A0A5K4EZK7_SCHMA Loading...

histone acetyltransferase

AlphaFold DB , UniProt , Accession A0A5K4EZK7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 260 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	27.7	Very low	39.7	Very low	244 Å²	244	119.6 Å²	119.6	100%	1.202	64%	0.643	S	S	*	*				0	88.2	0	-157.4	165	-179.4	0	0	105.4
2	L	28.5	Very low	42.6	Very low	143 Å²	143	110.8 Å²	110.8	75%	0.749	60%	0.597	S	S	*	*			cis	-112.4	161	13.1	-73.8	81.4	0	0	0	112.2	S4	L2-S4 WeakPolarHBondContact CD2-OG 3.43Å
3	P	29.4	Very low	45.9	Very low	117 Å²	117	105.6 Å²	105.6	76%	0.76	57%	0.569	S	S	*	*			trans	-114.3	101.1	143.9	33.1	-17.7	0	0	0	108.3
4	S	39.4	Very low	49	Very low	76 Å²	76	98.1 Å²	98.1	53%	0.531	53%	0.528	S	S	.	.			trans	-138.4	16.8	175.8	66.2	0	0	0	0	113.2	L2	L2-S4 WeakPolarHBondContact CD2-OG 3.43Å
5	Q	41.1	Very low	51.5	Low	171 Å²	171	92.5 Å²	92.5	80%	0.799	50%	0.5	S	S	*	.	S	Bend	trans	-100.2	-18	177	-73.3	-173.5	-9.2	0	0	113.4	L7	Q5-L7 PolarHBondContact O-N 3.32Å
6	D	33.2	Very low	53.7	Low	138 Å²	138	86.9 Å²	86.9	74%	0.738	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-2.8	-169.2	-55.6	-29.3	0	0	0	114.6
7	L	38.6	Very low	55.7	Low	130 Å²	130	82.5 Å²	82.5	68%	0.681	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-4.5	-175.2	-96.7	151.6	0	0	0	114.8	Q5	Q5-L7 PolarHBondContact O-N 3.32Å
8	L	41.9	Very low	57.2	Low	57 Å²	57	77.9 Å²	77.9	30%	0.298	42%	0.423	S	S	.	.	S	Bend	trans	-97.6	-9	176.6	-88.9	91.9	0	0	0	114.3	N10 T34	L8-N10 VanDerWaalsContact C-N 3.35Å; L8-T34 HydrophobicContact CD2-CG2 3.53Å
9	D	45.6	Very low	58.5	Low	135 Å²	135	74.6 Å²	74.6	72%	0.722	41%	0.406	S	S	*	.	S	Bend	trans	-82.4	-16.6	-176.8	-135.9	24	0	0	0	113
10	N	49.1	Very low	59.4	Low	88 Å²	88	72.5 Å²	72.5	47%	0.471	40%	0.396	S	S	.	.	S	Bend	trans	-110.1	111.4	167.6	-80.1	-54.3	0	0	0	108.5	L8 S12	L8-N10 VanDerWaalsContact C-N 3.35Å; N10-S12 PolarHBondContact O-N 2.98Å
11	S	61.8	Low	60.4	Low	17 Å²	17	71 Å²	71	12%	0.119	40%	0.398	C	S	.	.			trans	-62.3	83.4	176.1	56.8	0	0	0	0	110.3	L13 T31 L116	S11-L13 PolarHBondContact O-N 3.3Å; S11-T31 WeakPolarHBondContact CB-OG1 3.38Å; S11-L116 VanDerWaalsContact OG-CB 3.23Å; S11-L116 WeakPolarHBondContact OG-CB 3.22Å
12	S	74.9	Confident	62.8	Low	14 Å²	14	67 Å²	67	10%	0.098	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	126.5	175.6	57.9	0	0	0	0	108.5	N10 T31 N113	N10-S12 PolarHBondContact O-N 2.98Å; S12-T31 PolarHBondContact O-OG1 3.36Å; S12-N113 WeakPolarHBondContact CB-OD1 3.48Å
13	L	86.1	Confident	65.1	Low	43 Å²	43	65.7 Å²	65.7	23%	0.225	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123	174.1	-72.1	169.7	0	0	0	107.3	S11 V29 L60 T111 V112	S11-L13 PolarHBondContact O-N 3.3Å; L13-V29 HydrophobicContact CD2-CG1 4.12Å; L13-L60 HydrophobicContact CD2-CD1 3.97Å; L13-L60 HydrophobicContact CD2-CD2 3.67Å; L13-L60 HydrophobicContact CD2-CG 4.49Å; L13-T111 VanDerWaalsContact O-CA 3.31Å; L13-T111 WeakPolarHBondContact O-CA 3.29Å; L13-V112 PolarHBondContact N-O 3.26Å; L13-V112 PolarHBondContact O-N 3.1Å
14	I	88.1	Confident	67.7	Low	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.2	171	-60.8	129	0	0	0	106.7	V29 G30 V32 F81 Y84 L159	I14-V29 WeakPolarHBondContact O-CA 3.48Å; I14-G30 PolarHBondContact N-O 2.75Å; I14-G30 PolarHBondContact O-N 3.19Å; I14-G30 VanDerWaalsContact O-O 3.12Å; I14-V32 HydrophobicContact CD1-CG2 3.9Å; I14-F81 HydrophobicContact CB-CE2 4.24Å; I14-F81 HydrophobicContact CD1-CE2 4.48Å; I14-F81 HydrophobicContact CG2-CD2 4.35Å; I14-F81 HydrophobicContact CG2-CE2 4.27Å; I14-Y84 HydrophobicContact CD1-CE1 3.72Å; I14-Y84 HydrophobicContact CG1-CE1 3.95Å; I14-Y84 HydrophobicContact CG2-CD1 4.41Å; I14-Y84 HydrophobicContact CG2-CE1 4.09Å; I14-L159 HydrophobicContact CG2-CD1 4.22Å; I14-L159 HydrophobicContact CG2-CD2 4.46Å
15	S	87.2	Confident	70	Confident	15 Å²	15	61.1 Å²	61.1	11%	0.105	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.9	174	68.6	0	0	0	0	110.6	L28 S109 Q110	S15-L28 CarbonylContact C-O 3.49Å; S15-L28 VanDerWaalsContact CA-O 3.24Å; S15-L28 WeakPolarHBondContact CA-O 3.42Å; S15-S109 CarbonylContact O-C 3.45Å; S15-S109 WeakPolarHBondContact O-CA 3.37Å; S15-S109 WeakPolarHBondContact O-CB 3.43Å; S15-S109 PolarHBondContact O-OG 3.07Å; S15-Q110 PolarHBondContact N-O 3.2Å; S15-Q110 PolarHBondContact O-N 3.09Å; S15-Q110 WeakPolarHBondContact OG-CB 3.33Å; S15-Q110 PolarHBondContact OG-N 3.01Å; S15-Q110 PolarHBondContact OG-O 2.92Å
16	I	87.4	Confident	72.3	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.8	173.6	-49.9	177.9	0	0	0	106	I27 L28 L77 F81 L107 F108	I16-I27 CarbonylContact O-C 3.52Å; I16-I27 WeakPolarHBondContact O-CA 3.25Å; I16-L28 PolarHBondContact N-O 3.34Å; I16-L28 PolarHBondContact O-N 2.96Å; I16-L77 HydrophobicContact CB-CD2 4.1Å; I16-L77 HydrophobicContact CG2-CD2 3.68Å; I16-L77 WeakPolarHBondContact O-CD2 3.11Å; I16-F81 HydrophobicContact CD1-CB 3.95Å; I16-F81 HydrophobicContact CD1-CD2 4.43Å; I16-L107 HydrophobicContact CG2-CD2 3.42Å; I16-L107 VanDerWaalsContact CG2-CD2 3.42Å; I16-L107 HydrophobicContact CG2-CG 4.49Å; I16-F108 CarbonylContact C-O 3.48Å; I16-F108 WeakPolarHBondContact CA-O 3.24Å
17	A	87.2	Confident	75.1	Confident	13 Å²	13	49.3 Å²	49.3	11%	0.107	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.9	-178.1	0	0	0	0	0	109.9	L24 G26 I27 L107 F108	A17-L24 HydrophobicContact CB-CD1 3.6Å; A17-G26 CarbonylContact C-O 3.46Å; A17-G26 WeakPolarHBondContact CA-O 3.27Å; A17-I27 HydrophobicContact CB-CG1 4.44Å; A17-L107 CarbonylContact O-C 3.42Å; A17-L107 VanDerWaalsContact O-CA 3.27Å; A17-L107 WeakPolarHBondContact O-CA 3.48Å; A17-L107 WeakPolarHBondContact O-CG 3.33Å; A17-F108 HydrophobicContact CB-CB 4.07Å; A17-F108 PolarHBondContact N-O 3.08Å; A17-F108 PolarHBondContact O-N 2.99Å; A17-F108 VanDerWaalsContact O-O 3.04Å
18	A	82.9	Confident	77.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.5	168.6	0	0	0	0	0	108.7	V25 G26 V73 L77 L107	A18-V25 HydrophobicContact CB-CG2 3.72Å; A18-V25 VanDerWaalsContact O-CG2 3.25Å; A18-V25 WeakPolarHBondContact O-CG2 3.48Å; A18-V25 PolarHBondContact O-N 2.84Å; A18-G26 PolarHBondContact N-O 3.01Å; A18-G26 PolarHBondContact O-N 3.31Å; A18-V73 HydrophobicContact CB-CG1 3.49Å; A18-V73 VanDerWaalsContact CB-CG1 3.49Å; A18-L77 HydrophobicContact CB-CD1 4.24Å; A18-L77 HydrophobicContact CB-CD2 4.19Å; A18-L77 HydrophobicContact CB-CG 4.38Å; A18-L107 HydrophobicContact CB-CD1 3.59Å; A18-L107 HydrophobicContact CB-CG 4.16Å
