0	0	113.4	A41 T203 T204 Y205 I209 G210 L211	A41-S207 VanDerWaalsContact CB-OG 3.28Å; A41-S207 WeakPolarHBondContact CB-OG 3.38Å; T203-S207 VanDerWaalsContact O-CB 3.31Å; T203-S207 WeakPolarHBondContact O-CB 3.35Å; T203-S207 PolarHBondContact O-N 3.39Å; T203-S207 PolarHBondContact O-OG 3.47Å; T204-S207 PolarHBondContact O-OG 2.8Å; Y205-S207 VanDerWaalsContact C-N 3.3Å; Y205-S207 PolarHBondContact O-N 3.03Å; S207-I209 PolarHBondContact O-N 2.97Å; S207-G210 PolarHBondContact O-N 3.09Å; S207-L211 WeakPolarHBondContact CA-O 3.22Å; S207-L211 PolarHBondContact N-O 2.86Å
208	Q	89.8	Confident	93.7	Very high	85 Å²	85	33 Å²	33	40%	0.397	20%	0.2	S	C	.	.	H	α-helix	trans	-65.7	-24.4	178.7	-65.9	178.7	1.4	0	0	113.1	V39 Y205 A206	V39-Q208 PolarHBondContact O-NE2 3.43Å; Y205-Q208 WeakPolarHBondContact O-CB 3.48Å; Y205-Q208 PolarHBondContact O-N 3.46Å; A206-Q208 VanDerWaalsContact C-N 3.25Å; A206-Q208 PolarHBondContact O-N 2.68Å
209	I	91.8	Very high	93.6	Very high	80 Å²	80	33.8 Å²	33.8	41%	0.41	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	17	174.9	60.9	159.3	0	0	0	112.1	P188 L191 A206 S207 L211	P188-I209 HydrophobicContact CB-CD1 3.75Å; P188-I209 HydrophobicContact CB-CG1 4.04Å; P188-I209 HydrophobicContact CB-CG2 3.92Å; L191-I209 HydrophobicContact CD1-CD1 3.96Å; A206-I209 VanDerWaalsContact O-CG1 3.24Å; A206-I209 WeakPolarHBondContact O-CG1 3.37Å; A206-I209 PolarHBondContact O-N 3.42Å; S207-I209 PolarHBondContact O-N 2.97Å; I209-L211 VanDerWaalsContact C-N 3.34Å; I209-L211 HydrophobicContact CD1-CD1 3.49Å; I209-L211 VanDerWaalsContact CD1-CD1 3.49Å; I209-L211 HydrophobicContact CD1-CG 3.86Å; I209-L211 HydrophobicContact CG1-CD1 4.08Å; I209-L211 HydrophobicContact CG1-CG 3.95Å; I209-L211 PolarHBondContact O-N 3.49Å
210	G	89.8	Confident	93.5	Very high	55 Å²	55	36.3 Å²	36.3	57%	0.567	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	76	13.7	176.3	0	0	0	0	0	115.3	S207	S207-G210 PolarHBondContact O-N 3.09Å
211	L	92.6	Very high	93.3	Very high	33 Å²	33	37.5 Å²	37.5	17%	0.173	22%	0.224	C	C	.	.			trans	-88	142.1	175.6	-60.3	-178.9	0	0	0	111.1	Y117 L191 A206 S207 I209 D216	Y117-L211 HydrophobicContact CD1-CB 4.22Å; Y117-L211 HydrophobicContact CD1-CD1 3.89Å; Y117-L211 HydrophobicContact CE1-CB 3.94Å; Y117-L211 HydrophobicContact CE1-CD1 4.42Å; Y117-L211 HydrophobicContact CG-CD1 4.1Å; L191-L211 HydrophobicContact CD1-CD1 3.6Å; A206-L211 CarbonylContact C-O 3.57Å; A206-L211 HydrophobicContact CB-CB 4.2Å; A206-L211 PolarHBondContact O-N 2.9Å; A206-L211 VanDerWaalsContact O-N 3.09Å; S207-L211 WeakPolarHBondContact CA-O 3.22Å; S207-L211 PolarHBondContact N-O 2.86Å; I209-L211 VanDerWaalsContact C-N 3.34Å; I209-L211 HydrophobicContact CD1-CD1 3.49Å; I209-L211 VanDerWaalsContact CD1-CD1 3.49Å; I209-L211 HydrophobicContact CD1-CG 3.86Å; I209-L211 HydrophobicContact CG1-CD1 4.08Å; I209-L211 HydrophobicContact CG1-CG 3.95Å; I209-L211 PolarHBondContact O-N 3.49Å; L211-D216 WeakPolarHBondContact CA-OD2 3.24Å; L211-D216 HydrophobicContact CB-CB 4.37Å; L211-D216 HydrophobicContact CD2-CB 3.8Å
212	T	91.5	Very high	92.8	Very high	19 Å²	19	41.5 Å²	41.5	12%	0.117	25%	0.245	C	C	.	.			trans	-127.1	145.1	174	66.7	0	0	0	0	110.7	A214 K215 D216 N264	T212-A214 VanDerWaalsContact C-N 3.27Å; T212-A214 PolarHBondContact O-N 3.48Å; T212-K215 PolarHBondContact O-N 3.27Å; T212-K215 WeakPolarHBondContact OG1-CB 3.31Å; T212-K215 PolarHBondContact OG1-N 3.43Å; T212-D216 PolarHBondContact N-OD2 3.37Å; T212-D216 PolarHBondContact O-N 3Å; T212-N264 HydrophobicContact CG2-CB 4.42Å
213	P	92	Very high	92.2	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.052	28%	0.275	C	S	.	.	H	α-helix	trans	-54.9	-42.1	177.3	-26.9	34.1	0	0	0	113.2	P113 A115 Y117 T203 K215 G217 V220	P113-P213 WeakPolarHBondContact O-CG 3.45Å; A115-P213 HydrophobicContact CB-CB 3.99Å; A115-P213 HydrophobicContact CB-CG 4.38Å; Y117-P213 WeakPolarHBondContact OH-CA 3.24Å; Y117-P213 WeakPolarHBondContact OH-CD 3.28Å; Y117-P213 WeakPolarHBondContact OH-CG 3.49Å; Y117-P213 VanDerWaalsContact OH-N 3.15Å; T203-P213 HydrophobicContact CG2-CG 3.98Å; P213-K215 PolarHBondContact O-N 3.23Å; P213-G217 WeakPolarHBondContact O-CA 3.42Å; P213-G217 PolarHBondContact O-N 3.42Å; P213-G217 VanDerWaalsContact O-N 3.15Å; P213-V220 HydrophobicContact CB-CB 4.46Å; P213-V220 HydrophobicContact CB-CG1 3.6Å; P213-V220 HydrophobicContact CB-CG2 3.94Å; P213-V220 VanDerWaalsContact O-CG2 3.26Å; P213-V220 WeakPolarHBondContact O-CG2 3.35Å
214	A	89.3	Confident	91.7	Very high	91 Å²	91	56.8 Å²	56.8	75%	0.752	31%	0.314	S	S	*	.	H	α-helix	trans	-70	-31.8	-175.5	0	0	0	0	0	114.3	T212	T212-A214 VanDerWaalsContact C-N 3.27Å; T212-A214 PolarHBondContact O-N 3.48Å
215	K	91.5	Very high	91.4	Very high	166 Å²	166	57.6 Å²	57.6	72%	0.722	32%	0.32	S	S	*	.	H	α-helix	trans	-96.6	-42.1	-176.4	-176.7	-168.7	166.7	-164.1	0	112.7	T212 P213	T212-K215 PolarHBondContact O-N 3.27Å; T212-K215 WeakPolarHBondContact OG1-CB 3.31Å; T212-K215 PolarHBondContact OG1-N 3.43Å; P213-K215 PolarHBondContact O-N 3.23Å
216	D	94.7	Very high	91.1	Very high	48 Å²	48	60.8 Å²	60.8	26%	0.257	34%	0.341	S	S	.	.	H	α-helix	trans	-116.5	-7.8	-165.3	-44	-76.6	0	0	0	112.6	Y117 L211 T212	Y117-D216 HydrophobicContact CD1-CB 3.98Å; Y117-D216 WeakPolarHBondContact CD1-O 3.49Å; Y117-D216 HydrophobicContact CE1-CB 4Å; L211-D216 WeakPolarHBondContact CA-OD2 3.24Å; L211-D216 HydrophobicContact CB-CB 4.37Å; L211-D216 HydrophobicContact CD2-CB 3.8Å; T212-D216 PolarHBondContact N-OD2 3.37Å; T212-D216 PolarHBondContact O-N 3Å
217	G	95.3	Very high	91.1	Very high	24 Å²	24	61 Å²	61	25%	0.247	34%	0.342	C	S	.	.			trans	-74.3	125.1	178.3	0	0	0	0	0	112	G116 P213 F219	G116-G217 CarbonylContact O-C 3.59Å; G116-G217 WeakPolarHBondContact O-CA 3.3Å; P213-G217 WeakPolarHBondContact O-CA 3.42Å; P213-G217 PolarHBondContact O-N 3.42Å; P213-G217 VanDerWaalsContact O-N 3.15Å; G217-F219 VanDerWaalsContact C-N 3.31Å
218	I	97	Very high	91.2	Very high	41 Å²	41	60.9 Å²	60.9	21%	0.21	34%	0.339	C	S	.	.	S	Bend	trans	-71.2	-34	170.9	-62.2	179.2	0	0	0	110.2	G116 S118 I121 L124 L198	G116-I218 PolarHBondContact O-N 2.88Å; S118-I218 VanDerWaalsContact CB-CD1 3.48Å; I121-I218 HydrophobicContact CD1-CD1 4.15Å; I121-I218 HydrophobicContact CG1-CD1 3.83Å; I121-I218 WeakPolarHBondContact O-CD1 3.2Å; L124-I218 HydrophobicContact CD2-CG2 3.82Å; L124-I218 HydrophobicContact CG-CG2 3.92Å; L198-I218 HydrophobicContact CD1-CD1 3.93Å
219	F	96.7	Very high	91.4	Very high	15 Å²	15	57.2 Å²	57.2	7%	0.066	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	148.6	168.8	55.7	-89	0	0	0	109.5	A115 G116 L124 L148 L149 V152 L154 L198 V200 G217	A115-F219 CarbonylContact C-O 3.47Å; A115-F219 VanDerWaalsContact CA-O 3.24Å; A115-F219 WeakPolarHBondContact CA-O 3.1Å; A115-F219 VanDerWaalsContact CB-O 3.29Å; A115-F219 WeakPolarHBondContact CB-O 3.31Å; G116-F219 PolarHBondContact N-O 3.2Å; L124-F219 HydrophobicContact CD1-CD1 4.18Å; L124-F219 HydrophobicContact CD2-CD1 3.77Å; L124-F219 HydrophobicContact CD2-CE1 3.81Å; L124-F219 HydrophobicContact CG-CD1 4.31Å; L148-F219 HydrophobicContact CD1-CD2 4.09Å; L148-F219 HydrophobicContact CD2-CD2 3.7Å; L148-F219 HydrophobicContact CD2-CE2 3.67Å; L148-F219 HydrophobicContact CG-CD2 3.64Å; L148-F219 HydrophobicContact CG-CE2 3.68Å; L149-F219 HydrophobicContact CD2-CE2 4.28Å; L149-F219 HydrophobicContact CD2-CZ 3.75Å; V152-F219 HydrophobicContact CG1-CB 3.68Å; V152-F219 HydrophobicContact CG1-CD2 3.99Å; V152-F219 HydrophobicContact CG1-CG 3.85Å; V152-F219 HydrophobicContact CG2-CD1 4.46Å; V152-F219 HydrophobicContact CG2-CD2 4.35Å; V152-F219 HydrophobicContact CG2-CE2 4.49Å; V152-F219 HydrophobicContact CG2-CG 4.34Å; L154-F219 HydrophobicContact CD1-CE1 4.48Å; L198-F219 HydrophobicContact CD1-CE1 3.9Å; L198-F219 HydrophobicContact CD2-CE1 3.65Å; L198-F219 HydrophobicContact CD2-CZ 3.92Å; L198-F219 HydrophobicContact CG-CE1 4.3Å; V200-F219 HydrophobicContact CG2-CE2 4.12Å; V200-F219 HydrophobicContact CG2-CZ 3.92Å; G217-F219 VanDerWaalsContact C-N 3.31Å
220	V	94.9	Very high	91.7	Very high	54 Å²	54	53.6 Å²	53.6	33%	0.327	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142.5	-171	-173.9	0	0	0	0	109.4	P113 A115 P213	P113-V220 HydrophobicContact CB-CG1 3.9Å; A115-V220 HydrophobicContact CB-CB 4.33Å; A115-V220 HydrophobicContact CB-CG1 4.33Å; A115-V220 HydrophobicContact CB-CG2 3.94Å; P213-V220 HydrophobicContact CB-CB 4.46Å; P213-V220 HydrophobicContact CB-CG1 3.6Å; P213-V220 HydrophobicContact CB-CG2 3.94Å; P213-V220 VanDerWaalsContact O-CG2 3.26Å; P213-V220 WeakPolarHBondContact O-CG2 3.35Å
221	E	94.2	Very high	92.1	Very high	24 Å²	24	51 Å²	51	11%	0.112	28%	0.277	C	S	.	.			trans	-61.3	147.7	169.8	-173.4	-174.4	79.6	0	0	111.2	P113 I114 R144 L148 S225 Y227	P113-E221 HydrophobicContact CB-CB 4.12Å; P113-E221 WeakPolarHBondContact CB-O 3.29Å; I114-E221 HydrophobicContact CG2-CB 4.01Å; I114-E221 WeakPolarHBondContact O-CB 3.37Å; I114-E221 PolarHBondContact O-N 2.89Å; R144-E221 WeakPolarHBondContact CG-OE2 3.38Å; R144-E221 IonicContact CZ-OE1 2.67Å; R144-E221 IonicContact CZ-OE2 2.75Å; R144-E221 IonicContact NE-OE1 3.92Å; R144-E221 PolarHBondContact NE-OE1 2.91Å; R144-E221 IonicContact NE-OE2 2.83Å; R144-E221 PolarHBondContact NE-OE2 3.48Å; R144-E221 IonicContact NH2-OE1 3.43Å; R144-E221 PolarHBondContact NH2-OE1 3.45Å; R144-E221 IonicContact NH2-OE2 2.62Å; L148-E221 HydrophobicContact CD1-CB 4.47Å; L148-E221 HydrophobicContact CD2-CB 4.49Å; E221-S225 WeakPolarHBondContact OE1-CB 3.48Å; E221-S225 PolarHBondContact OE1-OG 3.01Å; E221-Y227 WeakPolarHBondContact OE2-CD2 3.31Å
222	D	88.7	Confident	92.4	Very high	85 Å²	85	49.4 Å²	49.4	46%	0.455	27%	0.269	S	S	.	.			trans	-64.5	157	174.9	-69.4	-4.1	0	0	0	111.9	K151 E224	K151-D222 IonicContact NZ-OD1 3.65Å; K151-D222 PolarHBondContact NZ-OD1 3.32Å; K151-D222 IonicContact NZ-OD2 3.63Å; K151-D222 PolarHBondContact NZ-OD2 3.35Å; D222-E224 PolarHBondContact O-N 3.27Å
223	K	82.9	Confident	92.7	Very high	148 Å²	148	48.5 Å²	48.5	64%	0.643	26%	0.263	S	S	*	.	S	Bend	trans	-64.4	-28.4	173.5	-61.3	-174	179.2	-179.4	0	112.5	S225 V268	K223-S225 PolarHBondContact O-N 3.2Å; K223-V268 HydrophobicContact CB-CG1 4.35Å; K223-V268 HydrophobicContact CB-CG2 3.98Å; K223-V268 HydrophobicContact CD-CG2 4.1Å; K223-V268 HydrophobicContact CG-CG2 3.87Å
224	E	83.2	Confident	93	Very high	182 Å²	182	49.1 Å²	49.1	85%	0.85	27%	0.265	S	S	*	.	S	Bend	trans	-83.6	100.2	173.4	-68	178.1	-172.1	0	0	109.2	D222	D222-E224 PolarHBondContact O-N 3.27Å
225	S	84.5	Confident	93.4	Very high	21 Å²	21	49.7 Å²	49.7	15%	0.147	25%	0.252	C	S	.	.			trans	-138.4	137	-167.6	-179.2	0	0	0	0	111.2	E221 K223 Y227	E221-S225 WeakPolarHBondContact OE1-CB 3.48Å; E221-S225 PolarHBondContact OE1-OG 3.01Å; K223-S225 PolarHBondContact O-N 3.2Å; S225-Y227 PolarHBondContact O-N 3.4Å; S225-Y227 VanDerWaalsContact OG-CD2 3.27Å; S225-Y227 WeakPolarHBondContact OG-CD2 3.36Å; S225-Y227 PolarHBondContact OG-N 3.43Å
226	P	88.8	Confident	93.6	Very high	68 Å²	68	48 Å²	48	44%	0.442	25%	0.251	S	S	.	.	S	Bend	trans	-72.1	-4.4	172.4	32.3	-34.9	0	0	0	112.4	L163 V228	L163-P226 HydrophobicContact CD1-CB 4.18Å; L163-P226 HydrophobicContact CD1-CG 4.3Å; L163-P226 HydrophobicContact CD2-CG 3.95Å; P226-V228 VanDerWaalsContact C-N 3.34Å; P226-V228 PolarHBondContact O-N 2.94Å
227	Y	93.4	Very high	93.7	Very high	5 Å²	5	46.5 Å²	46.5	2%	0.02	24%	0.242	C	C	.	.			trans	-96.2	42.1	-173.4	-53.9	-75.2	0	0	0	112.6	H88 P90 R144 E221 S225 N229	H88-Y227 AromaticContact CE1-CD1 3.7Å; H88-Y227 AromaticContact CG-CD1 3.95Å; H88-Y227 AromaticContact ND1-CD1 3.73Å; H88-Y227 AromaticContact NE2-CD1 3.91Å; P90-Y227 HydrophobicContact CB-CD1 4.37Å; P90-Y227 HydrophobicContact CB-CE1 4.19Å; P90-Y227 HydrophobicContact CG-CD1 3.83Å; P90-Y227 HydrophobicContact CG-CE1 3.87Å; R144-Y227 WeakPolarHBondContact CA-OH 3.38Å; R144-Y227 HydrophobicContact CB-CE1 3.93Å; R144-Y227 HydrophobicContact CB-CE2 3.91Å; R144-Y227 VanDerWaalsContact CD-CD2 3.47Å; R144-Y227 HydrophobicContact CG-CD1 4.45Å; R144-Y227 HydrophobicContact CG-CD2 3.73Å; R144-Y227 HydrophobicContact CG-CE1 4.13Å; R144-Y227 HydrophobicContact CG-CE2 3.39Å; R144-Y227 HydrophobicContact CG-CG 4.27Å; R144-Y227 VanDerWaalsContact NE-CD2 3.25Å; E221-Y227 WeakPolarHBondContact OE2-CD2 3.31Å; S225-Y227 PolarHBondContact O-N 3.4Å; S225-Y227 VanDerWaalsContact OG-CD2 3.27Å; S225-Y227 WeakPolarHBondContact OG-CD2 3.36Å; S225-Y227 PolarHBondContact OG-N 3.43Å; Y227-N229 PolarHBondContact O-N 3.48Å
228	V	92.9	Very high	93.8	Very high	26 Å²	26	49.9 Å²	49.9	16%	0.158	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	127.8	171.2	64.4	0	0	0	0	109.8	H88 N108 V111 P226 L230	H88-V228 WeakPolarHBondContact CA-O 3.45Å; H88-V228 VanDerWaalsContact CB-O 3.28Å; H88-V228 WeakPolarHBondContact CB-O 3.45Å; N108-V228 HydrophobicContact CB-CG2 4.1Å; V111-V228 HydrophobicContact CG2-CB 3.82Å; V111-V228 HydrophobicContact CG2-CG2 4.15Å; P226-V228 VanDerWaalsContact C-N 3.34Å; P226-V228 PolarHBondContact O-N 2.94Å; V228-L230 HydrophobicContact CG1-CD2 4.47Å
229	N	94.7	Very high	93.7	Very high	8 Å²	8	53 Å²	53	4%	0.043	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	153.1	176.2	-67.6	-77.7	0	0	0	111.2	F86 Q87 H88 T109 F110 Y112 Y227	F86-N229 PolarHBondContact O-OD1 3.43Å; Q87-N229 VanDerWaalsContact C-OD1 3.24Å; Q87-N229 CarbonylContact O-C 3.6Å; Q87-N229 VanDerWaalsContact O-CA 3.26Å; Q87-N229 WeakPolarHBondContact O-CA 3.45Å; H88-N229 PolarHBondContact N-OD1 2.95Å; T109-N229 PolarHBondContact N-O 3.34Å; T109-N229 WeakPolarHBondContact OG1-CB 3.48Å; T109-N229 PolarHBondContact OG1-O 2.92Å; F110-N229 WeakPolarHBondContact O-CB 3.44Å; F110-N229 PolarHBondContact O-N 3.45Å; F110-N229 PolarHBondContact O-ND2 2.53Å; Y112-N229 VanDerWaalsContact CD2-ND2 3.29Å; Y112-N229 WeakPolarHBondContact CD2-ND2 3.48Å; Y227-N229 PolarHBondContact O-N 3.48Å
230	L	97	Very high	93.7	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154.3	-168.1	-56.9	173.2	0	0	0	110.8	A85 Q87 K89 L92 A105 G107 N108 V228 V232	A85-L230 WeakPolarHBondContact CA-O 3.49Å; Q87-L230 PolarHBondContact O-N 3.12Å; K89-L230 HydrophobicContact CB-CD1 3.87Å; K89-L230 HydrophobicContact CD-CD1 4.04Å; L92-L230 HydrophobicContact CD2-CD1 4.01Å; A105-L230 HydrophobicContact CB-CB 4.47Å; A105-L230 HydrophobicContact CB-CD1 3.86Å; A105-L230 HydrophobicContact CB-CD2 4.36Å; A105-L230 HydrophobicContact CB-CG 4.47Å; G107-L230 CarbonylContact O-C 3.57Å; G107-L230 VanDerWaalsContact O-CA 3.32Å; G107-L230 WeakPolarHBondContact O-CA 3.43Å; N108-L230 WeakPolarHBondContact OD1-CD2 3.34Å; V228-L230 HydrophobicContact CG1-CD2 4.47Å; L230-V232 HydrophobicContact CB-CG2 3.86Å
231	I	98.2	Very high	93.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124	157.2	-55.1	175.1	0	0	0	106.2	A83 N84 A85 A105 V106 G107 T109 F246 V247 Y250	A83-I231 HydrophobicContact CB-CG2 4.35Å; N84-I231 CarbonylContact O-C 3.59Å; N84-I231 WeakPolarHBondContact O-CA 3.44Å; A85-I231 HydrophobicContact CB-CG1 4.29Å; A105-I231 WeakPolarHBondContact CA-O 3.37Å; V106-I231 HydrophobicContact CG2-CB 4.06Å; V106-I231 HydrophobicContact CG2-CG2 3.7Å; V106-I231 WeakPolarHBondContact CG2-O 3.24Å; V106-I231 PolarHBondContact N-O 3.27Å; G107-I231 PolarHBondContact N-O 2.93Å; G107-I231 PolarHBondContact O-N 2.94Å; T109-I231 HydrophobicContact CG2-CD1 4.18Å; T109-I231 HydrophobicContact CG2-CG1 3.61Å; I231-F246 HydrophobicContact CD1-CD1 4.36Å; I231-F246 HydrophobicContact CD1-CE1 4.23Å; I231-F246 HydrophobicContact CG2-CD1 4.19Å; I231-F246 HydrophobicContact CG2-CE1 4.21Å; I231-V247 HydrophobicContact CB-CG2 4.44Å; I231-V247 HydrophobicContact CD1-CB 4.31Å; I231-V247 HydrophobicContact CD1-CG1 4.48Å; I231-V247 HydrophobicContact CD1-CG2 3.94Å; I231-V247 HydrophobicContact CG2-CG2 4.19Å; I231-Y250 HydrophobicContact CD1-CD1 4.49Å; I231-Y250 HydrophobicContact CD1-CG 4.07Å
232	V	98.6	Very high	93.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	137.8	-175.1	-178.6	0	0	0	0	109.5	L76 A83 N84 Q87 L92 L103 V104 L230	L76-V232 HydrophobicContact CD2-CB 4.31Å; L76-V232 HydrophobicContact CD2-CG1 3.93Å; L76-V232 WeakPolarHBondContact CD2-O 3.34Å; A83-V232 CarbonylContact C-O 3.57Å; A83-V232 WeakPolarHBondContact CA-O 3.43Å; N84-V232 PolarHBondContact N-O 3.4Å; N84-V232 PolarHBondContact O-N 3.1Å; Q87-V232 HydrophobicContact CG-CG2 4.03Å; L92-V232 HydrophobicContact CD1-CG1 3.82Å; L92-V232 HydrophobicContact CD1-CG2 4.37Å; L92-V232 HydrophobicContact CD2-CG1 4.23Å; L92-V232 HydrophobicContact CD2-CG2 3.89Å; L103-V232 HydrophobicContact CB-CG1 3.75Å; L103-V232 HydrophobicContact CD1-CG1 4.49Å; V104-V232 WeakPolarHBondContact O-CA 3.27Å; V104-V232 WeakPolarHBondContact O-CG1 3.38Å; L230-V232 HydrophobicContact CB-CG2 3.86Å
233	T	98.7	Very high	94.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	177	175.7	65.9	0	0	0	0	109.9	A83 L103 V104 V106 N237 K238 V243	A83-T233 HydrophobicContact CB-CG2 3.85Å; L103-T233 CarbonylContact C-O 3.56Å; L103-T233 VanDerWaalsContact CA-O 3.23Å; L103-T233 WeakPolarHBondContact CA-O 3.18Å; V104-T233 PolarHBondContact N-O 2.65Å; V104-T233 PolarHBondContact O-N 2.66Å; V106-T233 HydrophobicContact CB-CG2 4.48Å; V106-T233 HydrophobicContact CG1-CG2 4.04Å; V106-T233 VanDerWaalsContact CG1-OG1 3.28Å; V106-T233 WeakPolarHBondContact CG1-OG1 3.37Å; V106-T233 HydrophobicContact CG2-CG2 3.63Å; T233-N237 WeakPolarHBondContact CB-OD1 3.34Å; T233-K238 WeakPolarHBondContact OG1-CA 3.37Å; T233-V243 HydrophobicContact CG2-CB 4.45Å; T233-V243 HydrophobicContact CG2-CG1 3.68Å; T233-V243 HydrophobicContact CG2-CG2 3.84Å
234	R	98.4	Very high	94.9	Very high	21 Å²	21	49.6 Å²	49.6	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	159.6	162.8	-66.1	178	-59.5	-74.4	-6.3	109.6	L76 I81 D82 K102 L103 D236 N237 K238	L76-R234 HydrophobicContact CD1-CG 4.35Å; L76-R234 HydrophobicContact CG-CG 4.35Å; L76-R234 VanDerWaalsContact O-CD 3.24Å; L76-R234 WeakPolarHBondContact O-CD 3.49Å; L76-R234 VanDerWaalsContact O-CG 3.29Å; L76-R234 WeakPolarHBondContact O-CG 3.21Å; L76-R234 PolarHBondContact O-NH1 3.13Å; I81-R234 PolarHBondContact O-NH1 3.49Å; D82-R234 IonicContact OD1-NH2 3.71Å; K102-R234 WeakPolarHBondContact O-CA 3.46Å; L103-R234 HydrophobicContact CD2-CB 4.45Å; L103-R234 HydrophobicContact CD2-CG 3.87Å; R234-D236 WeakPolarHBondContact CB-OD1 3.35Å; R234-D236 IonicContact CZ-OD1 3.01Å; R234-D236 IonicContact NE-OD1 3.66Å; R234-D236 PolarHBondContact NE-OD1 3.01Å; R234-D236 IonicContact NE-OD2 3.51Å; R234-D236 IonicContact NH2-OD1 2.63Å; R234-D236 PolarHBondContact O-N 2.86Å; R234-N237 WeakPolarHBondContact CA-OD1 3.36Å; R234-N237 WeakPolarHBondContact CB-OD1 3.35Å; R234-N237 PolarHBondContact N-OD1 2.69Å; R234-N237 PolarHBondContact NH2-ND2 3.2Å; R234-N237 PolarHBondContact O-N 3.22Å; R234-N237 PolarHBondContact O-OD1 3.45Å; R234-K238 PolarHBondContact O-N 2.7Å
235	E	97.2	Very high	95.6	Very high	103 Å²	103	42.2 Å²	42.2	48%	0.481	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-33.8	173	-77.9	-178.3	168	0	0	112.8	K102 V104 K238	K102-E235 HydrophobicContact CB-CG 4.26Å; K102-E235 PolarHBondContact O-N 3.25Å; V104-E235 HydrophobicContact CG1-CG 3.56Å; V104-E235 HydrophobicContact CG2-CG 4.49Å; E235-K238 WeakPolarHBondContact O-CG 3.1Å
236	D	96.2	Very high	96.2	Very high	131 Å²	131	41.2 Å²	41.2	70%	0.701	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-20.3	-173.6	68	-4.9	0	0	0	114.5	R234	R234-D236 WeakPolarHBondContact CB-OD1 3.35Å; R234-D236 IonicContact CZ-OD1 3.01Å; R234-D236 IonicContact NE-OD1 3.66Å; R234-D236 PolarHBondContact NE-OD1 3.01Å; R234-D236 IonicContact NE-OD2 3.51Å; R234-D236 IonicContact NH2-OD1 2.63Å; R234-D236 PolarHBondContact O-N 2.86Å
237	N	96.8	Very high	96.7	Very high	15 Å²	15	38.8 Å²	38.8	8%	0.08	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	6.4	-179.5	75.7	-34.2	0	0	0	114.1	D82 T233 R234 D239 A240	D82-N237 PolarHBondContact O-ND2 3.04Å; T233-N237 WeakPolarHBondContact CB-OD1 3.34Å; R234-N237 WeakPolarHBondContact CA-OD1 3.36Å; R234-N237 WeakPolarHBondContact CB-OD1 3.35Å; R234-N237 PolarHBondContact N-OD1 2.69Å; R234-N237 PolarHBondContact NH2-ND2 3.2Å; R234-N237 PolarHBondContact O-N 3.22Å; R234-N237 PolarHBondContact O-OD1 3.45Å; N237-D239 PolarHBondContact O-N 3.1Å; N237-D239 VanDerWaalsContact O-N 3.08Å; N237-A240 HydrophobicContact CB-CB 4.46Å; N237-A240 VanDerWaalsContact O-CB 3.24Å; N237-A240 WeakPolarHBondContact O-CB 3.34Å; N237-A240 PolarHBondContact O-N 3.21Å
238	K	96.2	Very high	96.8	Very high	95 Å²	95	43.4 Å²	43.4	41%	0.413	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.5	-177.5	74.1	-175.8	-176.7	177.2	0	114.5	V104 V106 T233 R234 E235	V104-K238 HydrophobicContact CG2-CB 3.66Å; V104-K238 HydrophobicContact CG2-CD 4.05Å; V104-K238 HydrophobicContact CG2-CG 4.47Å; V106-K238 HydrophobicContact CG1-CB 3.81Å; T233-K238 WeakPolarHBondContact OG1-CA 3.37Å; R234-K238 PolarHBondContact O-N 2.7Å; E235-K238 WeakPolarHBondContact O-CG 3.1Å
239	D	95.8	Very high	97	Very high	106 Å²	106	42.1 Å²	42.1	57%	0.567	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	2.3	-177.3	-68.5	-58.5	0	0	0	113.7	N237 K244	N237-D239 PolarHBondContact O-N 3.1Å; N237-D239 VanDerWaalsContact O-N 3.08Å; D239-K244 VanDerWaalsContact O-CE 3.31Å; D239-K244 WeakPolarHBondContact O-CE 3.24Å; D239-K244 PolarHBondContact O-NZ 3.34Å
240	A	95.8	Very high	97.1	Very high	31 Å²	31	41.9 Å²	41.9	26%	0.256	21%	0.206	S	C	.	.			trans	-62.5	145.1	-178.1	0	0	0	0	0	111.9	N237 N242 V243 K244	N237-A240 HydrophobicContact CB-CB 4.46Å; N237-A240 VanDerWaalsContact O-CB 3.24Å; N237-A240 WeakPolarHBondContact O-CB 3.34Å; N237-A240 PolarHBondContact O-N 3.21Å; A240-N242 VanDerWaalsContact C-N 3.34Å; A240-N242 WeakPolarHBondContact CB-OD1 3.07Å; A240-N242 PolarHBondContact O-N 2.84Å; A240-V243 HydrophobicContact CB-CB 4.41Å; A240-V243 HydrophobicContact CB-CG2 4.17Å; A240-V243 WeakPolarHBondContact O-CB 3.4Å; A240-V243 PolarHBondContact O-N 3.42Å; A240-K244 PolarHBondContact O-N 3.22Å; A240-K244 VanDerWaalsContact O-N 3.07Å
241	E	95.8	Very high	97.1	Very high	110 Å²	110	46 Å²	46	51%	0.514	23%	0.225	S	C	.	.	H	α-helix	trans	-63.7	-40	-175.5	-165.8	-173.5	153.1	0	0	112.1	V243 K244 K245	E241-V243 VanDerWaalsContact C-N 3.35Å; E241-V243 PolarHBondContact O-N 3.07Å; E241-K244 PolarHBondContact O-N 2.94Å; E241-K245 HydrophobicContact CG-CD 4.42Å; E241-K245 WeakPolarHBondContact O-CG 3.46Å; E241-K245 PolarHBondContact O-N 2.82Å; E241-K245 WeakPolarHBondContact OE1-CE 3.3Å; E241-K245 IonicContact OE1-NZ 3.67Å; E241-K245 PolarHBondContact OE1-NZ 3.26Å
242	N	97.2	Very high	97	Very high	8 Å²	8	46.7 Å²	46.7	4%	0.043	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-40.6	175.1	59.6	-3.4	0	0	0	112.6	P30 H32 I33 L59 A240 F246	P30-N242 WeakPolarHBondContact O-CB 3.45Å; H32-N242 PolarHBondContact O-ND2 2.87Å; I33-N242 HydrophobicContact CB-CB 4.21Å; L59-N242 HydrophobicContact CD1-CB 3.68Å; L59-N242 WeakPolarHBondContact CD2-O 3.19Å; A240-N242 VanDerWaalsContact C-N 3.34Å; A240-N242 WeakPolarHBondContact CB-OD1 3.07Å; A240-N242 PolarHBondContact O-N 2.84Å; N242-F246 WeakPolarHBondContact O-CB 3.38Å; N242-F246 PolarHBondContact O-N 3.08Å
243	V	97.5	Very high	96.8	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-48	174.6	169.2	0	0	0	0	110.4	I33 V106 T233 A240 E241 K245 F246 V247	I33-V243 HydrophobicContact CD1-CG2 3.99Å; V106-V243 HydrophobicContact CB-CG1 4.28Å; V106-V243 HydrophobicContact CG1-CG1 4.4Å; V106-V243 HydrophobicContact CG2-CG1 3.91Å; T233-V243 HydrophobicContact CG2-CB 4.45Å; T233-V243 HydrophobicContact CG2-CG1 3.68Å; T233-V243 HydrophobicContact CG2-CG2 3.84Å; A240-V243 HydrophobicContact CB-CB 4.41Å; A240-V243 HydrophobicContact CB-CG2 4.17Å; A240-V243 WeakPolarHBondContact O-CB 3.4Å; A240-V243 PolarHBondContact O-N 3.42Å; E241-V243 VanDerWaalsContact C-N 3.35Å; E241-V243 PolarHBondContact O-N 3.07Å; V243-K245 PolarHBondContact O-N 2.78Å; V243-F246 PolarHBondContact O-N 3.3Å; V243-V247 HydrophobicContact CG1-CG2 4.44Å; V243-V247 WeakPolarHBondContact O-CG2 3.1Å; V243-V247 PolarHBondContact O-N 2.97Å
244	K	96.9	Very high	96.6	Very high	105 Å²	105	55.1 Å²	55.1	46%	0.457	27%	0.273	S	S	.	.	H	α-helix	trans	-59.5	-47.5	178.6	-72.4	169.4	175.2	154.7	0	111.8	D239 A240 E241 F246 V247 Q248	D239-K244 VanDerWaalsContact O-CE 3.31Å; D239-K244 WeakPolarHBondContact O-CE 3.24Å; D239-K244 PolarHBondContact O-NZ 3.34Å; A240-K244 PolarHBondContact O-N 3.22Å; A240-K244 VanDerWaalsContact O-N 3.07Å; E241-K244 PolarHBondContact O-N 2.94Å; K244-F246 VanDerWaalsContact C-N 3.33Å; K244-F246 PolarHBondContact O-N 3.47Å; K244-V247 PolarHBondContact O-N 3.2Å; K244-Q248 VanDerWaalsContact O-CG 3.3Å; K244-Q248 WeakPolarHBondContact O-CG 3.41Å; K244-Q248 PolarHBondContact O-N 2.98Å
245	K	97.2	Very high	96.5	Very high	26 Å²	26	54.1 Å²	54.1	11%	0.113	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-43.1	175.6	-73.2	172.7	178.8	164.3	0	111.5	N31 Y57 L59 E241 V243 Q248 A249	N31-K245 PolarHBondContact OD1-NZ 3.04Å; Y57-K245 HydrophobicContact CD1-CG 4.32Å; Y57-K245 HydrophobicContact CG-CB 4.27Å; Y57-K245 HydrophobicContact CG-CG 4.35Å; L59-K245 HydrophobicContact CB-CB 4.4Å; L59-K245 HydrophobicContact CB-CD 4.44Å; L59-K245 HydrophobicContact CD2-CB 3.85Å; E241-K245 HydrophobicContact CG-CD 4.42Å; E241-K245 WeakPolarHBondContact O-CG 3.46Å; E241-K245 PolarHBondContact O-N 2.82Å; E241-K245 WeakPolarHBondContact OE1-CE 3.3Å; E241-K245 IonicContact OE1-NZ 3.67Å; E241-K245 PolarHBondContact OE1-NZ 3.26Å; V243-K245 PolarHBondContact O-N 2.78Å; K245-Q248 PolarHBondContact O-N 2.96Å; K245-A249 WeakPolarHBondContact O-CB 3.45Å; K245-A249 PolarHBondContact O-N 3.31Å
246	F	97.8	Very high	96.3	Very high	1 Å²	1	52.9 Å²	52.9	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-44.7	178	-177.3	-109.1	0	0	0	112.5	I33 V35 A49 L59 V61 I231 N242 V243 K244 Q248 A249 Y250	I33-F246 HydrophobicContact CD1-CB 4.11Å; I33-F246 HydrophobicContact CD1-CG 4.47Å; V35-F246 HydrophobicContact CB-CE1 4.42Å; V35-F246 HydrophobicContact CB-CZ 4.17Å; V35-F246 HydrophobicContact CG1-CE1 3.72Å; V35-F246 HydrophobicContact CG1-CZ 3.67Å; V35-F246 HydrophobicContact CG2-CD1 4.13Å; V35-F246 HydrophobicContact CG2-CD2 4.23Å; V35-F246 HydrophobicContact CG2-CE1 3.91Å; V35-F246 HydrophobicContact CG2-CE2 4.02Å; V35-F246 HydrophobicContact CG2-CG 4.28Å; V35-F246 HydrophobicContact CG2-CZ 3.85Å; A49-F246 HydrophobicContact CB-CE2 4.41Å; L59-F246 HydrophobicContact CD2-CB 3.82Å; V61-F246 HydrophobicContact CG1-CD2 4.15Å; V61-F246 HydrophobicContact CG1-CE2 3.88Å; V61-F246 HydrophobicContact CG2-CD2 3.8Å; V61-F246 HydrophobicContact CG2-CE2 4.23Å; I231-F246 HydrophobicContact CD1-CD1 4.36Å; I231-F246 HydrophobicContact CD1-CE1 4.23Å; I231-F246 HydrophobicContact CG2-CD1 4.19Å; I231-F246 HydrophobicContact CG2-CE1 4.21Å; N242-F246 WeakPolarHBondContact O-CB 3.38Å; N242-F246 PolarHBondContact O-N 3.08Å; V243-F246 PolarHBondContact O-N 3.3Å; K244-F246 VanDerWaalsContact C-N 3.33Å; K244-F246 PolarHBondContact O-N 3.47Å; F246-Q248 VanDerWaalsContact C-N 3.32Å; F246-Q248 PolarHBondContact O-N 2.75Å; F246-A249 PolarHBondContact O-N 2.95Å; F246-Y250 HydrophobicContact CE1-CD2 4.02Å; F246-Y250 HydrophobicContact CE2-CD2 4.14Å; F246-Y250 AromaticContact CZ-CD2 3.52Å; F246-Y250 HydrophobicContact CZ-CD2 3.52Å; F246-Y250 HydrophobicContact CZ-CE2 4.11Å; F246-Y250 WeakPolarHBondContact O-CB 3.18Å; F246-Y250 PolarHBondContact O-N 3.46Å