19	V	80.8	Confident	80.2	Confident	15 Å²	15	41.8 Å²	41.8	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	148	177.2	170.8	0	0	0	0	108.4	G21 D23 L24 C104 D106 F108	V19-G21 VanDerWaalsContact CG1-O 3.28Å; V19-G21 WeakPolarHBondContact CG1-O 3.18Å; V19-D23 CarbonylContact C-O 3.47Å; V19-D23 WeakPolarHBondContact CA-O 3.39Å; V19-D23 VanDerWaalsContact CG1-O 3.31Å; V19-D23 WeakPolarHBondContact CG1-O 3.04Å; V19-L24 HydrophobicContact CG2-CB 4.46Å; V19-L24 HydrophobicContact CG2-CD1 3.92Å; V19-C104 PolarHBondContact O-SG 3.39Å; V19-D106 CarbonylContact C-O 3.21Å; V19-D106 WeakPolarHBondContact CA-O 3.4Å; V19-D106 HydrophobicContact CB-CB 3.92Å; V19-D106 WeakPolarHBondContact CB-O 3.21Å; V19-D106 HydrophobicContact CG1-CB 4.02Å; V19-D106 PolarHBondContact N-O 3.44Å; V19-D106 CarbonylContact O-C 3.52Å; V19-D106 WeakPolarHBondContact O-CB 3.25Å; V19-D106 PolarHBondContact O-N 2.98Å; V19-F108 HydrophobicContact CB-CD2 3.54Å; V19-F108 HydrophobicContact CB-CE2 3.4Å; V19-F108 VanDerWaalsContact CB-CE2 3.4Å; V19-F108 HydrophobicContact CG1-CD2 4.31Å; V19-F108 HydrophobicContact CG1-CE2 3.68Å; V19-F108 HydrophobicContact CG2-CD2 3.23Å; V19-F108 HydrophobicContact CG2-CE2 3.47Å; V19-F108 VanDerWaalsContact CG2-CE2 3.47Å; V19-F108 HydrophobicContact CG2-CG 4.37Å
20	S	77.1	Confident	82.5	Confident	31 Å²	31	35.4 Å²	35.4	22%	0.217	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	104.3	175.4	177	0	0	0	0	107.6	D22 D23	S20-D22 PolarHBondContact O-N 3.14Å; S20-D23 PolarHBondContact N-O 3.03Å; S20-D23 PolarHBondContact O-N 3.2Å
21	G	79.8	Confident	84.5	Confident	43 Å²	43	31.4 Å²	31.4	44%	0.443	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	-115.6	-170.5	0	0	0	0	0	110.2	V19 D106	V19-G21 VanDerWaalsContact CG1-O 3.28Å; V19-G21 WeakPolarHBondContact CG1-O 3.18Å; G21-D106 PolarHBondContact N-OD2 3.3Å
22	D	79.9	Confident	86	Confident	158 Å²	158	31.1 Å²	31.1	85%	0.845	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105	-2.3	176.3	-65.8	-41.8	0	0	0	113	S20	S20-D22 PolarHBondContact O-N 3.14Å
23	D	75.7	Confident	86.7	Confident	117 Å²	117	31.2 Å²	31.2	63%	0.626	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.8	-174.8	-70.4	-30.8	0	0	0	112.3	V19 S20 V25	V19-D23 CarbonylContact C-O 3.47Å; V19-D23 WeakPolarHBondContact CA-O 3.39Å; V19-D23 VanDerWaalsContact CG1-O 3.31Å; V19-D23 WeakPolarHBondContact CG1-O 3.04Å; S20-D23 PolarHBondContact N-O 3.03Å; S20-D23 PolarHBondContact O-N 3.2Å; D23-V25 PolarHBondContact O-N 3.35Å; D23-V25 VanDerWaalsContact O-N 3.14Å
24	L	83.9	Confident	87	Confident	95 Å²	95	30.2 Å²	30.2	50%	0.497	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	107.8	166.9	-177.1	72.6	0	0	0	109.9	A17 V19 G26 T65	A17-L24 HydrophobicContact CB-CD1 3.6Å; V19-L24 HydrophobicContact CG2-CB 4.46Å; V19-L24 HydrophobicContact CG2-CD1 3.92Å; L24-G26 WeakPolarHBondContact CD1-O 3.2Å; L24-T65 WeakPolarHBondContact O-CG2 3.19Å
25	V	87.9	Confident	87.1	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-20	-178.2	-58.4	0	0	0	0	113.4	A18 D23 V64 T65 F68 V73 C104	A18-V25 HydrophobicContact CB-CG2 3.72Å; A18-V25 VanDerWaalsContact O-CG2 3.25Å; A18-V25 WeakPolarHBondContact O-CG2 3.48Å; A18-V25 PolarHBondContact O-N 2.84Å; D23-V25 PolarHBondContact O-N 3.35Å; D23-V25 VanDerWaalsContact O-N 3.14Å; V25-V64 CarbonylContact O-C 3.58Å; V25-V64 WeakPolarHBondContact O-CA 3.36Å; V25-V64 WeakPolarHBondContact O-CG1 3.48Å; V25-T65 PolarHBondContact O-N 3.4Å; V25-T65 PolarHBondContact O-OG1 2.93Å; V25-F68 HydrophobicContact CB-CB 4.21Å; V25-F68 HydrophobicContact CB-CD1 4.18Å; V25-F68 HydrophobicContact CB-CD2 3.81Å; V25-F68 HydrophobicContact CB-CE2 4.2Å; V25-F68 HydrophobicContact CB-CG 3.8Å; V25-F68 HydrophobicContact CG1-CD1 4.04Å; V25-F68 HydrophobicContact CG1-CD2 3.48Å; V25-F68 VanDerWaalsContact CG1-CD2 3.48Å; V25-F68 HydrophobicContact CG1-CE1 3.92Å; V25-F68 HydrophobicContact CG1-CE2 3.34Å; V25-F68 HydrophobicContact CG1-CG 3.84Å; V25-F68 HydrophobicContact CG1-CZ 3.57Å; V25-F68 HydrophobicContact CG2-CD1 4.44Å; V25-F68 HydrophobicContact CG2-CG 4.46Å; V25-V73 HydrophobicContact CG2-CG1 4.36Å; V25-C104 VanDerWaalsContact CG2-SG 3.6Å
26	G	89	Confident	87.1	Confident	3 Å²	3	30.9 Å²	30.9	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	162.2	175.9	0	0	0	0	0	113.4	A17 A18 L24 G63	A17-G26 CarbonylContact C-O 3.46Å; A17-G26 WeakPolarHBondContact CA-O 3.27Å; A18-G26 PolarHBondContact N-O 3.01Å; A18-G26 PolarHBondContact O-N 3.31Å; L24-G26 WeakPolarHBondContact CD1-O 3.2Å; G26-G63 CarbonylContact C-O 3.58Å; G26-G63 WeakPolarHBondContact CA-O 3.4Å
27	I	92.3	Very high	87.2	Confident	57 Å²	57	35.4 Å²	35.4	29%	0.292	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	140.7	176.4	-167.2	169.4	0	0	0	110.2	I16 A17 V29 L62 G63	I16-I27 CarbonylContact O-C 3.52Å; I16-I27 WeakPolarHBondContact O-CA 3.25Å; A17-I27 HydrophobicContact CB-CG1 4.44Å; I27-V29 HydrophobicContact CD1-CG2 4.02Å; I27-V29 HydrophobicContact CG1-CG2 4.03Å; I27-L62 CarbonylContact O-C 3.55Å; I27-L62 WeakPolarHBondContact O-CA 3.42Å; I27-G63 PolarHBondContact N-O 3.14Å; I27-G63 PolarHBondContact O-N 3.39Å
28	L	94	Very high	87.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.5	165.3	-177.8	153.8	0	0	0	107.4	S15 I16 I59 S61 L62 L77 L78 F81	S15-L28 CarbonylContact C-O 3.49Å; S15-L28 VanDerWaalsContact CA-O 3.24Å; S15-L28 WeakPolarHBondContact CA-O 3.42Å; I16-L28 PolarHBondContact N-O 3.34Å; I16-L28 PolarHBondContact O-N 2.96Å; L28-I59 HydrophobicContact CD1-CD1 4.48Å; L28-I59 HydrophobicContact CG-CG2 4.31Å; L28-S61 CarbonylContact C-O 3.58Å; L28-S61 WeakPolarHBondContact CA-O 3.18Å; L28-L62 HydrophobicContact CB-CD1 3.95Å; L28-L62 HydrophobicContact CD1-CD1 4.17Å; L28-L62 HydrophobicContact CG-CD1 4.36Å; L28-L77 HydrophobicContact CB-CB 4.11Å; L28-L77 HydrophobicContact CD1-CB 4.49Å; L28-L78 HydrophobicContact CD1-CB 4.41Å; L28-L78 HydrophobicContact CD1-CD1 4.24Å; L28-F81 HydrophobicContact CD1-CB 3.79Å; L28-F81 HydrophobicContact CD1-CG 4.22Å; L28-F81 HydrophobicContact CD2-CB 3.68Å; L28-F81 HydrophobicContact CD2-CD1 4.12Å; L28-F81 HydrophobicContact CD2-CD2 3.46Å; L28-F81 VanDerWaalsContact CD2-CD2 3.46Å; L28-F81 HydrophobicContact CD2-CE2 4.09Å; L28-F81 HydrophobicContact CD2-CG 3.47Å; L28-F81 VanDerWaalsContact CD2-CG 3.47Å; L28-F81 HydrophobicContact CG-CB 4.42Å
29	V	93.7	Very high	87.3	Confident	30 Å²	30	37.4 Å²	37.4	18%	0.182	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.6	172	-174.2	0	0	0	0	108.1	L13 I14 I27 L60 S61	L13-V29 HydrophobicContact CD2-CG1 4.12Å; I14-V29 WeakPolarHBondContact O-CA 3.48Å; I27-V29 HydrophobicContact CD1-CG2 4.02Å; I27-V29 HydrophobicContact CG1-CG2 4.03Å; V29-L60 PolarHBondContact O-N 2.98Å; V29-S61 PolarHBondContact N-O 2.78Å; V29-S61 PolarHBondContact O-N 3.14Å; V29-S61 VanDerWaalsContact O-N 3.12Å
30	G	93.6	Very high	87.3	Confident	0 Å²	0	40 Å²	40	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	169.8	177.3	0	0	0	0	0	111.8	I14 Y58	I14-G30 PolarHBondContact N-O 2.75Å; I14-G30 PolarHBondContact O-N 3.19Å; I14-G30 VanDerWaalsContact O-O 3.12Å; G30-Y58 CarbonylContact C-O 3.59Å; G30-Y58 WeakPolarHBondContact CA-O 3.29Å
31	T	91.8	Very high	87.5	Confident	4 Å²	4	42.5 Å²	42.5	3%	0.025	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	150.7	172.8	-168.8	0	0	0	0	109.8	S11 S12 A57 Y58 L60	S11-T31 WeakPolarHBondContact CB-OG1 3.38Å; S12-T31 PolarHBondContact O-OG1 3.36Å; T31-A57 CarbonylContact O-C 3.42Å; T31-A57 VanDerWaalsContact O-CA 3.3Å; T31-A57 WeakPolarHBondContact O-CA 3.28Å; T31-Y58 PolarHBondContact N-O 2.86Å; T31-Y58 PolarHBondContact O-N 2.86Å; T31-L60 HydrophobicContact CG2-CD1 3.85Å
32	V	91.8	Very high	87.7	Confident	11 Å²	11	40.6 Å²	40.6	7%	0.067	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.9	170.5	178	0	0	0	0	107.3	I14 A57 V85 V162 V165	I14-V32 HydrophobicContact CD1-CG2 3.9Å; V32-A57 HydrophobicContact CG2-CB 4.37Å; V32-V85 HydrophobicContact CG2-CB 4.36Å; V32-V85 HydrophobicContact CG2-CG1 3.72Å; V32-V162 HydrophobicContact CB-CG1 4.4Å; V32-V162 HydrophobicContact CG2-CB 4.45Å; V32-V162 HydrophobicContact CG2-CG1 4.14Å; V32-V165 HydrophobicContact CG1-CG1 3.79Å; V32-V165 HydrophobicContact CG2-CG1 4.41Å
33	T	90.9	Very high	88	Confident	16 Å²	16	37.7 Å²	37.7	10%	0.098	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	177.6	-179.6	-168.4	0	0	0	0	109.8	N37 G55 V56	T33-N37 VanDerWaalsContact OG1-CB 3.26Å; T33-N37 WeakPolarHBondContact OG1-CB 3.25Å; T33-G55 CarbonylContact O-C 3.55Å; T33-G55 WeakPolarHBondContact O-CA 3.41Å; T33-V56 HydrophobicContact CG2-CG2 3.88Å; T33-V56 PolarHBondContact N-O 3.08Å; T33-V56 PolarHBondContact O-N 2.97Å
34	T	91.3	Very high	88.6	Confident	22 Å²	22	39.3 Å²	39.3	14%	0.135	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	155.8	171.6	64.6	0	0	0	0	110.7	L8 G36 N37 C38 T54	L8-T34 HydrophobicContact CD2-CG2 3.53Å; T34-G36 PolarHBondContact O-N 3.03Å; T34-N37 PolarHBondContact O-N 2.92Å; T34-C38 PolarHBondContact O-N 2.67Å; T34-C38 PolarHBondContact O-SG 3.3Å; T34-C38 VanDerWaalsContact O-SG 3.4Å; T34-T54 CarbonylContact C-O 3.51Å; T34-T54 WeakPolarHBondContact CA-O 3.31Å
35	L	91	Very high	88.8	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.031	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-57.4	-35.6	176.7	-174.9	66.8	0	0	0	111.6	N37 C38 Y43 L45 L46 L52 T54 V56	L35-N37 VanDerWaalsContact C-N 3.27Å; L35-N37 PolarHBondContact O-N 3.12Å; L35-C38 WeakPolarHBondContact O-CB 3.41Å; L35-C38 PolarHBondContact O-N 2.76Å; L35-Y43 WeakPolarHBondContact O-CE1 3.39Å; L35-L45 HydrophobicContact CD1-CB 4.44Å; L35-L46 HydrophobicContact CD2-CB 4.32Å; L35-L46 HydrophobicContact CD2-CD1 4.32Å; L35-L52 HydrophobicContact CD2-CD2 4.36Å; L35-L52 HydrophobicContact CG-CD2 4.38Å; L35-L52 PolarHBondContact N-O 3.27Å; L35-T54 PolarHBondContact N-O 3.19Å; L35-V56 HydrophobicContact CD1-CG1 4.39Å
36	G	87.8	Confident	89	Confident	24 Å²	24	34.9 Å²	34.9	25%	0.247	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-67.2	-22.1	176.9	0	0	0	0	0	114.9	T34 L52	T34-G36 PolarHBondContact O-N 3.03Å; G36-L52 PolarHBondContact N-O 2.81Å
37	N	88.7	Confident	89.1	Confident	97 Å²	97	34.8 Å²	34.8	52%	0.519	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-91.2	-4	176.8	-71.2	-1.1	0	0	0	112.6	T33 T34 L35	T33-N37 VanDerWaalsContact OG1-CB 3.26Å; T33-N37 WeakPolarHBondContact OG1-CB 3.25Å; T34-N37 PolarHBondContact O-N 2.92Å; L35-N37 VanDerWaalsContact C-N 3.27Å; L35-N37 PolarHBondContact O-N 3.12Å
38	C	85.8	Confident	88.9	Confident	11 Å²	11	37 Å²	37	7%	0.074	22%	0.215	C	C	.	.	S	Bend	trans	-76.2	165.6	175.3	-64.3	0	0	0	0	111.3	T34 L35 D42 V56	T34-C38 PolarHBondContact O-N 2.67Å; T34-C38 PolarHBondContact O-SG 3.3Å; T34-C38 VanDerWaalsContact O-SG 3.4Å; L35-C38 WeakPolarHBondContact O-CB 3.41Å; L35-C38 PolarHBondContact O-N 2.76Å; C38-D42 HydrophobicContact CB-CB 4.17Å; C38-V56 WeakPolarHBondContact SG-CG2 2.95Å
39	S	85.9	Confident	88.8	Confident	43 Å²	43	41.1 Å²	41.1	30%	0.301	24%	0.243	S	C	.	.			trans	-64.1	149	172.1	96.7	0	0	0	0	110	D41 D42	S39-D41 PolarHBondContact O-N 3.22Å; S39-D41 VanDerWaalsContact O-N 3.09Å; S39-D41 PolarHBondContact OG-N 2.89Å; S39-D42 WeakPolarHBondContact CB-OD2 3.12Å; S39-D42 WeakPolarHBondContact O-CA 3.34Å; S39-D42 WeakPolarHBondContact O-CB 3.49Å; S39-D42 PolarHBondContact O-N 3.19Å; S39-D42 PolarHBondContact OG-OD2 2.8Å
40	A	81	Confident	88.7	Confident	69 Å²	69	41.2 Å²	41.2	57%	0.57	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-58.4	-27.1	-179	0	0	0	0	0	113.2	D42 Y43	A40-D42 PolarHBondContact O-N 3.18Å; A40-Y43 HydrophobicContact CB-CD2 4.36Å; A40-Y43 HydrophobicContact CB-CE2 4.03Å; A40-Y43 PolarHBondContact O-N 3.07Å
41	D	81.6	Confident	88.6	Confident	84 Å²	84	44.8 Å²	44.8	45%	0.449	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-66.6	-26.9	175.5	-67.2	-23.4	0	0	0	112	S39 R194	S39-D41 PolarHBondContact O-N 3.22Å; S39-D41 VanDerWaalsContact O-N 3.09Å; S39-D41 PolarHBondContact OG-N 2.89Å; D41-R194 IonicContact OD2-CZ 3.45Å; D41-R194 IonicContact OD2-NE 3.73Å; D41-R194 IonicContact OD2-NH2 2.77Å; D41-R194 PolarHBondContact OD2-NH2 3.43Å