247	V	97.6	Very high	96.2	Very high	16 Å²	16	53 Å²	53	10%	0.097	26%	0.256	C	S	.	.	H	α-helix	trans	-58.5	-45.9	175.6	173.2	0	0	0	0	110.5	V106 I231 V243 K244 A249 Y250 Q251	V106-V247 HydrophobicContact CB-CG2 4.42Å; V106-V247 HydrophobicContact CG2-CG2 3.89Å; I231-V247 HydrophobicContact CB-CG2 4.44Å; I231-V247 HydrophobicContact CD1-CB 4.31Å; I231-V247 HydrophobicContact CD1-CG1 4.48Å; I231-V247 HydrophobicContact CD1-CG2 3.94Å; I231-V247 HydrophobicContact CG2-CG2 4.19Å; V243-V247 HydrophobicContact CG1-CG2 4.44Å; V243-V247 WeakPolarHBondContact O-CG2 3.1Å; V243-V247 PolarHBondContact O-N 2.97Å; K244-V247 PolarHBondContact O-N 3.2Å; V247-A249 PolarHBondContact O-N 2.85Å; V247-Y250 PolarHBondContact O-N 3.45Å; V247-Q251 HydrophobicContact CG1-CG 4.47Å; V247-Q251 WeakPolarHBondContact O-CB 3.47Å; V247-Q251 WeakPolarHBondContact O-CG 3.43Å; V247-Q251 PolarHBondContact O-N 3.42Å
248	Q	96.6	Very high	96	Very high	102 Å²	102	53 Å²	53	48%	0.477	26%	0.259	S	S	.	.	H	α-helix	trans	-62.9	-40.3	177.1	-70.3	173.7	-31.2	0	0	112.7	Y57 K244 K245 F246 S252	Y57-Q248 HydrophobicContact CE1-CB 4.08Å; Y57-Q248 HydrophobicContact CE2-CB 4.28Å; Y57-Q248 WeakPolarHBondContact OH-CB 3.37Å; K244-Q248 VanDerWaalsContact O-CG 3.3Å; K244-Q248 WeakPolarHBondContact O-CG 3.41Å; K244-Q248 PolarHBondContact O-N 2.98Å; K245-Q248 PolarHBondContact O-N 2.96Å; F246-Q248 VanDerWaalsContact C-N 3.32Å; F246-Q248 PolarHBondContact O-N 2.75Å; Q248-S252 PolarHBondContact O-N 2.96Å
249	A	97.7	Very high	95.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-45.6	175.8	0	0	0	0	0	111.9	V52 A53 Y57 K245 F246 V247 Q251 S252 V255	V52-A249 HydrophobicContact CB-CB 4.32Å; V52-A249 HydrophobicContact CG1-CB 3.99Å; A53-A249 HydrophobicContact CB-CB 3.73Å; Y57-A249 HydrophobicContact CD2-CB 4Å; Y57-A249 HydrophobicContact CE2-CB 3.85Å; K245-A249 WeakPolarHBondContact O-CB 3.45Å; K245-A249 PolarHBondContact O-N 3.31Å; F246-A249 PolarHBondContact O-N 2.95Å; V247-A249 PolarHBondContact O-N 2.85Å; A249-Q251 VanDerWaalsContact C-N 3.32Å; A249-Q251 PolarHBondContact O-N 3.49Å; A249-S252 VanDerWaalsContact O-CB 3.24Å; A249-S252 WeakPolarHBondContact O-CB 3.49Å; A249-S252 PolarHBondContact O-N 2.97Å; A249-S252 PolarHBondContact O-OG 2.89Å; A249-V255 WeakPolarHBondContact O-CG2 3.4Å
250	Y	96.7	Very high	95.5	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-68	-31.2	-178.7	-151.5	-73.1	0	0	0	112.7	V45 A46 A49 A85 T109 F110 I231 F246 V247 S252 V255	V45-Y250 HydrophobicContact CG1-CE1 4.31Å; A46-Y250 HydrophobicContact CB-CE2 4.17Å; A49-Y250 HydrophobicContact CB-CD2 3.39Å; A49-Y250 HydrophobicContact CB-CE2 3.95Å; A49-Y250 HydrophobicContact CB-CG 3.97Å; A85-Y250 HydrophobicContact CB-CE2 4.3Å; T109-Y250 HydrophobicContact CG2-CD1 3.53Å; T109-Y250 HydrophobicContact CG2-CE1 3.32Å; T109-Y250 HydrophobicContact CG2-CG 4.37Å; F110-Y250 HydrophobicContact CD2-CE1 4.31Å; F110-Y250 HydrophobicContact CE2-CD1 4.38Å; F110-Y250 AromaticContact CE2-CE1 3.75Å; F110-Y250 HydrophobicContact CE2-CE1 3.75Å; I231-Y250 HydrophobicContact CD1-CD1 4.49Å; I231-Y250 HydrophobicContact CD1-CG 4.07Å; F246-Y250 HydrophobicContact CE1-CD2 4.02Å; F246-Y250 HydrophobicContact CE2-CD2 4.14Å; F246-Y250 AromaticContact CZ-CD2 3.52Å; F246-Y250 HydrophobicContact CZ-CD2 3.52Å; F246-Y250 HydrophobicContact CZ-CE2 4.11Å; F246-Y250 WeakPolarHBondContact O-CB 3.18Å; F246-Y250 PolarHBondContact O-N 3.46Å; V247-Y250 PolarHBondContact O-N 3.45Å; Y250-S252 VanDerWaalsContact C-N 3.28Å; Y250-S252 PolarHBondContact O-N 3.33Å; Y250-V255 HydrophobicContact CD1-CG1 4.11Å; Y250-V255 HydrophobicContact CE1-CG1 4.23Å; Y250-V255 HydrophobicContact CG-CG1 4.49Å; Y250-V255 WeakPolarHBondContact O-CB 3.41Å; Y250-V255 VanDerWaalsContact O-CG1 3.24Å; Y250-V255 WeakPolarHBondContact O-CG1 3.46Å
251	Q	95.3	Very high	95.2	Very high	92 Å²	92	53.2 Å²	53.2	43%	0.43	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	4.7	178.4	-68.9	-177.6	-19.8	0	0	114.1	N108 V247 A249	N108-Q251 PolarHBondContact O-NE2 3.32Å; V247-Q251 HydrophobicContact CG1-CG 4.47Å; V247-Q251 WeakPolarHBondContact O-CB 3.47Å; V247-Q251 WeakPolarHBondContact O-CG 3.43Å; V247-Q251 PolarHBondContact O-N 3.42Å; A249-Q251 VanDerWaalsContact C-N 3.32Å; A249-Q251 PolarHBondContact O-N 3.49Å
252	S	96.1	Very high	94.9	Very high	14 Å²	14	49.9 Å²	49.9	10%	0.098	24%	0.239	C	C	.	.	S	Bend	trans	-66.7	156.1	177.4	67.7	0	0	0	0	112.7	Q248 A249 Y250 E254 V255 Y256	Q248-S252 PolarHBondContact O-N 2.96Å; A249-S252 VanDerWaalsContact O-CB 3.24Å; A249-S252 WeakPolarHBondContact O-CB 3.49Å; A249-S252 PolarHBondContact O-N 2.97Å; A249-S252 PolarHBondContact O-OG 2.89Å; Y250-S252 VanDerWaalsContact C-N 3.28Å; Y250-S252 PolarHBondContact O-N 3.33Å; S252-E254 WeakPolarHBondContact CB-OE2 3.43Å; S252-E254 PolarHBondContact O-N 3.5Å; S252-V255 PolarHBondContact O-N 2.88Å; S252-V255 WeakPolarHBondContact OG-CG2 3.38Å; S252-V255 PolarHBondContact OG-N 3.32Å; S252-Y256 PolarHBondContact O-N 3.34Å; S252-Y256 VanDerWaalsContact O-N 3.09Å
253	D	94.4	Very high	94.3	Very high	96 Å²	96	49.9 Å²	49.9	51%	0.513	24%	0.239	S	C	.	.	H	α-helix	trans	-65.7	-30.7	177.3	-68.2	-31.3	0	0	0	111.5	V255 Y256 E257 K269	D253-V255 VanDerWaalsContact C-N 3.35Å; D253-V255 PolarHBondContact O-N 3.49Å; D253-Y256 WeakPolarHBondContact O-CB 3.03Å; D253-Y256 PolarHBondContact O-N 2.74Å; D253-E257 WeakPolarHBondContact O-CG 3.38Å; D253-E257 PolarHBondContact O-N 3.39Å; D253-K269 IonicContact OD1-NZ 3.97Å; D253-K269 PolarHBondContact OD1-NZ 3.38Å; D253-K269 VanDerWaalsContact OD1-NZ 3.1Å
254	E	95.8	Very high	93.6	Very high	82 Å²	82	55.3 Å²	55.3	38%	0.383	27%	0.268	S	S	.	.	H	α-helix	trans	-61	-41	174	-64.6	93.6	156.6	0	0	112.8	V52 K56 S252 A258	V52-E254 HydrophobicContact CG2-CB 3.97Å; K56-E254 VanDerWaalsContact CE-OE1 3.28Å; K56-E254 WeakPolarHBondContact CE-OE1 3.46Å; K56-E254 IonicContact NZ-OE1 3.59Å; K56-E254 PolarHBondContact NZ-OE1 2.81Å; K56-E254 IonicContact NZ-OE2 2.73Å; K56-E254 PolarHBondContact NZ-OE2 3.41Å; S252-E254 WeakPolarHBondContact CB-OE2 3.43Å; S252-E254 PolarHBondContact O-N 3.5Å; E254-A258 WeakPolarHBondContact O-CB 3.37Å; E254-A258 PolarHBondContact O-N 3.46Å
255	V	96	Very high	92.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-72.6	-35.1	176.9	178.3	0	0	0	0	110.8	V45 V48 A49 V52 F110 A249 Y250 S252 D253 A258 A259	V45-V255 HydrophobicContact CG1-CG1 3.63Å; V48-V255 HydrophobicContact CG1-CG2 4.05Å; A49-V255 HydrophobicContact CB-CG1 4.35Å; A49-V255 HydrophobicContact CB-CG2 3.8Å; V52-V255 HydrophobicContact CG2-CG2 4.23Å; F110-V255 HydrophobicContact CE2-CG1 4.19Å; F110-V255 HydrophobicContact CZ-CG1 4.12Å; A249-V255 WeakPolarHBondContact O-CG2 3.4Å; Y250-V255 HydrophobicContact CD1-CG1 4.11Å; Y250-V255 HydrophobicContact CE1-CG1 4.23Å; Y250-V255 HydrophobicContact CG-CG1 4.49Å; Y250-V255 WeakPolarHBondContact O-CB 3.41Å; Y250-V255 VanDerWaalsContact O-CG1 3.24Å; Y250-V255 WeakPolarHBondContact O-CG1 3.46Å; S252-V255 PolarHBondContact O-N 2.88Å; S252-V255 WeakPolarHBondContact OG-CG2 3.38Å; S252-V255 PolarHBondContact OG-N 3.32Å; D253-V255 VanDerWaalsContact C-N 3.35Å; D253-V255 PolarHBondContact O-N 3.49Å; V255-A258 PolarHBondContact O-N 3.04Å; V255-A259 WeakPolarHBondContact O-CB 3.48Å; V255-A259 PolarHBondContact O-N 3.37Å
256	Y	92.7	Very high	91.7	Very high	77 Å²	77	51.5 Å²	51.5	30%	0.302	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-45.5	173	174.8	-115.1	0	0	0	112.3	F110 S252 D253 A258 A259 N260 K269	F110-Y256 HydrophobicContact CD1-CD2 4.25Å; F110-Y256 AromaticContact CE1-CD2 3.69Å; F110-Y256 HydrophobicContact CE1-CD2 3.69Å; F110-Y256 HydrophobicContact CE1-CG 4.46Å; S252-Y256 PolarHBondContact O-N 3.34Å; S252-Y256 VanDerWaalsContact O-N 3.09Å; D253-Y256 WeakPolarHBondContact O-CB 3.03Å; D253-Y256 PolarHBondContact O-N 2.74Å; Y256-A258 VanDerWaalsContact C-N 3.32Å; Y256-A258 PolarHBondContact O-N 3.03Å; Y256-A259 PolarHBondContact O-N 2.94Å; Y256-N260 WeakPolarHBondContact O-CB 3.41Å; Y256-N260 PolarHBondContact O-N 2.89Å; Y256-K269 HydrophobicContact CD2-CB 4.12Å; Y256-K269 HydrophobicContact CD2-CD 4.25Å; Y256-K269 HydrophobicContact CD2-CG 4.29Å; Y256-K269 HydrophobicContact CE2-CB 3.8Å; Y256-K269 HydrophobicContact CE2-CD 4.46Å; Y256-K269 HydrophobicContact CE2-CG 4.44Å; Y256-K269 HydrophobicContact CG-CD 4.38Å
257	E	93.3	Very high	90.9	Very high	132 Å²	132	51.6 Å²	51.6	62%	0.617	27%	0.267	S	S	*	.	H	α-helix	trans	-61.8	-41.5	175.7	-73.1	179.8	176.3	0	0	111.6	D253 N260 K261	D253-E257 WeakPolarHBondContact O-CG 3.38Å; D253-E257 PolarHBondContact O-N 3.39Å; E257-N260 PolarHBondContact O-N 3.19Å; E257-K261 WeakPolarHBondContact O-CB 3.3Å; E257-K261 PolarHBondContact O-N 3.37Å
258	A	93.4	Very high	90.2	Very high	16 Å²	16	52.4 Å²	52.4	13%	0.132	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-47.1	173.9	0	0	0	0	0	111.8	V48 E254 V255 Y256 N260 K261 V262	V48-A258 HydrophobicContact CB-CB 3.99Å; V48-A258 HydrophobicContact CG1-CB 3.93Å; V48-A258 HydrophobicContact CG2-CB 3.71Å; E254-A258 WeakPolarHBondContact O-CB 3.37Å; E254-A258 PolarHBondContact O-N 3.46Å; V255-A258 PolarHBondContact O-N 3.04Å; Y256-A258 VanDerWaalsContact C-N 3.32Å; Y256-A258 PolarHBondContact O-N 3.03Å; A258-N260 VanDerWaalsContact C-N 3.35Å; A258-N260 PolarHBondContact O-N 3.21Å; A258-K261 PolarHBondContact O-N 3.44Å; A258-V262 WeakPolarHBondContact O-CB 3.42Å; A258-V262 VanDerWaalsContact O-CG2 3.22Å; A258-V262 WeakPolarHBondContact O-CG2 3.49Å; A258-V262 PolarHBondContact O-N 3.22Å
259	A	92.4	Very high	89.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-44	176.6	0	0	0	0	0	111.7	V45 F110 V255 Y256 K261 V262 F263 A267	V45-A259 HydrophobicContact CG1-CB 4.06Å; V45-A259 HydrophobicContact CG2-CB 3.94Å; F110-A259 HydrophobicContact CD1-CB 4.38Å; F110-A259 HydrophobicContact CD2-CB 3.95Å; F110-A259 HydrophobicContact CE1-CB 4.14Å; F110-A259 HydrophobicContact CE2-CB 3.62Å; F110-A259 HydrophobicContact CG-CB 4.31Å; F110-A259 HydrophobicContact CZ-CB 3.73Å; V255-A259 WeakPolarHBondContact O-CB 3.48Å; V255-A259 PolarHBondContact O-N 3.37Å; Y256-A259 PolarHBondContact O-N 2.94Å; A259-K261 VanDerWaalsContact C-N 3.29Å; A259-K261 PolarHBondContact O-N 2.77Å; A259-V262 PolarHBondContact O-N 3.11Å; A259-F263 WeakPolarHBondContact O-CB 3.36Å; A259-F263 WeakPolarHBondContact O-CD2 3.15Å; A259-F263 PolarHBondContact O-N 3.03Å; A259-A267 HydrophobicContact CB-CB 3.81Å
260	N	88.7	Confident	87.7	Confident	67 Å²	67	52.3 Å²	52.3	36%	0.358	27%	0.274	S	S	.	.	H	α-helix	trans	-60.4	-39.3	176.8	-168.2	45.8	0	0	0	111.9	Y256 E257 A258 N264 G265	Y256-N260 WeakPolarHBondContact O-CB 3.41Å; Y256-N260 PolarHBondContact O-N 2.89Å; E257-N260 PolarHBondContact O-N 3.19Å; A258-N260 VanDerWaalsContact C-N 3.35Å; A258-N260 PolarHBondContact O-N 3.21Å; N260-N264 CarbonylContact O-C 3.55Å; N260-N264 PolarHBondContact O-N 2.81Å; N260-G265 PolarHBondContact O-N 3.49Å; N260-G265 VanDerWaalsContact OD1-CA 3.3Å; N260-G265 WeakPolarHBondContact OD1-CA 3.22Å
261	K	90.8	Very high	85.5	Confident	169 Å²	169	57.2 Å²	57.2	74%	0.735	31%	0.308	S	S	*	.	H	α-helix	trans	-72	-51	176.9	-175.5	178.4	178.7	-179.4	0	112.5	E257 A258 A259 F263 N264	E257-K261 WeakPolarHBondContact O-CB 3.3Å; E257-K261 PolarHBondContact O-N 3.37Å; A258-K261 PolarHBondContact O-N 3.44Å; A259-K261 VanDerWaalsContact C-N 3.29Å; A259-K261 PolarHBondContact O-N 2.77Å; K261-F263 VanDerWaalsContact C-N 3.29Å; K261-F263 PolarHBondContact O-N 3.19Å; K261-N264 PolarHBondContact O-N 3.07Å; K261-N264 VanDerWaalsContact O-N 3.15Å; K261-N264 PolarHBondContact O-OD1 3.36Å
262	V	87.9	Confident	82.7	Confident	41 Å²	41	63 Å²	63	25%	0.248	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-38.4	-176.8	171.1	0	0	0	0	111.1	A41 Q44 V45 A258 A259	A41-V262 HydrophobicContact CB-CG1 3.6Å; Q44-V262 HydrophobicContact CB-CG1 4.33Å; Q44-V262 HydrophobicContact CB-CG2 4.2Å; V45-V262 HydrophobicContact CG2-CB 4.23Å; V45-V262 HydrophobicContact CG2-CG1 4.38Å; V45-V262 HydrophobicContact CG2-CG2 4.39Å; A258-V262 WeakPolarHBondContact O-CB 3.42Å; A258-V262 VanDerWaalsContact O-CG2 3.22Å; A258-V262 WeakPolarHBondContact O-CG2 3.49Å; A258-V262 PolarHBondContact O-N 3.22Å; A259-V262 PolarHBondContact O-N 3.11Å
263	F	85.1	Confident	79.5	Confident	7 Å²	7	66.9 Å²	66.9	3%	0.031	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	10.8	178.3	-68.7	-82.4	0	0	0	113.9	A41 E42 V45 Y112 T203 A259 K261 G265 G266 A267	A41-F263 HydrophobicContact CB-CD1 4.16Å; A41-F263 HydrophobicContact CB-CE1 3.47Å; A41-F263 VanDerWaalsContact CB-CE1 3.47Å; A41-F263 HydrophobicContact CB-CE2 3.99Å; A41-F263 HydrophobicContact CB-CZ 3.38Å; E42-F263 HydrophobicContact CG-CZ 3.88Å; V45-F263 HydrophobicContact CG2-CD2 4.35Å; V45-F263 HydrophobicContact CG2-CE2 3.9Å; Y112-F263 HydrophobicContact CD1-CD1 4.31Å; Y112-F263 HydrophobicContact CD1-CD2 4.25Å; Y112-F263 HydrophobicContact CD1-CE1 4.17Å; Y112-F263 HydrophobicContact CD1-CE2 4.11Å; Y112-F263 HydrophobicContact CD1-CG 4.34Å; Y112-F263 HydrophobicContact CD1-CZ 4.05Å; Y112-F263 HydrophobicContact CE1-CD1 4.43Å; Y112-F263 AromaticContact CE1-CD2 3.64Å; Y112-F263 HydrophobicContact CE1-CD2 3.64Å; Y112-F263 HydrophobicContact CE1-CE1 4.18Å; Y112-F263 AromaticContact CE1-CE2 3.33Å; Y112-F263 HydrophobicContact CE1-CE2 3.33Å; Y112-F263 HydrophobicContact CE1-CG 4.18Å; Y112-F263 AromaticContact CE1-CZ 3.61Å; Y112-F263 HydrophobicContact CE1-CZ 3.61Å; Y112-F263 HydrophobicContact CE2-CZ 4.3Å; Y112-F263 AromaticContact CZ-CE2 3.6Å; Y112-F263 AromaticContact CZ-CZ 3.74Å; T203-F263 HydrophobicContact CG2-CD1 3.76Å; T203-F263 HydrophobicContact CG2-CE1 3.99Å; A259-F263 WeakPolarHBondContact O-CB 3.36Å; A259-F263 WeakPolarHBondContact O-CD2 3.15Å; A259-F263 PolarHBondContact O-N 3.03Å; K261-F263 VanDerWaalsContact C-N 3.29Å; K261-F263 PolarHBondContact O-N 3.19Å; F263-G265 PolarHBondContact O-N 3.47Å; F263-G266 WeakPolarHBondContact O-CA 3.38Å; F263-G266 PolarHBondContact O-N 2.83Å; F263-A267 HydrophobicContact CB-CB 4.14Å; F263-A267 HydrophobicContact CD2-CB 4.09Å; F263-A267 HydrophobicContact CG-CB 4.38Å
264	N	82.5	Confident	76.5	Confident	117 Å²	117	66.5 Å²	66.5	63%	0.626	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	49.2	179.4	-66.9	-37.8	0	0	0	113.9	T212 N260 K261 G266	T212-N264 HydrophobicContact CG2-CB 4.42Å; N260-N264 CarbonylContact O-C 3.55Å; N260-N264 PolarHBondContact O-N 2.81Å; K261-N264 PolarHBondContact O-N 3.07Å; K261-N264 VanDerWaalsContact O-N 3.15Å; K261-N264 PolarHBondContact O-OD1 3.36Å; N264-G266 VanDerWaalsContact C-N 3.31Å; N264-G266 PolarHBondContact O-N 3.25Å
265	G	75.8	Confident	73.5	Confident	38 Å²	38	68.1 Å²	68.1	39%	0.392	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	-4.2	-176.7	0	0	0	0	0	115.2	N260 F263	N260-G265 PolarHBondContact O-N 3.49Å; N260-G265 VanDerWaalsContact OD1-CA 3.3Å; N260-G265 WeakPolarHBondContact OD1-CA 3.22Å; F263-G265 PolarHBondContact O-N 3.47Å
266	G	78.2	Confident	70.1	Confident	13 Å²	13	76 Å²	76	13%	0.134	41%	0.408	C	S	.	.			trans	-80.7	-11.3	-176.4	0	0	0	0	0	115.4	P113 F263 N264	P113-G266 WeakPolarHBondContact CD-O 3.32Å; F263-G266 WeakPolarHBondContact O-CA 3.38Å; F263-G266 PolarHBondContact O-N 2.83Å; N264-G266 VanDerWaalsContact C-N 3.31Å; N264-G266 PolarHBondContact O-N 3.25Å
267	A	82.2	Confident	67	Low	3 Å²	3	78.4 Å²	78.4	3%	0.025	43%	0.432	C	S	.	.			trans	-90.4	122.7	176.5	0	0	0	0	0	110.8	F110 Y112 A259 F263	F110-A267 HydrophobicContact CB-CB 4.42Å; F110-A267 HydrophobicContact CG-CB 4.46Å; Y112-A267 HydrophobicContact CD1-CB 4.16Å; Y112-A267 HydrophobicContact CE1-CB 3.81Å; A259-A267 HydrophobicContact CB-CB 3.81Å; F263-A267 HydrophobicContact CB-CB 4.14Å; F263-A267 HydrophobicContact CD2-CB 4.09Å; F263-A267 HydrophobicContact CG-CB 4.38Å
268	V	83.2	Confident	63.9	Low	33 Å²	33	77.9 Å²	77.9	20%	0.2	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.9	178.7	-177.4	0	0	0	0	109.6	F110 V111 K223 G270	F110-V268 CarbonylContact C-O 3.48Å; F110-V268 VanDerWaalsContact CA-O 3.31Å; F110-V268 WeakPolarHBondContact CA-O 3.4Å; V111-V268 HydrophobicContact CB-CB 4.19Å; V111-V268 PolarHBondContact N-O 2.92Å; V111-V268 PolarHBondContact O-N 3.08Å; K223-V268 HydrophobicContact CB-CG1 4.35Å; K223-V268 HydrophobicContact CB-CG2 3.98Å; K223-V268 HydrophobicContact CD-CG2 4.1Å; K223-V268 HydrophobicContact CG-CG2 3.87Å; V268-G270 PolarHBondContact O-N 3.14Å
269	K	78.6	Confident	60.6	Low	84 Å²	84	86.2 Å²	86.2	37%	0.365	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	125.3	-178.7	-159.5	167.9	-174	168	0	110	D253 Y256 C271	D253-K269 IonicContact OD1-NZ 3.97Å; D253-K269 PolarHBondContact OD1-NZ 3.38Å; D253-K269 VanDerWaalsContact OD1-NZ 3.1Å; Y256-K269 HydrophobicContact CD2-CB 4.12Å; Y256-K269 HydrophobicContact CD2-CD 4.25Å; Y256-K269 HydrophobicContact CD2-CG 4.29Å; Y256-K269 HydrophobicContact CE2-CB 3.8Å; Y256-K269 HydrophobicContact CE2-CD 4.46Å; Y256-K269 HydrophobicContact CE2-CG 4.44Å; Y256-K269 HydrophobicContact CG-CD 4.38Å; K269-C271 VanDerWaalsContact C-N 3.29Å; K269-C271 PolarHBondContact O-N 3.2Å
270	G	63.4	Low	57.8	Low	16 Å²	16	91 Å²	91	17%	0.165	51%	0.508	C	S	.	.			trans	-75.4	71.7	-179.9	0	0	0	0	0	112.8	N108 T109 V268 R272	N108-G270 PolarHBondContact ND2-O 3.23Å; N108-G270 VanDerWaalsContact ND2-O 3.15Å; T109-G270 PolarHBondContact O-N 3.32Å; V268-G270 PolarHBondContact O-N 3.14Å; G270-R272 VanDerWaalsContact C-N 3.31Å; G270-R272 PolarHBondContact O-N 3.35Å
271	C	48.8	Very low	54.9	Low	105 Å²	105	94.7 Å²	94.7	71%	0.709	53%	0.533	S	S	*	.			trans	-79	68.4	-176.4	-64.8	0	0	0	0	113.1	K269	K269-C271 VanDerWaalsContact C-N 3.29Å; K269-C271 PolarHBondContact O-N 3.2Å
272	R	36.7	Very low	52.2	Low	213 Å²	213	90.6 Å²	90.6	80%	0.804	53%	0.531	S	S	*	.			trans	-149.5	113.5	157.6	-73.5	-168.3	179.9	163	1.9	108.9	N108 G270	N108-R272 PolarHBondContact ND2-O 3.49Å; G270-R272 VanDerWaalsContact C-N 3.31Å; G270-R272 PolarHBondContact O-N 3.35Å
273	S	29.5	Very low	49.5	Very low	96 Å²	96	94.6 Å²	94.6	67%	0.671	56%	0.558	S	S	*	*			trans	-46.6	152.3	167.9	-74.8	0	0	0	0	110.6	V275	S273-V275 WeakPolarHBondContact O-CG2 3.28Å; S273-V275 PolarHBondContact O-N 3.19Å
274	P	31.8	Very low	46.7	Very low	88 Å²	88	103.5 Å²	103.5	57%	0.571	60%	0.599	S	S	*	*			trans	-62.5	93.2	163.5	-0.6	14.1	0	0	0	106.8
275	V	31.4	Very low	44.7	Very low	116 Å²	116	103.9 Å²	103.9	70%	0.703	61%	0.608	S	S	*	*			trans	-80	131.7	176.9	-179.3	0	0	0	0	107.1	S273	S273-V275 WeakPolarHBondContact O-CG2 3.28Å; S273-V275 PolarHBondContact O-N 3.19Å
276	E	25.8	Very low	42.8	Very low	166 Å²	166	112.2 Å²	112.2	78%	0.776	63%	0.634	S	S	*	*			trans	-36.7	151.3	169.5	-71.2	-179	146.9	0	0	113.5	V278	E276-V278 PolarHBondContact O-N 3.29Å
277	P	27.6	Very low	40.5	Very low	126 Å²	126	116.3 Å²	116.3	82%	0.818	67%	0.666	S	S	*	*			trans	-61.7	109.6	-174.7	25.2	-32.6	0	0	0	110.8	Q279	P277-Q279 PolarHBondContact O-N 3.27Å; P277-Q279 VanDerWaalsContact O-N 3.09Å
278	V	28.9	Very low	38.2	Very low	122 Å²	122	125 Å²	125	74%	0.739	71%	0.707	S	S	*	*			trans	-68.4	106	166.4	179.1	0	0	0	0	107.8	E276 S280	E276-V278 PolarHBondContact O-N 3.29Å; V278-S280 PolarHBondContact O-N 2.61Å
279	Q	24.2	Very low	35.9	Very low	190 Å²	190	129.1 Å²	129.1	89%	0.888	73%	0.733	S	S	*	*			trans	-64.2	108.6	160.8	-73.6	179.6	-14.6	0	0	108.1	P277	P277-Q279 PolarHBondContact O-N 3.27Å; P277-Q279 VanDerWaalsContact O-N 3.09Å
280	S	32.7	Very low	33.8	Very low	102 Å²	102	130 Å²	130	71%	0.713	76%	0.756	S	S	*	*			trans	-114.5	103.7	169	176.9	0	0	0	0	109.5	V278 A282	V278-S280 PolarHBondContact O-N 2.61Å; S280-A282 PolarHBondContact O-N 2.75Å
281	T	27.7	Very low	32.6	Very low	143 Å²	143	138.8 Å²	138.8	88%	0.877	79%	0.79	S	S	*	*			trans	-65.8	109.8	165.3	47.1	0	0	0	0	110.1
282	A	33.8	Very low	32	Very low	83 Å²	83	137.5 Å²	137.5	69%	0.686	78%	0.781	S	S	*	*			trans	-131.3	141.3	161.8	0	0	0	0	0	109.8	S280	S280-A282 PolarHBondContact O-N 2.75Å
283	P	32.1	Very low	32.3	Very low	126 Å²	126	133.4 Å²	133.4	82%	0.818	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-79.1	145.5	-162.8	-5.4	24	0	0	0	112.4	P285	P283-P285 WeakPolarHBondContact O-CD 3.37Å
284	Q	26.4	Very low	32.7	Very low	194 Å²	194	133 Å²	133	91%	0.907	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-66.5	131.6	174.2	-71.7	-170.2	-24.6	0	0	112.5
285	P	39.4	Very low	33.1	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-87.5	138.6	157.7	-1.2	21	0	0	0	110.7	P283	P283-P285 WeakPolarHBondContact O-CD 3.37Å
286	K	35.8	Very low	33.7	Very low	212 Å²	212	131.4 Å²	131.4	92%	0.922	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-67.5	151.9	177.4	-71.7	176.3	175	177.8	0	112.4
287	A	31.4	Very low	34.3	Very low	99 Å²	99	127.2 Å²	127.2	82%	0.818	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-86.1	147.7	-174.5	0	0	0	0	0	115.1
288	E	33.3	Very low	35	Very low	187 Å²	187	124.4 Å²	124.4	87%	0.874	73%	0.725	S	S	*	*			trans	-166.3	162.4	144.8	-120.8	-169.3	147.9	0	0	111
289	P	34.6	Very low	35.6	Very low	118 Å²	118	123.8 Å²	123.8	77%	0.766	72%	0.724	S	S	*	*				-114.9	161.2	-107.3	32.8	-15.9	0	0	0	115.9
290	A	35.1	Very low	36.5	Very low	102 Å²	102	118.3 Å²	118.3	84%	0.843	70%	0.703	S	S	*	*			trans	-85.9	153.2	-175.2	0	0	0	0	0	115.3
291	K	38	Very low	37.2	Very low	202 Å²	202	119.9 Å²	119.9	88%	0.878	69%	0.694	S	S	*	*			trans	-124.3	150.4	163.6	-83.1	-173.4	177.7	-178.1	0	111
292	P	36.1	Very low	38.1	Very low	78 Å²	78	116 Å²	116	51%	0.506	67%	0.667	S	S	.	*			trans	-103.3	158.7	-144.1	2	20.8	0	0	0	116.1	D323	P292-D323 WeakPolarHBondContact CD-OD2 3.31Å; P292-D323 WeakPolarHBondContact CG-OD2 3.08Å
293	K	42.1	Very low	39	Very low	126 Å²	126	112.8 Å²	112.8	55%	0.548	64%	0.637	S	S	.	*			trans	-115.1	152.8	170.3	-80.7	-170.2	176.4	-161.5	0	110.9	V170 V171	V170-K293 PolarHBondContact O-NZ 3.39Å; V171-K293 VanDerWaalsContact CA-NZ 3.3Å; V171-K293 PolarHBondContact O-NZ 3.45Å
294	A	38.3	Very low	39.8	Very low	88 Å²	88	111.8 Å²	111.8	73%	0.727	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-72.2	152	-168.3	0	0	0	0	0	116.1
295	P	39.9	Very low	40.9	Very low	77 Å²	77	105.3 Å²	105.3	50%	0.5	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-91.6	145.9	-162.2	34.7	-33.5	0	0	0	115.6	E319	P295-E319 WeakPolarHBondContact CB-OE2 3.4Å
296	R	43.9	Very low	41.3	Very low	93 Å²	93	100.6 Å²	100.6	35%	0.351	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-85.9	153.1	163.5	-83.5	179.7	170.5	-143.6	-17.6	109.9	L168 I179 E181 T298	L168-R296 HydrophobicContact CD2-CB 4.5Å; I179-R296 PolarHBondContact O-NH1 2.89Å; I179-R296 PolarHBondContact O-NH2 2.83Å; E181-R296 IonicContact OE1-CZ 2.72Å; E181-R296 IonicContact OE1-NH1 2.92Å; E181-R296 PolarHBondContact OE1-NH1 2.95Å; R296-T298 PolarHBondContact O-N 3.02Å
297	A	39.6	Very low	42.4	Very low	79 Å²	79	97.3 Å²	97.3	65%	0.653	56%	0.56	S	S	*	*			trans	-61.4	108.8	177.8	0	0	0	0	0	111.9
298	T	41.7	Very low	43.5	Very low	66 Å²	66	96.6 Å²	96.6	41%	0.405	54%	0.54	S	S	.	.			trans	-68.4	137.7	-177.9	-39.7	0	0	0	0	111.7	R296 V300	R296-T298 PolarHBondContact O-N 3.02Å; T298-V300 PolarHBondContact O-N 3.22Å
299	P	42.3	Very low	44.5	Very low	109 Å²	109	90.3 Å²	90.3	71%	0.708	51%	0.512	S	S	*	.			trans	-56.8	137.8	170	21.6	-30.8	0	0	0	110.7	R301	P299-R301 PolarHBondContact O-N 3.27Å
300	V	42.4	Very low	45.1	Very low	76 Å²	76	89 Å²	89	46%	0.461	50%	0.502	S	S	.	.			trans	-58.8	113.3	178.5	178.1	0	0	0	0	109.3	T298 I302 V355	T298-V300 PolarHBondContact O-N 3.22Å; V300-I302 HydrophobicContact CG1-CG1 4.02Å; V300-V355 WeakPolarHBondContact CG1-O 3.3Å
301	R	46.9	Very low	45.8	Very low	134 Å²	134	87.3 Å²	87.3	51%	0.506	49%	0.494	S	S	.	.			trans	-91.9	109.5	177.2	-157.2	171.4	-172.9	-175.9	8.9	108.9	P299 Y303	P299-R301 PolarHBondContact O-N 3.27Å; R301-Y303 HydrophobicContact CB-CE2 4.32Å; R301-Y303 HydrophobicContact CG-CE2 4.32Å
302	I	47.7	Very low	46.4	Very low	62 Å²	62	81.8 Å²	81.8	32%	0.318	47%	0.47	S	S	.	.			trans	-93.7	120.6	178.4	-57.2	178.4	0	0	0	108.2	V300 T304 M435	V300-I302 HydrophobicContact CG1-CG1 4.02Å; I302-T304 HydrophobicContact CG2-CG2 4.33Å; I302-M435 HydrophobicContact CB-CE 4.34Å; I302-M435 HydrophobicContact CD1-CE 3.21Å; I302-M435 HydrophobicContact CG1-CE 4.32Å; I302-M435 HydrophobicContact CG2-CE 3.93Å
303	Y	52.6	Low	46.8	Very low	15 Å²	15	80.2 Å²	80.2	6%	0.059	46%	0.46	C	S	.	.			trans	-94.2	113.5	176.4	-63.1	-89.1	0	0	0	108.5	R301 E308 L309 L317	R301-Y303 HydrophobicContact CB-CE2 4.32Å; R301-Y303 HydrophobicContact CG-CE2 4.32Å; Y303-E308 HydrophobicContact CD1-CB 4.26Å; Y303-L309 HydrophobicContact CD1-CD2 3.51Å; Y303-L309 HydrophobicContact CD1-CG 4.19Å; Y303-L309 HydrophobicContact CD2-CD2 3.77Å; Y303-L309 HydrophobicContact CE1-CD2 3.81Å; Y303-L309 HydrophobicContact CE2-CD2 4.06Å; Y303-L309 HydrophobicContact CG-CD2 3.48Å; Y303-L309 VanDerWaalsContact CG-CD2 3.48Å; Y303-L309 HydrophobicContact CG-CG 4.14Å; Y303-L317 HydrophobicContact CE1-CD2 3.98Å; Y303-L317 VanDerWaalsContact OH-C 3.31Å; Y303-L317 VanDerWaalsContact OH-CA 3.23Å; Y303-L317 WeakPolarHBondContact OH-CA 3.3Å; Y303-L317 WeakPolarHBondContact OH-CD2 3.32Å; Y303-L317 PolarHBondContact OH-O 3.04Å
304	T	47.5	Very low	46.8	Very low	105 Å²	105	80 Å²	80	64%	0.644	46%	0.459	S	S	*	.			trans	-95.4	-12.5	179.1	51.7	0	0	0	0	112.8	I302	I302-T304 HydrophobicContact CG2-CG2 4.33Å
305	N	50.1	Low	47.1	Very low	58 Å²	58	84.7 Å²	84.7	31%	0.31	46%	0.458	S	S	.	.			trans	-119.3	125	174.7	-175.8	-3.9	0	0	0	111	E307 E308	N305-E307 PolarHBondContact ND2-OE2 2.93Å; N305-E307 PolarHBondContact O-N 2.77Å; N305-E307 WeakPolarHBondContact OD1-CB 3.47Å; N305-E307 WeakPolarHBondContact OD1-CG 3.3Å; N305-E307 PolarHBondContact OD1-N 3.13Å; N305-E307 PolarHBondContact OD1-OE2 3.45Å; N305-E308 HydrophobicContact CB-CG 4.02Å; N305-E308 WeakPolarHBondContact O-CB 3.5Å; N305-E308 PolarHBondContact O-N 2.82Å
306	A	49.2	Very low	47.5	Very low	27 Å²	27	84.7 Å²	84.7	22%	0.223	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-61.2	-30.6	176.5	0	0	0	0	0	112.8	E308 L309 V310	A306-E308 PolarHBondContact O-N 2.86Å; A306-L309 WeakPolarHBondContact O-CB 3.38Å; A306-L309 PolarHBondContact O-N 2.85Å; A306-V310 PolarHBondContact O-N 2.96Å