42	D	85.1	Confident	88.6	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-93.5	1	-175.2	-57.8	-49.1	0	0	0	112.9	C38 S39 A40 K44 L45 Y169 H171	C38-D42 HydrophobicContact CB-CB 4.17Å; S39-D42 WeakPolarHBondContact CB-OD2 3.12Å; S39-D42 WeakPolarHBondContact O-CA 3.34Å; S39-D42 WeakPolarHBondContact O-CB 3.49Å; S39-D42 PolarHBondContact O-N 3.19Å; S39-D42 PolarHBondContact OG-OD2 2.8Å; A40-D42 PolarHBondContact O-N 3.18Å; D42-K44 PolarHBondContact O-N 3.33Å; D42-K44 VanDerWaalsContact O-N 3.08Å; D42-L45 HydrophobicContact CB-CD1 3.84Å; D42-L45 HydrophobicContact CB-CG 4.18Å; D42-L45 VanDerWaalsContact O-CB 3.24Å; D42-L45 WeakPolarHBondContact O-CB 3.33Å; D42-L45 VanDerWaalsContact O-CD1 3.32Å; D42-L45 WeakPolarHBondContact O-CD1 3.45Å; D42-L45 WeakPolarHBondContact O-CG 3.42Å; D42-L45 PolarHBondContact O-N 2.83Å; D42-Y169 HydrophobicContact CB-CE2 4.49Å; D42-H171 IonicContact OD1-NE2 3.56Å
43	Y	84.8	Confident	88.5	Confident	97 Å²	97	53.1 Å²	53.1	38%	0.38	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-63	-18.2	173.2	-64.6	-18.4	0	0	0	113	L35 A40 L45	L35-Y43 WeakPolarHBondContact O-CE1 3.39Å; A40-Y43 HydrophobicContact CB-CD2 4.36Å; A40-Y43 HydrophobicContact CB-CE2 4.03Å; A40-Y43 PolarHBondContact O-N 3.07Å; Y43-L45 PolarHBondContact O-N 3.08Å
44	K	89.1	Confident	88.6	Confident	150 Å²	150	53.1 Å²	53.1	65%	0.652	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-76.2	0.6	174.3	-60.9	177	-173.9	169.9	0	113.6	D42 L46 L191 L219	D42-K44 PolarHBondContact O-N 3.33Å; D42-K44 VanDerWaalsContact O-N 3.08Å; K44-L46 PolarHBondContact O-N 3.44Å; K44-L191 HydrophobicContact CB-CD2 4.07Å; K44-L191 WeakPolarHBondContact O-CD2 3.31Å; K44-L219 VanDerWaalsContact O-CD2 3.24Å; K44-L219 WeakPolarHBondContact O-CD2 3.42Å
45	L	88.8	Confident	88.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-63.2	-29	175.8	-73.1	171.6	0	0	0	112.4	L35 D42 Y43 Y169 L191 T209 V211 H213 L219	L35-L45 HydrophobicContact CD1-CB 4.44Å; D42-L45 HydrophobicContact CB-CD1 3.84Å; D42-L45 HydrophobicContact CB-CG 4.18Å; D42-L45 VanDerWaalsContact O-CB 3.24Å; D42-L45 WeakPolarHBondContact O-CB 3.33Å; D42-L45 VanDerWaalsContact O-CD1 3.32Å; D42-L45 WeakPolarHBondContact O-CD1 3.45Å; D42-L45 WeakPolarHBondContact O-CG 3.42Å; D42-L45 PolarHBondContact O-N 2.83Å; Y43-L45 PolarHBondContact O-N 3.08Å; L45-Y169 HydrophobicContact CD1-CD1 3.48Å; L45-Y169 VanDerWaalsContact CD1-CD1 3.48Å; L45-Y169 HydrophobicContact CD1-CD2 3.74Å; L45-Y169 HydrophobicContact CD1-CE1 3.71Å; L45-Y169 HydrophobicContact CD1-CE2 3.95Å; L45-Y169 HydrophobicContact CD1-CG 3.49Å; L45-Y169 VanDerWaalsContact CD1-CG 3.49Å; L45-Y169 VanDerWaalsContact CD2-CB 3.48Å; L45-Y169 HydrophobicContact CD2-CD1 4.49Å; L45-Y169 HydrophobicContact CD2-CD2 4.03Å; L45-Y169 HydrophobicContact CD2-CG 3.78Å; L45-Y169 HydrophobicContact CG-CD2 4.49Å; L45-Y169 HydrophobicContact CG-CG 4.3Å; L45-L191 HydrophobicContact CD2-CD2 4.09Å; L45-T209 HydrophobicContact CD2-CG2 4.16Å; L45-V211 HydrophobicContact CD2-CB 3.8Å; L45-V211 HydrophobicContact CD2-CG2 3.8Å; L45-H213 PolarHBondContact O-NE2 3.42Å; L45-L219 WeakPolarHBondContact O-CD2 3.24Å
46	L	92	Very high	88.8	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	31%	0.312	C	S	.	.	S	Bend	trans	-131.8	157.4	-180	-70.2	170.8	0	0	0	110.1	L35 K44 F50 T54 V56 R166 A167 H218	L35-L46 HydrophobicContact CD2-CB 4.32Å; L35-L46 HydrophobicContact CD2-CD1 4.32Å; K44-L46 PolarHBondContact O-N 3.44Å; L46-F50 HydrophobicContact CB-CB 4.25Å; L46-F50 HydrophobicContact CB-CD2 3.86Å; L46-F50 HydrophobicContact CB-CG 4.25Å; L46-F50 HydrophobicContact CD1-CB 4.43Å; L46-F50 HydrophobicContact CD1-CG 4.43Å; L46-F50 HydrophobicContact CD2-CD2 4.3Å; L46-F50 HydrophobicContact CD2-CE2 4.31Å; L46-T54 HydrophobicContact CD1-CG2 3.67Å; L46-V56 HydrophobicContact CD1-CG1 3.83Å; L46-R166 HydrophobicContact CD1-CB 4.03Å; L46-R166 HydrophobicContact CD2-CB 4.04Å; L46-A167 HydrophobicContact CD2-CB 4.09Å; L46-A167 HydrophobicContact CG-CB 4.33Å; L46-H218 CarbonylContact C-O 3.6Å; L46-H218 WeakPolarHBondContact CA-O 3.23Å
47	A	90.5	Very high	89.1	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.008	30%	0.301	C	S	.	.			trans	-55.8	147	172.5	0	0	0	0	0	111	S49 F50 H218 D220	A47-S49 PolarHBondContact O-N 3.49Å; A47-F50 HydrophobicContact CB-CD2 3.9Å; A47-F50 HydrophobicContact CB-CE2 4.04Å; A47-F50 WeakPolarHBondContact O-CD2 3.33Å; A47-F50 PolarHBondContact O-N 2.92Å; A47-H218 PolarHBondContact N-O 3.2Å; A47-D220 WeakPolarHBondContact CA-OD1 3.46Å; A47-D220 VanDerWaalsContact CB-OD1 3.25Å; A47-D220 WeakPolarHBondContact CB-OD1 3.36Å
48	S	88.5	Confident	89.5	Confident	104 Å²	104	49.1 Å²	49.1	73%	0.727	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-10.4	-180	67.5	0	0	0	0	113.7	F50 D220	S48-F50 VanDerWaalsContact C-N 3.32Å; S48-D220 VanDerWaalsContact N-CG 3.33Å; S48-D220 PolarHBondContact N-OD1 3.4Å; S48-D220 PolarHBondContact N-OD2 3.47Å
49	S	90.8	Very high	90	Very high	86 Å²	86	48.9 Å²	48.9	60%	0.601	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.7	173.7	60.5	0	0	0	0	113.7	A47	A47-S49 PolarHBondContact O-N 3.49Å
50	F	91.7	Very high	90.3	Very high	33 Å²	33	50 Å²	50	15%	0.145	29%	0.286	C	S	.	.	S	Bend	trans	-79.9	135.4	178.3	-72.4	-82.3	0	0	0	111.2	L46 A47 S48 T54 R166 H218	L46-F50 HydrophobicContact CB-CB 4.25Å; L46-F50 HydrophobicContact CB-CD2 3.86Å; L46-F50 HydrophobicContact CB-CG 4.25Å; L46-F50 HydrophobicContact CD1-CB 4.43Å; L46-F50 HydrophobicContact CD1-CG 4.43Å; L46-F50 HydrophobicContact CD2-CD2 4.3Å; L46-F50 HydrophobicContact CD2-CE2 4.31Å; A47-F50 HydrophobicContact CB-CD2 3.9Å; A47-F50 HydrophobicContact CB-CE2 4.04Å; A47-F50 WeakPolarHBondContact O-CD2 3.33Å; A47-F50 PolarHBondContact O-N 2.92Å; S48-F50 VanDerWaalsContact C-N 3.32Å; F50-T54 HydrophobicContact CD1-CG2 4.36Å; F50-R166 HydrophobicContact CE1-CG 4.32Å; F50-H218 AromaticContact CE2-CE1 3.36Å; F50-H218 WeakPolarHBondContact CE2-CE1 3.23Å; F50-H218 AromaticContact CE2-ND1 3.42Å; F50-H218 WeakPolarHBondContact CE2-ND1 3.45Å; F50-H218 AromaticContact CZ-CE1 3.58Å; F50-H218 AromaticContact CZ-ND1 3.52Å