307	E	57.2	Low	47.8	Very low	143 Å²	143	80.9 Å²	80.9	67%	0.668	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-64.7	-29.2	178.7	-63	161.6	168	0	0	112.1	N305 L309 V310	N305-E307 PolarHBondContact ND2-OE2 2.93Å; N305-E307 PolarHBondContact O-N 2.77Å; N305-E307 WeakPolarHBondContact OD1-CB 3.47Å; N305-E307 WeakPolarHBondContact OD1-CG 3.3Å; N305-E307 PolarHBondContact OD1-N 3.13Å; N305-E307 PolarHBondContact OD1-OE2 3.45Å; E307-L309 PolarHBondContact O-N 2.82Å; E307-V310 PolarHBondContact O-N 2.8Å; E307-V310 VanDerWaalsContact O-N 3.16Å
308	E	55.9	Low	48	Very low	84 Å²	84	78.2 Å²	78.2	39%	0.393	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-68	-14.3	175.8	-67.2	178.3	-160.9	0	0	113.2	Y303 N305 A306 K312	Y303-E308 HydrophobicContact CD1-CB 4.26Å; N305-E308 HydrophobicContact CB-CG 4.02Å; N305-E308 WeakPolarHBondContact O-CB 3.5Å; N305-E308 PolarHBondContact O-N 2.82Å; A306-E308 PolarHBondContact O-N 2.86Å; E308-K312 WeakPolarHBondContact O-CD 3.5Å; E308-K312 WeakPolarHBondContact O-CE 3.46Å; E308-K312 PolarHBondContact O-NZ 3.35Å; E308-K312 VanDerWaalsContact O-NZ 3.13Å
309	L	53.2	Low	47.9	Very low	54 Å²	54	79.4 Å²	79.4	28%	0.283	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-98.9	-18.7	177.2	-58.9	172.2	0	0	0	112.3	Y303 A306 E307 G311 L317	Y303-L309 HydrophobicContact CD1-CD2 3.51Å; Y303-L309 HydrophobicContact CD1-CG 4.19Å; Y303-L309 HydrophobicContact CD2-CD2 3.77Å; Y303-L309 HydrophobicContact CE1-CD2 3.81Å; Y303-L309 HydrophobicContact CE2-CD2 4.06Å; Y303-L309 HydrophobicContact CG-CD2 3.48Å; Y303-L309 VanDerWaalsContact CG-CD2 3.48Å; Y303-L309 HydrophobicContact CG-CG 4.14Å; A306-L309 WeakPolarHBondContact O-CB 3.38Å; A306-L309 PolarHBondContact O-N 2.85Å; E307-L309 PolarHBondContact O-N 2.82Å; L309-G311 PolarHBondContact O-N 2.76Å; L309-L317 HydrophobicContact CD2-CD1 4.33Å; L309-L317 HydrophobicContact CD2-CD2 3.67Å
310	V	47.8	Very low	47.5	Very low	92 Å²	92	77.8 Å²	77.8	56%	0.558	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	127.2	-178.4	178.3	0	0	0	0	110	A306 E307 K312	A306-V310 PolarHBondContact O-N 2.96Å; E307-V310 PolarHBondContact O-N 2.8Å; E307-V310 VanDerWaalsContact O-N 3.16Å; V310-K312 PolarHBondContact O-N 3.33Å
311	G	49.7	Very low	47.1	Very low	66 Å²	66	77 Å²	77	68%	0.68	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	-7	175	0	0	0	0	0	115.6	L309 P313	L309-G311 PolarHBondContact O-N 2.76Å; G311-P313 WeakPolarHBondContact O-CD 3.28Å
312	K	49.7	Very low	46.5	Very low	85 Å²	85	73.2 Å²	73.2	37%	0.37	41%	0.41	S	S	.	.			trans	-79.6	121	173.5	-66.8	-167.4	-172.9	164.7	0	110.9	E308 V310 L317	E308-K312 WeakPolarHBondContact O-CD 3.5Å; E308-K312 WeakPolarHBondContact O-CE 3.46Å; E308-K312 PolarHBondContact O-NZ 3.35Å; E308-K312 VanDerWaalsContact O-NZ 3.13Å; V310-K312 PolarHBondContact O-N 3.33Å; K312-L317 HydrophobicContact CB-CD2 4.05Å; K312-L317 HydrophobicContact CD-CD2 4.17Å
313	P	46.2	Very low	45.7	Very low	45 Å²	45	76.5 Å²	76.5	29%	0.292	43%	0.428	S	S	.	.			trans	-49.6	142.7	165.8	-25	32	0	0	0	110.9	G311 R315 D316	G311-P313 WeakPolarHBondContact O-CD 3.28Å; P313-R315 HydrophobicContact CB-CG 3.68Å; P313-R315 PolarHBondContact O-N 3.45Å; P313-D316 WeakPolarHBondContact CB-OD2 3.29Å; P313-D316 WeakPolarHBondContact CD-OD2 3.44Å; P313-D316 WeakPolarHBondContact CG-OD2 3.36Å; P313-D316 WeakPolarHBondContact O-CA 3.47Å; P313-D316 WeakPolarHBondContact O-CB 3.24Å; P313-D316 PolarHBondContact O-N 3.04Å
314	F	42.1	Very low	44.7	Very low	122 Å²	122	79.8 Å²	79.8	54%	0.535	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-54.9	-32.5	-176.9	-160.2	-101	0	0	0	113.2	D316 L317 V320	F314-D316 PolarHBondContact O-N 2.92Å; F314-L317 HydrophobicContact CD2-CD1 4.41Å; F314-L317 PolarHBondContact O-N 3.03Å; F314-V320 HydrophobicContact CD1-CG2 4.14Å; F314-V320 HydrophobicContact CE1-CG2 3.88Å
315	R	43	Very low	43.9	Very low	186 Å²	186	81 Å²	81	70%	0.702	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-61.7	-23	173.2	57.8	166.4	-167	-172.3	0.3	114.6	P313	P313-R315 HydrophobicContact CB-CG 3.68Å; P313-R315 PolarHBondContact O-N 3.45Å
316	D	50	Low	43	Very low	77 Å²	77	87.3 Å²	87.3	41%	0.412	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-94.8	0.4	-176	-57.6	-24.6	0	0	0	111.8	P313 F314	P313-D316 WeakPolarHBondContact CB-OD2 3.29Å; P313-D316 WeakPolarHBondContact CD-OD2 3.44Å; P313-D316 WeakPolarHBondContact CG-OD2 3.36Å; P313-D316 WeakPolarHBondContact O-CA 3.47Å; P313-D316 WeakPolarHBondContact O-CB 3.24Å; P313-D316 PolarHBondContact O-N 3.04Å; F314-D316 PolarHBondContact O-N 2.92Å
317	L	50.1	Low	42.2	Very low	14 Å²	14	90.8 Å²	90.8	7%	0.073	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-91.8	4.7	177.5	-64.1	176.9	0	0	0	114	Y303 L309 K312 F314	Y303-L317 HydrophobicContact CE1-CD2 3.98Å; Y303-L317 VanDerWaalsContact OH-C 3.31Å; Y303-L317 VanDerWaalsContact OH-CA 3.23Å; Y303-L317 WeakPolarHBondContact OH-CA 3.3Å; Y303-L317 WeakPolarHBondContact OH-CD2 3.32Å; Y303-L317 PolarHBondContact OH-O 3.04Å; L309-L317 HydrophobicContact CD2-CD1 4.33Å; L309-L317 HydrophobicContact CD2-CD2 3.67Å; K312-L317 HydrophobicContact CB-CD2 4.05Å; K312-L317 HydrophobicContact CD-CD2 4.17Å; F314-L317 HydrophobicContact CD2-CD1 4.41Å; F314-L317 PolarHBondContact O-N 3.03Å
318	G	43.1	Very low	41.1	Very low	23 Å²	23	89.7 Å²	89.7	24%	0.237	53%	0.529	C	S	.	.	S	Bend	trans	116.5	142.7	-170.8	0	0	0	0	0	110.7	V320	G318-V320 PolarHBondContact O-N 2.93Å
319	E	39	Very low	39.9	Very low	90 Å²	90	93.1 Å²	93.1	42%	0.421	55%	0.55	S	S	.	.			trans	-48.4	116.4	-167.2	-71.2	-176.7	151.1	0	0	114.3	P295	P295-E319 WeakPolarHBondContact CB-OE2 3.4Å
320	V	35.1	Very low	38.7	Very low	76 Å²	76	99 Å²	99	46%	0.461	58%	0.576	S	S	.	*			trans	-115.5	77.3	151.7	-170.8	0	0	0	0	105.4	F314 G318 G322	F314-V320 HydrophobicContact CD1-CG2 4.14Å; F314-V320 HydrophobicContact CE1-CG2 3.88Å; G318-V320 PolarHBondContact O-N 2.93Å; V320-G322 PolarHBondContact O-N 3.42Å
321	S	32.8	Very low	37.9	Very low	58 Å²	58	102.1 Å²	102.1	41%	0.406	59%	0.589	S	S	.	*			trans	-87.9	96	173.4	61.2	0	0	0	0	108.7
322	G	34.6	Very low	36.9	Very low	55 Å²	55	104.9 Å²	104.9	57%	0.567	60%	0.599	S	S	*	*			trans	-135	92.8	171.6	0	0	0	0	0	109.6	V320 S324	V320-G322 PolarHBondContact O-N 3.42Å; G322-S324 VanDerWaalsContact C-N 3.25Å; G322-S324 PolarHBondContact O-N 3.36Å
323	D	31.7	Very low	35.9	Very low	132 Å²	132	106.3 Å²	106.3	71%	0.706	62%	0.617	S	S	*	*			trans	-69.9	82.3	166.8	-85.8	0.5	0	0	0	109.3	P292	P292-D323 WeakPolarHBondContact CD-OD2 3.31Å; P292-D323 WeakPolarHBondContact CG-OD2 3.08Å
324	S	30.5	Very low	35.5	Very low	84 Å²	84	109.2 Å²	109.2	59%	0.587	64%	0.636	S	S	*	*			trans	-160.4	64	162.6	71.1	0	0	0	0	110.7	G322	G322-S324 VanDerWaalsContact C-N 3.25Å; G322-S324 PolarHBondContact O-N 3.36Å
325	C	30.6	Very low	35.3	Very low	129 Å²	129	106.8 Å²	106.8	87%	0.872	63%	0.634	S	S	*	*			trans	-134.5	56.1	167.2	-80.5	0	0	0	0	109.4
326	Q	32.1	Very low	35.1	Very low	192 Å²	192	104.6 Å²	104.6	90%	0.897	63%	0.634	S	S	*	*			trans	-138.1	138	159.4	-72.4	-155.7	-17.4	0	0	109.6
327	A	31.4	Very low	34.7	Very low	99 Å²	99	105.5 Å²	105.5	82%	0.818	65%	0.645	S	S	*	*	S	Bend	trans	76.6	81.9	173	0	0	0	0	0	117.2
328	S	35.4	Very low	34.3	Very low	120 Å²	120	108.7 Å²	108.7	84%	0.839	66%	0.664	S	S	*	*				178.8	120.4	111.2	57.1	0	0	0	0	110	Q330	S328-Q330 PolarHBondContact O-N 2.96Å
329	N	29.1	Very low	34.1	Very low	156 Å²	156	110 Å²	110	83%	0.834	67%	0.673	S	S	*	*			trans	-57.7	118.2	165.4	-66.7	-39.4	0	0	0	109.1
330	Q	29.5	Very low	34.3	Very low	179 Å²	179	113 Å²	113	84%	0.836	68%	0.68	S	S	*	*			trans	173.5	140.1	136.3	-91.5	157.5	33.7	0	0	109.1	S328	S328-Q330 PolarHBondContact O-N 2.96Å
331	D	30.8	Very low	34.6	Very low	156 Å²	156	116.1 Å²	116.1	83%	0.834	69%	0.688	S	S	*	*			trans	85.8	86.2	174.2	-53.1	-21.5	0	0	0	117.6
332	S	27.3	Very low	35.1	Very low	125 Å²	125	118.5 Å²	118.5	87%	0.874	69%	0.693	S	S	*	*			trans	-77	138.5	165.3	-60.4	0	0	0	0	111.6
333	P	30.3	Very low	35.3	Very low	115 Å²	115	122.6 Å²	122.6	75%	0.747	70%	0.699	S	S	*	*				-139.2	178.4	123.1	36	-21.5	0	0	0	112.3
334	P	37	Very low	35.8	Very low	106 Å²	106	121.5 Å²	121.5	69%	0.688	69%	0.689	S	S	*	*	S	Bend		-60.5	148.2	-108.3	31.8	-17.4	0	0	0	115	I336	P334-I336 PolarHBondContact O-N 3.25Å
335	S	38.8	Very low	36.4	Very low	71 Å²	71	121 Å²	121	50%	0.497	68%	0.679	S	S	.	*			trans	-36.3	119.8	-174	66	0	0	0	0	114	P337 T338	S335-P337 WeakPolarHBondContact O-CD 3.48Å; S335-T338 WeakPolarHBondContact O-CB 3.4Å; S335-T338 PolarHBondContact O-N 3.46Å; S335-T338 PolarHBondContact O-OG1 3.29Å; S335-T338 PolarHBondContact OG-OG1 2.89Å
336	I	38.6	Very low	37	Very low	140 Å²	140	118.3 Å²	118.3	72%	0.718	66%	0.656	S	S	*	*	H	α-helix	trans	-42	-34.6	177.1	-66.2	170.4	0	0	0	114.1	P334 T338 R340	P334-I336 PolarHBondContact O-N 3.25Å; I336-T338 VanDerWaalsContact C-N 3.3Å; I336-T338 PolarHBondContact O-N 3.47Å; I336-R340 WeakPolarHBondContact O-CB 3.3Å; I336-R340 PolarHBondContact O-N 2.99Å
337	P	40.3	Very low	37.2	Very low	96 Å²	96	110.5 Å²	110.5	62%	0.623	63%	0.625	S	S	*	*	H	α-helix	trans	-61.1	-33.6	173.7	-24.2	35.5	0	0	0	114.4	S335 K341	S335-P337 WeakPolarHBondContact O-CD 3.48Å; P337-K341 WeakPolarHBondContact O-CB 3.19Å; P337-K341 PolarHBondContact O-N 2.91Å
338	T	41.6	Very low	37.4	Very low	80 Å²	80	109.5 Å²	109.5	49%	0.491	61%	0.611	S	S	.	*	H	α-helix	trans	-77.4	-42.2	-176.9	-44.9	0	0	0	0	111.2	S335 I336 R340 K341 Q342	S335-T338 WeakPolarHBondContact O-CB 3.4Å; S335-T338 PolarHBondContact O-N 3.46Å; S335-T338 PolarHBondContact O-OG1 3.29Å; S335-T338 PolarHBondContact OG-OG1 2.89Å; I336-T338 VanDerWaalsContact C-N 3.3Å; I336-T338 PolarHBondContact O-N 3.47Å; T338-R340 VanDerWaalsContact C-N 3.34Å; T338-R340 PolarHBondContact O-N 3.19Å; T338-K341 PolarHBondContact O-N 3.28Å; T338-Q342 WeakPolarHBondContact O-CB 3.41Å; T338-Q342 PolarHBondContact O-N 3.05Å
339	A	40.6	Very low	37.4	Very low	50 Å²	50	111.2 Å²	111.2	41%	0.413	60%	0.604	S	S	.	*	H	α-helix	trans	-64.2	-38.9	173.2	0	0	0	0	0	111.9	Q342 M343	A339-Q342 PolarHBondContact O-N 3.24Å; A339-M343 WeakPolarHBondContact O-CB 3.15Å; A339-M343 PolarHBondContact O-N 3.27Å
340	R	42.5	Very low	37.7	Very low	154 Å²	154	107.8 Å²	107.8	58%	0.581	58%	0.584	S	S	*	*	H	α-helix	trans	-66.1	-40.4	177.1	-167	173.7	177.6	166.6	-1.3	112.3	I336 T338 Q344	I336-R340 WeakPolarHBondContact O-CB 3.3Å; I336-R340 PolarHBondContact O-N 2.99Å; T338-R340 VanDerWaalsContact C-N 3.34Å; T338-R340 PolarHBondContact O-N 3.19Å; R340-Q344 WeakPolarHBondContact O-CB 3.39Å; R340-Q344 VanDerWaalsContact O-CG 3.3Å; R340-Q344 WeakPolarHBondContact O-CG 3.46Å; R340-Q344 PolarHBondContact O-N 3.29Å
341	K	40.5	Very low	38.1	Very low	142 Å²	142	107.1 Å²	107.1	62%	0.617	58%	0.578	S	S	*	*	H	α-helix	trans	-68.4	-39.7	175.5	-156.6	174.1	-174.2	-178.3	0	111.6	P337 T338 Q344 I345	P337-K341 WeakPolarHBondContact O-CB 3.19Å; P337-K341 PolarHBondContact O-N 2.91Å; T338-K341 PolarHBondContact O-N 3.28Å; K341-Q344 PolarHBondContact O-N 3.19Å; K341-I345 HydrophobicContact CG-CD1 4.37Å; K341-I345 WeakPolarHBondContact O-CD1 3.37Å; K341-I345 VanDerWaalsContact O-CG1 3.22Å; K341-I345 WeakPolarHBondContact O-CG1 3.43Å; K341-I345 PolarHBondContact O-N 2.99Å
342	Q	43.1	Very low	38.4	Very low	108 Å²	108	101.4 Å²	101.4	51%	0.505	55%	0.553	S	S	.	*	H	α-helix	trans	-67.3	-39.4	176.4	-159.2	67.5	30.3	0	0	112.4	T338 A339 I345 N346	T338-Q342 WeakPolarHBondContact O-CB 3.41Å; T338-Q342 PolarHBondContact O-N 3.05Å; A339-Q342 PolarHBondContact O-N 3.24Å; Q342-I345 PolarHBondContact O-N 3.36Å; Q342-N346 WeakPolarHBondContact O-CB 3.37Å; Q342-N346 VanDerWaalsContact O-CG 3.25Å; Q342-N346 PolarHBondContact O-N 2.94Å; Q342-N346 PolarHBondContact O-ND2 3.47Å
343	M	40.2	Very low	39	Very low	141 Å²	141	96.6 Å²	96.6	70%	0.695	52%	0.517	S	S	*	.	H	α-helix	trans	-66.9	-39	173.9	-85.3	-175.4	176.3	0	0	112.8	A339 N346 A347	A339-M343 WeakPolarHBondContact O-CB 3.15Å; A339-M343 PolarHBondContact O-N 3.27Å; M343-N346 PolarHBondContact O-N 3.31Å; M343-A347 VanDerWaalsContact O-CB 3.25Å; M343-A347 WeakPolarHBondContact O-CB 3.49Å; M343-A347 PolarHBondContact O-N 2.91Å
344	Q	41.9	Very low	39.5	Very low	108 Å²	108	92.7 Å²	92.7	51%	0.505	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-40.1	174.5	-77.3	174.2	-28.3	0	0	112	R340 K341 S348	R340-Q344 WeakPolarHBondContact O-CB 3.39Å; R340-Q344 VanDerWaalsContact O-CG 3.3Å; R340-Q344 WeakPolarHBondContact O-CG 3.46Å; R340-Q344 PolarHBondContact O-N 3.29Å; K341-Q344 PolarHBondContact O-N 3.19Å; Q344-S348 PolarHBondContact O-N 3.14Å
345	I	41.9	Very low	39.6	Very low	73 Å²	73	88.6 Å²	88.6	37%	0.374	47%	0.467	S	S	.	.	H	α-helix	trans	-65.9	-39.6	175.2	-68.7	165.2	0	0	0	110.9	K341 Q342 S348	K341-I345 HydrophobicContact CG-CD1 4.37Å; K341-I345 WeakPolarHBondContact O-CD1 3.37Å; K341-I345 VanDerWaalsContact O-CG1 3.22Å; K341-I345 WeakPolarHBondContact O-CG1 3.43Å; K341-I345 PolarHBondContact O-N 2.99Å; Q342-I345 PolarHBondContact O-N 3.36Å; I345-S348 PolarHBondContact O-OG 3.03Å
346	N	44.3	Very low	39.4	Very low	74 Å²	74	87.4 Å²	87.4	40%	0.396	46%	0.455	S	S	.	.	H	α-helix	trans	-74.3	-37.6	178.8	-70.9	-12.4	0	0	0	112.9	Q342 M343 S348 K349 M350	Q342-N346 WeakPolarHBondContact O-CB 3.37Å; Q342-N346 VanDerWaalsContact O-CG 3.25Å; Q342-N346 PolarHBondContact O-N 2.94Å; Q342-N346 PolarHBondContact O-ND2 3.47Å; M343-N346 PolarHBondContact O-N 3.31Å; N346-S348 VanDerWaalsContact C-N 3.29Å; N346-S348 PolarHBondContact O-N 3.27Å; N346-K349 PolarHBondContact O-N 3Å; N346-M350 WeakPolarHBondContact O-CG 3.49Å; N346-M350 PolarHBondContact O-N 2.86Å
347	A	36.9	Very low	39.2	Very low	28 Å²	28	83.2 Å²	83.2	23%	0.231	43%	0.434	C	S	.	.	H	α-helix	trans	-62.8	-35.3	176	0	0	0	0	0	112.1	M343 K349 M350	M343-A347 VanDerWaalsContact O-CB 3.25Å; M343-A347 WeakPolarHBondContact O-CB 3.49Å; M343-A347 PolarHBondContact O-N 2.91Å; A347-K349 PolarHBondContact O-N 3.38Å; A347-M350 PolarHBondContact O-N 3.22Å
348	S	34.8	Very low	38.7	Very low	77 Å²	77	84 Å²	84	54%	0.538	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-12	174.4	70.1	0	0	0	0	114.3	Q344 I345 N346	Q344-S348 PolarHBondContact O-N 3.14Å; I345-S348 PolarHBondContact O-OG 3.03Å; N346-S348 VanDerWaalsContact C-N 3.29Å; N346-S348 PolarHBondContact O-N 3.27Å
349	K	35.7	Very low	38.3	Very low	157 Å²	157	84 Å²	84	68%	0.683	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-10.8	178.5	-67.6	-179.5	177.7	-177.7	0	113.8	N346 A347 K351	N346-K349 PolarHBondContact O-N 3Å; A347-K349 PolarHBondContact O-N 3.38Å; K349-K351 PolarHBondContact O-N 2.78Å
350	M	36.1	Very low	37.8	Very low	84 Å²	84	85.7 Å²	85.7	41%	0.414	44%	0.44	S	S	.	.			trans	-86	102.7	-172.8	-78.9	169.9	153.8	0	0	111.2	N346 A347	N346-M350 WeakPolarHBondContact O-CG 3.49Å; N346-M350 PolarHBondContact O-N 2.86Å; A347-M350 PolarHBondContact O-N 3.22Å
351	K	37.6	Very low	37.2	Very low	164 Å²	164	87.5 Å²	87.5	71%	0.713	46%	0.455	S	S	*	.			trans	-82.9	112.6	171.1	-73.8	-178.3	175.8	179.5	0	109.3	K349 I407	K349-K351 PolarHBondContact O-N 2.78Å; K351-I407 HydrophobicContact CB-CD1 4.3Å
352	A	36.2	Very low	37	Very low	37 Å²	37	85.2 Å²	85.2	31%	0.306	45%	0.453	S	S	.	.			trans	51.5	94.9	165.6	0	0	0	0	0	117.3	Q376	A352-Q376 VanDerWaalsContact CB-OE1 3.27Å; A352-Q376 WeakPolarHBondContact O-CB 3.39Å
353	N	39.5	Very low	36.5	Very low	23 Å²	23	86.1 Å²	86.1	12%	0.123	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.7	174.7	-63.2	-24.2	0	0	0	111.3	E375	N353-E375 VanDerWaalsContact CG-OE1 3.29Å; N353-E375 PolarHBondContact ND2-OE1 2.85Å; N353-E375 PolarHBondContact ND2-OE2 2.71Å; N353-E375 VanDerWaalsContact OD1-CA 3.3Å; N353-E375 WeakPolarHBondContact OD1-CA 3.44Å; N353-E375 VanDerWaalsContact OD1-CD 3.23Å; N353-E375 PolarHBondContact OD1-OE2 3.35Å
354	A	42.2	Very low	36.3	Very low	33 Å²	33	84.7 Å²	84.7	27%	0.273	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.4	165.6	0	0	0	0	0	108.2	A373 F374	A354-A373 CarbonylContact O-C 3.54Å; A354-A373 VanDerWaalsContact O-CA 3.24Å; A354-A373 WeakPolarHBondContact O-CA 3.31Å; A354-F374 PolarHBondContact N-O 2.93Å; A354-F374 PolarHBondContact O-N 3.08Å
355	V	38.6	Very low	35.9	Very low	20 Å²	20	82.9 Å²	82.9	12%	0.121	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.4	-178.5	-177.8	0	0	0	0	109.3	V300 L357 R371 A373	V300-V355 WeakPolarHBondContact CG1-O 3.3Å; V355-L357 PolarHBondContact O-N 3.07Å; V355-R371 HydrophobicContact CG1-CB 4.47Å; V355-R371 HydrophobicContact CG1-CG 4.3Å; V355-A373 HydrophobicContact CG2-CB 4.41Å
356	L	35.2	Very low	35.5	Very low	46 Å²	46	85.5 Å²	85.5	24%	0.241	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	118.3	162.1	-65.7	153.9	0	0	0	108.4	Q372 F374	L356-Q372 WeakPolarHBondContact CA-O 3.48Å; L356-Q372 HydrophobicContact CB-CB 4.17Å; L356-Q372 WeakPolarHBondContact CB-O 3.2Å; L356-Q372 HydrophobicContact CD1-CB 4.01Å; L356-Q372 PolarHBondContact N-O 3.03Å; L356-Q372 PolarHBondContact O-N 2.87Å; L356-F374 HydrophobicContact CD1-CD2 4.21Å; L356-F374 HydrophobicContact CD1-CE2 3.75Å
357	L	32.8	Very low	35.1	Very low	52 Å²	52	87 Å²	87	27%	0.272	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	108.5	161.6	-74.8	166.1	0	0	0	107.3	V355 R371	V355-L357 PolarHBondContact O-N 3.07Å; L357-R371 HydrophobicContact CD2-CG 4.42Å
358	H	31.2	Very low	35	Very low	114 Å²	114	87.4 Å²	87.4	53%	0.528	52%	0.521	S	S	.	.			trans	-82	115.7	167.6	-149.5	-22.9	0	0	0	107.9	C360	H358-C360 PolarHBondContact O-N 3.16Å; H358-C360 VanDerWaalsContact O-N 3.12Å
359	S	31.9	Very low	34.9	Very low	78 Å²	78	87.4 Å²	87.4	55%	0.545	52%	0.52	S	S	.	.			trans	-69.2	102.8	163.4	55.8	0	0	0	0	107.9
360	C	30.4	Very low	34.9	Very low	87 Å²	87	88.7 Å²	88.7	59%	0.588	52%	0.522	S	S	*	.			trans	-86.8	111.2	163.9	-99	0	0	0	0	108.1	H358 V362	H358-C360 PolarHBondContact O-N 3.16Å; H358-C360 VanDerWaalsContact O-N 3.12Å; C360-V362 HydrophobicContact CB-CG2 4.12Å; C360-V362 PolarHBondContact O-N 2.8Å; C360-V362 VanDerWaalsContact O-N 3.16Å
361	E	30.1	Very low	35.2	Very low	191 Å²	191	88.7 Å²	88.7	89%	0.893	52%	0.517	S	S	*	.			trans	-68.7	102.3	153.6	-77.9	-177.2	157.6	0	0	106.9	T363	E361-T363 PolarHBondContact O-N 2.85Å; E361-T363 VanDerWaalsContact O-N 3.16Å
362	V	37	Very low	35.7	Very low	95 Å²	95	86 Å²	86	58%	0.576	51%	0.507	S	S	*	.			trans	-80.1	96.1	178.7	-179	0	0	0	0	108.7	C360 S364	C360-V362 HydrophobicContact CB-CG2 4.12Å; C360-V362 PolarHBondContact O-N 2.8Å; C360-V362 VanDerWaalsContact O-N 3.16Å; V362-S364 PolarHBondContact O-N 3.03Å
363	T	33.2	Very low	36.7	Very low	127 Å²	127	86.3 Å²	86.3	78%	0.779	51%	0.509	S	S	*	.			trans	-77.9	103.9	153.3	52.4	0	0	0	0	107.8	E361	E361-T363 PolarHBondContact O-N 2.85Å; E361-T363 VanDerWaalsContact O-N 3.16Å
364	S	34.7	Very low	38.3	Very low	110 Å²	110	90.2 Å²	90.2	77%	0.769	53%	0.525	S	S	*	.	S	Bend	trans	67.2	120.1	168.9	67.3	0	0	0	0	119	V362	V362-S364 PolarHBondContact O-N 3.03Å
365	G	32.9	Very low	40	Very low	71 Å²	71	91.2 Å²	91.2	73%	0.732	52%	0.524	S	S	*	.	S	Bend	trans	73.3	76.9	139.6	0	0	0	0	0	118.3
366	T	35	Very low	42.4	Very low	127 Å²	127	91.3 Å²	91.3	78%	0.779	52%	0.524	S	S	*	.			trans	127.5	105.2	153.9	-45	0	0	0	0	110.8	G368	T366-G368 PolarHBondContact O-N 2.84Å
367	P	34.6	Very low	45.2	Very low	107 Å²	107	90.1 Å²	90.1	70%	0.695	52%	0.517	S	S	*	.			trans	-83.2	110.3	-176.4	22.1	-14.4	0	0	0	111.7
368	G	35	Very low	48.1	Very low	36 Å²	36	87.6 Å²	87.6	37%	0.371	50%	0.504	S	S	.	.			trans	-124.8	99.3	159.8	0	0	0	0	0	109.1	T366 Y370	T366-G368 PolarHBondContact O-N 2.84Å; G368-Y370 WeakPolarHBondContact O-CD2 3.41Å; G368-Y370 PolarHBondContact O-N 3.19Å
369	C	33.9	Very low	51.2	Low	77 Å²	77	83.5 Å²	83.5	52%	0.52	49%	0.487	S	S	.	.			trans	-74.2	93.6	171.7	-158.9	0	0	0	0	107.7	R371	C369-R371 PolarHBondContact O-N 2.76Å; C369-R371 VanDerWaalsContact O-N 3.13Å
370	Y	35.3	Very low	54.3	Low	184 Å²	184	79.8 Å²	79.8	72%	0.722	46%	0.461	S	S	*	.			trans	-73.6	104.4	177.7	-65.4	-82.8	0	0	0	109.2	G368 Q372	G368-Y370 WeakPolarHBondContact O-CD2 3.41Å; G368-Y370 PolarHBondContact O-N 3.19Å; Y370-Q372 PolarHBondContact O-N 2.83Å
371	R	41.2	Very low	57.5	Low	83 Å²	83	81.5 Å²	81.5	31%	0.313	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	116.2	162.3	-74.6	-175.6	-173.9	-178	2.4	107.8	V355 L357 C369 A373	V355-R371 HydrophobicContact CG1-CB 4.47Å; V355-R371 HydrophobicContact CG1-CG 4.3Å; L357-R371 HydrophobicContact CD2-CG 4.42Å; C369-R371 PolarHBondContact O-N 2.76Å; C369-R371 VanDerWaalsContact O-N 3.13Å; R371-A373 PolarHBondContact O-N 3.39Å
372	Q	49	Very low	60.6	Low	109 Å²	109	72.8 Å²	72.8	51%	0.509	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	92	169.9	-72.9	165.5	-6.9	0	0	107	L356 Y370	L356-Q372 WeakPolarHBondContact CA-O 3.48Å; L356-Q372 HydrophobicContact CB-CB 4.17Å; L356-Q372 WeakPolarHBondContact CB-O 3.2Å; L356-Q372 HydrophobicContact CD1-CB 4.01Å; L356-Q372 PolarHBondContact N-O 3.03Å; L356-Q372 PolarHBondContact O-N 2.87Å; Y370-Q372 PolarHBondContact O-N 2.83Å
373	A	56.9	Low	63.3	Low	42 Å²	42	68.4 Å²	68.4	35%	0.347	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136.9	172.8	0	0	0	0	0	109.2	A354 V355 R371	A354-A373 CarbonylContact O-C 3.54Å; A354-A373 VanDerWaalsContact O-CA 3.24Å; A354-A373 WeakPolarHBondContact O-CA 3.31Å; V355-A373 HydrophobicContact CG2-CB 4.41Å; R371-A373 PolarHBondContact O-N 3.39Å
374	F	72.8	Confident	66.3	Low	105 Å²	105	62.4 Å²	62.4	46%	0.461	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.6	163.5	-71.1	-73.8	0	0	0	108	A354 L356 V501	A354-F374 PolarHBondContact N-O 2.93Å; A354-F374 PolarHBondContact O-N 3.08Å; L356-F374 HydrophobicContact CD1-CD2 4.21Å; L356-F374 HydrophobicContact CD1-CE2 3.75Å; F374-V501 HydrophobicContact CB-CG1 3.68Å; F374-V501 HydrophobicContact CD1-CG1 4.02Å; F374-V501 HydrophobicContact CG-CG1 4.03Å
375	E	78.8	Confident	69.1	Low	54 Å²	54	59.5 Å²	59.5	25%	0.252	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	144.1	179.6	-56.9	-76.5	136.1	0	0	109.9	N353 I377 Y410	N353-E375 VanDerWaalsContact CG-OE1 3.29Å; N353-E375 PolarHBondContact ND2-OE1 2.85Å; N353-E375 PolarHBondContact ND2-OE2 2.71Å; N353-E375 VanDerWaalsContact OD1-CA 3.3Å; N353-E375 WeakPolarHBondContact OD1-CA 3.44Å; N353-E375 VanDerWaalsContact OD1-CD 3.23Å; N353-E375 PolarHBondContact OD1-OE2 3.35Å; E375-I377 PolarHBondContact O-N 2.84Å; E375-Y410 HydrophobicContact CB-CE2 4.36Å; E375-Y410 WeakPolarHBondContact CB-OH 3.36Å; E375-Y410 WeakPolarHBondContact CG-OH 3.46Å
376	Q	87.8	Confident	71.8	Confident	22 Å²	22	58.8 Å²	58.8	10%	0.103	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-72	120.5	168.4	178.7	174.7	-5.5	0	0	109.3	A352 G378 I407 P499 V500	A352-Q376 VanDerWaalsContact CB-OE1 3.27Å; A352-Q376 WeakPolarHBondContact O-CB 3.39Å; Q376-G378 VanDerWaalsContact CG-O 3.26Å; Q376-G378 WeakPolarHBondContact CG-O 3.44Å; Q376-G378 PolarHBondContact NE2-O 2.87Å; Q376-I407 HydrophobicContact CB-CD1 4.29Å; Q376-I407 HydrophobicContact CG-CD1 3.99Å; Q376-I407 VanDerWaalsContact O-CD1 3.29Å; Q376-I407 WeakPolarHBondContact O-CD1 3.29Å; Q376-I407 WeakPolarHBondContact O-CG1 3.15Å; Q376-P499 HydrophobicContact CG-CB 4.12Å; Q376-V500 CarbonylContact C-O 3.6Å; Q376-V500 WeakPolarHBondContact CA-O 3.24Å
377	I	94.3	Very high	74.4	Confident	21 Å²	21	57.4 Å²	57.4	11%	0.108	29%	0.286	C	S	.	.			trans	-92.7	-19	178.4	68.3	161.2	0	0	0	112.9	E375 L406 I407 Y410 V500 V501 I503	E375-I377 PolarHBondContact O-N 2.84Å; I377-L406 HydrophobicContact CD1-CD2 4.41Å; I377-L406 WeakPolarHBondContact O-CA 3.42Å; I377-I407 PolarHBondContact O-N 2.78Å; I377-Y410 HydrophobicContact CB-CD2 3.94Å; I377-Y410 HydrophobicContact CB-CE2 4.41Å; I377-Y410 HydrophobicContact CB-CG 3.98Å; I377-Y410 HydrophobicContact CG2-CD1 4.05Å; I377-Y410 HydrophobicContact CG2-CD2 3.96Å; I377-Y410 HydrophobicContact CG2-CE1 4.1Å; I377-Y410 HydrophobicContact CG2-CE2 4Å; I377-Y410 HydrophobicContact CG2-CG 3.97Å; I377-V500 HydrophobicContact CD1-CG1 4.16Å; I377-V500 HydrophobicContact CG1-CB 4.4Å; I377-V500 HydrophobicContact CG1-CG1 3.92Å; I377-V500 WeakPolarHBondContact CG1-O 3.25Å; I377-V500 PolarHBondContact N-O 2.55Å; I377-V501 WeakPolarHBondContact CG2-O 3.47Å; I377-I503 HydrophobicContact CD1-CG1 4.34Å; I377-I503 HydrophobicContact CD1-CG2 4.39Å
378	G	94.3	Very high	77	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.6	174	-178.9	0	0	0	0	0	114.2	Q376 H405 V500	Q376-G378 VanDerWaalsContact CG-O 3.26Å; Q376-G378 WeakPolarHBondContact CG-O 3.44Å; Q376-G378 PolarHBondContact NE2-O 2.87Å; G378-H405 CarbonylContact C-O 3.59Å; G378-H405 WeakPolarHBondContact CA-O 3.43Å; G378-V500 PolarHBondContact N-O 2.77Å; G378-V500 PolarHBondContact O-N 3.18Å
379	V	95.9	Very high	79.6	Confident	27 Å²	27	54.2 Å²	54.2	16%	0.164	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.9	179.2	-176.1	0	0	0	0	108.8	H405 I407	V379-H405 PolarHBondContact N-O 2.61Å; V379-H405 PolarHBondContact O-N 3.01Å; V379-I407 HydrophobicContact CG2-CG2 4.25Å
380	I	97.7	Very high	82.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	132.6	169.9	-66.4	-63	0	0	0	110.7	E403 L404 I427 L489 L492 L494 G497 T498 V500	I380-E403 CarbonylContact C-O 3.56Å; I380-E403 WeakPolarHBondContact CA-O 3.4Å; I380-L404 HydrophobicContact CD1-CB 4.2Å; I380-L404 HydrophobicContact CD1-CD1 4.26Å; I380-I427 HydrophobicContact CD1-CD1 4.29Å; I380-L489 HydrophobicContact CD1-CD1 4.2Å; I380-L492 HydrophobicContact CG2-CD2 3.62Å; I380-L494 HydrophobicContact CD1-CD1 3.75Å; I380-L494 HydrophobicContact CG1-CB 4.32Å; I380-L494 HydrophobicContact CG1-CD1 3.72Å; I380-L494 HydrophobicContact CG2-CB 4.01Å; I380-G497 WeakPolarHBondContact O-CA 3.45Å; I380-G497 PolarHBondContact O-N 3.42Å; I380-T498 HydrophobicContact CG1-CG2 4.4Å; I380-T498 PolarHBondContact N-O 2.77Å; I380-V500 HydrophobicContact CD1-CG2 3.94Å; I380-V500 HydrophobicContact CG1-CG2 3.81Å
381	R	96.8	Very high	85	Confident	123 Å²	123	43.6 Å²	43.6	46%	0.464	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.6	161.4	-59.6	-57.4	-174	-179.8	-0.4	109	G402 E403 D496	R381-G402 CarbonylContact O-C 3.43Å; R381-G402 VanDerWaalsContact O-CA 3.27Å; R381-G402 WeakPolarHBondContact O-CA 3.43Å; R381-E403 HydrophobicContact CB-CB 4.26Å; R381-E403 PolarHBondContact N-O 2.69Å; R381-E403 PolarHBondContact O-N 3.37Å; R381-D496 VanDerWaalsContact CA-OD1 3.27Å; R381-D496 WeakPolarHBondContact CA-OD1 3.27Å
382	S	95.5	Very high	87	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.063	22%	0.217	C	C	.	.			trans	-139.7	163	-174.8	93.3	0	0	0	0	112.6	Y384 K385 L494 D496	S382-Y384 PolarHBondContact O-N 3.47Å; S382-Y384 PolarHBondContact OG-N 3.04Å; S382-Y384 VanDerWaalsContact OG-N 3.15Å; S382-Y384 PolarHBondContact OG-O 3.29Å; S382-K385 PolarHBondContact O-NZ 3.26Å; S382-L494 WeakPolarHBondContact CB-O 3.37Å; S382-L494 PolarHBondContact OG-O 2.94Å; S382-D496 PolarHBondContact N-OD1 2.82Å; S382-D496 PolarHBondContact OG-N 3.03Å