51	P	92.4	Very high	91	Very high	75 Å²	75	49.4 Å²	49.4	49%	0.487	28%	0.278	S	S	.	.			trans	-67.6	152.3	176.7	28.4	-34	0	0	0	111.1	S53 T54	P51-S53 PolarHBondContact O-N 3.26Å; P51-S53 VanDerWaalsContact O-N 3.13Å; P51-T54 VanDerWaalsContact CD-OG1 3.32Å; P51-T54 WeakPolarHBondContact CD-OG1 3.19Å; P51-T54 WeakPolarHBondContact CG-OG1 3.16Å; P51-T54 WeakPolarHBondContact O-CB 3.18Å; P51-T54 PolarHBondContact O-N 2.6Å; P51-T54 PolarHBondContact O-OG1 3.03Å
52	L	90.4	Very high	91.6	Very high	100 Å²	100	47.2 Å²	47.2	52%	0.524	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.9	176.9	-66.4	177.5	0	0	0	113.4	L35 G36 T54	L35-L52 HydrophobicContact CD2-CD2 4.36Å; L35-L52 HydrophobicContact CG-CD2 4.38Å; L35-L52 PolarHBondContact N-O 3.27Å; G36-L52 PolarHBondContact N-O 2.81Å; L52-T54 PolarHBondContact O-N 2.87Å
53	S	90.4	Very high	92	Very high	90 Å²	90	48.4 Å²	48.4	63%	0.629	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-3	172	57.5	0	0	0	0	113.9	P51 G55	P51-S53 PolarHBondContact O-N 3.26Å; P51-S53 VanDerWaalsContact O-N 3.13Å; S53-G55 PolarHBondContact O-N 3.33Å
54	T	92.7	Very high	92.3	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.098	27%	0.267	C	S	.	.			trans	-64	128.3	179.8	-58.8	0	0	0	0	110.7	T34 L35 L46 F50 P51 L52 R166	T34-T54 CarbonylContact C-O 3.51Å; T34-T54 WeakPolarHBondContact CA-O 3.31Å; L35-T54 PolarHBondContact N-O 3.19Å; L46-T54 HydrophobicContact CD1-CG2 3.67Å; F50-T54 HydrophobicContact CD1-CG2 4.36Å; P51-T54 VanDerWaalsContact CD-OG1 3.32Å; P51-T54 WeakPolarHBondContact CD-OG1 3.19Å; P51-T54 WeakPolarHBondContact CG-OG1 3.16Å; P51-T54 WeakPolarHBondContact O-CB 3.18Å; P51-T54 PolarHBondContact O-N 2.6Å; P51-T54 PolarHBondContact O-OG1 3.03Å; L52-T54 PolarHBondContact O-N 2.87Å; T54-R166 HydrophobicContact CG2-CB 3.72Å; T54-R166 HydrophobicContact CG2-CG 3.41Å; T54-R166 VanDerWaalsContact CG2-CG 3.41Å
55	G	92.6	Very high	92.4	Very high	10 Å²	10	40 Å²	40	10%	0.103	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133	176.7	0	0	0	0	0	112.5	T33 S53 V165 R166	T33-G55 CarbonylContact O-C 3.55Å; T33-G55 WeakPolarHBondContact O-CA 3.41Å; S53-G55 PolarHBondContact O-N 3.33Å; G55-V165 WeakPolarHBondContact O-CA 3.14Å; G55-V165 WeakPolarHBondContact O-CB 3.22Å; G55-R166 PolarHBondContact O-N 2.77Å
56	V	94.7	Very high	92.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.1	172.8	-63.1	0	0	0	0	109.4	T33 L35 C38 L46 A167 Y169	T33-V56 HydrophobicContact CG2-CG2 3.88Å; T33-V56 PolarHBondContact N-O 3.08Å; T33-V56 PolarHBondContact O-N 2.97Å; L35-V56 HydrophobicContact CD1-CG1 4.39Å; C38-V56 WeakPolarHBondContact SG-CG2 2.95Å; L46-V56 HydrophobicContact CD1-CG1 3.83Å; V56-A167 CarbonylContact C-O 3.56Å; V56-A167 WeakPolarHBondContact CA-O 3.41Å; V56-A167 HydrophobicContact CG1-CB 4.19Å; V56-Y169 HydrophobicContact CG2-CE1 4.19Å
57	A	94.9	Very high	92.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128.6	176.5	0	0	0	0	0	110.5	T31 V32 F81 V85 V165 A167 V168 Y169	T31-A57 CarbonylContact O-C 3.42Å; T31-A57 VanDerWaalsContact O-CA 3.3Å; T31-A57 WeakPolarHBondContact O-CA 3.28Å; V32-A57 HydrophobicContact CG2-CB 4.37Å; A57-F81 HydrophobicContact CB-CE1 3.98Å; A57-F81 HydrophobicContact CB-CZ 4.08Å; A57-V85 HydrophobicContact CB-CB 4.09Å; A57-V85 HydrophobicContact CB-CG1 4.03Å; A57-V85 HydrophobicContact CB-CG2 3.94Å; A57-V165 HydrophobicContact CB-CG1 4.3Å; A57-V165 HydrophobicContact CB-CG2 4.14Å; A57-A167 PolarHBondContact N-O 2.65Å; A57-V168 HydrophobicContact CB-CG1 4.34Å; A57-V168 HydrophobicContact CB-CG2 4.2Å; A57-V168 CarbonylContact O-C 3.58Å; A57-V168 VanDerWaalsContact O-CA 3.31Å; A57-V168 WeakPolarHBondContact O-CA 3.42Å; A57-Y169 VanDerWaalsContact O-CD1 3.26Å; A57-Y169 WeakPolarHBondContact O-CD1 3.47Å; A57-Y169 PolarHBondContact O-N 3.38Å
58	Y	95.2	Very high	91.8	Very high	55 Å²	55	49.7 Å²	49.7	22%	0.216	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	128	173.5	-179.6	-126.7	0	0	0	109.8	G30 T31 L60 Y169 H171	G30-Y58 CarbonylContact C-O 3.59Å; G30-Y58 WeakPolarHBondContact CA-O 3.29Å; T31-Y58 PolarHBondContact N-O 2.86Å; T31-Y58 PolarHBondContact O-N 2.86Å; Y58-L60 HydrophobicContact CD1-CD1 3.72Å; Y58-L60 HydrophobicContact CD1-CG 3.75Å; Y58-L60 HydrophobicContact CE1-CB 4.4Å; Y58-L60 HydrophobicContact CE1-CD1 4.28Å; Y58-L60 HydrophobicContact CE1-CG 3.78Å; Y58-Y169 WeakPolarHBondContact CA-O 3.34Å; Y58-Y169 HydrophobicContact CD2-CD1 4.28Å; Y58-Y169 AromaticContact CD2-CD2 3.68Å; Y58-Y169 HydrophobicContact CD2-CD2 3.68Å; Y58-Y169 AromaticContact CD2-CE1 3.94Å; Y58-Y169 HydrophobicContact CD2-CE1 3.94Å; Y58-Y169 AromaticContact CD2-CE2 3.28Å; Y58-Y169 HydrophobicContact CD2-CE2 3.28Å; Y58-Y169 HydrophobicContact CD2-CG 4.17Å; Y58-Y169 AromaticContact CD2-CZ 3.42Å; Y58-Y169 VanDerWaalsContact CD2-CZ 3.42Å; Y58-Y169 WeakPolarHBondContact CD2-O 3.25Å; Y58-Y169 HydrophobicContact CE2-CD2 4.15Å; Y58-Y169 AromaticContact CE2-CE2 3.75Å; Y58-Y169 HydrophobicContact CE2-CE2 3.75Å; Y58-Y169 HydrophobicContact CG-CE1 4.15Å; Y58-Y169 HydrophobicContact CG-CE2 4.11Å; Y58-Y169 AromaticContact CG-CZ 3.77Å; Y58-H171 AromaticContact CE2-ND1 3.81Å; Y58-H171 AromaticContact CZ-ND1 3.92Å; Y58-H171 PolarHBondContact OH-ND1 3Å
59	I	96.2	Very high	91.6	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	112.5	169.6	-60.1	169.9	0	0	0	107.7	L28 L62 L78 F81 V168 Y169 L170	L28-I59 HydrophobicContact CD1-CD1 4.48Å; L28-I59 HydrophobicContact CG-CG2 4.31Å; I59-L62 HydrophobicContact CG2-CB 4.47Å; I59-L78 HydrophobicContact CD1-CD1 3.47Å; I59-L78 VanDerWaalsContact CD1-CD1 3.47Å; I59-F81 HydrophobicContact CD1-CD1 4.13Å; I59-F81 HydrophobicContact CD1-CE1 4.28Å; I59-F81 HydrophobicContact CG1-CD1 3.96Å; I59-F81 HydrophobicContact CG1-CE1 3.67Å; I59-F81 HydrophobicContact CG1-CZ 4.48Å; I59-V168 HydrophobicContact CD1-CG1 3.81Å; I59-V168 HydrophobicContact CG1-CG1 4.05Å; I59-Y169 PolarHBondContact N-O 3.3Å; I59-L170 HydrophobicContact CB-CB 4.03Å; I59-L170 HydrophobicContact CD1-CD2 4.05Å