383	P	94.8	Very high	88.8	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.013	21%	0.209	C	C	.	.	S	Bend	trans	-72	-14.7	173.8	29.9	-37	0	0	0	112.9	K385 N401 F554 L581 H582	P383-K385 PolarHBondContact O-N 2.72Å; P383-N401 VanDerWaalsContact CD-O 3.23Å; P383-N401 WeakPolarHBondContact CD-O 3.5Å; P383-F554 HydrophobicContact CB-CE1 3.67Å; P383-F554 HydrophobicContact CB-CE2 4.39Å; P383-F554 HydrophobicContact CB-CZ 3.55Å; P383-F554 HydrophobicContact CG-CE1 4.11Å; P383-F554 HydrophobicContact CG-CE2 3.91Å; P383-F554 HydrophobicContact CG-CZ 3.5Å; P383-F554 VanDerWaalsContact CG-CZ 3.5Å; P383-L581 CarbonylContact O-C 3.55Å; P383-L581 WeakPolarHBondContact O-CA 3.32Å; P383-H582 PolarHBondContact O-N 2.86Å
384	Y	95.3	Very high	90.3	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-87.1	106.6	-177.3	-55.3	-73.8	0	0	0	110.6	S382 V390 P391 A400 L492 D496 F554 V558 L581	S382-Y384 PolarHBondContact O-N 3.47Å; S382-Y384 PolarHBondContact OG-N 3.04Å; S382-Y384 VanDerWaalsContact OG-N 3.15Å; S382-Y384 PolarHBondContact OG-O 3.29Å; Y384-V390 HydrophobicContact CD1-CG2 4.05Å; Y384-V390 HydrophobicContact CG-CG2 3.86Å; Y384-P391 WeakPolarHBondContact OH-CD 3.16Å; Y384-P391 WeakPolarHBondContact OH-CG 3.17Å; Y384-A400 HydrophobicContact CE2-CB 4.13Å; Y384-A400 VanDerWaalsContact OH-CB 3.26Å; Y384-A400 WeakPolarHBondContact OH-CB 3.37Å; Y384-L492 WeakPolarHBondContact CE2-O 3.32Å; Y384-D496 WeakPolarHBondContact O-CB 3.3Å; Y384-D496 PolarHBondContact O-N 3.18Å; Y384-F554 HydrophobicContact CD1-CZ 4.39Å; Y384-F554 HydrophobicContact CE1-CE2 4.07Å; Y384-F554 AromaticContact CE1-CZ 3.89Å; Y384-F554 HydrophobicContact CE1-CZ 3.89Å; Y384-F554 AromaticContact CZ-CE2 3.93Å; Y384-V558 HydrophobicContact CE1-CG2 4Å; Y384-L581 HydrophobicContact CD1-CD2 3.81Å; Y384-L581 HydrophobicContact CE1-CD2 4.24Å
385	K	93	Very high	91.1	Very high	49 Å²	49	41 Å²	41	21%	0.213	20%	0.198	C	C	.	.	S	Bend	trans	-87.4	-7.9	-177.4	-58.6	-58.2	172.1	177.6	0	114.3	S382 P383 D496 W580 H582	S382-K385 PolarHBondContact O-NZ 3.26Å; P383-K385 PolarHBondContact O-N 2.72Å; K385-D496 HydrophobicContact CD-CB 4.01Å; K385-D496 IonicContact NZ-OD1 3.45Å; K385-D496 IonicContact NZ-OD2 2.78Å; K385-D496 PolarHBondContact NZ-OD2 3.4Å; K385-W580 HydrophobicContact CB-CB 3.91Å; K385-W580 PolarHBondContact N-O 3Å; K385-H582 WeakPolarHBondContact CE-O 3.47Å; K385-H582 WeakPolarHBondContact CG-O 3.31Å
386	E	90.2	Very high	91.7	Very high	56 Å²	56	40 Å²	40	26%	0.262	19%	0.194	S	C	.	.	S	Bend	trans	-146.3	167.7	177.4	61	-174.4	179.4	0	0	110	F388 V390 V579 W580	E386-F388 HydrophobicContact CG-CB 4.16Å; E386-F388 PolarHBondContact O-N 2.83Å; E386-V390 VanDerWaalsContact O-CG2 3.3Å; E386-V390 WeakPolarHBondContact O-CG2 3.27Å; E386-V579 HydrophobicContact CG-CG2 4.47Å; E386-V579 VanDerWaalsContact OE1-CA 3.29Å; E386-V579 WeakPolarHBondContact OE1-CA 3.26Å; E386-V579 WeakPolarHBondContact OE1-CG2 3.46Å; E386-W580 HydrophobicContact CG-CB 4.26Å; E386-W580 PolarHBondContact OE1-N 2.76Å
387	K	88.9	Confident	92	Very high	99 Å²	99	39 Å²	39	43%	0.43	19%	0.19	S	C	.	.	S	Bend	trans	-67.8	-27.5	178.5	-52.9	-179.2	-172	146.5	0	113.1	V390 Q433 T434 V495	K387-V390 WeakPolarHBondContact O-CG2 3.48Å; K387-V390 PolarHBondContact O-N 2.8Å; K387-Q433 HydrophobicContact CD-CB 4.35Å; K387-Q433 WeakPolarHBondContact CE-O 3.47Å; K387-Q433 HydrophobicContact CG-CB 4.48Å; K387-Q433 VanDerWaalsContact NZ-C 3.28Å; K387-Q433 PolarHBondContact NZ-O 2.62Å; K387-T434 HydrophobicContact CD-CG2 4.11Å; K387-T434 VanDerWaalsContact NZ-CG2 3.3Å; K387-V495 HydrophobicContact CG-CG2 4.3Å
388	F	89.1	Confident	91.9	Very high	64 Å²	64	45.2 Å²	45.2	28%	0.281	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	138.1	-177	-175.5	-120.2	0	0	0	109.6	E386 V390 P563 A578 V579 W588	E386-F388 HydrophobicContact CG-CB 4.16Å; E386-F388 PolarHBondContact O-N 2.83Å; F388-V390 PolarHBondContact O-N 2.84Å; F388-V390 VanDerWaalsContact O-N 3.15Å; F388-P563 HydrophobicContact CE2-CB 4.38Å; F388-P563 WeakPolarHBondContact CE2-O 3.32Å; F388-P563 HydrophobicContact CZ-CB 4.32Å; F388-A578 WeakPolarHBondContact CE1-O 3.4Å; F388-V579 HydrophobicContact CD1-CB 3.9Å; F388-V579 HydrophobicContact CD1-CG2 3.85Å; F388-V579 HydrophobicContact CE1-CB 4.15Å; F388-W588 AromaticContact CE1-CH2 3.69Å; F388-W588 HydrophobicContact CE1-CH2 3.69Å; F388-W588 HydrophobicContact CZ-CH2 4.07Å
389	A	89.6	Confident	91.9	Very high	12 Å²	12	45.6 Å²	45.6	10%	0.099	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	1.7	-172.8	0	0	0	0	0	118.6	V558 P563 V579	A389-V558 HydrophobicContact CB-CG1 3.68Å; A389-P563 HydrophobicContact CB-CB 3.46Å; A389-P563 VanDerWaalsContact CB-CB 3.46Å; A389-P563 HydrophobicContact CB-CG 4.06Å; A389-V579 HydrophobicContact CB-CB 4.48Å; A389-V579 HydrophobicContact CB-CG2 3.66Å
390	V	91.9	Very high	91.8	Very high	28 Å²	28	44.3 Å²	44.3	17%	0.17	21%	0.21	C	C	.	.			trans	-59.7	128.8	166.3	-177.7	0	0	0	0	108.5	Y384 E386 K387 F388 D493 V495	Y384-V390 HydrophobicContact CD1-CG2 4.05Å; Y384-V390 HydrophobicContact CG-CG2 3.86Å; E386-V390 VanDerWaalsContact O-CG2 3.3Å; E386-V390 WeakPolarHBondContact O-CG2 3.27Å; K387-V390 WeakPolarHBondContact O-CG2 3.48Å; K387-V390 PolarHBondContact O-N 2.8Å; F388-V390 PolarHBondContact O-N 2.84Å; F388-V390 VanDerWaalsContact O-N 3.15Å; V390-D493 VanDerWaalsContact CG1-C 3.43Å; V390-D493 WeakPolarHBondContact CG1-O 3.33Å; V390-V495 HydrophobicContact CG2-CG2 3.64Å
391	P	90.6	Very high	91.7	Very high	10 Å²	10	47.1 Å²	47.1	7%	0.065	23%	0.226	C	C	.	.			trans	-60.2	144.8	178.4	24.2	-32.7	0	0	0	109.9	Y384 Q393 L396 V397 D493	Y384-P391 WeakPolarHBondContact OH-CD 3.16Å; Y384-P391 WeakPolarHBondContact OH-CG 3.17Å; P391-Q393 PolarHBondContact O-N 3.46Å; P391-Q393 VanDerWaalsContact O-N 3.14Å; P391-L396 HydrophobicContact CB-CB 3.94Å; P391-L396 HydrophobicContact CB-CD1 4.18Å; P391-V397 HydrophobicContact CB-CG2 4.18Å; P391-V397 HydrophobicContact CG-CG2 4.2Å; P391-D493 HydrophobicContact CG-CB 3.96Å
392	R	84.6	Confident	91.6	Very high	143 Å²	143	41.7 Å²	41.7	54%	0.54	21%	0.208	S	C	.	.	S	Bend	trans	-70	-13.9	-172	-67	176.8	179	-88.2	-1.4	114
393	Q	86	Confident	91.7	Very high	76 Å²	76	43.8 Å²	43.8	36%	0.355	22%	0.217	S	C	.	.	S	Bend	trans	-155.2	155.9	179.6	-71.7	-60.2	-68.6	0	0	107.7	P391 L396	P391-Q393 PolarHBondContact O-N 3.46Å; P391-Q393 VanDerWaalsContact O-N 3.14Å; Q393-L396 HydrophobicContact CB-CD1 4.48Å
394	P	88.6	Confident	91.9	Very high	27 Å²	27	43.8 Å²	43.8	18%	0.175	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	162.1	177.2	31.2	-36	0	0	0	111.3	L396 S471 L472 S491 D493	P394-L396 VanDerWaalsContact C-N 3.28Å; P394-L396 PolarHBondContact O-N 3.37Å; P394-S471 WeakPolarHBondContact CG-OG 3.48Å; P394-L472 WeakPolarHBondContact CB-O 3.47Å; P394-L472 HydrophobicContact CG-CB 4.48Å; P394-L472 WeakPolarHBondContact CG-O 3.36Å; P394-S491 WeakPolarHBondContact CA-O 3.29Å; P394-S491 WeakPolarHBondContact CB-O 3.4Å; P394-D493 HydrophobicContact CB-CB 4.37Å; P394-D493 VanDerWaalsContact CD-OD2 3.24Å; P394-D493 WeakPolarHBondContact CD-OD2 3.03Å
395	G	89.9	Confident	92	Very high	38 Å²	38	46.3 Å²	46.3	39%	0.392	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	84	-12.8	177.7	0	0	0	0	0	115.9	S491	G395-S491 PolarHBondContact N-O 2.82Å
396	L	91.4	Very high	92.1	Very high	34 Å²	34	44.7 Å²	44.7	18%	0.178	22%	0.222	C	C	.	.	S	Bend	trans	-73.5	-29.3	179.1	-63.1	179.8	0	0	0	113.3	P391 Q393 P394 A524 P525 Q561	P391-L396 HydrophobicContact CB-CB 3.94Å; P391-L396 HydrophobicContact CB-CD1 4.18Å; Q393-L396 HydrophobicContact CB-CD1 4.48Å; P394-L396 VanDerWaalsContact C-N 3.28Å; P394-L396 PolarHBondContact O-N 3.37Å; L396-A524 HydrophobicContact CD2-CB 4.19Å; L396-P525 HydrophobicContact CD1-CG 4.14Å; L396-P525 HydrophobicContact CD2-CG 4.11Å; L396-Q561 PolarHBondContact O-NE2 2.6Å; L396-Q561 VanDerWaalsContact O-NE2 3.13Å
397	V	93.4	Very high	92.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	22%	0.218	C	C	.	.	S	Bend	trans	-122.4	100.7	176.4	179.2	0	0	0	0	106.6	P391 A400 S491 F554 E557 V558 Q561	P391-V397 HydrophobicContact CB-CG2 4.18Å; P391-V397 HydrophobicContact CG-CG2 4.2Å; V397-A400 HydrophobicContact CB-CB 4.03Å; V397-A400 HydrophobicContact CG1-CB 3.7Å; V397-A400 WeakPolarHBondContact O-CB 3.4Å; V397-A400 PolarHBondContact O-N 3.19Å; V397-S491 WeakPolarHBondContact O-CA 3.38Å; V397-F554 HydrophobicContact CG1-CD2 3.84Å; V397-F554 HydrophobicContact CG1-CE2 4.03Å; V397-E557 HydrophobicContact CB-CB 4.41Å; V397-E557 HydrophobicContact CG1-CB 3.75Å; V397-E557 HydrophobicContact CG2-CB 4.43Å; V397-V558 HydrophobicContact CG1-CG2 3.9Å; V397-V558 HydrophobicContact CG2-CG2 4.12Å; V397-Q561 HydrophobicContact CG2-CG 4.13Å
398	K	93	Very high	92	Very high	150 Å²	150	42.2 Å²	42.2	65%	0.652	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-30.7	-170.8	-67.1	-177.8	179	179.7	0	112.5	A400 E557	K398-A400 PolarHBondContact O-N 2.84Å; K398-E557 PolarHBondContact N-OE2 3.13Å
399	S	93.9	Very high	92.1	Very high	8 Å²	8	43.1 Å²	43.1	6%	0.056	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-4.9	177.1	59.7	0	0	0	0	113.8	N401 F554 E557	S399-N401 VanDerWaalsContact C-N 3.34Å; S399-N401 PolarHBondContact O-N 2.84Å; S399-N401 PolarHBondContact O-ND2 2.92Å; S399-F554 WeakPolarHBondContact OG-CA 3.33Å; S399-F554 PolarHBondContact OG-N 2.88Å; S399-E557 VanDerWaalsContact CB-OE2 3.32Å; S399-E557 WeakPolarHBondContact CB-OE2 3.18Å; S399-E557 PolarHBondContact N-OE2 2.9Å; S399-E557 PolarHBondContact OG-OE2 3.4Å
400	A	93.8	Very high	92.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.			trans	-72.4	85.1	177.6	0	0	0	0	0	111.4	Y384 V397 K398 S491 L492 F554	Y384-A400 HydrophobicContact CE2-CB 4.13Å; Y384-A400 VanDerWaalsContact OH-CB 3.26Å; Y384-A400 WeakPolarHBondContact OH-CB 3.37Å; V397-A400 HydrophobicContact CB-CB 4.03Å; V397-A400 HydrophobicContact CG1-CB 3.7Å; V397-A400 WeakPolarHBondContact O-CB 3.4Å; V397-A400 PolarHBondContact O-N 3.19Å; K398-A400 PolarHBondContact O-N 2.84Å; A400-S491 PolarHBondContact O-N 3.13Å; A400-L492 PolarHBondContact O-N 2.86Å; A400-F554 HydrophobicContact CB-CD2 4.24Å; A400-F554 HydrophobicContact CB-CE2 3.87Å
401	N	94.6	Very high	92.2	Very high	60 Å²	60	46.7 Å²	46.7	32%	0.321	25%	0.248	S	C	.	.			trans	-87.7	143	176.9	-60.1	-59.9	0	0	0	111	P383 S399 K476 L489	P383-N401 VanDerWaalsContact CD-O 3.23Å; P383-N401 WeakPolarHBondContact CD-O 3.5Å; S399-N401 VanDerWaalsContact C-N 3.34Å; S399-N401 PolarHBondContact O-N 2.84Å; S399-N401 PolarHBondContact O-ND2 2.92Å; N401-K476 PolarHBondContact OD1-NZ 2.61Å; N401-L489 WeakPolarHBondContact CA-O 3.44Å
402	G	95.4	Very high	92.2	Very high	9 Å²	9	51.6 Å²	51.6	9%	0.093	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	-173.7	176.5	0	0	0	0	0	111.6	R381 L489	R381-G402 CarbonylContact O-C 3.43Å; R381-G402 VanDerWaalsContact O-CA 3.27Å; R381-G402 WeakPolarHBondContact O-CA 3.43Å; G402-L489 PolarHBondContact N-O 3.02Å; G402-L489 PolarHBondContact O-N 2.92Å
403	E	97.7	Very high	92.5	Very high	53 Å²	53	47.2 Å²	47.2	25%	0.248	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.1	-177.8	-49.4	-178.8	163.5	0	0	110.3	I380 R381 H405 I486 L487 K488	I380-E403 CarbonylContact C-O 3.56Å; I380-E403 WeakPolarHBondContact CA-O 3.4Å; R381-E403 HydrophobicContact CB-CB 4.26Å; R381-E403 PolarHBondContact N-O 2.69Å; R381-E403 PolarHBondContact O-N 3.37Å; E403-H405 IonicContact OE2-CD2 2.67Å; E403-H405 IonicContact OE2-CE1 2.66Å; E403-H405 IonicContact OE2-NE2 2.65Å; E403-H405 PolarHBondContact OE2-NE2 2.88Å; E403-I486 HydrophobicContact CB-CG2 3.9Å; E403-I486 HydrophobicContact CG-CG2 4.39Å; E403-L487 CarbonylContact C-O 3.5Å; E403-L487 VanDerWaalsContact CA-O 3.25Å; E403-L487 WeakPolarHBondContact CA-O 3.37Å; E403-K488 HydrophobicContact CG-CD 3.95Å; E403-K488 IonicContact OE1-NZ 3.96Å; E403-K488 PolarHBondContact OE1-NZ 3.18Å
404	L	98.3	Very high	92.8	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.1	163.9	171.1	55.5	0	0	0	108.6	I380 L406 I486 L487 L489 V500 I503	I380-L404 HydrophobicContact CD1-CB 4.2Å; I380-L404 HydrophobicContact CD1-CD1 4.26Å; L404-L406 HydrophobicContact CD1-CD2 4.49Å; L404-L406 HydrophobicContact CD2-CD2 4.11Å; L404-L406 HydrophobicContact CG-CD2 4.07Å; L404-I486 CarbonylContact O-C 3.57Å; L404-I486 WeakPolarHBondContact O-CA 3.19Å; L404-L487 HydrophobicContact CB-CB 4.24Å; L404-L487 HydrophobicContact CD2-CD1 4.16Å; L404-L487 PolarHBondContact N-O 3.33Å; L404-L487 PolarHBondContact O-N 3.25Å; L404-L489 HydrophobicContact CB-CD1 3.83Å; L404-V500 HydrophobicContact CD1-CB 3.94Å; L404-V500 HydrophobicContact CD1-CG1 4.38Å; L404-V500 HydrophobicContact CD1-CG2 3.59Å; L404-V500 HydrophobicContact CD2-CG1 4.17Å; L404-V500 HydrophobicContact CD2-CG2 4.44Å; L404-I503 HydrophobicContact CD2-CG2 3.62Å
405	H	97.6	Very high	93	Very high	54 Å²	54	50.9 Å²	50.9	25%	0.25	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	108.2	174.9	-72.9	-126.3	0	0	0	108.4	G378 V379 E403	G378-H405 CarbonylContact C-O 3.59Å; G378-H405 WeakPolarHBondContact CA-O 3.43Å; V379-H405 PolarHBondContact N-O 2.61Å; V379-H405 PolarHBondContact O-N 3.01Å; E403-H405 IonicContact OE2-CD2 2.67Å; E403-H405 IonicContact OE2-CE1 2.66Å; E403-H405 IonicContact OE2-NE2 2.65Å; E403-H405 PolarHBondContact OE2-NE2 2.88Å
406	L	95.9	Very high	93.2	Very high	15 Å²	15	49.3 Å²	49.3	8%	0.079	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	139.5	173	-61.7	-173.7	0	0	0	109.5	I377 L404 N411 V416 V485	I377-L406 HydrophobicContact CD1-CD2 4.41Å; I377-L406 WeakPolarHBondContact O-CA 3.42Å; L404-L406 HydrophobicContact CD1-CD2 4.49Å; L404-L406 HydrophobicContact CD2-CD2 4.11Å; L404-L406 HydrophobicContact CG-CD2 4.07Å; L406-N411 HydrophobicContact CB-CB 4.17Å; L406-N411 WeakPolarHBondContact O-CB 3.46Å; L406-V416 HydrophobicContact CD1-CG1 3.73Å; L406-V485 HydrophobicContact CB-CB 4.27Å; L406-V485 HydrophobicContact CD1-CB 4.06Å; L406-V485 HydrophobicContact CD1-CG1 3.68Å; L406-V485 HydrophobicContact CG-CB 4.41Å; L406-V485 HydrophobicContact CG-CG1 4.25Å; L406-V485 PolarHBondContact N-O 3.35Å
407	I	90.4	Very high	93.3	Very high	34 Å²	34	56.9 Å²	56.9	17%	0.174	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-103.8	156.2	179	65.4	175.4	0	0	0	110.4	K351 Q376 I377 V379 Y410 N411	K351-I407 HydrophobicContact CB-CD1 4.3Å; Q376-I407 HydrophobicContact CB-CD1 4.29Å; Q376-I407 HydrophobicContact CG-CD1 3.99Å; Q376-I407 VanDerWaalsContact O-CD1 3.29Å; Q376-I407 WeakPolarHBondContact O-CD1 3.29Å; Q376-I407 WeakPolarHBondContact O-CG1 3.15Å; I377-I407 PolarHBondContact O-N 2.78Å; V379-I407 HydrophobicContact CG2-CG2 4.25Å; I407-Y410 WeakPolarHBondContact O-CA 3.24Å; I407-Y410 WeakPolarHBondContact O-CB 3.29Å; I407-Y410 WeakPolarHBondContact O-CD2 3.4Å; I407-Y410 PolarHBondContact O-N 2.83Å; I407-N411 PolarHBondContact O-N 2.86Å
408	A	86.2	Confident	93.5	Very high	70 Å²	70	58.6 Å²	58.6	58%	0.579	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	141.2	176.9	0	0	0	0	0	111.8	N411	A408-N411 WeakPolarHBondContact CA-OD1 3.21Å
409	P	90.7	Very high	93.6	Very high	83 Å²	83	52.4 Å²	52.4	54%	0.539	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.1	6.9	4.7	37	-37.1	0	0	0	115.1	N411 Q412	P409-N411 VanDerWaalsContact C-N 3.33Å; P409-Q412 WeakPolarHBondContact O-CG 3.3Å; P409-Q412 PolarHBondContact O-NE2 2.96Å
410	Y	91.2	Very high	93.7	Very high	78 Å²	78	57.3 Å²	57.3	31%	0.306	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-11.7	-174.2	-47.4	-74.6	0	0	0	114	E375 I377 I407 Q412	E375-Y410 HydrophobicContact CB-CE2 4.36Å; E375-Y410 WeakPolarHBondContact CB-OH 3.36Å; E375-Y410 WeakPolarHBondContact CG-OH 3.46Å; I377-Y410 HydrophobicContact CB-CD2 3.94Å; I377-Y410 HydrophobicContact CB-CE2 4.41Å; I377-Y410 HydrophobicContact CB-CG 3.98Å; I377-Y410 HydrophobicContact CG2-CD1 4.05Å; I377-Y410 HydrophobicContact CG2-CD2 3.96Å; I377-Y410 HydrophobicContact CG2-CE1 4.1Å; I377-Y410 HydrophobicContact CG2-CE2 4Å; I377-Y410 HydrophobicContact CG2-CG 3.97Å; I407-Y410 WeakPolarHBondContact O-CA 3.24Å; I407-Y410 WeakPolarHBondContact O-CB 3.29Å; I407-Y410 WeakPolarHBondContact O-CD2 3.4Å; I407-Y410 PolarHBondContact O-N 2.83Å; Y410-Q412 PolarHBondContact O-N 2.88Å
411	N	92.5	Very high	93.9	Very high	37 Å²	37	61.5 Å²	61.5	20%	0.198	35%	0.353	C	S	.	.			trans	-75	41.7	177.3	68.3	-29.9	0	0	0	113.5	L406 I407 A408 P409 D483 V485	L406-N411 HydrophobicContact CB-CB 4.17Å; L406-N411 WeakPolarHBondContact O-CB 3.46Å; I407-N411 PolarHBondContact O-N 2.86Å; A408-N411 WeakPolarHBondContact CA-OD1 3.21Å; P409-N411 VanDerWaalsContact C-N 3.33Å; N411-D483 PolarHBondContact ND2-O 2.87Å; N411-V485 VanDerWaalsContact C-CG2 3.47Å; N411-V485 WeakPolarHBondContact O-CG2 3.47Å
412	Q	91.1	Very high	94	Very high	113 Å²	113	62 Å²	62	53%	0.528	35%	0.353	S	S	.	.			trans	-102.7	132.9	177.8	-64.1	-176	16	0	0	110.3	P409 Y410 D414 A415	P409-Q412 WeakPolarHBondContact O-CG 3.3Å; P409-Q412 PolarHBondContact O-NE2 2.96Å; Y410-Q412 PolarHBondContact O-N 2.88Å; Q412-D414 PolarHBondContact O-N 3.18Å; Q412-D414 VanDerWaalsContact O-N 3.17Å; Q412-A415 WeakPolarHBondContact O-CB 3.31Å; Q412-A415 PolarHBondContact O-N 3.37Å
413	A	91.4	Very high	94.1	Very high	51 Å²	51	65.3 Å²	65.3	42%	0.421	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-56.7	-33.7	179.4	0	0	0	0	0	112.5	A415 V416 R417 C480	A413-A415 VanDerWaalsContact C-N 3.26Å; A413-A415 PolarHBondContact O-N 3.05Å; A413-V416 WeakPolarHBondContact O-CG2 3.4Å; A413-V416 PolarHBondContact O-N 2.76Å; A413-R417 PolarHBondContact O-N 2.96Å; A413-C480 HydrophobicContact CB-CB 4.19Å
414	D	91.6	Very high	94.1	Very high	106 Å²	106	66 Å²	66	57%	0.567	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-64.8	-27.8	177.2	-72.4	-14.6	0	0	0	113.2	Q412 V416 R417	Q412-D414 PolarHBondContact O-N 3.18Å; Q412-D414 VanDerWaalsContact O-N 3.17Å; D414-V416 VanDerWaalsContact C-N 3.26Å; D414-V416 PolarHBondContact O-N 3.46Å; D414-R417 IonicContact OD1-CZ 3.46Å; D414-R417 IonicContact OD1-NE 3.87Å; D414-R417 IonicContact OD1-NH2 2.89Å; D414-R417 PolarHBondContact OD1-NH2 3.27Å
415	A	92	Very high	94	Very high	73 Å²	73	66 Å²	66	60%	0.603	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-72	-19.7	178.8	0	0	0	0	0	113.3	Q412 A413	Q412-A415 WeakPolarHBondContact O-CB 3.31Å; Q412-A415 PolarHBondContact O-N 3.37Å; A413-A415 VanDerWaalsContact C-N 3.26Å; A413-A415 PolarHBondContact O-N 3.05Å
416	V	95.3	Very high	94	Very high	6 Å²	6	65.8 Å²	65.8	4%	0.036	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-115.7	6.4	-179.2	-62.3	0	0	0	0	113.1	L406 A413 D414 G418 L419 V478 V485 L487	L406-V416 HydrophobicContact CD1-CG1 3.73Å; A413-V416 WeakPolarHBondContact O-CG2 3.4Å; A413-V416 PolarHBondContact O-N 2.76Å; D414-V416 VanDerWaalsContact C-N 3.26Å; D414-V416 PolarHBondContact O-N 3.46Å; V416-G418 PolarHBondContact O-N 3.35Å; V416-L419 HydrophobicContact CB-CB 4.49Å; V416-L419 HydrophobicContact CB-CD2 4.32Å; V416-L419 HydrophobicContact CG1-CD2 4.37Å; V416-L419 WeakPolarHBondContact O-CB 3.4Å; V416-L419 PolarHBondContact O-N 3.03Å; V416-V478 HydrophobicContact CB-CG1 4.24Å; V416-V478 HydrophobicContact CG2-CG1 3.74Å; V416-V485 HydrophobicContact CB-CG1 4.31Å; V416-V485 HydrophobicContact CG1-CG1 3.78Å; V416-V485 HydrophobicContact CG2-CG1 3.64Å; V416-L487 HydrophobicContact CG1-CD2 4.34Å
417	R	94.2	Very high	94.1	Very high	192 Å²	192	65.1 Å²	65.1	73%	0.725	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	123.3	-178.6	-178.1	-176.5	-67.6	-172.9	-0.3	111	A413 D414 L419	A413-R417 PolarHBondContact O-N 2.96Å; D414-R417 IonicContact OD1-CZ 3.46Å; D414-R417 IonicContact OD1-NE 3.87Å; D414-R417 IonicContact OD1-NH2 2.89Å; D414-R417 PolarHBondContact OD1-NH2 3.27Å; R417-L419 VanDerWaalsContact C-N 3.29Å
418	G	95.6	Very high	94.4	Very high	38 Å²	38	66 Å²	66	39%	0.392	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	0.9	177.8	0	0	0	0	0	113.6	V416 E420 A421	V416-G418 PolarHBondContact O-N 3.35Å; G418-E420 WeakPolarHBondContact CA-OE2 3.19Å; G418-E420 PolarHBondContact N-OE2 2.82Å; G418-E420 VanDerWaalsContact N-OE2 3.14Å; G418-E420 PolarHBondContact O-N 2.93Å; G418-A421 WeakPolarHBondContact O-CB 3.48Å; G418-A421 PolarHBondContact O-N 2.9Å; G418-A421 VanDerWaalsContact O-N 3.17Å
419	L	96.7	Very high	94.8	Very high	19 Å²	19	63.1 Å²	63.1	10%	0.099	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-64.4	-26.6	174.8	-161.4	66.6	0	0	0	111.5	V416 R417 A421 F422 L425 L475 V478 L487 I503	V416-L419 HydrophobicContact CB-CB 4.49Å; V416-L419 HydrophobicContact CB-CD2 4.32Å; V416-L419 HydrophobicContact CG1-CD2 4.37Å; V416-L419 WeakPolarHBondContact O-CB 3.4Å; V416-L419 PolarHBondContact O-N 3.03Å; R417-L419 VanDerWaalsContact C-N 3.29Å; L419-A421 PolarHBondContact O-N 3.27Å; L419-A421 VanDerWaalsContact O-N 3.14Å; L419-F422 PolarHBondContact O-N 2.61Å; L419-L425 HydrophobicContact CD1-CD2 3.54Å; L419-L425 HydrophobicContact CD2-CD1 4Å; L419-L425 HydrophobicContact CD2-CD2 4.24Å; L419-L425 HydrophobicContact CG-CD1 4.48Å; L419-L425 HydrophobicContact CG-CD2 3.94Å; L419-L475 HydrophobicContact CB-CD2 4.49Å; L419-L475 HydrophobicContact CD2-CD2 4.28Å; L419-L475 HydrophobicContact CG-CD2 3.85Å; L419-L475 VanDerWaalsContact O-CD2 3.29Å; L419-L475 WeakPolarHBondContact O-CD2 3.11Å; L419-V478 HydrophobicContact CB-CG2 4.37Å; L419-L487 HydrophobicContact CD2-CD1 3.81Å; L419-L487 HydrophobicContact CD2-CD2 4.14Å; L419-I503 HydrophobicContact CD2-CD1 4.23Å
420	E	95.8	Very high	94.8	Very high	112 Å²	112	60 Å²	60	52%	0.523	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-61.2	-17.7	175	-54.7	83.5	173.7	0	0	113.4	G418 F422 V478	G418-E420 WeakPolarHBondContact CA-OE2 3.19Å; G418-E420 PolarHBondContact N-OE2 2.82Å; G418-E420 VanDerWaalsContact N-OE2 3.14Å; G418-E420 PolarHBondContact O-N 2.93Å; E420-F422 PolarHBondContact O-N 3.09Å; E420-V478 HydrophobicContact CG-CB 3.93Å; E420-V478 HydrophobicContact CG-CG2 3.72Å; E420-V478 WeakPolarHBondContact OE1-CB 2.92Å
421	A	96.7	Very high	94.7	Very high	88 Å²	88	58.1 Å²	58.1	73%	0.727	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-76.3	-4.9	174.9	0	0	0	0	0	113.2	G418 L419	G418-A421 WeakPolarHBondContact O-CB 3.48Å; G418-A421 PolarHBondContact O-N 2.9Å; G418-A421 VanDerWaalsContact O-N 3.17Å; L419-A421 PolarHBondContact O-N 3.27Å; L419-A421 VanDerWaalsContact O-N 3.14Å
422	F	97.7	Very high	94.4	Very high	71 Å²	71	58.9 Å²	58.9	31%	0.311	33%	0.325	S	S	.	.			trans	-114.2	134.6	179.8	-59.2	-89.3	0	0	0	110.6	L419 E420 P505 L507	L419-F422 PolarHBondContact O-N 2.61Å; E420-F422 PolarHBondContact O-N 3.09Å; F422-P505 HydrophobicContact CB-CB 4.25Å; F422-P505 HydrophobicContact CD1-CB 3.4Å; F422-P505 VanDerWaalsContact CD1-CB 3.4Å; F422-P505 HydrophobicContact CD2-CB 3.84Å; F422-P505 HydrophobicContact CE1-CB 3.55Å; F422-P505 HydrophobicContact CE1-CG 4.21Å; F422-P505 HydrophobicContact CE2-CB 3.97Å; F422-P505 HydrophobicContact CE2-CG 4.44Å; F422-P505 HydrophobicContact CG-CB 3.55Å; F422-P505 HydrophobicContact CZ-CB 3.83Å; F422-P505 HydrophobicContact CZ-CG 4.17Å; F422-L507 HydrophobicContact CE1-CD2 3.97Å
423	S	96.6	Very high	94.1	Very high	77 Å²	77	57.3 Å²	57.3	54%	0.538	32%	0.317	S	S	.	.	S	Bend	trans	-81.1	-20.4	177.7	57.7	0	0	0	0	113.6	L475	S423-L475 PolarHBondContact O-N 2.63Å
424	H	97.7	Very high	93.5	Very high	68 Å²	68	55.8 Å²	55.8	32%	0.315	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.3	-174.5	-65.3	74	0	0	0	112	L472 V473 Y506	H424-L472 HydrophobicContact CB-CD1 3.87Å; H424-V473 CarbonylContact C-O 3.56Å; H424-V473 VanDerWaalsContact CA-O 3.22Å; H424-V473 WeakPolarHBondContact CA-O 3.35Å; H424-V473 WeakPolarHBondContact CB-O 3.35Å; H424-Y506 HydrophobicContact CB-CG 4.32Å; H424-Y506 WeakPolarHBondContact O-CB 3.49Å; H424-Y506 PolarHBondContact O-N 2.75Å
425	L	97.6	Very high	92.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141.8	177	-59	177.3	0	0	0	110.8	L419 L472 V473 L475 L487 K504	L419-L425 HydrophobicContact CD1-CD2 3.54Å; L419-L425 HydrophobicContact CD2-CD1 4Å; L419-L425 HydrophobicContact CD2-CD2 4.24Å; L419-L425 HydrophobicContact CG-CD1 4.48Å; L419-L425 HydrophobicContact CG-CD2 3.94Å; L425-L472 WeakPolarHBondContact O-CA 3.24Å; L425-V473 HydrophobicContact CB-CG2 4.38Å; L425-V473 PolarHBondContact N-O 3.4Å; L425-V473 PolarHBondContact O-N 3.25Å; L425-L475 HydrophobicContact CD1-CB 4.26Å; L425-L475 HydrophobicContact CD1-CD1 4Å; L425-L475 HydrophobicContact CD1-CD2 4.17Å; L425-L475 HydrophobicContact CD1-CG 4.38Å; L425-L475 HydrophobicContact CD2-CD2 4.42Å; L425-L475 HydrophobicContact CG-CB 4.13Å; L425-L475 HydrophobicContact CG-CD2 4.33Å; L425-L487 HydrophobicContact CD1-CD1 3.75Å; L425-K504 CarbonylContact C-O 3.48Å; L425-K504 WeakPolarHBondContact CA-O 3.42Å
426	W	97.6	Very high	91.5	Very high	51 Å²	51	58.6 Å²	58.6	19%	0.193	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	130.7	154	-73.2	114.1	0	0	0	109.9	M470 S471 L472 I503 K504 Y506 E511	W426-M470 HydrophobicContact CD2-CE 3.99Å; W426-M470 HydrophobicContact CE3-CB 4.48Å; W426-M470 HydrophobicContact CE3-CE 3.51Å; W426-M470 HydrophobicContact CH2-CE 3.56Å; W426-M470 HydrophobicContact CZ2-CE 4.01Å; W426-M470 HydrophobicContact CZ3-CE 3.27Å; W426-M470 HydrophobicContact CZ3-CG 4.39Å; W426-S471 CarbonylContact C-O 3.53Å; W426-S471 WeakPolarHBondContact CA-O 3.25Å; W426-L472 HydrophobicContact CD2-CB 4.45Å; W426-L472 HydrophobicContact CD2-CD1 4.3Å; W426-L472 HydrophobicContact CE3-CB 3.91Å; W426-L472 HydrophobicContact CH2-CB 3.78Å; W426-L472 HydrophobicContact CH2-CD2 4.41Å; W426-L472 HydrophobicContact CZ2-CB 4.35Å; W426-L472 HydrophobicContact CZ2-CD1 4.44Å; W426-L472 HydrophobicContact CZ2-CD2 4.46Å; W426-L472 HydrophobicContact CZ3-CB 3.54Å; W426-I503 CarbonylContact O-C 3.56Å; W426-I503 VanDerWaalsContact O-CA 3.24Å; W426-I503 WeakPolarHBondContact O-CA 3.17Å; W426-K504 HydrophobicContact CB-CB 4.28Å; W426-K504 PolarHBondContact N-O 3.38Å; W426-K504 PolarHBondContact O-N 2.85Å; W426-Y506 HydrophobicContact CZ2-CD2 4.24Å; W426-Y506 HydrophobicContact CZ2-CE2 4.18Å; W426-Y506 AromaticContact NE1-CD2 3.58Å; W426-E511 VanDerWaalsContact CD1-OE1 3.29Å; W426-E511 PolarHBondContact NE1-OE1 3.46Å; W426-E511 PolarHBondContact NE1-OE2 2.93Å; W426-E511 VanDerWaalsContact NE1-OE2 3.09Å