60	L	93.6	Very high	91.4	Very high	65 Å²	65	54.9 Å²	54.9	34%	0.34	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-40.3	178.8	-70.8	80.8	0	0	0	111.2	L13 V29 T31 Y58	L13-L60 HydrophobicContact CD2-CD1 3.97Å; L13-L60 HydrophobicContact CD2-CD2 3.67Å; L13-L60 HydrophobicContact CD2-CG 4.49Å; V29-L60 PolarHBondContact O-N 2.98Å; T31-L60 HydrophobicContact CG2-CD1 3.85Å; Y58-L60 HydrophobicContact CD1-CD1 3.72Å; Y58-L60 HydrophobicContact CD1-CG 3.75Å; Y58-L60 HydrophobicContact CE1-CB 4.4Å; Y58-L60 HydrophobicContact CE1-CD1 4.28Å; Y58-L60 HydrophobicContact CE1-CG 3.78Å
61	S	94.7	Very high	91.1	Very high	58 Å²	58	60.7 Å²	60.7	41%	0.406	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	142.8	-177	-173.9	0	0	0	0	111.4	L28 V29	L28-S61 CarbonylContact C-O 3.58Å; L28-S61 WeakPolarHBondContact CA-O 3.18Å; V29-S61 PolarHBondContact N-O 2.78Å; V29-S61 PolarHBondContact O-N 3.14Å; V29-S61 VanDerWaalsContact O-N 3.12Å
62	L	95.2	Very high	90.8	Very high	37 Å²	37	58 Å²	58	19%	0.194	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	120.3	167	174	60.5	0	0	0	108.2	I27 L28 I59 L77 F182 Y183	I27-L62 CarbonylContact O-C 3.55Å; I27-L62 WeakPolarHBondContact O-CA 3.42Å; L28-L62 HydrophobicContact CB-CD1 3.95Å; L28-L62 HydrophobicContact CD1-CD1 4.17Å; L28-L62 HydrophobicContact CG-CD1 4.36Å; I59-L62 HydrophobicContact CG2-CB 4.47Å; L62-L77 HydrophobicContact CD1-CB 4.17Å; L62-L77 HydrophobicContact CD1-CD1 4.22Å; L62-F182 HydrophobicContact CD2-CE1 3.68Å; L62-F182 HydrophobicContact CD2-CZ 4.18Å; L62-Y183 HydrophobicContact CD2-CE1 4.09Å
63	G	92.7	Very high	90.6	Very high	30 Å²	30	53.5 Å²	53.5	31%	0.309	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	144.5	-177.9	0	0	0	0	0	112.1	G26 I27	G26-G63 CarbonylContact C-O 3.58Å; G26-G63 WeakPolarHBondContact CA-O 3.4Å; I27-G63 PolarHBondContact N-O 3.14Å; I27-G63 PolarHBondContact O-N 3.39Å
64	V	92.1	Very high	90.7	Very high	19 Å²	19	50.2 Å²	50.2	12%	0.115	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.4	170.1	179.6	0	0	0	0	108.3	V25 F68 R69 V73 A74 L77	V25-V64 CarbonylContact O-C 3.58Å; V25-V64 WeakPolarHBondContact O-CA 3.36Å; V25-V64 WeakPolarHBondContact O-CG1 3.48Å; V64-F68 HydrophobicContact CG1-CB 3.82Å; V64-R69 HydrophobicContact CG1-CG 4.5Å; V64-R69 PolarHBondContact O-NE 3.05Å; V64-V73 HydrophobicContact CG1-CB 4.11Å; V64-V73 HydrophobicContact CG1-CG1 4.24Å; V64-V73 HydrophobicContact CG2-CB 4.21Å; V64-V73 HydrophobicContact CG2-CG1 4.01Å; V64-A74 HydrophobicContact CG2-CB 3.72Å; V64-L77 HydrophobicContact CG2-CD1 4.43Å
65	T	89.5	Confident	90.6	Very high	52 Å²	52	51 Å²	51	32%	0.319	29%	0.293	S	S	.	.			trans	-59.1	145.4	176.8	57.7	0	0	0	0	110.4	L24 V25 S67 F68 R69	L24-T65 WeakPolarHBondContact O-CG2 3.19Å; V25-T65 PolarHBondContact O-N 3.4Å; V25-T65 PolarHBondContact O-OG1 2.93Å; T65-S67 VanDerWaalsContact C-N 3.26Å; T65-S67 PolarHBondContact O-N 3.33Å; T65-F68 CarbonylContact O-C 3.56Å; T65-F68 PolarHBondContact O-N 2.74Å; T65-F68 WeakPolarHBondContact OG1-CD2 3.37Å; T65-R69 WeakPolarHBondContact O-CG 3.35Å; T65-R69 PolarHBondContact O-N 2.68Å; T65-R69 VanDerWaalsContact O-N 3.14Å
66	S	89.6	Confident	90.3	Very high	94 Å²	94	52.6 Å²	52.6	66%	0.657	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-56.5	-37.9	-172.3	48.9	0	0	0	0	113.3	F68 R69	S66-F68 PolarHBondContact O-N 2.79Å; S66-R69 PolarHBondContact O-N 2.98Å
67	S	86.3	Confident	90.2	Very high	71 Å²	71	52.6 Å²	52.6	50%	0.497	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-63.8	-24.2	177.3	43.2	0	0	0	0	114.1	T65 R71	T65-S67 VanDerWaalsContact C-N 3.26Å; T65-S67 PolarHBondContact O-N 3.33Å; S67-R71 PolarHBondContact O-NE 2.89Å; S67-R71 VanDerWaalsContact O-NE 3.09Å
68	F	82.9	Confident	90.1	Very high	42 Å²	42	52.7 Å²	52.7	18%	0.184	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-108.5	3.1	-179	-69.8	-95.7	0	0	0	113.7	V25 V64 T65 S66 V73	V25-F68 HydrophobicContact CB-CB 4.21Å; V25-F68 HydrophobicContact CB-CD1 4.18Å; V25-F68 HydrophobicContact CB-CD2 3.81Å; V25-F68 HydrophobicContact CB-CE2 4.2Å; V25-F68 HydrophobicContact CB-CG 3.8Å; V25-F68 HydrophobicContact CG1-CD1 4.04Å; V25-F68 HydrophobicContact CG1-CD2 3.48Å; V25-F68 VanDerWaalsContact CG1-CD2 3.48Å; V25-F68 HydrophobicContact CG1-CE1 3.92Å; V25-F68 HydrophobicContact CG1-CE2 3.34Å; V25-F68 HydrophobicContact CG1-CG 3.84Å; V25-F68 HydrophobicContact CG1-CZ 3.57Å; V25-F68 HydrophobicContact CG2-CD1 4.44Å; V25-F68 HydrophobicContact CG2-CG 4.46Å; V64-F68 HydrophobicContact CG1-CB 3.82Å; T65-F68 CarbonylContact O-C 3.56Å; T65-F68 PolarHBondContact O-N 2.74Å; T65-F68 WeakPolarHBondContact OG1-CD2 3.37Å; S66-F68 PolarHBondContact O-N 2.79Å; F68-V73 HydrophobicContact CB-CG2 4.36Å
69	R	85.6	Confident	89.9	Confident	165 Å²	165	56.8 Å²	56.8	62%	0.623	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	151.3	172.3	-71.6	-179.8	-171.3	176.4	0.9	110.8	V64 T65 S66 R71	V64-R69 HydrophobicContact CG1-CG 4.5Å; V64-R69 PolarHBondContact O-NE 3.05Å; T65-R69 WeakPolarHBondContact O-CG 3.35Å; T65-R69 PolarHBondContact O-N 2.68Å; T65-R69 VanDerWaalsContact O-N 3.14Å; S66-R69 PolarHBondContact O-N 2.98Å; R69-R71 PolarHBondContact O-N 3.02Å; R69-R71 VanDerWaalsContact O-N 3.07Å
70	S	85.9	Confident	89.6	Confident	134 Å²	134	56.5 Å²	56.5	94%	0.937	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	11.6	-179.7	-51.6	0	0	0	0	115.6
71	R	85.1	Confident	89.5	Confident	155 Å²	155	53.4 Å²	53.4	59%	0.585	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.5	173.5	-59.3	-175	-175.2	-122.7	-0.4	113.8	S67 R69 L102	S67-R71 PolarHBondContact O-NE 2.89Å; S67-R71 VanDerWaalsContact O-NE 3.09Å; R69-R71 PolarHBondContact O-N 3.02Å; R69-R71 VanDerWaalsContact O-N 3.07Å; R71-L102 HydrophobicContact CB-CD2 4.4Å; R71-L102 WeakPolarHBondContact O-CD2 3.42Å
72	G	85.7	Confident	89.4	Confident	20 Å²	20	51.7 Å²	51.7	21%	0.206	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.9	-4.7	-179.7	0	0	0	0	0	115.3	A74 S75 I76	G72-A74 PolarHBondContact O-N 3.16Å; G72-S75 WeakPolarHBondContact O-CA 3.34Å; G72-S75 WeakPolarHBondContact O-CB 3.39Å; G72-S75 PolarHBondContact O-N 3.26Å; G72-S75 PolarHBondContact O-OG 3.45Å; G72-I76 PolarHBondContact O-N 2.98Å
73	V	87.9	Confident	89.1	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.024	27%	0.273	C	S	.	.	H	α-helix	trans	-52.1	-50.5	178.6	179.2	0	0	0	0	112.3	A18 V25 V64 F68 S75 I76 L77 L102	A18-V73 HydrophobicContact CB-CG1 3.49Å; A18-V73 VanDerWaalsContact CB-CG1 3.49Å; V25-V73 HydrophobicContact CG2-CG1 4.36Å; V64-V73 HydrophobicContact CG1-CB 4.11Å; V64-V73 HydrophobicContact CG1-CG1 4.24Å; V64-V73 HydrophobicContact CG2-CB 4.21Å; V64-V73 HydrophobicContact CG2-CG1 4.01Å; F68-V73 HydrophobicContact CB-CG2 4.36Å; V73-S75 PolarHBondContact O-N 3.33Å; V73-I76 PolarHBondContact O-N 3.25Å; V73-I76 VanDerWaalsContact O-N 3.16Å; V73-L77 HydrophobicContact CG1-CD1 4.07Å; V73-L77 WeakPolarHBondContact O-CG 3.42Å; V73-L77 PolarHBondContact O-N 2.88Å; V73-L102 HydrophobicContact CG2-CD2 4.24Å
74	A	91.8	Very high	89	Confident	22 Å²	22	49.4 Å²	49.4	18%	0.182	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-34.9	177.3	0	0	0	0	0	112.3	V64 G72 L78 F182	V64-A74 HydrophobicContact CG2-CB 3.72Å; G72-A74 PolarHBondContact O-N 3.16Å; A74-L78 VanDerWaalsContact O-CB 3.23Å; A74-L78 WeakPolarHBondContact O-CB 3.3Å; A74-L78 PolarHBondContact O-N 3.23Å; A74-F182 HydrophobicContact CB-CE2 3.72Å; A74-F182 HydrophobicContact CB-CZ 3.65Å
75	S	90.1	Very high	88.9	Confident	33 Å²	33	48.5 Å²	48.5	23%	0.231	26%	0.257	C	S	.	.	H	α-helix	trans	-66.4	-43.4	177.9	-41.7	0	0	0	0	111.2	G72 V73 R79 R186	G72-S75 WeakPolarHBondContact O-CA 3.34Å; G72-S75 WeakPolarHBondContact O-CB 3.39Å; G72-S75 PolarHBondContact O-N 3.26Å; G72-S75 PolarHBondContact O-OG 3.45Å; V73-S75 PolarHBondContact O-N 3.33Å; S75-R79 WeakPolarHBondContact O-CB 3.46Å; S75-R79 PolarHBondContact O-N 3.43Å; S75-R186 PolarHBondContact OG-NH2 3.4Å
76	I	87.2	Confident	89	Confident	42 Å²	42	46.1 Å²	46.1	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-52.4	176.8	-69.5	-162.6	0	0	0	109.6	G72 V73 L78 R79 S80 L102 L107 L152	G72-I76 PolarHBondContact O-N 2.98Å; V73-I76 PolarHBondContact O-N 3.25Å; V73-I76 VanDerWaalsContact O-N 3.16Å; I76-L78 VanDerWaalsContact C-N 3.29Å; I76-L78 PolarHBondContact O-N 2.82Å; I76-R79 PolarHBondContact O-N 2.79Å; I76-S80 VanDerWaalsContact O-CB 3.29Å; I76-S80 WeakPolarHBondContact O-CB 3.34Å; I76-S80 PolarHBondContact O-N 3.37Å; I76-S80 PolarHBondContact O-OG 3.27Å; I76-S80 VanDerWaalsContact O-OG 3.05Å; I76-L102 HydrophobicContact CD1-CD1 3.25Å; I76-L102 HydrophobicContact CD1-CG 4.5Å; I76-L102 HydrophobicContact CG1-CD1 3.86Å; I76-L107 HydrophobicContact CG2-CD1 4.03Å; I76-L107 HydrophobicContact CG2-CD2 4.42Å; I76-L152 HydrophobicContact CG2-CD1 4.03Å
77	L	91.3	Very high	88.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-52.6	-49.5	179.3	-71.3	171.2	0	0	0	111.6	I16 A18 L28 L62 V64 V73 F81 L107	I16-L77 HydrophobicContact CB-CD2 4.1Å; I16-L77 HydrophobicContact CG2-CD2 3.68Å; I16-L77 WeakPolarHBondContact O-CD2 3.11Å; A18-L77 HydrophobicContact CB-CD1 4.24Å; A18-L77 HydrophobicContact CB-CD2 4.19Å; A18-L77 HydrophobicContact CB-CG 4.38Å; L28-L77 HydrophobicContact CB-CB 4.11Å; L28-L77 HydrophobicContact CD1-CB 4.49Å; L62-L77 HydrophobicContact CD1-CB 4.17Å; L62-L77 HydrophobicContact CD1-CD1 4.22Å; V64-L77 HydrophobicContact CG2-CD1 4.43Å; V73-L77 HydrophobicContact CG1-CD1 4.07Å; V73-L77 WeakPolarHBondContact O-CG 3.42Å; V73-L77 PolarHBondContact O-N 2.88Å; L77-F81 PolarHBondContact O-N 3.31Å; L77-L107 HydrophobicContact CD2-CD1 4.28Å; L77-L107 HydrophobicContact CD2-CD2 3.96Å; L77-L107 HydrophobicContact CD2-CG 4.29Å
78	L	93.6	Very high	88.5	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-45.9	179.7	-178.9	60.3	0	0	0	112.3	L28 I59 A74 I76 F81 I82 F182 Y183 F188	L28-L78 HydrophobicContact CD1-CB 4.41Å; L28-L78 HydrophobicContact CD1-CD1 4.24Å; I59-L78 HydrophobicContact CD1-CD1 3.47Å; I59-L78 VanDerWaalsContact CD1-CD1 3.47Å; A74-L78 VanDerWaalsContact O-CB 3.23Å; A74-L78 WeakPolarHBondContact O-CB 3.3Å; A74-L78 PolarHBondContact O-N 3.23Å; I76-L78 VanDerWaalsContact C-N 3.29Å; I76-L78 PolarHBondContact O-N 2.82Å; L78-F81 PolarHBondContact O-N 3.23Å; L78-I82 HydrophobicContact CD1-CD1 3.76Å; L78-I82 HydrophobicContact CD1-CG1 4.16Å; L78-I82 HydrophobicContact CD2-CD1 4.44Å; L78-I82 HydrophobicContact CG-CD1 3.7Å; L78-I82 HydrophobicContact CG-CG1 4.48Å; L78-I82 VanDerWaalsContact O-CG1 3.26Å; L78-I82 WeakPolarHBondContact O-CG1 3.32Å; L78-I82 PolarHBondContact O-N 2.98Å; L78-F182 HydrophobicContact CB-CZ 4.46Å; L78-F182 HydrophobicContact CD2-CE1 3.6Å; L78-F182 HydrophobicContact CD2-CZ 3.95Å; L78-Y183 HydrophobicContact CD2-CD1 4.14Å; L78-Y183 HydrophobicContact CD2-CE1 4.18Å; L78-F188 HydrophobicContact CD1-CE2 4.4Å; L78-F188 HydrophobicContact CD1-CZ 4.24Å; L78-F188 HydrophobicContact CD2-CE2 4.04Å
79	R	91.6	Very high	88	Confident	141 Å²	141	49.4 Å²	49.4	53%	0.532	26%	0.258	S	S	.	.	H	α-helix	trans	-67.4	-39.3	-178.6	-168.6	178.2	171.6	104.3	1.1	111.5	S75 I76 I82 G83 M90 W92	S75-R79 WeakPolarHBondContact O-CB 3.46Å; S75-R79 PolarHBondContact O-N 3.43Å; I76-R79 PolarHBondContact O-N 2.79Å; R79-I82 PolarHBondContact O-N 2.85Å; R79-G83 PolarHBondContact O-N 3.42Å; R79-M90 WeakPolarHBondContact O-CE 3.39Å; R79-W92 HydrophobicContact CB-CH2 4.37Å; R79-W92 HydrophobicContact CB-CZ2 4.36Å; R79-W92 VanDerWaalsContact CD-CH2 3.46Å; R79-W92 VanDerWaalsContact CD-CZ2 3.47Å; R79-W92 HydrophobicContact CG-CH2 3.93Å; R79-W92 HydrophobicContact CG-CZ2 3.6Å; R79-W92 VanDerWaalsContact NE-CZ2 3.31Å
80	S	88.6	Confident	87.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.2	-47.9	172.8	-68	0	0	0	0	111.3	I76 Y84	I76-S80 VanDerWaalsContact O-CB 3.29Å; I76-S80 WeakPolarHBondContact O-CB 3.34Å; I76-S80 PolarHBondContact O-N 3.37Å; I76-S80 PolarHBondContact O-OG 3.27Å; I76-S80 VanDerWaalsContact O-OG 3.05Å; S80-Y84 WeakPolarHBondContact O-CB 3.37Å; S80-Y84 PolarHBondContact O-N 2.92Å