427	I	97.4	Very high	90.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122	169	-62.6	-174.9	0	0	0	108	I380 F429 M470 S471 V473 L489 L494 V500 I503	I380-I427 HydrophobicContact CD1-CD1 4.29Å; I427-F429 HydrophobicContact CG2-CB 4.3Å; I427-F429 HydrophobicContact CG2-CD1 4.4Å; I427-M470 CarbonylContact O-C 3.55Å; I427-M470 VanDerWaalsContact O-CA 3.25Å; I427-M470 WeakPolarHBondContact O-CA 3.27Å; I427-S471 PolarHBondContact N-O 3.22Å; I427-S471 PolarHBondContact O-N 3.05Å; I427-V473 HydrophobicContact CD1-CG1 4.44Å; I427-V473 HydrophobicContact CD1-CG2 3.5Å; I427-V473 HydrophobicContact CG1-CG2 3.88Å; I427-L489 HydrophobicContact CD1-CD1 3.52Å; I427-L494 HydrophobicContact CG2-CD1 4.28Å; I427-V500 HydrophobicContact CG2-CB 4.44Å; I427-V500 HydrophobicContact CG2-CG1 3.87Å; I427-V500 HydrophobicContact CG2-CG2 3.74Å; I427-I503 HydrophobicContact CG1-CG2 4.23Å
428	L	96.8	Very high	89.2	Confident	52 Å²	52	53 Å²	53	27%	0.272	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.7	168.1	-60.8	-174.2	0	0	0	108.9	M470 V501 D502	L428-M470 HydrophobicContact CD2-CB 3.67Å; L428-V501 PolarHBondContact O-N 2.96Å; L428-D502 HydrophobicContact CB-CB 4.2Å; L428-D502 HydrophobicContact CD1-CB 4.12Å; L428-D502 HydrophobicContact CG-CB 4.42Å; L428-D502 PolarHBondContact N-O 3.13Å; L428-D502 PolarHBondContact O-N 2.92Å
429	F	94.3	Very high	88.7	Confident	11 Å²	11	57.9 Å²	57.9	5%	0.048	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	165.5	-170.1	65.8	-91.9	0	0	0	112.3	I427 F431 I468 G469 M470 L494 T498 P499	I427-F429 HydrophobicContact CG2-CB 4.3Å; I427-F429 HydrophobicContact CG2-CD1 4.4Å; F429-F431 HydrophobicContact CD2-CD1 4.46Å; F429-F431 AromaticContact CE2-CD1 3.62Å; F429-F431 HydrophobicContact CE2-CD1 3.62Å; F429-F431 AromaticContact CE2-CE1 3.4Å; F429-F431 HydrophobicContact CE2-CE1 3.4Å; F429-F431 VanDerWaalsContact CE2-CE1 3.4Å; F429-F431 HydrophobicContact CE2-CG 4.42Å; F429-F431 HydrophobicContact CE2-CZ 4.06Å; F429-F431 HydrophobicContact CZ-CD1 4.42Å; F429-F431 AromaticContact CZ-CE1 3.76Å; F429-F431 HydrophobicContact CZ-CE1 3.76Å; F429-F431 HydrophobicContact CZ-CZ 4.15Å; F429-I468 CarbonylContact O-C 3.41Å; F429-I468 VanDerWaalsContact O-CA 3.31Å; F429-I468 WeakPolarHBondContact O-CA 3.42Å; F429-G469 VanDerWaalsContact CE1-C 3.42Å; F429-G469 PolarHBondContact N-O 3.22Å; F429-G469 VanDerWaalsContact N-O 3.09Å; F429-G469 PolarHBondContact O-N 3.38Å; F429-M470 VanDerWaalsContact CE1-N 3.35Å; F429-L494 HydrophobicContact CD1-CD1 4.37Å; F429-L494 HydrophobicContact CD1-CD2 3.64Å; F429-L494 HydrophobicContact CD2-CD2 3.86Å; F429-L494 HydrophobicContact CE1-CD2 3.36Å; F429-L494 HydrophobicContact CE2-CD2 3.59Å; F429-L494 HydrophobicContact CG-CD2 3.88Å; F429-L494 HydrophobicContact CZ-CD2 3.33Å; F429-T498 HydrophobicContact CB-CG2 3.69Å; F429-T498 HydrophobicContact CD2-CG2 3.66Å; F429-T498 HydrophobicContact CG-CG2 3.96Å; F429-P499 CarbonylContact C-O 3.54Å; F429-P499 VanDerWaalsContact CA-O 3.26Å; F429-P499 WeakPolarHBondContact CA-O 3.19Å; F429-P499 WeakPolarHBondContact CB-O 3.49Å
430	V	91.5	Very high	88.1	Confident	16 Å²	16	63 Å²	63	10%	0.097	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.4	178.1	-174.3	0	0	0	0	110.4	H432 M435 P467 P499 V501	V430-H432 PolarHBondContact O-N 2.89Å; V430-M435 HydrophobicContact CG1-CE 4.31Å; V430-M435 HydrophobicContact CG1-CG 4.31Å; V430-M435 HydrophobicContact CG1-SD 3.48Å; V430-M435 WeakPolarHBondContact CG1-SD 3.46Å; V430-P467 CarbonylContact C-O 3.52Å; V430-P467 WeakPolarHBondContact CA-O 3.22Å; V430-P467 HydrophobicContact CG1-CB 4.48Å; V430-P467 HydrophobicContact CG1-CG 4.11Å; V430-P499 HydrophobicContact CB-CB 4.3Å; V430-P499 HydrophobicContact CG2-CB 4.41Å; V430-P499 PolarHBondContact N-O 2.88Å; V430-V501 HydrophobicContact CG2-CG2 3.66Å
431	F	89.6	Confident	87.7	Confident	39 Å²	39	61.2 Å²	61.2	17%	0.171	33%	0.327	C	S	.	.			trans	-70.8	58.8	169.3	-64.4	-63.3	0	0	0	111.6	F429 Q433 T434 M435 T462 P467	F429-F431 HydrophobicContact CD2-CD1 4.46Å; F429-F431 AromaticContact CE2-CD1 3.62Å; F429-F431 HydrophobicContact CE2-CD1 3.62Å; F429-F431 AromaticContact CE2-CE1 3.4Å; F429-F431 HydrophobicContact CE2-CE1 3.4Å; F429-F431 VanDerWaalsContact CE2-CE1 3.4Å; F429-F431 HydrophobicContact CE2-CG 4.42Å; F429-F431 HydrophobicContact CE2-CZ 4.06Å; F429-F431 HydrophobicContact CZ-CD1 4.42Å; F429-F431 AromaticContact CZ-CE1 3.76Å; F429-F431 HydrophobicContact CZ-CE1 3.76Å; F429-F431 HydrophobicContact CZ-CZ 4.15Å; F431-Q433 VanDerWaalsContact C-N 3.3Å; F431-Q433 PolarHBondContact O-N 2.94Å; F431-T434 WeakPolarHBondContact CB-OG1 3.49Å; F431-T434 PolarHBondContact O-N 3Å; F431-T434 PolarHBondContact O-OG1 2.95Å; F431-M435 WeakPolarHBondContact O-CG 3.35Å; F431-M435 PolarHBondContact O-N 3.17Å; F431-T462 HydrophobicContact CB-CG2 4.3Å; F431-T462 HydrophobicContact CD1-CG2 3.45Å; F431-T462 VanDerWaalsContact CD1-CG2 3.45Å; F431-T462 HydrophobicContact CD2-CG2 4.12Å; F431-T462 HydrophobicContact CE1-CG2 3.63Å; F431-T462 HydrophobicContact CE2-CG2 4.26Å; F431-T462 HydrophobicContact CG-CG2 3.72Å; F431-T462 HydrophobicContact CZ-CG2 4.03Å; F431-P467 HydrophobicContact CB-CB 4.3Å; F431-P467 WeakPolarHBondContact CD2-O 3.38Å; F431-P467 PolarHBondContact N-O 2.9Å
432	H	85.8	Confident	87.4	Confident	54 Å²	54	59.3 Å²	59.3	25%	0.25	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-53.4	-42	-168.3	65.5	-66.9	0	0	0	113.6	V430 T434 M435 T498 P499	V430-H432 PolarHBondContact O-N 2.89Å; H432-T434 VanDerWaalsContact C-N 3.27Å; H432-T434 PolarHBondContact O-N 2.91Å; H432-M435 HydrophobicContact CB-SD 4.39Å; H432-M435 WeakPolarHBondContact O-CG 3.26Å; H432-M435 PolarHBondContact O-N 2.88Å; H432-T498 VanDerWaalsContact CE1-CA 3.47Å; H432-T498 WeakPolarHBondContact CE1-CA 3.22Å; H432-T498 PolarHBondContact CE1-OG1 2.96Å; H432-T498 VanDerWaalsContact CE1-OG1 3.27Å; H432-P499 HydrophobicContact CB-CG 4.02Å
433	Q	84.4	Confident	87	Confident	80 Å²	80	56.7 Å²	56.7	37%	0.374	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-75	-9.6	-179.1	-61.8	-170.8	-11.6	0	0	114.3	K387 F431	K387-Q433 HydrophobicContact CD-CB 4.35Å; K387-Q433 WeakPolarHBondContact CE-O 3.47Å; K387-Q433 HydrophobicContact CG-CB 4.48Å; K387-Q433 VanDerWaalsContact NZ-C 3.28Å; K387-Q433 PolarHBondContact NZ-O 2.62Å; F431-Q433 VanDerWaalsContact C-N 3.3Å; F431-Q433 PolarHBondContact O-N 2.94Å
434	T	78.7	Confident	86.5	Confident	19 Å²	19	60 Å²	60	12%	0.117	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-110.1	0.4	177	58.4	0	0	0	0	113.5	K387 F431 H432 E436 G437 T462	K387-T434 HydrophobicContact CD-CG2 4.11Å; K387-T434 VanDerWaalsContact NZ-CG2 3.3Å; F431-T434 WeakPolarHBondContact CB-OG1 3.49Å; F431-T434 PolarHBondContact O-N 3Å; F431-T434 PolarHBondContact O-OG1 2.95Å; H432-T434 VanDerWaalsContact C-N 3.27Å; H432-T434 PolarHBondContact O-N 2.91Å; T434-E436 VanDerWaalsContact C-N 3.26Å; T434-E436 PolarHBondContact O-N 3.18Å; T434-G437 PolarHBondContact O-N 3.34Å; T434-T462 HydrophobicContact CG2-CG2 4.32Å; T434-T462 VanDerWaalsContact OG1-CB 3.3Å; T434-T462 WeakPolarHBondContact OG1-CB 3.26Å
435	M	73	Confident	85.7	Confident	51 Å²	51	57.4 Å²	57.4	25%	0.251	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-59.7	-38	-173.9	-66.9	179	63.9	0	0	112.5	I302 V430 F431 H432 G437 G438 P467	I302-M435 HydrophobicContact CB-CE 4.34Å; I302-M435 HydrophobicContact CD1-CE 3.21Å; I302-M435 HydrophobicContact CG1-CE 4.32Å; I302-M435 HydrophobicContact CG2-CE 3.93Å; V430-M435 HydrophobicContact CG1-CE 4.31Å; V430-M435 HydrophobicContact CG1-CG 4.31Å; V430-M435 HydrophobicContact CG1-SD 3.48Å; V430-M435 WeakPolarHBondContact CG1-SD 3.46Å; F431-M435 WeakPolarHBondContact O-CG 3.35Å; F431-M435 PolarHBondContact O-N 3.17Å; H432-M435 HydrophobicContact CB-SD 4.39Å; H432-M435 WeakPolarHBondContact O-CG 3.26Å; H432-M435 PolarHBondContact O-N 2.88Å; M435-G437 PolarHBondContact O-N 2.67Å; M435-G438 PolarHBondContact O-N 3.19Å; M435-P467 HydrophobicContact CE-CG 4.16Å; M435-P467 HydrophobicContact CG-CB 4.14Å; M435-P467 HydrophobicContact CG-CG 3.99Å; M435-P467 HydrophobicContact SD-CG 4.42Å
436	E	68	Low	84.7	Confident	187 Å²	187	60 Å²	60	87%	0.874	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-64.4	-23.2	178.8	-63.9	-179.8	172.9	0	0	113.1	T434 G438	T434-E436 VanDerWaalsContact C-N 3.26Å; T434-E436 PolarHBondContact O-N 3.18Å; E436-G438 PolarHBondContact O-N 2.98Å
437	G	69.1	Low	83.6	Confident	40 Å²	40	62.3 Å²	62.3	41%	0.412	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-76.2	-2.4	-179.3	0	0	0	0	0	115	T434 M435	T434-G437 PolarHBondContact O-N 3.34Å; M435-G437 PolarHBondContact O-N 2.67Å
438	G	73	Confident	82.5	Confident	40 Å²	40	65 Å²	65	41%	0.412	33%	0.325	S	S	.	.			trans	68.3	176.3	180	0	0	0	0	0	114.1	M435 E436 F463	M435-G438 PolarHBondContact O-N 3.19Å; E436-G438 PolarHBondContact O-N 2.98Å; G438-F463 WeakPolarHBondContact O-CD1 3.25Å
439	W	84.2	Confident	81.1	Confident	140 Å²	140	65.2 Å²	65.2	53%	0.53	34%	0.341	S	S	.	.			trans	-92.4	156	174.3	85	-78.7	0	0	0	111	P441 F463 R464 P465	W439-P441 HydrophobicContact CH2-CB 4.03Å; W439-P441 HydrophobicContact CZ3-CB 3.79Å; W439-P441 HydrophobicContact CZ3-CG 4.49Å; W439-F463 CarbonylContact C-O 3.51Å; W439-F463 WeakPolarHBondContact CA-O 3.05Å; W439-R464 VanDerWaalsContact CB-C 3.47Å; W439-P465 HydrophobicContact CB-CG 4.42Å; W439-P465 HydrophobicContact CD2-CG 3.87Å; W439-P465 HydrophobicContact CE3-CG 3.58Å; W439-P465 HydrophobicContact CG-CG 4.23Å; W439-P465 HydrophobicContact CZ3-CG 4.09Å
440	R	83.8	Confident	79.7	Confident	126 Å²	126	65.9 Å²	65.9	48%	0.475	35%	0.351	S	S	.	.			trans	-134	136.3	176.2	-60.3	-179.9	-176.4	-163.2	-2.7	109.3	T442 V443 V456 F463	R440-T442 PolarHBondContact O-N 2.89Å; R440-V443 HydrophobicContact CB-CG1 4.45Å; R440-V456 WeakPolarHBondContact O-CB 3.27Å; R440-V456 VanDerWaalsContact O-CG1 3.29Å; R440-V456 WeakPolarHBondContact O-CG1 3.43Å; R440-F463 HydrophobicContact CB-CB 4.26Å; R440-F463 HydrophobicContact CG-CB 4.17Å; R440-F463 PolarHBondContact N-O 2.55Å
441	P	87.9	Confident	78.5	Confident	75 Å²	75	72 Å²	72	49%	0.487	38%	0.382	S	S	.	.	S	Bend	trans	-69.2	-23.9	177.4	26.1	-33.9	0	0	0	112.9	W439 G455 V456	W439-P441 HydrophobicContact CH2-CB 4.03Å; W439-P441 HydrophobicContact CZ3-CB 3.79Å; W439-P441 HydrophobicContact CZ3-CG 4.49Å; P441-G455 CarbonylContact O-C 3.6Å; P441-G455 WeakPolarHBondContact O-CA 3.5Å; P441-V456 PolarHBondContact O-N 3.43Å
442	T	91.5	Very high	78	Confident	48 Å²	48	72.1 Å²	72.1	29%	0.294	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.2	177.1	59.9	0	0	0	0	111.2	R440 R453 M454	R440-T442 PolarHBondContact O-N 2.89Å; T442-R453 PolarHBondContact OG1-NH1 2.96Å; T442-R453 VanDerWaalsContact OG1-NH1 3.08Å; T442-M454 CarbonylContact C-O 3.49Å; T442-M454 WeakPolarHBondContact CA-O 3.38Å
443	V	88.3	Confident	78.1	Confident	17 Å²	17	76.6 Å²	76.6	10%	0.103	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	168.8	179.7	-61.3	0	0	0	0	110	R440 P445 R453 M454 V456 T459 F463	R440-V443 HydrophobicContact CB-CG1 4.45Å; V443-P445 WeakPolarHBondContact O-CD 3.5Å; V443-R453 CarbonylContact O-C 3.54Å; V443-R453 VanDerWaalsContact O-CA 3.29Å; V443-R453 WeakPolarHBondContact O-CA 3.42Å; V443-M454 PolarHBondContact N-O 2.83Å; V443-M454 PolarHBondContact O-N 3.4Å; V443-V456 HydrophobicContact CG1-CG2 4.38Å; V443-T459 HydrophobicContact CG2-CG2 3.5Å; V443-F463 HydrophobicContact CG1-CB 4.36Å
444	R	86.8	Confident	78.3	Confident	146 Å²	146	75.1 Å²	75.1	55%	0.551	40%	0.4	S	S	*	.			trans	-112.1	94.9	177.5	-73	174.1	167.9	177.8	4.2	110	P446 G450 R453	R444-P446 WeakPolarHBondContact O-CD 3.47Å; R444-G450 VanDerWaalsContact CD-O 3.3Å; R444-G450 WeakPolarHBondContact CD-O 3.33Å; R444-R453 HydrophobicContact CG-CG 3.73Å
445	P	80.7	Confident	78.9	Confident	14 Å²	14	75.9 Å²	75.9	9%	0.091	41%	0.411	C	S	.	.			trans	-62.6	129.8	179.8	-23.9	35.5	0	0	0	111.4	V443 R447 L448 M454 T459 Y520	V443-P445 WeakPolarHBondContact O-CD 3.5Å; P445-R447 PolarHBondContact O-N 3.36Å; P445-L448 HydrophobicContact CB-CD1 4.27Å; P445-L448 HydrophobicContact CB-CG 4.36Å; P445-L448 HydrophobicContact CG-CD1 4.07Å; P445-L448 PolarHBondContact O-N 3.12Å; P445-M454 HydrophobicContact CG-CB 3.92Å; P445-M454 HydrophobicContact CG-CG 3.74Å; P445-T459 HydrophobicContact CG-CG2 3.92Å; P445-Y520 HydrophobicContact CB-CE2 4.24Å; P445-Y520 HydrophobicContact CG-CE2 4.38Å
446	P	76.3	Confident	79.7	Confident	54 Å²	54	73.5 Å²	73.5	35%	0.351	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-60.8	-28.4	178.3	-31.1	41.2	0	0	0	113.9	R444 L448 G449 A566	R444-P446 WeakPolarHBondContact O-CD 3.47Å; P446-L448 PolarHBondContact O-N 3.3Å; P446-G449 PolarHBondContact O-N 3.41Å; P446-A566 HydrophobicContact CB-CB 4.4Å
447	R	75	Confident	80.9	Confident	100 Å²	100	72 Å²	72	38%	0.377	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-65.8	-17.6	176.2	-70.9	-171.3	-179.8	-134.6	13.6	113.9	P445 G449 S523	P445-R447 PolarHBondContact O-N 3.36Å; R447-G449 VanDerWaalsContact C-N 3.32Å; R447-S523 PolarHBondContact NH1-O 2.87Å
448	L	73.9	Confident	81.9	Confident	55 Å²	55	72.9 Å²	72.9	29%	0.288	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-98.8	27.4	175.8	-63.3	174.5	0	0	0	111.9	P445 P446 G450 A452 M454 Y520	P445-L448 HydrophobicContact CB-CD1 4.27Å; P445-L448 HydrophobicContact CB-CG 4.36Å; P445-L448 HydrophobicContact CG-CD1 4.07Å; P445-L448 PolarHBondContact O-N 3.12Å; P446-L448 PolarHBondContact O-N 3.3Å; L448-G450 PolarHBondContact O-N 2.81Å; L448-G450 VanDerWaalsContact O-N 3.14Å; L448-A452 HydrophobicContact CB-CB 4Å; L448-A452 HydrophobicContact CD1-CB 4.16Å; L448-M454 HydrophobicContact CD1-CG 3.43Å; L448-M454 VanDerWaalsContact CD1-CG 3.43Å; L448-M454 HydrophobicContact CD1-SD 3.89Å; L448-Y520 HydrophobicContact CD1-CD1 4.41Å; L448-Y520 HydrophobicContact CD1-CG 4.4Å; L448-Y520 HydrophobicContact CD2-CG 4.09Å; L448-Y520 HydrophobicContact CG-CD2 4.41Å; L448-Y520 HydrophobicContact CG-CG 4.31Å
449	G	66.5	Low	82.7	Confident	58 Å²	58	71.6 Å²	71.6	60%	0.598	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	8.2	-179.1	0	0	0	0	0	114.6	P446 R447 N451	P446-G449 PolarHBondContact O-N 3.41Å; R447-G449 VanDerWaalsContact C-N 3.32Å; G449-N451 PolarHBondContact O-N 3.48Å
450	G	65.3	Low	82.9	Confident	25 Å²	25	72.2 Å²	72.2	26%	0.258	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	-7.1	178.3	0	0	0	0	0	115.7	R444 L448	R444-G450 VanDerWaalsContact CD-O 3.3Å; R444-G450 WeakPolarHBondContact CD-O 3.33Å; L448-G450 PolarHBondContact O-N 2.81Å; L448-G450 VanDerWaalsContact O-N 3.14Å
451	N	67.7	Low	83.2	Confident	143 Å²	143	67.3 Å²	67.3	77%	0.765	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-36.5	-178.1	-69.1	-27.1	0	0	0	112.8	G449	G449-N451 PolarHBondContact O-N 3.48Å
452	A	78.8	Confident	83.2	Confident	43 Å²	43	65.6 Å²	65.6	36%	0.355	35%	0.353	S	S	.	.	S	Bend	trans	-76.3	136.9	178.8	0	0	0	0	0	111.8	L448	L448-A452 HydrophobicContact CB-CB 4Å; L448-A452 HydrophobicContact CD1-CB 4.16Å
453	R	87.1	Confident	82.9	Confident	147 Å²	147	66.1 Å²	66.1	56%	0.555	35%	0.351	S	S	*	.			trans	-93.9	139.8	169.2	-80.6	-168.4	178.9	-156.9	8.9	110.4	T442 V443 R444	T442-R453 PolarHBondContact OG1-NH1 2.96Å; T442-R453 VanDerWaalsContact OG1-NH1 3.08Å; V443-R453 CarbonylContact O-C 3.54Å; V443-R453 VanDerWaalsContact O-CA 3.29Å; V443-R453 WeakPolarHBondContact O-CA 3.42Å; R444-R453 HydrophobicContact CG-CG 3.73Å
454	M	88.6	Confident	82.9	Confident	50 Å²	50	67.9 Å²	67.9	25%	0.246	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	147.3	173.1	-64.6	-57	-74.7	0	0	109.7	T442 V443 P445 L448 A458 T459 Y520	T442-M454 CarbonylContact C-O 3.49Å; T442-M454 WeakPolarHBondContact CA-O 3.38Å; V443-M454 PolarHBondContact N-O 2.83Å; V443-M454 PolarHBondContact O-N 3.4Å; P445-M454 HydrophobicContact CG-CB 3.92Å; P445-M454 HydrophobicContact CG-CG 3.74Å; L448-M454 HydrophobicContact CD1-CG 3.43Å; L448-M454 VanDerWaalsContact CD1-CG 3.43Å; L448-M454 HydrophobicContact CD1-SD 3.89Å; M454-A458 HydrophobicContact CE-CB 4.44Å; M454-T459 HydrophobicContact CB-CG2 3.66Å; M454-Y520 HydrophobicContact CE-CD1 4.35Å; M454-Y520 HydrophobicContact CE-CE1 3.74Å; M454-Y520 HydrophobicContact CG-CE1 4.44Å
455	G	91.4	Very high	82.8	Confident	34 Å²	34	63.8 Å²	63.8	35%	0.351	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	138.6	170.6	0	0	0	0	0	110.5	P441 F457 A458 T459	P441-G455 CarbonylContact O-C 3.6Å; P441-G455 WeakPolarHBondContact O-CA 3.5Å; G455-F457 PolarHBondContact O-N 3.46Å; G455-A458 WeakPolarHBondContact O-CA 3.35Å; G455-A458 VanDerWaalsContact O-CB 3.31Å; G455-A458 WeakPolarHBondContact O-CB 3.29Å; G455-A458 PolarHBondContact O-N 3.06Å; G455-T459 WeakPolarHBondContact O-CG2 3.41Å
456	V	90.8	Very high	82.9	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.012	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-56.9	-38	-172.2	65.2	0	0	0	0	113.2	R440 P441 V443 A458 T459 F463 R464	R440-V456 WeakPolarHBondContact O-CB 3.27Å; R440-V456 VanDerWaalsContact O-CG1 3.29Å; R440-V456 WeakPolarHBondContact O-CG1 3.43Å; P441-V456 PolarHBondContact O-N 3.43Å; V443-V456 HydrophobicContact CG1-CG2 4.38Å; V456-A458 VanDerWaalsContact C-N 3.29Å; V456-A458 PolarHBondContact O-N 2.66Å; V456-T459 CarbonylContact O-C 3.53Å; V456-T459 WeakPolarHBondContact O-CA 3.3Å; V456-T459 PolarHBondContact O-N 3.04Å; V456-T459 PolarHBondContact O-OG1 2.83Å; V456-F463 WeakPolarHBondContact CG2-O 3.06Å; V456-R464 HydrophobicContact CG2-CB 4.03Å
457	F	91.4	Very high	83.4	Confident	156 Å²	156	66 Å²	66	68%	0.684	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-73.5	-19.4	177	-58.1	-48	0	0	0	113.8	G455 T459 P465	G455-F457 PolarHBondContact O-N 3.46Å; F457-T459 PolarHBondContact O-N 3.15Å; F457-P465 HydrophobicContact CE1-CG 4.2Å; F457-P465 HydrophobicContact CZ-CG 3.84Å
458	A	91.3	Very high	84.2	Confident	58 Å²	58	63.8 Å²	63.8	48%	0.479	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-79	3.8	168.5	0	0	0	0	0	111.8	M454 G455 V456 Y520	M454-A458 HydrophobicContact CE-CB 4.44Å; G455-A458 WeakPolarHBondContact O-CA 3.35Å; G455-A458 VanDerWaalsContact O-CB 3.31Å; G455-A458 WeakPolarHBondContact O-CB 3.29Å; G455-A458 PolarHBondContact O-N 3.06Å; V456-A458 VanDerWaalsContact C-N 3.29Å; V456-A458 PolarHBondContact O-N 2.66Å; A458-Y520 PolarHBondContact O-OH 3.13Å
459	T	89.5	Confident	85.1	Confident	13 Å²	13	61.4 Å²	61.4	8%	0.08	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	170.2	-179.2	81.6	0	0	0	0	111.9	V443 P445 M454 G455 V456 F457 S461 R464 Y520	V443-T459 HydrophobicContact CG2-CG2 3.5Å; P445-T459 HydrophobicContact CG-CG2 3.92Å; M454-T459 HydrophobicContact CB-CG2 3.66Å; G455-T459 WeakPolarHBondContact O-CG2 3.41Å; V456-T459 CarbonylContact O-C 3.53Å; V456-T459 WeakPolarHBondContact O-CA 3.3Å; V456-T459 PolarHBondContact O-N 3.04Å; V456-T459 PolarHBondContact O-OG1 2.83Å; F457-T459 PolarHBondContact O-N 3.15Å; T459-S461 VanDerWaalsContact C-N 3.33Å; T459-S461 WeakPolarHBondContact OG1-CB 3.1Å; T459-S461 PolarHBondContact OG1-N 2.85Å; T459-R464 PolarHBondContact O-NH2 3.44Å; T459-Y520 WeakPolarHBondContact CG2-OH 3.46Å
460	R	89.3	Confident	86.5	Confident	153 Å²	153	62 Å²	62	58%	0.577	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	27.1	168.2	-59.1	-68.1	-176.4	166.1	-0.7	112.6	M470	R460-M470 PolarHBondContact NH1-SD 2.77Å
461	S	88.4	Confident	87.9	Confident	23 Å²	23	60.9 Å²	60.9	16%	0.161	32%	0.318	C	S	.	.			trans	-66.5	149.1	-176.8	-175.5	0	0	0	0	112.7	T459 F463 R464	T459-S461 VanDerWaalsContact C-N 3.33Å; T459-S461 WeakPolarHBondContact OG1-CB 3.1Å; T459-S461 PolarHBondContact OG1-N 2.85Å; S461-F463 VanDerWaalsContact C-N 3.32Å; S461-F463 PolarHBondContact OG-N 2.92Å; S461-R464 WeakPolarHBondContact O-CG 3.33Å; S461-R464 PolarHBondContact O-NE 2.87Å
462	T	88.9	Confident	89.3	Confident	38 Å²	38	56.3 Å²	56.3	23%	0.233	29%	0.293	C	S	.	.	S	Bend	trans	-72.6	-21.4	176	65	0	0	0	0	113.5	F431 T434 R464	F431-T462 HydrophobicContact CB-CG2 4.3Å; F431-T462 HydrophobicContact CD1-CG2 3.45Å; F431-T462 VanDerWaalsContact CD1-CG2 3.45Å; F431-T462 HydrophobicContact CD2-CG2 4.12Å; F431-T462 HydrophobicContact CE1-CG2 3.63Å; F431-T462 HydrophobicContact CE2-CG2 4.26Å; F431-T462 HydrophobicContact CG-CG2 3.72Å; F431-T462 HydrophobicContact CZ-CG2 4.03Å; T434-T462 HydrophobicContact CG2-CG2 4.32Å; T434-T462 VanDerWaalsContact OG1-CB 3.3Å; T434-T462 WeakPolarHBondContact OG1-CB 3.26Å; T462-R464 PolarHBondContact O-N 2.78Å
463	F	86	Confident	90.1	Very high	59 Å²	59	54.3 Å²	54.3	26%	0.259	28%	0.276	S	S	.	.			trans	-83.5	49.4	-177.1	-59.5	-77.4	0	0	0	112.8	G438 W439 R440 V443 V456 S461	G438-F463 WeakPolarHBondContact O-CD1 3.25Å; W439-F463 CarbonylContact C-O 3.51Å; W439-F463 WeakPolarHBondContact CA-O 3.05Å; R440-F463 HydrophobicContact CB-CB 4.26Å; R440-F463 HydrophobicContact CG-CB 4.17Å; R440-F463 PolarHBondContact N-O 2.55Å; V443-F463 HydrophobicContact CG1-CB 4.36Å; V456-F463 WeakPolarHBondContact CG2-O 3.06Å; S461-F463 VanDerWaalsContact C-N 3.32Å; S461-F463 PolarHBondContact OG-N 2.92Å
464	R	88.2	Confident	90.6	Very high	54 Å²	54	50.7 Å²	50.7	20%	0.204	27%	0.266	C	S	.	.	S	Bend	trans	-106	155.6	-176.9	43.9	171.7	51.4	-162.3	-15.6	111.8	W439 V456 T459 S461 T462 N466 I468	W439-R464 VanDerWaalsContact CB-C 3.47Å; V456-R464 HydrophobicContact CG2-CB 4.03Å; T459-R464 PolarHBondContact O-NH2 3.44Å; S461-R464 WeakPolarHBondContact O-CG 3.33Å; S461-R464 PolarHBondContact O-NE 2.87Å; T462-R464 PolarHBondContact O-N 2.78Å; R464-N466 VanDerWaalsContact C-N 3.31Å; R464-N466 WeakPolarHBondContact CD-O 3.27Å; R464-N466 WeakPolarHBondContact CG-O 3.14Å; R464-N466 CarbonylContact O-C 3.54Å; R464-N466 PolarHBondContact O-N 2.88Å; R464-I468 VanDerWaalsContact CD-O 3.22Å; R464-I468 WeakPolarHBondContact CD-O 3.47Å; R464-I468 PolarHBondContact NH1-O 2.72Å
465	P	83.2	Confident	91.1	Very high	60 Å²	60	49.1 Å²	49.1	39%	0.39	26%	0.258	S	S	.	.	S	Bend	trans	-54.3	-43.1	-175	-29	35.9	0	0	0	114.2	W439 F457	W439-P465 HydrophobicContact CB-CG 4.42Å; W439-P465 HydrophobicContact CD2-CG 3.87Å; W439-P465 HydrophobicContact CE3-CG 3.58Å; W439-P465 HydrophobicContact CG-CG 4.23Å; W439-P465 HydrophobicContact CZ3-CG 4.09Å; F457-P465 HydrophobicContact CE1-CG 4.2Å; F457-P465 HydrophobicContact CZ-CG 3.84Å
466	N	84	Confident	91.3	Very high	87 Å²	87	52.3 Å²	52.3	47%	0.465	26%	0.262	S	S	.	.	S	Bend	trans	-104.8	117.3	166.3	-64.7	-31.7	0	0	0	106.6	R464 I468	R464-N466 VanDerWaalsContact C-N 3.31Å; R464-N466 WeakPolarHBondContact CD-O 3.27Å; R464-N466 WeakPolarHBondContact CG-O 3.14Å; R464-N466 CarbonylContact O-C 3.54Å; R464-N466 PolarHBondContact O-N 2.88Å; N466-I468 HydrophobicContact CB-CD1 4.1Å; N466-I468 HydrophobicContact CB-CG1 4.22Å; N466-I468 PolarHBondContact O-N 2.81Å
467	P	85.9	Confident	91.7	Very high	28 Å²	28	57.5 Å²	57.5	18%	0.182	29%	0.287	C	S	.	.			trans	-73.8	44.6	-175.2	31.1	-35.5	0	0	0	112.2	V430 F431 M435	V430-P467 CarbonylContact C-O 3.52Å; V430-P467 WeakPolarHBondContact CA-O 3.22Å; V430-P467 HydrophobicContact CG1-CB 4.48Å; V430-P467 HydrophobicContact CG1-CG 4.11Å; F431-P467 HydrophobicContact CB-CB 4.3Å; F431-P467 WeakPolarHBondContact CD2-O 3.38Å; F431-P467 PolarHBondContact N-O 2.9Å; M435-P467 HydrophobicContact CE-CG 4.16Å; M435-P467 HydrophobicContact CG-CB 4.14Å; M435-P467 HydrophobicContact CG-CG 3.99Å; M435-P467 HydrophobicContact SD-CG 4.42Å
468	I	91	Very high	91.9	Very high	54 Å²	54	51 Å²	51	28%	0.277	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.5	-178.3	-60.4	172.9	0	0	0	109.2	F429 R464 N466	F429-I468 CarbonylContact O-C 3.41Å; F429-I468 VanDerWaalsContact O-CA 3.31Å; F429-I468 WeakPolarHBondContact O-CA 3.42Å; R464-I468 VanDerWaalsContact CD-O 3.22Å; R464-I468 WeakPolarHBondContact CD-O 3.47Å; R464-I468 PolarHBondContact NH1-O 2.72Å; N466-I468 HydrophobicContact CB-CD1 4.1Å; N466-I468 HydrophobicContact CB-CG1 4.22Å; N466-I468 PolarHBondContact O-N 2.81Å
469	G	93.2	Very high	92.2	Very high	4 Å²	4	49.3 Å²	49.3	4%	0.041	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	167	167.1	0	0	0	0	0	111.5	F429	F429-G469 VanDerWaalsContact CE1-C 3.42Å; F429-G469 PolarHBondContact N-O 3.22Å; F429-G469 VanDerWaalsContact N-O 3.09Å; F429-G469 PolarHBondContact O-N 3.38Å
470	M	95.5	Very high	92.4	Very high	71 Å²	71	51.2 Å²	51.2	35%	0.35	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.7	171.3	66.6	-173.3	-74.2	0	0	109.5	W426 I427 L428 F429 R460	W426-M470 HydrophobicContact CD2-CE 3.99Å; W426-M470 HydrophobicContact CE3-CB 4.48Å; W426-M470 HydrophobicContact CE3-CE 3.51Å; W426-M470 HydrophobicContact CH2-CE 3.56Å; W426-M470 HydrophobicContact CZ2-CE 4.01Å; W426-M470 HydrophobicContact CZ3-CE 3.27Å; W426-M470 HydrophobicContact CZ3-CG 4.39Å; I427-M470 CarbonylContact O-C 3.55Å; I427-M470 VanDerWaalsContact O-CA 3.25Å; I427-M470 WeakPolarHBondContact O-CA 3.27Å; L428-M470 HydrophobicContact CD2-CB 3.67Å; F429-M470 VanDerWaalsContact CE1-N 3.35Å; R460-M470 PolarHBondContact NH1-SD 2.77Å
471	S	96.4	Very high	92.4	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.007	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	136.1	178.2	-175.2	0	0	0	0	110.2	P394 W426 I427 V473 D493	P394-S471 WeakPolarHBondContact CG-OG 3.48Å; W426-S471 CarbonylContact C-O 3.53Å; W426-S471 WeakPolarHBondContact CA-O 3.25Å; I427-S471 PolarHBondContact N-O 3.22Å; I427-S471 PolarHBondContact O-N 3.05Å; S471-V473 WeakPolarHBondContact OG-CG1 3.36Å; S471-D493 VanDerWaalsContact CB-OD1 3.25Å; S471-D493 WeakPolarHBondContact CB-OD1 3.1Å; S471-D493 PolarHBondContact OG-OD1 3.44Å
472	L	96.3	Very high	91.9	Very high	48 Å²	48	58.2 Å²	58.2	25%	0.251	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	109.9	172.1	178.9	60.8	0	0	0	108.2	P394 H424 L425 W426 Y506	P394-L472 WeakPolarHBondContact CB-O 3.47Å; P394-L472 HydrophobicContact CG-CB 4.48Å; P394-L472 WeakPolarHBondContact CG-O 3.36Å; H424-L472 HydrophobicContact CB-CD1 3.87Å; L425-L472 WeakPolarHBondContact O-CA 3.24Å; W426-L472 HydrophobicContact CD2-CB 4.45Å; W426-L472 HydrophobicContact CD2-CD1 4.3Å; W426-L472 HydrophobicContact CE3-CB 3.91Å; W426-L472 HydrophobicContact CH2-CB 3.78Å; W426-L472 HydrophobicContact CH2-CD2 4.41Å; W426-L472 HydrophobicContact CZ2-CB 4.35Å; W426-L472 HydrophobicContact CZ2-CD1 4.44Å; W426-L472 HydrophobicContact CZ2-CD2 4.46Å; W426-L472 HydrophobicContact CZ3-CB 3.54Å; L472-Y506 HydrophobicContact CD1-CD2 3.45Å; L472-Y506 VanDerWaalsContact CD1-CD2 3.45Å; L472-Y506 HydrophobicContact CD1-CE2 4.16Å; L472-Y506 HydrophobicContact CD1-CG 3.81Å; L472-Y506 HydrophobicContact CD2-CD2 4.05Å; L472-Y506 HydrophobicContact CD2-CE2 3.9Å; L472-Y506 HydrophobicContact CG-CD2 4.42Å
473	V	96.7	Very high	91.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	152.9	-175.2	-61.3	0	0	0	0	111.2	H424 L425 I427 S471 L489 L492	H424-V473 CarbonylContact C-O 3.56Å; H424-V473 VanDerWaalsContact CA-O 3.22Å; H424-V473 WeakPolarHBondContact CA-O 3.35Å; H424-V473 WeakPolarHBondContact CB-O 3.35Å; L425-V473 HydrophobicContact CB-CG2 4.38Å; L425-V473 PolarHBondContact N-O 3.4Å; L425-V473 PolarHBondContact O-N 3.25Å; I427-V473 HydrophobicContact CD1-CG1 4.44Å; I427-V473 HydrophobicContact CD1-CG2 3.5Å; I427-V473 HydrophobicContact CG1-CG2 3.88Å; S471-V473 WeakPolarHBondContact OG-CG1 3.36Å; V473-L489 HydrophobicContact CG2-CD1 4.31Å; V473-L489 HydrophobicContact CG2-CD2 3.96Å; V473-L492 HydrophobicContact CG1-CD1 4.03Å
474	E	97.5	Very high	91.9	Very high	72 Å²	72	61.4 Å²	61.4	34%	0.336	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.8	172.2	-177.5	-172.9	-165.2	0	0	109.5	K476 L489 G490	E474-K476 HydrophobicContact CG-CG 4.25Å; E474-K476 WeakPolarHBondContact OE2-CE 3.4Å; E474-K476 IonicContact OE2-NZ 3.98Å; E474-L489 CarbonylContact O-C 3.52Å; E474-L489 VanDerWaalsContact O-CA 3.31Å; E474-L489 WeakPolarHBondContact O-CA 3.38Å; E474-G490 PolarHBondContact N-O 2.82Å; E474-G490 PolarHBondContact O-N 3.01Å
475	L	97.8	Very high	92.2	Very high	16 Å²	16	58.9 Å²	58.9	8%	0.084	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.8	169	178.4	63.2	0	0	0	108.9	L419 S423 L425 V478 L487 L489	L419-L475 HydrophobicContact CB-CD2 4.49Å; L419-L475 HydrophobicContact CD2-CD2 4.28Å; L419-L475 HydrophobicContact CG-CD2 3.85Å; L419-L475 VanDerWaalsContact O-CD2 3.29Å; L419-L475 WeakPolarHBondContact O-CD2 3.11Å; S423-L475 PolarHBondContact O-N 2.63Å; L425-L475 HydrophobicContact CD1-CB 4.26Å; L425-L475 HydrophobicContact CD1-CD1 4Å; L425-L475 HydrophobicContact CD1-CD2 4.17Å; L425-L475 HydrophobicContact CD1-CG 4.38Å; L425-L475 HydrophobicContact CD2-CD2 4.42Å; L425-L475 HydrophobicContact CG-CB 4.13Å; L425-L475 HydrophobicContact CG-CD2 4.33Å; L475-V478 HydrophobicContact CD1-CG2 4.23Å; L475-V478 HydrophobicContact CD2-CG2 4.1Å; L475-L487 HydrophobicContact CD1-CB 4.01Å; L475-L489 HydrophobicContact CD1-CD2 4.29Å
476	K	96.8	Very high	92.9	Very high	101 Å²	101	57.1 Å²	57.1	44%	0.439	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-40.4	-178.7	-66.2	-170.5	167.5	-178.1	0	112.7	N401 E474 K488	N401-K476 PolarHBondContact OD1-NZ 2.61Å; E474-K476 HydrophobicContact CG-CG 4.25Å; E474-K476 WeakPolarHBondContact OE2-CE 3.4Å; E474-K476 IonicContact OE2-NZ 3.98Å; K476-K488 HydrophobicContact CB-CB 4.18Å; K476-K488 PolarHBondContact N-O 3.45Å
477	E	97.6	Very high	93.6	Very high	111 Å²	111	53 Å²	53	52%	0.519	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	146.7	-175.1	-169.4	-179.5	-165.7	0	0	110.5	V479 K488	E477-V479 HydrophobicContact CG-CG2 3.87Å; E477-K488 HydrophobicContact CB-CB 3.9Å; E477-K488 HydrophobicContact CB-CG 3.81Å; E477-K488 PolarHBondContact O-N 3.03Å
478	V	97.4	Very high	94.2	Very high	20 Å²	20	54.6 Å²	54.6	12%	0.121	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.6	169	-178.1	0	0	0	0	107.6	V416 L419 E420 L475 L487	V416-V478 HydrophobicContact CB-CG1 4.24Å; V416-V478 HydrophobicContact CG2-CG1 3.74Å; L419-V478 HydrophobicContact CB-CG2 4.37Å; E420-V478 HydrophobicContact CG-CB 3.93Å; E420-V478 HydrophobicContact CG-CG2 3.72Å; E420-V478 WeakPolarHBondContact OE1-CB 2.92Å; L475-V478 HydrophobicContact CD1-CG2 4.23Å; L475-V478 HydrophobicContact CD2-CG2 4.1Å; V478-L487 HydrophobicContact CB-CD2 4.32Å; V478-L487 HydrophobicContact CG1-CD2 3.88Å; V478-L487 HydrophobicContact CG2-CD2 4.02Å
479	V	96.9	Very high	94.5	Very high	22 Å²	22	52.1 Å²	52.1	13%	0.133	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	109.9	-178.5	-176.5	0	0	0	0	109.2	E477 H481 V485 I486 K488	E477-V479 HydrophobicContact CG-CG2 3.87Å; V479-H481 WeakPolarHBondContact CG1-NE2 3.26Å; V479-V485 WeakPolarHBondContact O-CA 3.21Å; V479-I486 HydrophobicContact CB-CB 4.35Å; V479-I486 PolarHBondContact N-O 3.18Å; V479-I486 PolarHBondContact O-N 3.14Å; V479-K488 HydrophobicContact CG2-CG 4.17Å
480	C	93.7	Very high	94.6	Very high	54 Å²	54	52 Å²	52	37%	0.365	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.2	176.9	-67.9	0	0	0	0	110.3	A413	A413-C480 HydrophobicContact CB-CB 4.19Å
481	H	88.9	Confident	94.4	Very high	123 Å²	123	49.5 Å²	49.5	57%	0.569	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118	171	164.4	-56	-56.5	0	0	0	109.3	V479 D483 S484	V479-H481 WeakPolarHBondContact CG1-NE2 3.26Å; H481-D483 PolarHBondContact O-N 2.85Å; H481-S484 WeakPolarHBondContact CB-OG 3.3Å; H481-S484 PolarHBondContact N-O 3.07Å; H481-S484 PolarHBondContact O-N 3.34Å; H481-S484 VanDerWaalsContact O-O 3.12Å
482	K	78.9	Confident	94.2	Very high	200 Å²	200	49.4 Å²	49.4	87%	0.87	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.2	-39.8	-170.9	-168.9	178.3	178.2	-176.6	0	114.3
483	D	82.9	Confident	94.1	Very high	124 Å²	124	48 Å²	48	66%	0.663	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.2	16.6	-176.1	-56.7	-54.4	0	0	0	113.2	N411 H481	N411-D483 PolarHBondContact ND2-O 2.87Å; H481-D483 PolarHBondContact O-N 2.85Å
484	S	90.6	Very high	94.1	Very high	39 Å²	39	48.2 Å²	48.2	27%	0.273	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	136.5	-177.8	68.6	0	0	0	0	112.6	H481	H481-S484 WeakPolarHBondContact CB-OG 3.3Å; H481-S484 PolarHBondContact N-O 3.07Å; H481-S484 PolarHBondContact O-N 3.34Å; H481-S484 VanDerWaalsContact O-O 3.12Å
485	V	96	Very high	93.9	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.3	169.2	176.2	0	0	0	0	107.9	L406 N411 V416 V479 L487	L406-V485 HydrophobicContact CB-CB 4.27Å; L406-V485 HydrophobicContact CD1-CB 4.06Å; L406-V485 HydrophobicContact CD1-CG1 3.68Å; L406-V485 HydrophobicContact CG-CB 4.41Å; L406-V485 HydrophobicContact CG-CG1 4.25Å; L406-V485 PolarHBondContact N-O 3.35Å; N411-V485 VanDerWaalsContact C-CG2 3.47Å; N411-V485 WeakPolarHBondContact O-CG2 3.47Å; V416-V485 HydrophobicContact CB-CG1 4.31Å; V416-V485 HydrophobicContact CG1-CG1 3.78Å; V416-V485 HydrophobicContact CG2-CG1 3.64Å; V479-V485 WeakPolarHBondContact O-CA 3.21Å; V485-L487 HydrophobicContact CG1-CD2 4.33Å
486	I	97.9	Very high	93.8	Very high	24 Å²	24	46.4 Å²	46.4	12%	0.123	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.9	-177.8	-58.3	170.2	0	0	0	108.4	E403 L404 V479	E403-I486 HydrophobicContact CB-CG2 3.9Å; E403-I486 HydrophobicContact CG-CG2 4.39Å; L404-I486 CarbonylContact O-C 3.57Å; L404-I486 WeakPolarHBondContact O-CA 3.19Å; V479-I486 HydrophobicContact CB-CB 4.35Å; V479-I486 PolarHBondContact N-O 3.18Å; V479-I486 PolarHBondContact O-N 3.14Å
487	L	98.1	Very high	93.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.9	171.6	-46.2	-172.9	0	0	0	108.5	E403 L404 V416 L419 L425 L475 V478 V485 L489 I503	E403-L487 CarbonylContact C-O 3.5Å; E403-L487 VanDerWaalsContact CA-O 3.25Å; E403-L487 WeakPolarHBondContact CA-O 3.37Å; L404-L487 HydrophobicContact CB-CB 4.24Å; L404-L487 HydrophobicContact CD2-CD1 4.16Å; L404-L487 PolarHBondContact N-O 3.33Å; L404-L487 PolarHBondContact O-N 3.25Å; V416-L487 HydrophobicContact CG1-CD2 4.34Å; L419-L487 HydrophobicContact CD2-CD1 3.81Å; L419-L487 HydrophobicContact CD2-CD2 4.14Å; L425-L487 HydrophobicContact CD1-CD1 3.75Å; L475-L487 HydrophobicContact CD1-CB 4.01Å; V478-L487 HydrophobicContact CB-CD2 4.32Å; V478-L487 HydrophobicContact CG1-CD2 3.88Å; V478-L487 HydrophobicContact CG2-CD2 4.02Å; V485-L487 HydrophobicContact CG1-CD2 4.33Å; L487-L489 HydrophobicContact CB-CD2 4.04Å; L487-I503 HydrophobicContact CD1-CD1 3.8Å
488	K	97.7	Very high	93.5	Very high	62 Å²	62	37.7 Å²	37.7	27%	0.27	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	125	172.1	-57	-66.6	-175.3	165.8	0	108.5	E403 K476 E477 V479	E403-K488 HydrophobicContact CG-CD 3.95Å; E403-K488 IonicContact OE1-NZ 3.96Å; E403-K488 PolarHBondContact OE1-NZ 3.18Å; K476-K488 HydrophobicContact CB-CB 4.18Å; K476-K488 PolarHBondContact N-O 3.45Å; E477-K488 HydrophobicContact CB-CB 3.9Å; E477-K488 HydrophobicContact CB-CG 3.81Å; E477-K488 PolarHBondContact O-N 3.03Å; V479-K488 HydrophobicContact CG2-CG 4.17Å
489	L	97.4	Very high	93.4	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.3	-169.9	-56.5	177.5	0	0	0	111.3	I380 N401 G402 L404 I427 V473 E474 L475 L487 L492	I380-L489 HydrophobicContact CD1-CD1 4.2Å; N401-L489 WeakPolarHBondContact CA-O 3.44Å; G402-L489 PolarHBondContact N-O 3.02Å; G402-L489 PolarHBondContact O-N 2.92Å; L404-L489 HydrophobicContact CB-CD1 3.83Å; I427-L489 HydrophobicContact CD1-CD1 3.52Å; V473-L489 HydrophobicContact CG2-CD1 4.31Å; V473-L489 HydrophobicContact CG2-CD2 3.96Å; E474-L489 CarbonylContact O-C 3.52Å; E474-L489 VanDerWaalsContact O-CA 3.31Å; E474-L489 WeakPolarHBondContact O-CA 3.38Å; L475-L489 HydrophobicContact CD1-CD2 4.29Å; L487-L489 HydrophobicContact CB-CD2 4.04Å; L489-L492 HydrophobicContact CB-CD1 3.6Å; L489-L492 HydrophobicContact CD1-CD1 3.66Å; L489-L492 HydrophobicContact CG-CD1 4.3Å
490	G	95.3	Very high	93.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	155.3	173.9	0	0	0	0	0	113.2	E474 L492	E474-G490 PolarHBondContact N-O 2.82Å; E474-G490 PolarHBondContact O-N 3.01Å; G490-L492 VanDerWaalsContact C-N 3.35Å; G490-L492 PolarHBondContact O-N 3.13Å
491	S	90.9	Very high	93.3	Very high	19 Å²	19	35.4 Å²	35.4	13%	0.133	19%	0.186	C	C	.	.	S	Bend	trans	56.6	40.8	173.3	-54.2	0	0	0	0	115.2	P394 G395 V397 A400	P394-S491 WeakPolarHBondContact CA-O 3.29Å; P394-S491 WeakPolarHBondContact CB-O 3.4Å; G395-S491 PolarHBondContact N-O 2.82Å; V397-S491 WeakPolarHBondContact O-CA 3.38Å; A400-S491 PolarHBondContact O-N 3.13Å
492	L	92.5	Very high	93.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.			trans	-68.9	147	-173.3	-140.4	87.7	0	0	0	113.1	I380 Y384 A400 V473 L489 G490 L494	I380-L492 HydrophobicContact CG2-CD2 3.62Å; Y384-L492 WeakPolarHBondContact CE2-O 3.32Å; A400-L492 PolarHBondContact O-N 2.86Å; V473-L492 HydrophobicContact CG1-CD1 4.03Å; L489-L492 HydrophobicContact CB-CD1 3.6Å; L489-L492 HydrophobicContact CD1-CD1 3.66Å; L489-L492 HydrophobicContact CG-CD1 4.3Å; G490-L492 VanDerWaalsContact C-N 3.35Å; G490-L492 PolarHBondContact O-N 3.13Å; L492-L494 HydrophobicContact CD2-CB 3.88Å; L492-L494 HydrophobicContact CD2-CG 4.47Å; L492-L494 HydrophobicContact CG-CB 4.24Å; L492-L494 HydrophobicContact CG-CD1 4.48Å; L492-L494 HydrophobicContact CG-CG 4.35Å
493	D	94.6	Very high	94.6	Very high	18 Å²	18	24 Å²	24	10%	0.096	14%	0.138	C	C	.	.			trans	-126.2	29.7	173.8	71.9	-33.2	0	0	0	112.8	V390 P391 P394 S471	V390-D493 VanDerWaalsContact CG1-C 3.43Å; V390-D493 WeakPolarHBondContact CG1-O 3.33Å; P391-D493 HydrophobicContact CG-CB 3.96Å; P394-D493 HydrophobicContact CB-CB 4.37Å; P394-D493 VanDerWaalsContact CD-OD2 3.24Å; P394-D493 WeakPolarHBondContact CD-OD2 3.03Å; S471-D493 VanDerWaalsContact CB-OD1 3.25Å; S471-D493 WeakPolarHBondContact CB-OD1 3.1Å; S471-D493 PolarHBondContact OG-OD1 3.44Å
494	L	95.9	Very high	95.3	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.021	13%	0.129	C	C	.	.			trans	-118.9	136.2	-172.4	-55.9	175.9	0	0	0	111.3	I380 S382 I427 F429 L492	I380-L494 HydrophobicContact CD1-CD1 3.75Å; I380-L494 HydrophobicContact CG1-CB 4.32Å; I380-L494 HydrophobicContact CG1-CD1 3.72Å; I380-L494 HydrophobicContact CG2-CB 4.01Å; S382-L494 WeakPolarHBondContact CB-O 3.37Å; S382-L494 PolarHBondContact OG-O 2.94Å; I427-L494 HydrophobicContact CG2-CD1 4.28Å; F429-L494 HydrophobicContact CD1-CD1 4.37Å; F429-L494 HydrophobicContact CD1-CD2 3.64Å; F429-L494 HydrophobicContact CD2-CD2 3.86Å; F429-L494 HydrophobicContact CE1-CD2 3.36Å; F429-L494 HydrophobicContact CE2-CD2 3.59Å; F429-L494 HydrophobicContact CG-CD2 3.88Å; F429-L494 HydrophobicContact CZ-CD2 3.33Å; L492-L494 HydrophobicContact CD2-CB 3.88Å; L492-L494 HydrophobicContact CD2-CG 4.47Å; L492-L494 HydrophobicContact CG-CB 4.24Å; L492-L494 HydrophobicContact CG-CD1 4.48Å; L492-L494 HydrophobicContact CG-CG 4.35Å
495	V	94.6	Very high	95.6	Very high	15 Å²	15	23.6 Å²	23.6	9%	0.091	13%	0.13	C	C	.	.			trans	-67.5	145.4	174.1	-178	0	0	0	0	110	K387 V390 G497 T498	K387-V495 HydrophobicContact CG-CG2 4.3Å; V390-V495 HydrophobicContact CG2-CG2 3.64Å; V495-G497 PolarHBondContact O-N 3.15Å; V495-T498 VanDerWaalsContact O-CB 3.26Å; V495-T498 WeakPolarHBondContact O-CB 3.26Å; V495-T498 PolarHBondContact O-N 3.14Å; V495-T498 VanDerWaalsContact O-N 3.13Å; V495-T498 PolarHBondContact O-OG1 3Å
496	D	95.5	Very high	95.6	Very high	35 Å²	35	25.8 Å²	25.8	19%	0.187	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	135	175.1	-169.5	43.1	0	0	0	110.8	R381 S382 Y384 K385	R381-D496 VanDerWaalsContact CA-OD1 3.27Å; R381-D496 WeakPolarHBondContact CA-OD1 3.27Å; S382-D496 PolarHBondContact N-OD1 2.82Å; S382-D496 PolarHBondContact OG-N 3.03Å; Y384-D496 WeakPolarHBondContact O-CB 3.3Å; Y384-D496 PolarHBondContact O-N 3.18Å; K385-D496 HydrophobicContact CD-CB 4.01Å; K385-D496 IonicContact NZ-OD1 3.45Å; K385-D496 IonicContact NZ-OD2 2.78Å; K385-D496 PolarHBondContact NZ-OD2 3.4Å
497	G	93.2	Very high	95.6	Very high	25 Å²	25	27.8 Å²	27.8	26%	0.258	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	0.7	-175.5	0	0	0	0	0	115.1	I380 V495 P499	I380-G497 WeakPolarHBondContact O-CA 3.45Å; I380-G497 PolarHBondContact O-N 3.42Å; V495-G497 PolarHBondContact O-N 3.15Å; G497-P499 VanDerWaalsContact O-CD 3.27Å; G497-P499 WeakPolarHBondContact O-CD 3.33Å
498	T	94.6	Very high	95.4	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.031	18%	0.175	C	C	.	.			trans	-56.7	122	178.7	-66.3	0	0	0	0	111.9	I380 F429 H432 V495	I380-T498 HydrophobicContact CG1-CG2 4.4Å; I380-T498 PolarHBondContact N-O 2.77Å; F429-T498 HydrophobicContact CB-CG2 3.69Å; F429-T498 HydrophobicContact CD2-CG2 3.66Å; F429-T498 HydrophobicContact CG-CG2 3.96Å; H432-T498 VanDerWaalsContact CE1-CA 3.47Å; H432-T498 WeakPolarHBondContact CE1-CA 3.22Å; H432-T498 PolarHBondContact CE1-OG1 2.96Å; H432-T498 VanDerWaalsContact CE1-OG1 3.27Å; V495-T498 VanDerWaalsContact O-CB 3.26Å; V495-T498 WeakPolarHBondContact O-CB 3.26Å; V495-T498 PolarHBondContact O-N 3.14Å; V495-T498 VanDerWaalsContact O-N 3.13Å; V495-T498 PolarHBondContact O-OG1 3Å
499	P	94.7	Very high	95.2	Very high	23 Å²	23	37.6 Å²	37.6	15%	0.149	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	132.4	174.5	-21.3	34.5	0	0	0	112	Q376 F429 V430 H432 G497	Q376-P499 HydrophobicContact CG-CB 4.12Å; F429-P499 CarbonylContact C-O 3.54Å; F429-P499 VanDerWaalsContact CA-O 3.26Å; F429-P499 WeakPolarHBondContact CA-O 3.19Å; F429-P499 WeakPolarHBondContact CB-O 3.49Å; V430-P499 HydrophobicContact CB-CB 4.3Å; V430-P499 HydrophobicContact CG2-CB 4.41Å; V430-P499 PolarHBondContact N-O 2.88Å; H432-P499 HydrophobicContact CB-CG 4.02Å; G497-P499 VanDerWaalsContact O-CD 3.27Å; G497-P499 WeakPolarHBondContact O-CD 3.33Å
500	V	95.9	Very high	94.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.1	174.9	177.4	0	0	0	0	109.6	Q376 I377 G378 I380 L404 I427 I503	Q376-V500 CarbonylContact C-O 3.6Å; Q376-V500 WeakPolarHBondContact CA-O 3.24Å; I377-V500 HydrophobicContact CD1-CG1 4.16Å; I377-V500 HydrophobicContact CG1-CB 4.4Å; I377-V500 HydrophobicContact CG1-CG1 3.92Å; I377-V500 WeakPolarHBondContact CG1-O 3.25Å; I377-V500 PolarHBondContact N-O 2.55Å; G378-V500 PolarHBondContact N-O 2.77Å; G378-V500 PolarHBondContact O-N 3.18Å; I380-V500 HydrophobicContact CD1-CG2 3.94Å; I380-V500 HydrophobicContact CG1-CG2 3.81Å; L404-V500 HydrophobicContact CD1-CB 3.94Å; L404-V500 HydrophobicContact CD1-CG1 4.38Å; L404-V500 HydrophobicContact CD1-CG2 3.59Å; L404-V500 HydrophobicContact CD2-CG1 4.17Å; L404-V500 HydrophobicContact CD2-CG2 4.44Å; I427-V500 HydrophobicContact CG2-CB 4.44Å; I427-V500 HydrophobicContact CG2-CG1 3.87Å; I427-V500 HydrophobicContact CG2-CG2 3.74Å; V500-I503 HydrophobicContact CG1-CG2 4.03Å
501	V	93.9	Very high	94.9	Very high	25 Å²	25	43.5 Å²	43.5	15%	0.152	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-37.1	-179.4	177.5	0	0	0	0	111.3	F374 I377 L428 V430	F374-V501 HydrophobicContact CB-CG1 3.68Å; F374-V501 HydrophobicContact CD1-CG1 4.02Å; F374-V501 HydrophobicContact CG-CG1 4.03Å; I377-V501 WeakPolarHBondContact CG2-O 3.47Å; L428-V501 PolarHBondContact O-N 2.96Å; V430-V501 HydrophobicContact CG2-CG2 3.66Å
502	D	96.4	Very high	95.1	Very high	52 Å²	52	45.7 Å²	45.7	28%	0.278	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	159.4	-178.8	-166.4	30.9	0	0	0	111.3	L428 K504	L428-D502 HydrophobicContact CB-CB 4.2Å; L428-D502 HydrophobicContact CD1-CB 4.12Å; L428-D502 HydrophobicContact CG-CB 4.42Å; L428-D502 PolarHBondContact N-O 3.13Å; L428-D502 PolarHBondContact O-N 2.92Å; D502-K504 VanDerWaalsContact OD2-CE 3.27Å; D502-K504 WeakPolarHBondContact OD2-CE 3.2Å; D502-K504 IonicContact OD2-NZ 2.66Å; D502-K504 PolarHBondContact OD2-NZ 2.95Å
503	I	97.4	Very high	95.1	Very high	32 Å²	32	51.7 Å²	51.7	16%	0.164	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.6	171.7	60.1	174.6	0	0	0	110.5	I377 L404 L419 W426 I427 L487 V500	I377-I503 HydrophobicContact CD1-CG1 4.34Å; I377-I503 HydrophobicContact CD1-CG2 4.39Å; L404-I503 HydrophobicContact CD2-CG2 3.62Å; L419-I503 HydrophobicContact CD2-CD1 4.23Å; W426-I503 CarbonylContact O-C 3.56Å; W426-I503 VanDerWaalsContact O-CA 3.24Å; W426-I503 WeakPolarHBondContact O-CA 3.17Å; I427-I503 HydrophobicContact CG1-CG2 4.23Å; L487-I503 HydrophobicContact CD1-CD1 3.8Å; V500-I503 HydrophobicContact CG1-CG2 4.03Å
504	K	97.5	Very high	94.9	Very high	106 Å²	106	56 Å²	56	46%	0.461	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	141.4	175.4	-58.2	-168.8	-175.9	-48.6	0	111.2	L425 W426 D502	L425-K504 CarbonylContact C-O 3.48Å; L425-K504 WeakPolarHBondContact CA-O 3.42Å; W426-K504 HydrophobicContact CB-CB 4.28Å; W426-K504 PolarHBondContact N-O 3.38Å; W426-K504 PolarHBondContact O-N 2.85Å; D502-K504 VanDerWaalsContact OD2-CE 3.27Å; D502-K504 WeakPolarHBondContact OD2-CE 3.2Å; D502-K504 IonicContact OD2-NZ 2.66Å; D502-K504 PolarHBondContact OD2-NZ 2.95Å
505	P	97.3	Very high	94.7	Very high	47 Å²	47	63.2 Å²	63.2	31%	0.305	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	140.6	170.2	26.5	-32.8	0	0	0	110.7	F422	F422-P505 HydrophobicContact CB-CB 4.25Å; F422-P505 HydrophobicContact CD1-CB 3.4Å; F422-P505 VanDerWaalsContact CD1-CB 3.4Å; F422-P505 HydrophobicContact CD2-CB 3.84Å; F422-P505 HydrophobicContact CE1-CB 3.55Å; F422-P505 HydrophobicContact CE1-CG 4.21Å; F422-P505 HydrophobicContact CE2-CB 3.97Å; F422-P505 HydrophobicContact CE2-CG 4.44Å; F422-P505 HydrophobicContact CG-CB 3.55Å; F422-P505 HydrophobicContact CZ-CB 3.83Å; F422-P505 HydrophobicContact CZ-CG 4.17Å
506	Y	97.3	Very high	94.6	Very high	48 Å²	48	65.1 Å²	65.1	19%	0.188	37%	0.369	C	S	.	.			trans	-75	133.3	172.1	-177.6	-100.7	0	0	0	110.6	H424 W426 L472 P508 E511	H424-Y506 HydrophobicContact CB-CG 4.32Å; H424-Y506 WeakPolarHBondContact O-CB 3.49Å; H424-Y506 PolarHBondContact O-N 2.75Å; W426-Y506 HydrophobicContact CZ2-CD2 4.24Å; W426-Y506 HydrophobicContact CZ2-CE2 4.18Å; W426-Y506 AromaticContact NE1-CD2 3.58Å; L472-Y506 HydrophobicContact CD1-CD2 3.45Å; L472-Y506 VanDerWaalsContact CD1-CD2 3.45Å; L472-Y506 HydrophobicContact CD1-CE2 4.16Å; L472-Y506 HydrophobicContact CD1-CG 3.81Å; L472-Y506 HydrophobicContact CD2-CD2 4.05Å; L472-Y506 HydrophobicContact CD2-CE2 3.9Å; L472-Y506 HydrophobicContact CG-CD2 4.42Å; Y506-P508 HydrophobicContact CD1-CG 4.05Å; Y506-P508 HydrophobicContact CE1-CB 4.3Å; Y506-P508 HydrophobicContact CE1-CG 3.93Å; Y506-E511 VanDerWaalsContact CA-OE2 3.31Å; Y506-E511 WeakPolarHBondContact CA-OE2 3.43Å; Y506-E511 HydrophobicContact CD2-CB 4.19Å; Y506-E511 WeakPolarHBondContact CD2-OE2 3.48Å; Y506-E511 HydrophobicContact CE2-CB 3.56Å; Y506-E511 WeakPolarHBondContact CE2-OE2 3.48Å
507	L	96.4	Very high	94.4	Very high	66 Å²	66	68.8 Å²	68.8	35%	0.346	40%	0.398	S	S	.	.			trans	-119.1	97.6	-177.1	-63.3	179.5	0	0	0	110.4	F422 F509 A510 E511	F422-L507 HydrophobicContact CE1-CD2 3.97Å; L507-F509 VanDerWaalsContact C-N 3.28Å; L507-F509 HydrophobicContact CB-CD1 4.18Å; L507-F509 HydrophobicContact CB-CE1 3.95Å; L507-F509 HydrophobicContact CD1-CE1 4.07Å; L507-F509 HydrophobicContact CG-CE1 4.42Å; L507-F509 PolarHBondContact O-N 3.09Å; L507-F509 VanDerWaalsContact O-N 3.13Å; L507-A510 HydrophobicContact CB-CB 4.34Å; L507-A510 PolarHBondContact O-N 2.79Å; L507-E511 PolarHBondContact N-OE2 2.55Å; L507-E511 WeakPolarHBondContact O-CB 3.23Å; L507-E511 PolarHBondContact O-N 2.97Å
508	P	94	Very high	94.1	Very high	83 Å²	83	69.6 Å²	69.6	54%	0.539	40%	0.402	S	S	.	.	H	α-helix	trans	-53.6	-39.7	-174.9	-28.6	34.2	0	0	0	114.5	Y506 A510 S512	Y506-P508 HydrophobicContact CD1-CG 4.05Å; Y506-P508 HydrophobicContact CE1-CB 4.3Å; Y506-P508 HydrophobicContact CE1-CG 3.93Å; P508-A510 PolarHBondContact O-N 2.82Å; P508-S512 WeakPolarHBondContact O-CB 3.47Å; P508-S512 PolarHBondContact O-N 2.95Å
509	F	93.1	Very high	93.3	Very high	184 Å²	184	74.9 Å²	74.9	81%	0.807	44%	0.439	S	S	*	.	H	α-helix	trans	-63.7	-28.9	-178.6	84.1	-90.4	0	0	0	113.6	L507	L507-F509 VanDerWaalsContact C-N 3.28Å; L507-F509 HydrophobicContact CB-CD1 4.18Å; L507-F509 HydrophobicContact CB-CE1 3.95Å; L507-F509 HydrophobicContact CD1-CE1 4.07Å; L507-F509 HydrophobicContact CG-CE1 4.42Å; L507-F509 PolarHBondContact O-N 3.09Å; L507-F509 VanDerWaalsContact O-N 3.13Å
510	A	93	Very high	92.4	Very high	56 Å²	56	76.2 Å²	76.2	46%	0.463	44%	0.441	S	S	.	.	H	α-helix	trans	-100.9	-27.2	-176	0	0	0	0	0	112.6	L507 P508	L507-A510 HydrophobicContact CB-CB 4.34Å; L507-A510 PolarHBondContact O-N 2.79Å; P508-A510 PolarHBondContact O-N 2.82Å
511	E	95	Very high	91.7	Very high	71 Å²	71	78.6 Å²	78.6	33%	0.332	46%	0.462	S	S	.	.	H	α-helix	trans	-116	-18.7	-165.8	-57.3	-176.4	128.6	0	0	113.3	W426 Y506 L507 L513	W426-E511 VanDerWaalsContact CD1-OE1 3.29Å; W426-E511 PolarHBondContact NE1-OE1 3.46Å; W426-E511 PolarHBondContact NE1-OE2 2.93Å; W426-E511 VanDerWaalsContact NE1-OE2 3.09Å; Y506-E511 VanDerWaalsContact CA-OE2 3.31Å; Y506-E511 WeakPolarHBondContact CA-OE2 3.43Å; Y506-E511 HydrophobicContact CD2-CB 4.19Å; Y506-E511 WeakPolarHBondContact CD2-OE2 3.48Å; Y506-E511 HydrophobicContact CE2-CB 3.56Å; Y506-E511 WeakPolarHBondContact CE2-OE2 3.48Å; L507-E511 PolarHBondContact N-OE2 2.55Å; L507-E511 WeakPolarHBondContact O-CB 3.23Å; L507-E511 PolarHBondContact O-N 2.97Å; E511-L513 PolarHBondContact O-N 2.83Å
512	S	94.4	Very high	91.4	Very high	64 Å²	64	82.8 Å²	82.8	45%	0.448	48%	0.479	S	S	.	.			trans	-83.8	99.8	176.4	-171.1	0	0	0	0	110.5	P508 P514	P508-S512 WeakPolarHBondContact O-CB 3.47Å; P508-S512 PolarHBondContact O-N 2.95Å; S512-P514 WeakPolarHBondContact O-CD 3.49Å
513	L	92.2	Very high	90.8	Very high	127 Å²	127	84.5 Å²	84.5	67%	0.665	50%	0.496	S	S	*	.			trans	-110	82.9	175.8	-62.7	177	0	0	0	110.2	E511 D515 A516	E511-L513 PolarHBondContact O-N 2.83Å; L513-D515 PolarHBondContact O-N 2.88Å; L513-A516 HydrophobicContact CB-CB 4Å; L513-A516 VanDerWaalsContact O-CB 3.25Å; L513-A516 WeakPolarHBondContact O-CB 2.99Å; L513-A516 PolarHBondContact O-N 2.91Å; L513-A516 VanDerWaalsContact O-N 3.11Å
514	P	89.8	Confident	90.3	Very high	108 Å²	108	86.6 Å²	86.6	70%	0.701	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.4	-175.8	25.2	-34.4	0	0	0	113.3	S512 A516	S512-P514 WeakPolarHBondContact O-CD 3.49Å; P514-A516 VanDerWaalsContact C-N 3.32Å
515	D	92.5	Very high	89.6	Confident	156 Å²	156	84 Å²	84	83%	0.834	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	8.7	-179.6	-53.8	-46.6	0	0	0	113.2	L513	L513-D515 PolarHBondContact O-N 2.88Å
516	A	91.7	Very high	88.5	Confident	54 Å²	54	85 Å²	85	45%	0.446	52%	0.524	S	S	.	.			trans	-64.4	138.2	177.8	0	0	0	0	0	111.8	L513 P514 Q522	L513-A516 HydrophobicContact CB-CB 4Å; L513-A516 VanDerWaalsContact O-CB 3.25Å; L513-A516 WeakPolarHBondContact O-CB 2.99Å; L513-A516 PolarHBondContact O-N 2.91Å; L513-A516 VanDerWaalsContact O-N 3.11Å; P514-A516 VanDerWaalsContact C-N 3.32Å; A516-Q522 PolarHBondContact O-NE2 2.82Å; A516-Q522 VanDerWaalsContact O-NE2 3.08Å
517	S	91.6	Very high	87.7	Confident	112 Å²	112	85.1 Å²	85.1	78%	0.783	53%	0.534	S	S	*	.			trans	-109.3	136.2	-179.8	-175.2	0	0	0	0	111.9
518	A	86.8	Confident	87.1	Confident	43 Å²	43	89.8 Å²	89.8	36%	0.355	56%	0.555	S	S	.	*			trans	-127	121.5	172.6	0	0	0	0	0	110.3	Y520	A518-Y520 PolarHBondContact O-N 3.01Å; A518-Y520 VanDerWaalsContact O-N 3.13Å
519	S	78.3	Confident	86.8	Confident	115 Å²	115	88.1 Å²	88.1	80%	0.804	54%	0.54	S	S	*	.	S	Bend	trans	-59.1	-27.6	-178.3	56.5	0	0	0	0	113.5
520	Y	76.7	Confident	86.9	Confident	51 Å²	51	82 Å²	82	20%	0.2	52%	0.524	C	S	.	.	S	Bend	trans	-140.5	146.4	167.9	63.6	-80.7	0	0	0	108.3	P445 L448 M454 A458 T459 A518	P445-Y520 HydrophobicContact CB-CE2 4.24Å; P445-Y520 HydrophobicContact CG-CE2 4.38Å; L448-Y520 HydrophobicContact CD1-CD1 4.41Å; L448-Y520 HydrophobicContact CD1-CG 4.4Å; L448-Y520 HydrophobicContact CD2-CG 4.09Å; L448-Y520 HydrophobicContact CG-CD2 4.41Å; L448-Y520 HydrophobicContact CG-CG 4.31Å; M454-Y520 HydrophobicContact CE-CD1 4.35Å; M454-Y520 HydrophobicContact CE-CE1 3.74Å; M454-Y520 HydrophobicContact CG-CE1 4.44Å; A458-Y520 PolarHBondContact O-OH 3.13Å; T459-Y520 WeakPolarHBondContact CG2-OH 3.46Å; A518-Y520 PolarHBondContact O-N 3.01Å; A518-Y520 VanDerWaalsContact O-N 3.13Å
521	A	81.3	Confident	87.1	Confident	51 Å²	51	80.2 Å²	80.2	42%	0.421	51%	0.507	S	S	.	.			trans	72.9	31.5	-174.8	0	0	0	0	0	116.8	S523	A521-S523 PolarHBondContact O-N 2.6Å
522	Q	85.8	Confident	87.2	Confident	112 Å²	112	79.3 Å²	79.3	52%	0.523	51%	0.509	S	S	.	.	S	Bend	trans	-56.1	-33.9	171.1	-171.2	66.5	45.6	0	0	112.9	A516	A516-Q522 PolarHBondContact O-NE2 2.82Å; A516-Q522 VanDerWaalsContact O-NE2 3.08Å
523	S	85.6	Confident	87.3	Confident	89 Å²	89	77 Å²	77	62%	0.622	49%	0.491	S	S	*	.	S	Bend	trans	-118.4	153.8	-179.8	-51.8	0	0	0	0	112	R447 A521	R447-S523 PolarHBondContact NH1-O 2.87Å; A521-S523 PolarHBondContact O-N 2.6Å
524	A	85.4	Confident	87.6	Confident	76 Å²	76	72.3 Å²	72.3	63%	0.628	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-58	145.2	167.2	0	0	0	0	0	110.1	L396	L396-A524 HydrophobicContact CD2-CB 4.19Å
525	P	83.8	Confident	87.9	Confident	52 Å²	52	71 Å²	71	34%	0.338	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-64.2	143.4	173.4	30.2	-31	0	0	0	109.3	L396 A527	L396-P525 HydrophobicContact CD1-CG 4.14Å; L396-P525 HydrophobicContact CD2-CG 4.11Å; P525-A527 PolarHBondContact O-N 3.14Å
526	A	75	Confident	88.1	Confident	68 Å²	68	70 Å²	70	56%	0.562	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-72.2	117.9	174.9	0	0	0	0	0	108.7	E528	A526-E528 HydrophobicContact CB-CG 3.63Å; A526-E528 VanDerWaalsContact CB-OE1 3.29Å; A526-E528 WeakPolarHBondContact CB-OE1 3.31Å; A526-E528 PolarHBondContact O-N 3.04Å
527	A	80.5	Confident	88.4	Confident	49 Å²	49	67.5 Å²	67.5	41%	0.405	44%	0.435	S	S	.	.			trans	-82.5	57.7	-179.3	0	0	0	0	0	110.6	P525 A560	P525-A527 PolarHBondContact O-N 3.14Å; A527-A560 CarbonylContact C-O 3.55Å; A527-A560 WeakPolarHBondContact CA-O 3.4Å; A527-A560 HydrophobicContact CB-CB 4.42Å
528	E	81.8	Confident	88.6	Confident	165 Å²	165	67.1 Å²	67.1	77%	0.771	42%	0.421	S	S	*	.			trans	-92	-7	-164.2	-69.2	176.9	175.5	0	0	114.2	A526 A530	A526-E528 HydrophobicContact CB-CG 3.63Å; A526-E528 VanDerWaalsContact CB-OE1 3.29Å; A526-E528 WeakPolarHBondContact CB-OE1 3.31Å; A526-E528 PolarHBondContact O-N 3.04Å; E528-A530 PolarHBondContact O-N 3.14Å; E528-A530 VanDerWaalsContact O-N 3.09Å
529	M	89.4	Confident	89.1	Confident	47 Å²	47	72.8 Å²	72.8	23%	0.232	44%	0.437	C	S	.	.			trans	-67.6	115	-178.2	-175.9	64.9	64.3	0	0	109.7	A560 D562 F595	M529-A560 WeakPolarHBondContact O-CA 3.44Å; M529-D562 HydrophobicContact CE-CB 4.47Å; M529-F595 HydrophobicContact CE-CE1 3.95Å; M529-F595 HydrophobicContact CE-CE2 4.46Å; M529-F595 HydrophobicContact CE-CZ 3.85Å; M529-F595 HydrophobicContact CG-CD1 4.17Å; M529-F595 HydrophobicContact CG-CD2 3.56Å; M529-F595 HydrophobicContact CG-CE1 4.19Å; M529-F595 HydrophobicContact CG-CE2 3.61Å; M529-F595 HydrophobicContact CG-CG 3.85Å; M529-F595 HydrophobicContact CG-CZ 3.91Å; M529-F595 HydrophobicContact SD-CD1 3.97Å; M529-F595 HydrophobicContact SD-CD2 4.43Å; M529-F595 HydrophobicContact SD-CE1 3.88Å; M529-F595 HydrophobicContact SD-CE2 4.36Å; M529-F595 HydrophobicContact SD-CG 4.24Å; M529-F595 HydrophobicContact SD-CZ 4.07Å
530	A	94.2	Very high	89.9	Confident	57 Å²	57	70.4 Å²	70.4	47%	0.471	41%	0.414	S	S	.	.			trans	-66.6	136.4	174.6	0	0	0	0	0	109.9	E528 A593 G594 F595	E528-A530 PolarHBondContact O-N 3.14Å; E528-A530 VanDerWaalsContact O-N 3.09Å; A530-A593 WeakPolarHBondContact CB-O 3.46Å; A530-G594 CarbonylContact O-C 3.45Å; A530-G594 WeakPolarHBondContact O-CA 3.12Å; A530-F595 PolarHBondContact O-N 3.23Å
531	V	96.7	Very high	90.8	Very high	18 Å²	18	68.1 Å²	68.1	11%	0.109	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	118.3	-178.8	-174.8	0	0	0	0	109.4	F533 R556 L559 A560 F595 V597	V531-F533 HydrophobicContact CG1-CZ 4.47Å; V531-R556 HydrophobicContact CB-CG 4.17Å; V531-L559 HydrophobicContact CG1-CB 4.15Å; V531-L559 HydrophobicContact CG1-CD1 4Å; V531-L559 HydrophobicContact CG2-CB 3.67Å; V531-A560 HydrophobicContact CG2-CB 4.45Å; V531-F595 CarbonylContact C-O 3.54Å; V531-F595 VanDerWaalsContact CA-O 3.29Å; V531-F595 WeakPolarHBondContact CA-O 3.47Å; V531-V597 HydrophobicContact CG1-CG2 4.12Å
532	S	97.3	Very high	91.4	Very high	52 Å²	52	71.7 Å²	71.7	36%	0.364	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	166.1	173.5	61.2	0	0	0	0	111.2	F595 E596 V597	S532-F595 PolarHBondContact N-O 3.36Å; S532-F595 PolarHBondContact OG-O 3.19Å; S532-E596 WeakPolarHBondContact O-CA 3.49Å; S532-V597 PolarHBondContact O-N 3.35Å
533	F	97.9	Very high	91.8	Very high	15 Å²	15	70.7 Å²	70.7	7%	0.066	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.9	177.6	-60.5	-91.1	0	0	0	108.2	V531 V537 E538 L541 T552 I555 R556 V597	V531-F533 HydrophobicContact CG1-CZ 4.47Å; F533-V537 HydrophobicContact CB-CB 4.5Å; F533-V537 HydrophobicContact CB-CG1 4.32Å; F533-V537 HydrophobicContact CD1-CG1 3.75Å; F533-V537 HydrophobicContact CG-CG1 4.49Å; F533-E538 HydrophobicContact CB-CG 3.62Å; F533-L541 HydrophobicContact CD1-CD1 3.61Å; F533-L541 HydrophobicContact CE1-CD1 3.74Å; F533-L541 HydrophobicContact CG-CD1 4.12Å; F533-L541 HydrophobicContact CZ-CD1 4.35Å; F533-T552 HydrophobicContact CD2-CG2 4.45Å; F533-T552 HydrophobicContact CE2-CG2 3.83Å; F533-T552 HydrophobicContact CZ-CG2 4.01Å; F533-I555 HydrophobicContact CE1-CB 4.34Å; F533-I555 HydrophobicContact CE1-CG2 3.83Å; F533-I555 HydrophobicContact CZ-CB 4.35Å; F533-I555 HydrophobicContact CZ-CG2 4.09Å; F533-R556 HydrophobicContact CE2-CB 4.5Å; F533-R556 HydrophobicContact CZ-CB 4.4Å; F533-V597 HydrophobicContact CD1-CB 3.6Å; F533-V597 HydrophobicContact CD1-CG1 4.08Å; F533-V597 HydrophobicContact CD1-CG2 3.92Å; F533-V597 HydrophobicContact CE1-CB 3.97Å; F533-V597 HydrophobicContact CE1-CG1 4.31Å; F533-V597 HydrophobicContact CE1-CG2 3.79Å; F533-V597 HydrophobicContact CG-CB 4.45Å
534	T	97.7	Very high	92.3	Very high	29 Å²	29	68.4 Å²	68.4	18%	0.178	40%	0.398	C	S	.	.			trans	-65.6	153	168.8	60.2	0	0	0	0	110.5	E536 V537 E538 E596 V597 F598	T534-E536 PolarHBondContact O-N 3.32Å; T534-E536 VanDerWaalsContact O-N 3.12Å; T534-V537 PolarHBondContact O-N 3.17Å; T534-V537 VanDerWaalsContact OG1-CG2 3.31Å; T534-V537 WeakPolarHBondContact OG1-CG2 3.22Å; T534-V537 PolarHBondContact OG1-N 3.24Å; T534-E538 PolarHBondContact O-N 3.21Å; T534-E596 HydrophobicContact CG2-CG 4.06Å; T534-V597 PolarHBondContact N-O 3.07Å; T534-V597 PolarHBondContact OG1-O 3.15Å; T534-F598 HydrophobicContact CG2-CB 3.96Å
535	A	96.8	Very high	92.7	Very high	81 Å²	81	67.9 Å²	67.9	67%	0.669	38%	0.383	S	S	*	.	H	α-helix	trans	-56.6	-31.7	180	0	0	0	0	0	113.2	K539	A535-K539 PolarHBondContact O-N 3.44Å
536	E	96.4	Very high	93.1	Very high	135 Å²	135	74 Å²	74	63%	0.631	40%	0.404	S	S	*	.	H	α-helix	trans	-65.4	-48.9	174.1	-176.8	176.5	178.6	0	0	111.5	T534 K539 Q540	T534-E536 PolarHBondContact O-N 3.32Å; T534-E536 VanDerWaalsContact O-N 3.12Å; E536-K539 PolarHBondContact O-N 3.46Å; E536-Q540 WeakPolarHBondContact O-CG 3.29Å; E536-Q540 PolarHBondContact O-N 2.96Å; E536-Q540 PolarHBondContact OE1-NE2 3.13Å
537	V	97.2	Very high	94	Very high	0 Å²	0	79.8 Å²	79.8	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-64.7	-40	178.6	173.5	0	0	0	0	111.3	F533 T534 K539 Q540 L541 V597 L600	F533-V537 HydrophobicContact CB-CB 4.5Å; F533-V537 HydrophobicContact CB-CG1 4.32Å; F533-V537 HydrophobicContact CD1-CG1 3.75Å; F533-V537 HydrophobicContact CG-CG1 4.49Å; T534-V537 PolarHBondContact O-N 3.17Å; T534-V537 VanDerWaalsContact OG1-CG2 3.31Å; T534-V537 WeakPolarHBondContact OG1-CG2 3.22Å; T534-V537 PolarHBondContact OG1-N 3.24Å; V537-K539 VanDerWaalsContact C-N 3.3Å; V537-K539 PolarHBondContact O-N 2.78Å; V537-Q540 WeakPolarHBondContact O-CB 3.43Å; V537-Q540 PolarHBondContact O-N 2.89Å; V537-Q540 VanDerWaalsContact O-N 3.14Å; V537-L541 HydrophobicContact CG1-CD1 3.86Å; V537-L541 HydrophobicContact CG1-CG 4.17Å; V537-L541 WeakPolarHBondContact O-CB 3.31Å; V537-L541 WeakPolarHBondContact O-CG 3.49Å; V537-L541 PolarHBondContact O-N 3.46Å; V537-V597 HydrophobicContact CG1-CG1 4.08Å; V537-L600 HydrophobicContact CG1-CD1 3.77Å; V537-L600 HydrophobicContact CG1-CG 3.94Å
538	E	96.9	Very high	94.5	Very high	104 Å²	104	78.8 Å²	78.8	49%	0.486	40%	0.397	S	S	.	.	H	α-helix	trans	-57.6	-43.4	174.9	-70.6	-172.7	154.4	0	0	111.8	F533 T534 L541 L542	F533-E538 HydrophobicContact CB-CG 3.62Å; T534-E538 PolarHBondContact O-N 3.21Å; E538-L541 PolarHBondContact O-N 2.94Å; E538-L542 WeakPolarHBondContact O-CG 3.41Å; E538-L542 PolarHBondContact O-N 3.27Å
539	K	95.8	Very high	95	Very high	162 Å²	162	75.8 Å²	75.8	70%	0.704	39%	0.393	S	S	*	.	H	α-helix	trans	-65.1	-39.3	176.3	-172	-179.1	179.2	-176.5	0	112.2	A535 E536 V537	A535-K539 PolarHBondContact O-N 3.44Å; E536-K539 PolarHBondContact O-N 3.46Å; V537-K539 VanDerWaalsContact C-N 3.3Å; V537-K539 PolarHBondContact O-N 2.78Å
540	Q	95.9	Very high	95.1	Very high	65 Å²	65	78.2 Å²	78.2	30%	0.304	40%	0.403	S	S	.	.	H	α-helix	trans	-63.8	-45.1	175.2	-69.3	178.7	11.6	0	0	111.1	E536 V537 L542 T543 L544	E536-Q540 WeakPolarHBondContact O-CG 3.29Å; E536-Q540 PolarHBondContact O-N 2.96Å; E536-Q540 PolarHBondContact OE1-NE2 3.13Å; V537-Q540 WeakPolarHBondContact O-CB 3.43Å; V537-Q540 PolarHBondContact O-N 2.89Å; V537-Q540 VanDerWaalsContact O-N 3.14Å; Q540-L542 PolarHBondContact O-N 2.96Å; Q540-T543 WeakPolarHBondContact O-CB 3.46Å; Q540-T543 PolarHBondContact O-N 3.31Å; Q540-L544 WeakPolarHBondContact O-CG 3.35Å; Q540-L544 PolarHBondContact O-N 3.4Å
541	L	96.2	Very high	95.2	Very high	3 Å²	3	75.6 Å²	75.6	2%	0.016	38%	0.381	C	S	.	.	H	α-helix	trans	-58.6	-41.6	-179.8	-76.4	168.2	0	0	0	112.8	F533 V537 E538 T543 L544 E545 L551 T552 I555 L600	F533-L541 HydrophobicContact CD1-CD1 3.61Å; F533-L541 HydrophobicContact CE1-CD1 3.74Å; F533-L541 HydrophobicContact CG-CD1 4.12Å; F533-L541 HydrophobicContact CZ-CD1 4.35Å; V537-L541 HydrophobicContact CG1-CD1 3.86Å; V537-L541 HydrophobicContact CG1-CG 4.17Å; V537-L541 WeakPolarHBondContact O-CB 3.31Å; V537-L541 WeakPolarHBondContact O-CG 3.49Å; V537-L541 PolarHBondContact O-N 3.46Å; E538-L541 PolarHBondContact O-N 2.94Å; L541-T543 PolarHBondContact O-N 3.32Å; L541-T543 VanDerWaalsContact O-N 3.13Å; L541-L544 PolarHBondContact O-N 2.97Å; L541-L544 VanDerWaalsContact O-N 3.1Å; L541-E545 WeakPolarHBondContact O-CB 3.38Å; L541-E545 WeakPolarHBondContact O-CG 3.41Å; L541-E545 PolarHBondContact O-N 3.03Å; L541-L551 HydrophobicContact CD2-CB 4.47Å; L541-L551 HydrophobicContact CD2-CD2 3.82Å; L541-L551 HydrophobicContact CD2-CG 3.88Å; L541-T552 HydrophobicContact CD1-CG2 4.1Å; L541-I555 HydrophobicContact CD2-CD1 4.2Å; L541-L600 HydrophobicContact CD2-CD1 3.59Å; L541-L600 HydrophobicContact CG-CD1 3.84Å
542	L	93.9	Very high	95.2	Very high	126 Å²	126	76.1 Å²	76.1	66%	0.66	39%	0.385	S	S	*	.	H	α-helix	trans	-55.6	-32.1	175.2	-70.9	172.5	0	0	0	113.3	E538 Q540	E538-L542 WeakPolarHBondContact O-CG 3.41Å; E538-L542 PolarHBondContact O-N 3.27Å; Q540-L542 PolarHBondContact O-N 2.96Å
543	T	94.1	Very high	95.1	Very high	92 Å²	92	77 Å²	77	56%	0.564	39%	0.385	S	S	*	.	H	α-helix	trans	-82	-43.6	177.3	-55.7	0	0	0	0	110.9	Q540 L541 E545 K546	Q540-T543 WeakPolarHBondContact O-CB 3.46Å; Q540-T543 PolarHBondContact O-N 3.31Å; L541-T543 PolarHBondContact O-N 3.32Å; L541-T543 VanDerWaalsContact O-N 3.13Å; T543-E545 PolarHBondContact O-N 3.44Å; T543-K546 PolarHBondContact O-N 2.99Å
544	L	94.6	Very high	95	Very high	40 Å²	40	76.5 Å²	76.5	21%	0.209	38%	0.383	C	S	.	.	H	α-helix	trans	-67.7	-31.9	-177.9	-67	177.3	0	0	0	113	Q540 L541 K546 R547 Y548 L551 F584 L600	Q540-L544 WeakPolarHBondContact O-CG 3.35Å; Q540-L544 PolarHBondContact O-N 3.4Å; L541-L544 PolarHBondContact O-N 2.97Å; L541-L544 VanDerWaalsContact O-N 3.1Å; L544-K546 PolarHBondContact O-N 3.47Å; L544-K546 VanDerWaalsContact O-N 3.13Å; L544-R547 PolarHBondContact O-N 2.99Å; L544-Y548 PolarHBondContact O-N 3.11Å; L544-L551 HydrophobicContact CB-CD2 3.79Å; L544-L551 HydrophobicContact CD1-CD2 4.12Å; L544-F584 HydrophobicContact CD1-CD1 4.41Å; L544-F584 HydrophobicContact CD1-CE1 3.79Å; L544-F584 HydrophobicContact CD1-CE2 4.44Å; L544-F584 HydrophobicContact CD1-CZ 3.82Å; L544-F584 HydrophobicContact CD2-CE1 3.91Å; L544-F584 HydrophobicContact CD2-CZ 3.7Å; L544-F584 HydrophobicContact CG-CE1 4.49Å; L544-F584 HydrophobicContact CG-CZ 4.28Å; L544-L600 HydrophobicContact CD1-CD1 4.14Å
545	E	94.1	Very high	95	Very high	65 Å²	65	75.1 Å²	75.1	30%	0.304	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.2	-179.8	-80.6	-170	163.3	0	0	114	L541 T543 R547 Y548 L551 T552	L541-E545 WeakPolarHBondContact O-CB 3.38Å; L541-E545 WeakPolarHBondContact O-CG 3.41Å; L541-E545 PolarHBondContact O-N 3.03Å; T543-E545 PolarHBondContact O-N 3.44Å; E545-R547 PolarHBondContact O-N 3.24Å; E545-Y548 WeakPolarHBondContact CA-O 3.46Å; E545-Y548 CarbonylContact O-C 3.59Å; E545-L551 HydrophobicContact CG-CB 4.16Å; E545-T552 WeakPolarHBondContact OE1-CB 3.49Å; E545-T552 PolarHBondContact OE1-N 3.46Å; E545-T552 PolarHBondContact OE1-OG1 3.32Å
546	K	93	Very high	94.9	Very high	180 Å²	180	76.6 Å²	76.6	78%	0.783	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-30.7	170.9	-62.8	179.9	-178.2	176.8	0	112.4	T543 L544	T543-K546 PolarHBondContact O-N 2.99Å; L544-K546 PolarHBondContact O-N 3.47Å; L544-K546 VanDerWaalsContact O-N 3.13Å
547	R	92.7	Very high	94.9	Very high	191 Å²	191	72.2 Å²	72.2	72%	0.721	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-32.2	179.9	-176.5	174.1	175	-178.3	-3.4	112.4	L544 E545	L544-R547 PolarHBondContact O-N 2.99Å; E545-R547 PolarHBondContact O-N 3.24Å
548	Y	92.4	Very high	94.8	Very high	27 Å²	27	72.2 Å²	72.2	11%	0.106	34%	0.342	C	S	.	.	S	Bend	trans	-122.5	84.8	-179.8	-56.2	-88.6	0	0	0	109.5	L544 E545 Q550 L551 H582 D583 F584	L544-Y548 PolarHBondContact O-N 3.11Å; E545-Y548 WeakPolarHBondContact CA-O 3.46Å; E545-Y548 CarbonylContact O-C 3.59Å; Y548-Q550 PolarHBondContact O-N 3.48Å; Y548-L551 WeakPolarHBondContact O-CB 3.35Å; Y548-L551 PolarHBondContact O-N 2.96Å; Y548-H582 HydrophobicContact CD1-CB 4.2Å; Y548-H582 AromaticContact CD1-ND1 3.83Å; Y548-H582 HydrophobicContact CE1-CB 4.16Å; Y548-D583 PolarHBondContact OH-OD2 2.94Å; Y548-F584 AromaticContact CD2-CE2 3.86Å; Y548-F584 HydrophobicContact CD2-CE2 3.86Å; Y548-F584 HydrophobicContact CD2-CZ 4.01Å; Y548-F584 HydrophobicContact CE1-CE2 4.4Å; Y548-F584 AromaticContact CE2-CE2 3.68Å; Y548-F584 HydrophobicContact CE2-CE2 3.68Å; Y548-F584 AromaticContact CE2-CZ 3.57Å; Y548-F584 HydrophobicContact CE2-CZ 3.57Å; Y548-F584 HydrophobicContact CG-CE2 4.33Å; Y548-F584 AromaticContact CZ-CE2 3.97Å
549	P	91	Very high	94.7	Very high	103 Å²	103	67.3 Å²	67.3	67%	0.669	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	136.6	-179.5	-26	34.9	0	0	0	111.8	L551	P549-L551 VanDerWaalsContact C-N 3.27Å; P549-L551 PolarHBondContact O-N 3.3Å
550	Q	93	Very high	94.7	Very high	98 Å²	98	60.2 Å²	60.2	46%	0.458	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	17.9	-179	-51.6	-176.5	-3.1	0	0	115.8	Y548 T552 L553 F554	Y548-Q550 PolarHBondContact O-N 3.48Å; Q550-T552 VanDerWaalsContact C-N 3.29Å; Q550-T552 PolarHBondContact O-N 3.38Å; Q550-L553 HydrophobicContact CB-CB 4.41Å; Q550-L553 PolarHBondContact O-N 3.19Å; Q550-L553 VanDerWaalsContact O-N 3.1Å; Q550-F554 WeakPolarHBondContact O-CB 3.38Å; Q550-F554 PolarHBondContact O-N 3.07Å
551	L	95.1	Very high	94.4	Very high	2 Å²	2	59 Å²	59	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-53.7	-42.2	-179	-178.2	61	0	0	0	113.3	L541 L544 E545 Y548 P549 L553 F554 I555 F584	L541-L551 HydrophobicContact CD2-CB 4.47Å; L541-L551 HydrophobicContact CD2-CD2 3.82Å; L541-L551 HydrophobicContact CD2-CG 3.88Å; L544-L551 HydrophobicContact CB-CD2 3.79Å; L544-L551 HydrophobicContact CD1-CD2 4.12Å; E545-L551 HydrophobicContact CG-CB 4.16Å; Y548-L551 WeakPolarHBondContact O-CB 3.35Å; Y548-L551 PolarHBondContact O-N 2.96Å; P549-L551 VanDerWaalsContact C-N 3.27Å; P549-L551 PolarHBondContact O-N 3.3Å; L551-L553 PolarHBondContact O-N 3.26Å; L551-F554 HydrophobicContact CD1-CD1 4.49Å; L551-F554 PolarHBondContact O-N 3.02Å; L551-I555 HydrophobicContact CD1-CD1 3.85Å; L551-I555 HydrophobicContact CD1-CG1 4.16Å; L551-I555 HydrophobicContact CG-CD1 3.92Å; L551-I555 WeakPolarHBondContact O-CG1 3.34Å; L551-I555 PolarHBondContact O-N 3.33Å; L551-F584 HydrophobicContact CD2-CD2 4.43Å; L551-F584 HydrophobicContact CD2-CE2 4.06Å
552	T	96.4	Very high	94.1	Very high	29 Å²	29	59.7 Å²	59.7	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-45.9	178.6	-52.7	0	0	0	0	111.6	F533 L541 E545 Q550 R556	F533-T552 HydrophobicContact CD2-CG2 4.45Å; F533-T552 HydrophobicContact CE2-CG2 3.83Å; F533-T552 HydrophobicContact CZ-CG2 4.01Å; L541-T552 HydrophobicContact CD1-CG2 4.1Å; E545-T552 WeakPolarHBondContact OE1-CB 3.49Å; E545-T552 PolarHBondContact OE1-N 3.46Å; E545-T552 PolarHBondContact OE1-OG1 3.32Å; Q550-T552 VanDerWaalsContact C-N 3.29Å; Q550-T552 PolarHBondContact O-N 3.38Å; T552-R556 WeakPolarHBondContact O-CB 3.22Å; T552-R556 PolarHBondContact O-N 3.28Å; T552-R556 VanDerWaalsContact O-N 3.09Å
553	L	95.9	Very high	93.9	Very high	70 Å²	70	54.9 Å²	54.9	37%	0.366	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-42.9	178.9	178.8	62.6	0	0	0	110.8	Q550 L551 R556 E557	Q550-L553 HydrophobicContact CB-CB 4.41Å; Q550-L553 PolarHBondContact O-N 3.19Å; Q550-L553 VanDerWaalsContact O-N 3.1Å; L551-L553 PolarHBondContact O-N 3.26Å; L553-R556 PolarHBondContact O-N 3.01Å; L553-E557 HydrophobicContact CD1-CG 4.09Å; L553-E557 HydrophobicContact CG-CG 4.39Å; L553-E557 WeakPolarHBondContact O-CB 3.46Å; L553-E557 WeakPolarHBondContact O-CG 3.39Å; L553-E557 PolarHBondContact O-N 2.86Å
554	F	95.9	Very high	93.5	Very high	4 Å²	4	51 Å²	51	2%	0.018	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-51	178.3	173.4	-116.4	0	0	0	112.9	P383 Y384 V397 S399 A400 Q550 L551 R556 E557 V558 L581 H582	P383-F554 HydrophobicContact CB-CE1 3.67Å; P383-F554 HydrophobicContact CB-CE2 4.39Å; P383-F554 HydrophobicContact CB-CZ 3.55Å; P383-F554 HydrophobicContact CG-CE1 4.11Å; P383-F554 HydrophobicContact CG-CE2 3.91Å; P383-F554 HydrophobicContact CG-CZ 3.5Å; P383-F554 VanDerWaalsContact CG-CZ 3.5Å; Y384-F554 HydrophobicContact CD1-CZ 4.39Å; Y384-F554 HydrophobicContact CE1-CE2 4.07Å; Y384-F554 AromaticContact CE1-CZ 3.89Å; Y384-F554 HydrophobicContact CE1-CZ 3.89Å; Y384-F554 AromaticContact CZ-CE2 3.93Å; V397-F554 HydrophobicContact CG1-CD2 3.84Å; V397-F554 HydrophobicContact CG1-CE2 4.03Å; S399-F554 WeakPolarHBondContact OG-CA 3.33Å; S399-F554 PolarHBondContact OG-N 2.88Å; A400-F554 HydrophobicContact CB-CD2 4.24Å; A400-F554 HydrophobicContact CB-CE2 3.87Å; Q550-F554 WeakPolarHBondContact O-CB 3.38Å; Q550-F554 PolarHBondContact O-N 3.07Å; L551-F554 HydrophobicContact CD1-CD1 4.49Å; L551-F554 PolarHBondContact O-N 3.02Å; F554-R556 VanDerWaalsContact C-N 3.29Å; F554-R556 PolarHBondContact O-N 3.36Å; F554-E557 PolarHBondContact O-N 3.43Å; F554-V558 HydrophobicContact CD2-CG2 3.89Å; F554-V558 HydrophobicContact CE1-CG2 4.47Å; F554-V558 HydrophobicContact CE2-CG2 3.44Å; F554-V558 VanDerWaalsContact CE2-CG2 3.44Å; F554-V558 HydrophobicContact CZ-CG2 3.77Å; F554-V558 VanDerWaalsContact O-CG2 3.31Å; F554-V558 WeakPolarHBondContact O-CG2 3.36Å; F554-V558 PolarHBondContact O-N 2.69Å; F554-L581 HydrophobicContact CE1-CB 4.04Å; F554-L581 HydrophobicContact CE1-CD1 4.23Å; F554-L581 HydrophobicContact CE1-CD2 4.17Å; F554-L581 HydrophobicContact CE1-CG 4.37Å; F554-L581 HydrophobicContact CZ-CD2 4.07Å; F554-H582 AromaticContact CD1-CD2 3.81Å; F554-H582 AromaticContact CD1-NE2 3.81Å; F554-H582 AromaticContact CE1-CD2 3.75Å; F554-H582 AromaticContact CE1-NE2 3.92Å
555	I	96.7	Very high	92.6	Very high	1 Å²	1	51 Å²	51	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-44.4	177.4	-67.9	167.4	0	0	0	110.5	F533 L541 L551 V558 L559 L581 V586 V597 L600	F533-I555 HydrophobicContact CE1-CB 4.34Å; F533-I555 HydrophobicContact CE1-CG2 3.83Å; F533-I555 HydrophobicContact CZ-CB 4.35Å; F533-I555 HydrophobicContact CZ-CG2 4.09Å; L541-I555 HydrophobicContact CD2-CD1 4.2Å; L551-I555 HydrophobicContact CD1-CD1 3.85Å; L551-I555 HydrophobicContact CD1-CG1 4.16Å; L551-I555 HydrophobicContact CG-CD1 3.92Å; L551-I555 WeakPolarHBondContact O-CG1 3.34Å; L551-I555 PolarHBondContact O-N 3.33Å; I555-V558 PolarHBondContact O-N 3.01Å; I555-L559 HydrophobicContact CG2-CD1 3.87Å; I555-L559 HydrophobicContact CG2-CG 4.31Å; I555-L559 WeakPolarHBondContact O-CB 3.41Å; I555-L559 WeakPolarHBondContact O-CG 3.48Å; I555-L559 PolarHBondContact O-N 2.82Å; I555-L581 HydrophobicContact CG1-CD1 4.49Å; I555-V586 HydrophobicContact CD1-CG2 4.15Å; I555-V586 HydrophobicContact CG1-CG2 4.32Å; I555-V586 HydrophobicContact CG2-CG1 3.87Å; I555-V597 HydrophobicContact CG2-CG2 4.12Å; I555-L600 HydrophobicContact CD1-CD2 3.94Å
556	R	96.6	Very high	91.5	Very high	112 Å²	112	50 Å²	50	42%	0.423	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-50	178.1	178.5	177.3	-66.1	152.9	2.4	111.6	V531 F533 T552 L553 F554 L559 A560	V531-R556 HydrophobicContact CB-CG 4.17Å; F533-R556 HydrophobicContact CE2-CB 4.5Å; F533-R556 HydrophobicContact CZ-CB 4.4Å; T552-R556 WeakPolarHBondContact O-CB 3.22Å; T552-R556 PolarHBondContact O-N 3.28Å; T552-R556 VanDerWaalsContact O-N 3.09Å; L553-R556 PolarHBondContact O-N 3.01Å; F554-R556 VanDerWaalsContact C-N 3.29Å; F554-R556 PolarHBondContact O-N 3.36Å; R556-L559 PolarHBondContact O-N 2.66Å; R556-A560 WeakPolarHBondContact O-CB 3.25Å; R556-A560 PolarHBondContact O-N 2.78Å
557	E	95.4	Very high	90.3	Very high	42 Å²	42	50 Å²	50	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-64.6	-40	-179.1	-74.8	-175.8	163.9	0	0	112.4	V397 K398 S399 L553 F554 Q561	V397-E557 HydrophobicContact CB-CB 4.41Å; V397-E557 HydrophobicContact CG1-CB 3.75Å; V397-E557 HydrophobicContact CG2-CB 4.43Å; K398-E557 PolarHBondContact N-OE2 3.13Å; S399-E557 VanDerWaalsContact CB-OE2 3.32Å; S399-E557 WeakPolarHBondContact CB-OE2 3.18Å; S399-E557 PolarHBondContact N-OE2 2.9Å; S399-E557 PolarHBondContact OG-OE2 3.4Å; L553-E557 HydrophobicContact CD1-CG 4.09Å; L553-E557 HydrophobicContact CG-CG 4.39Å; L553-E557 WeakPolarHBondContact O-CB 3.46Å; L553-E557 WeakPolarHBondContact O-CG 3.39Å; L553-E557 PolarHBondContact O-N 2.86Å; F554-E557 PolarHBondContact O-N 3.43Å; E557-Q561 WeakPolarHBondContact O-CG 3.31Å
558	V	95.2	Very high	89.2	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-50.1	176.5	170.7	0	0	0	0	111	Y384 A389 V397 F554 I555 A560 Q561 L581	Y384-V558 HydrophobicContact CE1-CG2 4Å; A389-V558 HydrophobicContact CB-CG1 3.68Å; V397-V558 HydrophobicContact CG1-CG2 3.9Å; V397-V558 HydrophobicContact CG2-CG2 4.12Å; F554-V558 HydrophobicContact CD2-CG2 3.89Å; F554-V558 HydrophobicContact CE1-CG2 4.47Å; F554-V558 HydrophobicContact CE2-CG2 3.44Å; F554-V558 VanDerWaalsContact CE2-CG2 3.44Å; F554-V558 HydrophobicContact CZ-CG2 3.77Å; F554-V558 VanDerWaalsContact O-CG2 3.31Å; F554-V558 WeakPolarHBondContact O-CG2 3.36Å; F554-V558 PolarHBondContact O-N 2.69Å; I555-V558 PolarHBondContact O-N 3.01Å; V558-A560 VanDerWaalsContact C-N 3.32Å; V558-A560 PolarHBondContact O-N 2.85Å; V558-Q561 WeakPolarHBondContact O-CB 3.45Å; V558-Q561 PolarHBondContact O-N 3.38Å; V558-L581 HydrophobicContact CB-CD1 4.35Å; V558-L581 HydrophobicContact CG1-CD1 4.03Å; V558-L581 HydrophobicContact CG2-CD1 4.5Å
559	L	95.4	Very high	88	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-69.8	-30	-178.1	-68.6	-173.8	0	0	0	112.3	V531 I555 R556 Q561 D562 P563 W588 F595 V597	V531-L559 HydrophobicContact CG1-CB 4.15Å; V531-L559 HydrophobicContact CG1-CD1 4Å; V531-L559 HydrophobicContact CG2-CB 3.67Å; I555-L559 HydrophobicContact CG2-CD1 3.87Å; I555-L559 HydrophobicContact CG2-CG 4.31Å; I555-L559 WeakPolarHBondContact O-CB 3.41Å; I555-L559 WeakPolarHBondContact O-CG 3.48Å; I555-L559 PolarHBondContact O-N 2.82Å; R556-L559 PolarHBondContact O-N 2.66Å; L559-Q561 PolarHBondContact O-N 2.75Å; L559-D562 PolarHBondContact O-N 2.71Å; L559-P563 HydrophobicContact CD2-CG 4.07Å; L559-W588 HydrophobicContact CD1-CB 4.31Å; L559-W588 HydrophobicContact CD1-CD2 4.4Å; L559-W588 HydrophobicContact CD1-CG 4.31Å; L559-W588 HydrophobicContact CD2-CD2 3.88Å; L559-W588 HydrophobicContact CD2-CE3 3.92Å; L559-W588 HydrophobicContact CD2-CH2 4Å; L559-W588 HydrophobicContact CD2-CZ2 3.99Å; L559-W588 HydrophobicContact CD2-CZ3 4Å; L559-F595 HydrophobicContact CB-CD2 4.2Å; L559-V597 HydrophobicContact CD1-CG2 3.48Å; L559-V597 VanDerWaalsContact CD1-CG2 3.48Å
560	A	94.5	Very high	86.8	Confident	13 Å²	13	47.7 Å²	47.7	11%	0.107	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-23.9	174.3	0	0	0	0	0	113.3	A527 M529 V531 R556 V558 D562	A527-A560 CarbonylContact C-O 3.55Å; A527-A560 WeakPolarHBondContact CA-O 3.4Å; A527-A560 HydrophobicContact CB-CB 4.42Å; M529-A560 WeakPolarHBondContact O-CA 3.44Å; V531-A560 HydrophobicContact CG2-CB 4.45Å; R556-A560 WeakPolarHBondContact O-CB 3.25Å; R556-A560 PolarHBondContact O-N 2.78Å; V558-A560 VanDerWaalsContact C-N 3.32Å; V558-A560 PolarHBondContact O-N 2.85Å; A560-D562 PolarHBondContact O-N 3.48Å
561	Q	91.1	Very high	85.4	Confident	39 Å²	39	45.6 Å²	45.6	18%	0.182	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-5.7	174.1	-60.4	-59.8	-45.7	0	0	113.6	L396 V397 E557 V558 L559	L396-Q561 PolarHBondContact O-NE2 2.6Å; L396-Q561 VanDerWaalsContact O-NE2 3.13Å; V397-Q561 HydrophobicContact CG2-CG 4.13Å; E557-Q561 WeakPolarHBondContact O-CG 3.31Å; V558-Q561 WeakPolarHBondContact O-CB 3.45Å; V558-Q561 PolarHBondContact O-N 3.38Å; L559-Q561 PolarHBondContact O-N 2.75Å
562	D	90.2	Very high	83.9	Confident	19 Å²	19	53.7 Å²	53.7	10%	0.102	28%	0.276	C	S	.	.			trans	52.1	79.2	-172.6	-172.7	4.1	0	0	0	112.1	M529 L559 A560 R564 K569 F595	M529-D562 HydrophobicContact CE-CB 4.47Å; L559-D562 PolarHBondContact O-N 2.71Å; A560-D562 PolarHBondContact O-N 3.48Å; D562-R564 PolarHBondContact O-N 2.85Å; D562-R564 VanDerWaalsContact O-N 3.13Å; D562-R564 WeakPolarHBondContact OD1-CB 3.48Å; D562-R564 WeakPolarHBondContact OD1-CG 3.48Å; D562-R564 IonicContact OD1-CZ 3.77Å; D562-R564 PolarHBondContact OD1-N 3.05Å; D562-R564 IonicContact OD1-NE 2.76Å; D562-R564 PolarHBondContact OD1-NE 3.21Å; D562-R564 IonicContact OD1-NH2 2.88Å; D562-R564 PolarHBondContact OD1-NH2 3.29Å; D562-R564 IonicContact OD2-CZ 3.04Å; D562-R564 IonicContact OD2-NE 3.69Å; D562-R564 IonicContact OD2-NH2 2.61Å; D562-R564 PolarHBondContact OD2-NH2 3.02Å; D562-K569 VanDerWaalsContact OD2-CE 3.22Å; D562-K569 WeakPolarHBondContact OD2-CE 3.44Å; D562-K569 IonicContact OD2-NZ 3.83Å; D562-K569 PolarHBondContact OD2-NZ 3.41Å; D562-F595 WeakPolarHBondContact OD1-CZ 3.21Å
563	P	88.2	Confident	83	Confident	24 Å²	24	56.3 Å²	56.3	16%	0.156	29%	0.291	C	S	.	.			trans	-69.9	-8.9	-175.4	30.6	-37.2	0	0	0	113.4	F388 A389 L559 W588	F388-P563 HydrophobicContact CE2-CB 4.38Å; F388-P563 WeakPolarHBondContact CE2-O 3.32Å; F388-P563 HydrophobicContact CZ-CB 4.32Å; A389-P563 HydrophobicContact CB-CB 3.46Å; A389-P563 VanDerWaalsContact CB-CB 3.46Å; A389-P563 HydrophobicContact CB-CG 4.06Å; L559-P563 HydrophobicContact CD2-CG 4.07Å; P563-W588 HydrophobicContact CG-CH2 3.99Å; P563-W588 HydrophobicContact CG-CZ2 3.77Å
564	R	86.7	Confident	82.3	Confident	12 Å²	12	55.1 Å²	55.1	5%	0.045	30%	0.297	C	S	.	.	S	Bend	trans	-58.2	149.8	-178.4	-60.5	177.8	-61.8	173.2	-1.3	111	D562 A566 Y577 F595	D562-R564 PolarHBondContact O-N 2.85Å; D562-R564 VanDerWaalsContact O-N 3.13Å; D562-R564 WeakPolarHBondContact OD1-CB 3.48Å; D562-R564 WeakPolarHBondContact OD1-CG 3.48Å; D562-R564 IonicContact OD1-CZ 3.77Å; D562-R564 PolarHBondContact OD1-N 3.05Å; D562-R564 IonicContact OD1-NE 2.76Å; D562-R564 PolarHBondContact OD1-NE 3.21Å; D562-R564 IonicContact OD1-NH2 2.88Å; D562-R564 PolarHBondContact OD1-NH2 3.29Å; D562-R564 IonicContact OD2-CZ 3.04Å; D562-R564 IonicContact OD2-NE 3.69Å; D562-R564 IonicContact OD2-NH2 2.61Å; D562-R564 PolarHBondContact OD2-NH2 3.02Å; R564-A566 PolarHBondContact O-N 2.82Å; R564-Y577 HydrophobicContact CB-CE1 4.44Å; R564-Y577 HydrophobicContact CG-CD1 4.26Å; R564-Y577 HydrophobicContact CG-CD2 4.42Å; R564-Y577 HydrophobicContact CG-CE1 3.88Å; R564-Y577 HydrophobicContact CG-CE2 4.09Å; R564-F595 HydrophobicContact CG-CZ 4.24Å
565	P	75.5	Confident	82	Confident	39 Å²	39	58.8 Å²	58.8	25%	0.253	31%	0.312	S	S	.	.			trans	-55.4	140.5	170.2	-22.2	32.4	0	0	0	111.2	Y567 R568	P565-Y567 HydrophobicContact CB-CD1 3.72Å; P565-Y567 HydrophobicContact CB-CE1 3.24Å; P565-Y567 HydrophobicContact CB-CE2 4.29Å; P565-Y567 HydrophobicContact CB-CG 4.4Å; P565-Y567 HydrophobicContact CG-CE1 4.16Å; P565-Y567 PolarHBondContact O-N 3.08Å; P565-Y567 VanDerWaalsContact O-N 3.07Å; P565-R568 HydrophobicContact CB-CG 4.34Å; P565-R568 HydrophobicContact CG-CG 4.48Å; P565-R568 WeakPolarHBondContact O-CB 3.36Å; P565-R568 PolarHBondContact O-N 3.47Å
566	A	70.4	Confident	81.8	Confident	44 Å²	44	62.3 Å²	62.3	36%	0.364	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-55.9	-32.7	-173.6	0	0	0	0	0	113.8	P446 R564 R568 K569	P446-A566 HydrophobicContact CB-CB 4.4Å; R564-A566 PolarHBondContact O-N 2.82Å; A566-R568 PolarHBondContact O-N 3.02Å; A566-K569 PolarHBondContact O-N 2.89Å
567	Y	67.1	Low	81.6	Confident	180 Å²	180	57.9 Å²	57.9	71%	0.706	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-73.1	-10.4	177.7	63.2	-96	0	0	0	114	P565	P565-Y567 HydrophobicContact CB-CD1 3.72Å; P565-Y567 HydrophobicContact CB-CE1 3.24Å; P565-Y567 HydrophobicContact CB-CE2 4.29Å; P565-Y567 HydrophobicContact CB-CG 4.4Å; P565-Y567 HydrophobicContact CG-CE1 4.16Å; P565-Y567 PolarHBondContact O-N 3.08Å; P565-Y567 VanDerWaalsContact O-N 3.07Å
568	R	70.8	Confident	81.6	Confident	80 Å²	80	57.9 Å²	57.9	30%	0.302	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-101.4	3.4	178.2	-63.4	-161.3	176.8	-176.9	-0.8	113.7	P565 A566 G570 E571 Y577	P565-R568 HydrophobicContact CB-CG 4.34Å; P565-R568 HydrophobicContact CG-CG 4.48Å; P565-R568 WeakPolarHBondContact O-CB 3.36Å; P565-R568 PolarHBondContact O-N 3.47Å; A566-R568 PolarHBondContact O-N 3.02Å; R568-G570 PolarHBondContact O-N 3.47Å; R568-E571 HydrophobicContact CB-CG 4.11Å; R568-E571 VanDerWaalsContact CD-OE1 3.26Å; R568-E571 WeakPolarHBondContact CD-OE1 3.42Å; R568-E571 VanDerWaalsContact CG-OE1 3.3Å; R568-E571 WeakPolarHBondContact CG-OE1 3.36Å; R568-E571 IonicContact NE-OE1 3.31Å; R568-E571 WeakPolarHBondContact O-CB 3.4Å; R568-E571 WeakPolarHBondContact O-CG 3.04Å; R568-E571 PolarHBondContact O-N 3.43Å; R568-Y577 WeakPolarHBondContact CD-OH 3.06Å
569	K	67.4	Low	81.6	Confident	111 Å²	111	57.8 Å²	57.8	48%	0.483	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.1	-176.4	-71.6	-165.5	171.1	-145.4	0	113.9	D562 A566	D562-K569 VanDerWaalsContact OD2-CE 3.22Å; D562-K569 WeakPolarHBondContact OD2-CE 3.44Å; D562-K569 IonicContact OD2-NZ 3.83Å; D562-K569 PolarHBondContact OD2-NZ 3.41Å; A566-K569 PolarHBondContact O-N 2.89Å
570	G	64.4	Low	81.5	Confident	81 Å²	81	61.5 Å²	61.5	84%	0.835	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	16.7	175.9	0	0	0	0	0	115.1	R568	R568-G570 PolarHBondContact O-N 3.47Å
571	E	64.9	Low	81.5	Confident	54 Å²	54	60.9 Å²	60.9	25%	0.252	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-73.4	154.1	179.9	-76.2	-179.2	161.6	0	0	113.8	R568 K575 Y577	R568-E571 HydrophobicContact CB-CG 4.11Å; R568-E571 VanDerWaalsContact CD-OE1 3.26Å; R568-E571 WeakPolarHBondContact CD-OE1 3.42Å; R568-E571 VanDerWaalsContact CG-OE1 3.3Å; R568-E571 WeakPolarHBondContact CG-OE1 3.36Å; R568-E571 IonicContact NE-OE1 3.31Å; R568-E571 WeakPolarHBondContact O-CB 3.4Å; R568-E571 WeakPolarHBondContact O-CG 3.04Å; R568-E571 PolarHBondContact O-N 3.43Å; E571-K575 IonicContact OE1-NZ 2.87Å; E571-K575 PolarHBondContact OE1-NZ 3.37Å; E571-K575 WeakPolarHBondContact OE2-CD 3.29Å; E571-K575 WeakPolarHBondContact OE2-CE 3.5Å; E571-K575 IonicContact OE2-NZ 2.63Å; E571-K575 PolarHBondContact OE2-NZ 2.85Å; E571-Y577 PolarHBondContact OE2-OH 2.89Å
572	E	64.1	Low	81.6	Confident	173 Å²	173	61.2 Å²	61.2	81%	0.808	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-62.1	146.3	-177.1	-64.8	178	169.4	0	0	113.7
573	T	77.1	Confident	81.7	Confident	83 Å²	83	63.2 Å²	63.2	51%	0.509	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	136	169.7	-53.9	0	0	0	0	110.9	D592	T573-D592 WeakPolarHBondContact CG2-OD1 3.43Å; T573-D592 PolarHBondContact OG1-OD1 3.13Å
574	G	81.3	Confident	82	Confident	46 Å²	46	62.7 Å²	62.7	47%	0.474	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.1	-15.6	177.7	0	0	0	0	0	115.1	T576 V590	G574-T576 PolarHBondContact O-N 3.26Å; G574-V590 PolarHBondContact N-O 3.22Å
575	K	88.5	Confident	82.4	Confident	81 Å²	81	62.9 Å²	62.9	35%	0.352	34%	0.343	S	S	.	.			trans	-66.8	135.4	178.5	-157.3	-179.9	-169.5	158.1	0	111.8	E571 Y577 R589 V590	E571-K575 IonicContact OE1-NZ 2.87Å; E571-K575 PolarHBondContact OE1-NZ 3.37Å; E571-K575 WeakPolarHBondContact OE2-CD 3.29Å; E571-K575 WeakPolarHBondContact OE2-CE 3.5Å; E571-K575 IonicContact OE2-NZ 2.63Å; E571-K575 PolarHBondContact OE2-NZ 2.85Å; K575-Y577 HydrophobicContact CB-CE2 4.36Å; K575-Y577 HydrophobicContact CD-CE2 4.16Å; K575-Y577 HydrophobicContact CG-CE2 4.28Å; K575-R589 WeakPolarHBondContact O-CA 3.47Å; K575-V590 PolarHBondContact O-N 3.03Å
576	T	92.3	Very high	83.5	Confident	75 Å²	75	61 Å²	61	46%	0.46	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145.9	-178.8	60.9	0	0	0	0	112.2	G574 W588 R589 F598	G574-T576 PolarHBondContact O-N 3.26Å; T576-W588 CarbonylContact C-O 3.57Å; T576-W588 WeakPolarHBondContact CA-O 3.49Å; T576-R589 HydrophobicContact CG2-CB 4.25Å; T576-F598 HydrophobicContact CG2-CE1 3.84Å; T576-F598 HydrophobicContact CG2-CZ 3.9Å
577	Y	93.7	Very high	84.7	Confident	18 Å²	18	62.7 Å²	62.7	7%	0.071	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	161.7	175.8	-71.1	-93.5	0	0	0	109.9	R564 R568 E571 K575 R587 W588 V590	R564-Y577 HydrophobicContact CB-CE1 4.44Å; R564-Y577 HydrophobicContact CG-CD1 4.26Å; R564-Y577 HydrophobicContact CG-CD2 4.42Å; R564-Y577 HydrophobicContact CG-CE1 3.88Å; R564-Y577 HydrophobicContact CG-CE2 4.09Å; R568-Y577 WeakPolarHBondContact CD-OH 3.06Å; E571-Y577 PolarHBondContact OE2-OH 2.89Å; K575-Y577 HydrophobicContact CB-CE2 4.36Å; K575-Y577 HydrophobicContact CD-CE2 4.16Å; K575-Y577 HydrophobicContact CG-CE2 4.28Å; Y577-R587 WeakPolarHBondContact O-CA 3.31Å; Y577-W588 HydrophobicContact CD1-CZ2 4.37Å; Y577-W588 HydrophobicContact CG-CH2 4.43Å; Y577-W588 AromaticContact CG-CZ2 3.87Å; Y577-W588 HydrophobicContact CG-CZ2 3.87Å; Y577-W588 PolarHBondContact N-O 3.14Å; Y577-W588 PolarHBondContact O-N 3.09Å; Y577-V590 HydrophobicContact CD2-CG2 4.17Å; Y577-V590 HydrophobicContact CE2-CG2 3.87Å
578	A	94.4	Very high	86.1	Confident	42 Å²	42	54.1 Å²	54.1	35%	0.347	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	144.2	-176.9	0	0	0	0	0	109.5	F388 N585 V586 R587	F388-A578 WeakPolarHBondContact CE1-O 3.4Å; A578-N585 WeakPolarHBondContact CB-OD1 3.19Å; A578-V586 WeakPolarHBondContact CA-O 3.39Å; A578-R587 HydrophobicContact CB-CG 4.26Å
579	V	94.9	Very high	87.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	140.1	176.1	64	0	0	0	0	111.4	E386 F388 A389 L581 V586 W588	E386-V579 HydrophobicContact CG-CG2 4.47Å; E386-V579 VanDerWaalsContact OE1-CA 3.29Å; E386-V579 WeakPolarHBondContact OE1-CA 3.26Å; E386-V579 WeakPolarHBondContact OE1-CG2 3.46Å; F388-V579 HydrophobicContact CD1-CB 3.9Å; F388-V579 HydrophobicContact CD1-CG2 3.85Å; F388-V579 HydrophobicContact CE1-CB 4.15Å; A389-V579 HydrophobicContact CB-CB 4.48Å; A389-V579 HydrophobicContact CB-CG2 3.66Å; V579-L581 HydrophobicContact CG1-CD1 3.92Å; V579-L581 HydrophobicContact CG1-CG 3.95Å; V579-L581 HydrophobicContact CG2-CD2 4.28Å; V579-L581 HydrophobicContact CG2-CG 4.22Å; V579-L581 PolarHBondContact O-N 3.32Å; V579-V586 HydrophobicContact CG1-CB 4Å; V579-V586 PolarHBondContact N-O 2.62Å; V579-V586 PolarHBondContact O-N 3.02Å; V579-W588 HydrophobicContact CB-CH2 4.26Å; V579-W588 HydrophobicContact CB-CZ3 3.88Å; V579-W588 HydrophobicContact CG1-CE3 4.4Å; V579-W588 HydrophobicContact CG1-CH2 4.16Å; V579-W588 HydrophobicContact CG1-CZ3 3.54Å
580	W	94.9	Very high	88.5	Confident	77 Å²	77	50.7 Å²	50.7	29%	0.292	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	105.5	175.4	-67.7	104.1	0	0	0	112.4	K385 E386 F584 N585 R603	K385-W580 HydrophobicContact CB-CB 3.91Å; K385-W580 PolarHBondContact N-O 3Å; E386-W580 HydrophobicContact CG-CB 4.26Å; E386-W580 PolarHBondContact OE1-N 2.76Å; W580-F584 WeakPolarHBondContact CA-O 3.49Å; W580-F584 VanDerWaalsContact CE3-C 3.49Å; W580-N585 HydrophobicContact CD2-CB 4.25Å; W580-N585 HydrophobicContact CE3-CB 3.86Å; W580-N585 HydrophobicContact CH2-CB 3.61Å; W580-N585 HydrophobicContact CZ2-CB 3.98Å; W580-N585 HydrophobicContact CZ3-CB 3.52Å; W580-N585 VanDerWaalsContact CZ3-N 3.29Å; W580-R603 HydrophobicContact CE3-CB 4.13Å; W580-R603 HydrophobicContact CE3-CG 4.11Å; W580-R603 HydrophobicContact CH2-CB 4.24Å; W580-R603 HydrophobicContact CH2-CG 4.1Å; W580-R603 HydrophobicContact CZ3-CB 3.52Å; W580-R603 HydrophobicContact CZ3-CG 3.67Å
581	L	94.6	Very high	89.8	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.3	177.2	-64.2	178	0	0	0	110.2	P383 Y384 F554 I555 V558 V579 D583 F584 V586	P383-L581 CarbonylContact O-C 3.55Å; P383-L581 WeakPolarHBondContact O-CA 3.32Å; Y384-L581 HydrophobicContact CD1-CD2 3.81Å; Y384-L581 HydrophobicContact CE1-CD2 4.24Å; F554-L581 HydrophobicContact CE1-CB 4.04Å; F554-L581 HydrophobicContact CE1-CD1 4.23Å; F554-L581 HydrophobicContact CE1-CD2 4.17Å; F554-L581 HydrophobicContact CE1-CG 4.37Å; F554-L581 HydrophobicContact CZ-CD2 4.07Å; I555-L581 HydrophobicContact CG1-CD1 4.49Å; V558-L581 HydrophobicContact CB-CD1 4.35Å; V558-L581 HydrophobicContact CG1-CD1 4.03Å; V558-L581 HydrophobicContact CG2-CD1 4.5Å; V579-L581 HydrophobicContact CG1-CD1 3.92Å; V579-L581 HydrophobicContact CG1-CG 3.95Å; V579-L581 HydrophobicContact CG2-CD2 4.28Å; V579-L581 HydrophobicContact CG2-CG 4.22Å; V579-L581 PolarHBondContact O-N 3.32Å; L581-D583 PolarHBondContact O-N 2.57Å; L581-F584 PolarHBondContact N-O 3.37Å; L581-F584 PolarHBondContact O-N 2.87Å; L581-F584 VanDerWaalsContact O-O 3.14Å; L581-V586 HydrophobicContact CB-CG2 3.98Å; L581-V586 HydrophobicContact CD1-CG2 4.13Å; L581-V586 HydrophobicContact CG-CG2 4.36Å
582	H	92.6	Very high	90.9	Very high	45 Å²	45	52.8 Å²	52.8	21%	0.208	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	-117.3	-166.5	-70.7	-81	0	0	0	111.1	P383 K385 Y548 F554 F584	P383-H582 PolarHBondContact O-N 2.86Å; K385-H582 WeakPolarHBondContact CE-O 3.47Å; K385-H582 WeakPolarHBondContact CG-O 3.31Å; Y548-H582 HydrophobicContact CD1-CB 4.2Å; Y548-H582 AromaticContact CD1-ND1 3.83Å; Y548-H582 HydrophobicContact CE1-CB 4.16Å; F554-H582 AromaticContact CD1-CD2 3.81Å; F554-H582 AromaticContact CD1-NE2 3.81Å; F554-H582 AromaticContact CE1-CD2 3.75Å; F554-H582 AromaticContact CE1-NE2 3.92Å; H582-F584 HydrophobicContact CB-CD2 4.18Å; H582-F584 HydrophobicContact CB-CE2 4.42Å
583	D	92.1	Very high	92.1	Very high	61 Å²	61	48.6 Å²	48.6	33%	0.326	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	24.4	-179.5	-57.1	-42.3	0	0	0	110.7	Y548 L581 P602 R603	Y548-D583 PolarHBondContact OH-OD2 2.94Å; L581-D583 PolarHBondContact O-N 2.57Å; D583-P602 WeakPolarHBondContact O-CA 3.29Å; D583-R603 WeakPolarHBondContact O-CB 3.49Å; D583-R603 PolarHBondContact O-N 3.21Å
584	F	94.7	Very high	92.8	Very high	14 Å²	14	45 Å²	45	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.9	-173.8	-50.8	-77.6	0	0	0	112.3	L544 Y548 L551 W580 L581 H582 V586 E601	L544-F584 HydrophobicContact CD1-CD1 4.41Å; L544-F584 HydrophobicContact CD1-CE1 3.79Å; L544-F584 HydrophobicContact CD1-CE2 4.44Å; L544-F584 HydrophobicContact CD1-CZ 3.82Å; L544-F584 HydrophobicContact CD2-CE1 3.91Å; L544-F584 HydrophobicContact CD2-CZ 3.7Å; L544-F584 HydrophobicContact CG-CE1 4.49Å; L544-F584 HydrophobicContact CG-CZ 4.28Å; Y548-F584 AromaticContact CD2-CE2 3.86Å; Y548-F584 HydrophobicContact CD2-CE2 3.86Å; Y548-F584 HydrophobicContact CD2-CZ 4.01Å; Y548-F584 HydrophobicContact CE1-CE2 4.4Å; Y548-F584 AromaticContact CE2-CE2 3.68Å; Y548-F584 HydrophobicContact CE2-CE2 3.68Å; Y548-F584 AromaticContact CE2-CZ 3.57Å; Y548-F584 HydrophobicContact CE2-CZ 3.57Å; Y548-F584 HydrophobicContact CG-CE2 4.33Å; Y548-F584 AromaticContact CZ-CE2 3.97Å; L551-F584 HydrophobicContact CD2-CD2 4.43Å; L551-F584 HydrophobicContact CD2-CE2 4.06Å; W580-F584 WeakPolarHBondContact CA-O 3.49Å; W580-F584 VanDerWaalsContact CE3-C 3.49Å; L581-F584 PolarHBondContact N-O 3.37Å; L581-F584 PolarHBondContact O-N 2.87Å; L581-F584 VanDerWaalsContact O-O 3.14Å; H582-F584 HydrophobicContact CB-CD2 4.18Å; H582-F584 HydrophobicContact CB-CE2 4.42Å; F584-V586 HydrophobicContact CB-CG2 4.42Å; F584-V586 PolarHBondContact O-N 3.02Å; F584-E601 CarbonylContact C-O 3.46Å; F584-E601 VanDerWaalsContact CA-O 3.27Å; F584-E601 WeakPolarHBondContact CA-O 3.38Å
585	N	95.6	Very high	93.5	Very high	16 Å²	16	42.9 Å²	42.9	9%	0.086	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	101	160.6	-169	19.5	0	0	0	108.1	A578 W580 R587 E601	A578-N585 WeakPolarHBondContact CB-OD1 3.19Å; W580-N585 HydrophobicContact CD2-CB 4.25Å; W580-N585 HydrophobicContact CE3-CB 3.86Å; W580-N585 HydrophobicContact CH2-CB 3.61Å; W580-N585 HydrophobicContact CZ2-CB 3.98Å; W580-N585 HydrophobicContact CZ3-CB 3.52Å; W580-N585 VanDerWaalsContact CZ3-N 3.29Å; N585-R587 PolarHBondContact O-N 3.2Å; N585-E601 HydrophobicContact CB-CB 4.1Å; N585-E601 PolarHBondContact N-O 2.99Å; N585-E601 PolarHBondContact ND2-OE2 3.12Å; N585-E601 PolarHBondContact O-N 3.35Å; N585-E601 VanDerWaalsContact O-N 3.13Å
586	V	97	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.2	178.7	-177.3	0	0	0	0	108.4	I555 A578 V579 L581 F584 V597 L600	I555-V586 HydrophobicContact CD1-CG2 4.15Å; I555-V586 HydrophobicContact CG1-CG2 4.32Å; I555-V586 HydrophobicContact CG2-CG1 3.87Å; A578-V586 WeakPolarHBondContact CA-O 3.39Å; V579-V586 HydrophobicContact CG1-CB 4Å; V579-V586 PolarHBondContact N-O 2.62Å; V579-V586 PolarHBondContact O-N 3.02Å; L581-V586 HydrophobicContact CB-CG2 3.98Å; L581-V586 HydrophobicContact CD1-CG2 4.13Å; L581-V586 HydrophobicContact CG-CG2 4.36Å; F584-V586 HydrophobicContact CB-CG2 4.42Å; F584-V586 PolarHBondContact O-N 3.02Å; V586-V597 HydrophobicContact CG1-CG1 3.95Å; V586-V597 HydrophobicContact CG1-CG2 4.5Å; V586-L600 HydrophobicContact CB-CD2 4.14Å; V586-L600 HydrophobicContact CG1-CD2 3.97Å; V586-L600 HydrophobicContact CG2-CD2 3.7Å
587	R	97.6	Very high	94.2	Very high	79 Å²	79	37.4 Å²	37.4	30%	0.298	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.9	-179.4	-56.5	-178.6	67.9	145.7	4.7	110.8	Y577 A578 N585 V597 F598 A599 E601	Y577-R587 WeakPolarHBondContact O-CA 3.31Å; A578-R587 HydrophobicContact CB-CG 4.26Å; N585-R587 PolarHBondContact O-N 3.2Å; R587-V597 WeakPolarHBondContact O-CA 3.35Å; R587-F598 HydrophobicContact CB-CE1 4.02Å; R587-F598 HydrophobicContact CB-CE2 3.98Å; R587-F598 HydrophobicContact CB-CZ 3.68Å; R587-F598 PolarHBondContact O-N 3.19Å; R587-A599 HydrophobicContact CB-CB 4.15Å; R587-A599 HydrophobicContact CG-CB 4.47Å; R587-A599 PolarHBondContact N-O 2.92Å; R587-A599 PolarHBondContact O-N 3.09Å; R587-E601 VanDerWaalsContact CD-CD 3.42Å; R587-E601 WeakPolarHBondContact CD-OE1 3.49Å; R587-E601 IonicContact CZ-OE1 2.61Å; R587-E601 IonicContact NE-OE1 3.91Å; R587-E601 IonicContact NH1-OE1 2.75Å; R587-E601 PolarHBondContact NH1-OE1 2.85Å; R587-E601 IonicContact NH1-OE2 3.79Å
588	W	96.3	Very high	94.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.8	178.1	76.2	99.7	0	0	0	111.5	F388 L559 P563 T576 Y577 V579 F595 E596 V597 F598	F388-W588 AromaticContact CE1-CH2 3.69Å; F388-W588 HydrophobicContact CE1-CH2 3.69Å; F388-W588 HydrophobicContact CZ-CH2 4.07Å; L559-W588 HydrophobicContact CD1-CB 4.31Å; L559-W588 HydrophobicContact CD1-CD2 4.4Å; L559-W588 HydrophobicContact CD1-CG 4.31Å; L559-W588 HydrophobicContact CD2-CD2 3.88Å; L559-W588 HydrophobicContact CD2-CE3 3.92Å; L559-W588 HydrophobicContact CD2-CH2 4Å; L559-W588 HydrophobicContact CD2-CZ2 3.99Å; L559-W588 HydrophobicContact CD2-CZ3 4Å; P563-W588 HydrophobicContact CG-CH2 3.99Å; P563-W588 HydrophobicContact CG-CZ2 3.77Å; T576-W588 CarbonylContact C-O 3.57Å; T576-W588 WeakPolarHBondContact CA-O 3.49Å; Y577-W588 HydrophobicContact CD1-CZ2 4.37Å; Y577-W588 HydrophobicContact CG-CH2 4.43Å; Y577-W588 AromaticContact CG-CZ2 3.87Å; Y577-W588 HydrophobicContact CG-CZ2 3.87Å; Y577-W588 PolarHBondContact N-O 3.14Å; Y577-W588 PolarHBondContact O-N 3.09Å; V579-W588 HydrophobicContact CB-CH2 4.26Å; V579-W588 HydrophobicContact CB-CZ3 3.88Å; V579-W588 HydrophobicContact CG1-CE3 4.4Å; V579-W588 HydrophobicContact CG1-CH2 4.16Å; V579-W588 HydrophobicContact CG1-CZ3 3.54Å; W588-F595 AromaticContact CD1-CD1 3.79Å; W588-F595 AromaticContact CD1-CD2 3.77Å; W588-F595 AromaticContact CD1-CG 3.46Å; W588-F595 VanDerWaalsContact CD1-CG 3.46Å; W588-F595 HydrophobicContact CG-CB 4.43Å; W588-F595 AromaticContact NE1-CD1 3.89Å; W588-F595 AromaticContact NE1-CD2 3.58Å; W588-F595 AromaticContact NE1-CE2 3.72Å; W588-F595 AromaticContact NE1-CG 3.68Å; W588-F595 AromaticContact NE1-CZ 3.97Å; W588-E596 CarbonylContact C-O 3.56Å; W588-E596 WeakPolarHBondContact CA-O 3.32Å; W588-E596 WeakPolarHBondContact CB-O 3.4Å; W588-V597 HydrophobicContact CB-CG2 4.25Å; W588-F598 VanDerWaalsContact C-CE1 3.44Å
589	R	94.9	Very high	94.5	Very high	105 Å²	105	38.1 Å²	38.1	40%	0.396	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	149.5	173.3	62.7	-174.4	174.5	-165.5	3.1	110.6	K575 T576 T591 F595 E596 F598	K575-R589 WeakPolarHBondContact O-CA 3.47Å; T576-R589 HydrophobicContact CG2-CB 4.25Å; R589-T591 HydrophobicContact CG-CG2 4.11Å; R589-F595 WeakPolarHBondContact O-CA 3.13Å; R589-E596 HydrophobicContact CG-CB 4.27Å; R589-E596 IonicContact CZ-OE2 3Å; R589-E596 PolarHBondContact N-O 3.1Å; R589-E596 IonicContact NE-OE2 2.71Å; R589-E596 PolarHBondContact NE-OE2 3.38Å; R589-E596 IonicContact NH2-OE2 2.6Å; R589-E596 PolarHBondContact NH2-OE2 3.2Å; R589-E596 PolarHBondContact O-N 3.46Å; R589-F598 HydrophobicContact CB-CD1 4.15Å; R589-F598 HydrophobicContact CB-CE1 4.16Å; R589-F598 HydrophobicContact CG-CD1 4.16Å
590	V	92.7	Very high	94.6	Very high	13 Å²	13	38.7 Å²	38.7	8%	0.079	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	127.3	170.7	-173.6	0	0	0	0	108.5	G574 K575 Y577 F595	G574-V590 PolarHBondContact N-O 3.22Å; K575-V590 PolarHBondContact O-N 3.03Å; Y577-V590 HydrophobicContact CD2-CG2 4.17Å; Y577-V590 HydrophobicContact CE2-CG2 3.87Å; V590-F595 HydrophobicContact CG1-CE1 4.44Å; V590-F595 HydrophobicContact CG2-CD1 4.28Å; V590-F595 HydrophobicContact CG2-CE1 3.95Å
591	T	92	Very high	94.5	Very high	33 Å²	33	38.4 Å²	38.4	20%	0.202	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	163.7	176.5	71.4	0	0	0	0	109.3	R589 A593 G594 E596	R589-T591 HydrophobicContact CG-CG2 4.11Å; T591-A593 PolarHBondContact O-N 3.45Å; T591-A593 VanDerWaalsContact O-N 3.15Å; T591-A593 PolarHBondContact OG1-N 3.36Å; T591-G594 WeakPolarHBondContact CA-O 3.4Å; T591-G594 PolarHBondContact N-O 3.13Å; T591-G594 PolarHBondContact O-N 3.5Å; T591-G594 VanDerWaalsContact O-N 3.07Å; T591-G594 VanDerWaalsContact O-O 3.09Å; T591-G594 PolarHBondContact OG1-N 2.89Å; T591-G594 PolarHBondContact OG1-O 3.1Å; T591-E596 HydrophobicContact CG2-CB 3.88Å
592	D	87.3	Confident	94.2	Very high	147 Å²	147	43.3 Å²	43.3	79%	0.786	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.3	174.5	-59.9	-19.5	0	0	0	112.3	T573	T573-D592 WeakPolarHBondContact CG2-OD1 3.43Å; T573-D592 PolarHBondContact OG1-OD1 3.13Å
593	A	89.5	Confident	93.5	Very high	84 Å²	84	51 Å²	51	69%	0.694	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-4.3	179.4	0	0	0	0	0	114	A530 T591	A530-A593 WeakPolarHBondContact CB-O 3.46Å; T591-A593 PolarHBondContact O-N 3.45Å; T591-A593 VanDerWaalsContact O-N 3.15Å; T591-A593 PolarHBondContact OG1-N 3.36Å
594	G	92.9	Very high	93.6	Very high	9 Å²	9	50.5 Å²	50.5	9%	0.093	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	127.3	-140.8	-174.5	0	0	0	0	0	112.5	A530 T591	A530-G594 CarbonylContact O-C 3.45Å; A530-G594 WeakPolarHBondContact O-CA 3.12Å; T591-G594 WeakPolarHBondContact CA-O 3.4Å; T591-G594 PolarHBondContact N-O 3.13Å; T591-G594 PolarHBondContact O-N 3.5Å; T591-G594 VanDerWaalsContact O-N 3.07Å; T591-G594 VanDerWaalsContact O-O 3.09Å; T591-G594 PolarHBondContact OG1-N 2.89Å; T591-G594 PolarHBondContact OG1-O 3.1Å
595	F	95.5	Very high	93.5	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.6	178.9	-64.5	-18.5	0	0	0	112	M529 A530 V531 S532 L559 D562 R564 W588 R589 V590	M529-F595 HydrophobicContact CE-CE1 3.95Å; M529-F595 HydrophobicContact CE-CE2 4.46Å; M529-F595 HydrophobicContact CE-CZ 3.85Å; M529-F595 HydrophobicContact CG-CD1 4.17Å; M529-F595 HydrophobicContact CG-CD2 3.56Å; M529-F595 HydrophobicContact CG-CE1 4.19Å; M529-F595 HydrophobicContact CG-CE2 3.61Å; M529-F595 HydrophobicContact CG-CG 3.85Å; M529-F595 HydrophobicContact CG-CZ 3.91Å; M529-F595 HydrophobicContact SD-CD1 3.97Å; M529-F595 HydrophobicContact SD-CD2 4.43Å; M529-F595 HydrophobicContact SD-CE1 3.88Å; M529-F595 HydrophobicContact SD-CE2 4.36Å; M529-F595 HydrophobicContact SD-CG 4.24Å; M529-F595 HydrophobicContact SD-CZ 4.07Å; A530-F595 PolarHBondContact O-N 3.23Å; V531-F595 CarbonylContact C-O 3.54Å; V531-F595 VanDerWaalsContact CA-O 3.29Å; V531-F595 WeakPolarHBondContact CA-O 3.47Å; S532-F595 PolarHBondContact N-O 3.36Å; S532-F595 PolarHBondContact OG-O 3.19Å; L559-F595 HydrophobicContact CB-CD2 4.2Å; D562-F595 WeakPolarHBondContact OD1-CZ 3.21Å; R564-F595 HydrophobicContact CG-CZ 4.24Å; W588-F595 AromaticContact CD1-CD1 3.79Å; W588-F595 AromaticContact CD1-CD2 3.77Å; W588-F595 AromaticContact CD1-CG 3.46Å; W588-F595 VanDerWaalsContact CD1-CG 3.46Å; W588-F595 HydrophobicContact CG-CB 4.43Å; W588-F595 AromaticContact NE1-CD1 3.89Å; W588-F595 AromaticContact NE1-CD2 3.58Å; W588-F595 AromaticContact NE1-CE2 3.72Å; W588-F595 AromaticContact NE1-CG 3.68Å; W588-F595 AromaticContact NE1-CZ 3.97Å; R589-F595 WeakPolarHBondContact O-CA 3.13Å; V590-F595 HydrophobicContact CG1-CE1 4.44Å; V590-F595 HydrophobicContact CG2-CD1 4.28Å; V590-F595 HydrophobicContact CG2-CE1 3.95Å
596	E	97.3	Very high	93.4	Very high	41 Å²	41	54.4 Å²	54.4	19%	0.192	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.6	171.8	-173.3	-173.5	-121	0	0	110	S532 T534 W588 R589 T591 F598	S532-E596 WeakPolarHBondContact O-CA 3.49Å; T534-E596 HydrophobicContact CG2-CG 4.06Å; W588-E596 CarbonylContact C-O 3.56Å; W588-E596 WeakPolarHBondContact CA-O 3.32Å; W588-E596 WeakPolarHBondContact CB-O 3.4Å; R589-E596 HydrophobicContact CG-CB 4.27Å; R589-E596 IonicContact CZ-OE2 3Å; R589-E596 PolarHBondContact N-O 3.1Å; R589-E596 IonicContact NE-OE2 2.71Å; R589-E596 PolarHBondContact NE-OE2 3.38Å; R589-E596 IonicContact NH2-OE2 2.6Å; R589-E596 PolarHBondContact NH2-OE2 3.2Å; R589-E596 PolarHBondContact O-N 3.46Å; T591-E596 HydrophobicContact CG2-CB 3.88Å; E596-F598 PolarHBondContact O-N 3.49Å
597	V	98	Very high	93.2	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	118.4	174.4	-175.9	0	0	0	0	108.9	V531 S532 F533 T534 V537 I555 L559 V586 R587 W588 L600	V531-V597 HydrophobicContact CG1-CG2 4.12Å; S532-V597 PolarHBondContact O-N 3.35Å; F533-V597 HydrophobicContact CD1-CB 3.6Å; F533-V597 HydrophobicContact CD1-CG1 4.08Å; F533-V597 HydrophobicContact CD1-CG2 3.92Å; F533-V597 HydrophobicContact CE1-CB 3.97Å; F533-V597 HydrophobicContact CE1-CG1 4.31Å; F533-V597 HydrophobicContact CE1-CG2 3.79Å; F533-V597 HydrophobicContact CG-CB 4.45Å; T534-V597 PolarHBondContact N-O 3.07Å; T534-V597 PolarHBondContact OG1-O 3.15Å; V537-V597 HydrophobicContact CG1-CG1 4.08Å; I555-V597 HydrophobicContact CG2-CG2 4.12Å; L559-V597 HydrophobicContact CD1-CG2 3.48Å; L559-V597 VanDerWaalsContact CD1-CG2 3.48Å; V586-V597 HydrophobicContact CG1-CG1 3.95Å; V586-V597 HydrophobicContact CG1-CG2 4.5Å; R587-V597 WeakPolarHBondContact O-CA 3.35Å; W588-V597 HydrophobicContact CB-CG2 4.25Å; V597-L600 HydrophobicContact CG1-CD2 4.3Å
598	F	97	Very high	92.9	Very high	54 Å²	54	56.3 Å²	56.3	24%	0.237	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-13.2	-173.9	69.9	-97.1	0	0	0	113.8	T534 T576 R587 W588 R589 E596	T534-F598 HydrophobicContact CG2-CB 3.96Å; T576-F598 HydrophobicContact CG2-CE1 3.84Å; T576-F598 HydrophobicContact CG2-CZ 3.9Å; R587-F598 HydrophobicContact CB-CE1 4.02Å; R587-F598 HydrophobicContact CB-CE2 3.98Å; R587-F598 HydrophobicContact CB-CZ 3.68Å; R587-F598 PolarHBondContact O-N 3.19Å; W588-F598 VanDerWaalsContact C-CE1 3.44Å; R589-F598 HydrophobicContact CB-CD1 4.15Å; R589-F598 HydrophobicContact CB-CE1 4.16Å; R589-F598 HydrophobicContact CG-CD1 4.16Å; E596-F598 PolarHBondContact O-N 3.49Å
599	A	97.2	Very high	92.7	Very high	20 Å²	20	60 Å²	60	17%	0.165	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	146.8	173	0	0	0	0	0	112.8	R587 E601	R587-A599 HydrophobicContact CB-CB 4.15Å; R587-A599 HydrophobicContact CG-CB 4.47Å; R587-A599 PolarHBondContact N-O 2.92Å; R587-A599 PolarHBondContact O-N 3.09Å; A599-E601 HydrophobicContact CB-CG 4.38Å
600	L	96.2	Very high	92.6	Very high	12 Å²	12	56.8 Å²	56.8	6%	0.063	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	94.5	168.3	-65.1	177.8	0	0	0	108.1	V537 L541 L544 I555 V586 V597	V537-L600 HydrophobicContact CG1-CD1 3.77Å; V537-L600 HydrophobicContact CG1-CG 3.94Å; L541-L600 HydrophobicContact CD2-CD1 3.59Å; L541-L600 HydrophobicContact CG-CD1 3.84Å; L544-L600 HydrophobicContact CD1-CD1 4.14Å; I555-L600 HydrophobicContact CD1-CD2 3.94Å; V586-L600 HydrophobicContact CB-CD2 4.14Å; V586-L600 HydrophobicContact CG1-CD2 3.97Å; V586-L600 HydrophobicContact CG2-CD2 3.7Å; V597-L600 HydrophobicContact CG1-CD2 4.3Å
601	E	93.2	Very high	92.5	Very high	72 Å²	72	60.2 Å²	60.2	34%	0.336	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.7	-177.3	-52	161.3	170.3	0	0	108.9	F584 N585 R587 A599	F584-E601 CarbonylContact C-O 3.46Å; F584-E601 VanDerWaalsContact CA-O 3.27Å; F584-E601 WeakPolarHBondContact CA-O 3.38Å; N585-E601 HydrophobicContact CB-CB 4.1Å; N585-E601 PolarHBondContact N-O 2.99Å; N585-E601 PolarHBondContact ND2-OE2 3.12Å; N585-E601 PolarHBondContact O-N 3.35Å; N585-E601 VanDerWaalsContact O-N 3.13Å; R587-E601 VanDerWaalsContact CD-CD 3.42Å; R587-E601 WeakPolarHBondContact CD-OE1 3.49Å; R587-E601 IonicContact CZ-OE1 2.61Å; R587-E601 IonicContact NE-OE1 3.91Å; R587-E601 IonicContact NH1-OE1 2.75Å; R587-E601 PolarHBondContact NH1-OE1 2.85Å; R587-E601 IonicContact NH1-OE2 3.79Å; A599-E601 HydrophobicContact CB-CG 4.38Å
602	P	88.6	Confident	92.6	Very high	103 Å²	103	62.4 Å²	62.4	67%	0.669	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	145.9	176.8	26.9	-33.2	0	0	0	111.2	D583	D583-P602 WeakPolarHBondContact O-CA 3.29Å
603	R	78.6	Confident	93.1	Very high	206 Å²	206	54.7 Å²	54.7	78%	0.777	29%	0.294	S	S	*	.			trans	-69.2	0	177.8	-169.8	173	-178.6	-177.5	3.1	113.7	W580 D583	W580-R603 HydrophobicContact CE3-CB 4.13Å; W580-R603 HydrophobicContact CE3-CG 4.11Å; W580-R603 HydrophobicContact CH2-CB 4.24Å; W580-R603 HydrophobicContact CH2-CG 4.1Å; W580-R603 HydrophobicContact CZ3-CB 3.52Å; W580-R603 HydrophobicContact CZ3-CG 3.67Å; D583-R603 WeakPolarHBondContact O-CB 3.49Å; D583-R603 PolarHBondContact O-N 3.21Å

Retrieved 603 of 603 residues in 413.5 ms (Link to these results)

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