81	F	92	Very high	86.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-48.2	177.1	-178.2	-101.9	0	0	0	112.3	I14 I16 L28 A57 I59 L77 L78 G83 Y84 V85 V168	I14-F81 HydrophobicContact CB-CE2 4.24Å; I14-F81 HydrophobicContact CD1-CE2 4.48Å; I14-F81 HydrophobicContact CG2-CD2 4.35Å; I14-F81 HydrophobicContact CG2-CE2 4.27Å; I16-F81 HydrophobicContact CD1-CB 3.95Å; I16-F81 HydrophobicContact CD1-CD2 4.43Å; L28-F81 HydrophobicContact CD1-CB 3.79Å; L28-F81 HydrophobicContact CD1-CG 4.22Å; L28-F81 HydrophobicContact CD2-CB 3.68Å; L28-F81 HydrophobicContact CD2-CD1 4.12Å; L28-F81 HydrophobicContact CD2-CD2 3.46Å; L28-F81 VanDerWaalsContact CD2-CD2 3.46Å; L28-F81 HydrophobicContact CD2-CE2 4.09Å; L28-F81 HydrophobicContact CD2-CG 3.47Å; L28-F81 VanDerWaalsContact CD2-CG 3.47Å; L28-F81 HydrophobicContact CG-CB 4.42Å; A57-F81 HydrophobicContact CB-CE1 3.98Å; A57-F81 HydrophobicContact CB-CZ 4.08Å; I59-F81 HydrophobicContact CD1-CD1 4.13Å; I59-F81 HydrophobicContact CD1-CE1 4.28Å; I59-F81 HydrophobicContact CG1-CD1 3.96Å; I59-F81 HydrophobicContact CG1-CE1 3.67Å; I59-F81 HydrophobicContact CG1-CZ 4.48Å; L77-F81 PolarHBondContact O-N 3.31Å; L78-F81 PolarHBondContact O-N 3.23Å; F81-G83 PolarHBondContact O-N 3.47Å; F81-Y84 PolarHBondContact O-N 2.91Å; F81-V85 HydrophobicContact CD1-CG1 4.41Å; F81-V85 HydrophobicContact CD1-CG2 4.5Å; F81-V85 HydrophobicContact CD2-CG1 4.31Å; F81-V85 HydrophobicContact CE1-CG1 3.97Å; F81-V85 HydrophobicContact CE1-CG2 4.31Å; F81-V85 HydrophobicContact CE2-CG1 3.85Å; F81-V85 HydrophobicContact CZ-CG1 3.67Å; F81-V85 WeakPolarHBondContact O-CG2 3.4Å; F81-V85 PolarHBondContact O-N 2.72Å; F81-V168 HydrophobicContact CD1-CG1 4.48Å; F81-V168 HydrophobicContact CE1-CG1 4.14Å
82	I	92.6	Very high	85.6	Confident	22 Å²	22	36.3 Å²	36.3	11%	0.113	20%	0.195	C	C	.	.	H	α-helix	trans	-59.8	-46	-179.8	-69.3	163.9	0	0	0	111	L78 R79 Y84 V85 S86 V168 F188 L212 T214	L78-I82 HydrophobicContact CD1-CD1 3.76Å; L78-I82 HydrophobicContact CD1-CG1 4.16Å; L78-I82 HydrophobicContact CD2-CD1 4.44Å; L78-I82 HydrophobicContact CG-CD1 3.7Å; L78-I82 HydrophobicContact CG-CG1 4.48Å; L78-I82 VanDerWaalsContact O-CG1 3.26Å; L78-I82 WeakPolarHBondContact O-CG1 3.32Å; L78-I82 PolarHBondContact O-N 2.98Å; R79-I82 PolarHBondContact O-N 2.85Å; I82-Y84 VanDerWaalsContact C-N 3.35Å; I82-Y84 PolarHBondContact O-N 2.94Å; I82-V85 WeakPolarHBondContact O-CG2 3.45Å; I82-V85 PolarHBondContact O-N 3.17Å; I82-S86 WeakPolarHBondContact O-CB 3.37Å; I82-S86 PolarHBondContact O-N 2.84Å; I82-S86 PolarHBondContact O-OG 2.74Å; I82-V168 HydrophobicContact CG1-CG2 4.39Å; I82-F188 HydrophobicContact CD1-CE2 4.02Å; I82-F188 HydrophobicContact CD1-CZ 4.1Å; I82-L212 HydrophobicContact CD1-CD2 3.66Å; I82-L212 HydrophobicContact CG1-CD2 4.3Å; I82-L212 HydrophobicContact CG2-CD2 4.17Å; I82-T214 HydrophobicContact CG2-CG2 4.43Å
83	G	89.7	Confident	84.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-39.5	180	0	0	0	0	0	112.4	R79 F81 G87 E88	R79-G83 PolarHBondContact O-N 3.42Å; F81-G83 PolarHBondContact O-N 3.47Å; G83-G87 PolarHBondContact O-N 2.81Å; G83-G87 VanDerWaalsContact O-N 3.1Å; G83-E88 PolarHBondContact O-N 2.62Å; G83-E88 VanDerWaalsContact O-N 3.07Å
84	Y	89.2	Confident	83	Confident	20 Å²	20	40.4 Å²	40.4	8%	0.078	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-52.7	173.2	168	-108.4	0	0	0	112.2	I14 S80 F81 I82 S86 G87 I156 L159 P160 V162	I14-Y84 HydrophobicContact CD1-CE1 3.72Å; I14-Y84 HydrophobicContact CG1-CE1 3.95Å; I14-Y84 HydrophobicContact CG2-CD1 4.41Å; I14-Y84 HydrophobicContact CG2-CE1 4.09Å; S80-Y84 WeakPolarHBondContact O-CB 3.37Å; S80-Y84 PolarHBondContact O-N 2.92Å; F81-Y84 PolarHBondContact O-N 2.91Å; I82-Y84 VanDerWaalsContact C-N 3.35Å; I82-Y84 PolarHBondContact O-N 2.94Å; Y84-S86 VanDerWaalsContact C-N 3.33Å; Y84-S86 PolarHBondContact O-N 3.34Å; Y84-G87 PolarHBondContact O-N 3.28Å; Y84-I156 HydrophobicContact CD2-CG2 3.74Å; Y84-I156 HydrophobicContact CG-CG2 4.21Å; Y84-L159 HydrophobicContact CD1-CD1 4.16Å; Y84-L159 HydrophobicContact CD2-CB 4.08Å; Y84-L159 HydrophobicContact CD2-CD1 3.82Å; Y84-L159 HydrophobicContact CE1-CD1 4.09Å; Y84-L159 HydrophobicContact CE2-CB 3.27Å; Y84-L159 HydrophobicContact CE2-CD1 3.73Å; Y84-L159 HydrophobicContact CE2-CG 4.14Å; Y84-L159 HydrophobicContact CG-CD1 4.02Å; Y84-P160 PolarHBondContact OH-O 2.72Å; Y84-V162 HydrophobicContact CD1-CG2 4.43Å; Y84-V162 HydrophobicContact CE1-CG1 4.37Å; Y84-V162 HydrophobicContact CE1-CG2 3.91Å; Y84-V162 HydrophobicContact CE2-CG2 4.09Å
85	V	91.6	Very high	81.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-72.8	-25.7	-177.4	-58.4	0	0	0	0	113.3	V32 A57 F81 I82 G87 P164 V165 V168	V32-V85 HydrophobicContact CG2-CB 4.36Å; V32-V85 HydrophobicContact CG2-CG1 3.72Å; A57-V85 HydrophobicContact CB-CB 4.09Å; A57-V85 HydrophobicContact CB-CG1 4.03Å; A57-V85 HydrophobicContact CB-CG2 3.94Å; F81-V85 HydrophobicContact CD1-CG1 4.41Å; F81-V85 HydrophobicContact CD1-CG2 4.5Å; F81-V85 HydrophobicContact CD2-CG1 4.31Å; F81-V85 HydrophobicContact CE1-CG1 3.97Å; F81-V85 HydrophobicContact CE1-CG2 4.31Å; F81-V85 HydrophobicContact CE2-CG1 3.85Å; F81-V85 HydrophobicContact CZ-CG1 3.67Å; F81-V85 WeakPolarHBondContact O-CG2 3.4Å; F81-V85 PolarHBondContact O-N 2.72Å; I82-V85 WeakPolarHBondContact O-CG2 3.45Å; I82-V85 PolarHBondContact O-N 3.17Å; V85-G87 VanDerWaalsContact C-N 3.33Å; V85-P164 WeakPolarHBondContact O-CA 3.46Å; V85-V165 HydrophobicContact CB-CG1 4.27Å; V85-V165 HydrophobicContact CB-CG2 3.87Å; V85-V165 HydrophobicContact CG2-CG2 3.67Å; V85-V165 WeakPolarHBondContact O-CG2 3.35Å; V85-V165 PolarHBondContact O-N 2.92Å; V85-V168 HydrophobicContact CG2-CG2 3.72Å
86	S	90.9	Very high	79	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-83.5	-11.9	178.4	-54.6	0	0	0	0	112.6	I82 Y84 E88 P164 T214 N215	I82-S86 WeakPolarHBondContact O-CB 3.37Å; I82-S86 PolarHBondContact O-N 2.84Å; I82-S86 PolarHBondContact O-OG 2.74Å; Y84-S86 VanDerWaalsContact C-N 3.33Å; Y84-S86 PolarHBondContact O-N 3.34Å; S86-E88 PolarHBondContact O-N 3.05Å; S86-P164 WeakPolarHBondContact O-CB 3.37Å; S86-T214 WeakPolarHBondContact OG-CG2 3.4Å; S86-N215 PolarHBondContact O-ND2 3.18Å; S86-N215 PolarHBondContact O-OD1 3.19Å
87	G	85	Confident	76.7	Confident	55 Å²	55	51 Å²	51	57%	0.567	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	25.2	-173.2	0	0	0	0	0	113.1	G83 Y84 V85	G83-G87 PolarHBondContact O-N 2.81Å; G83-G87 VanDerWaalsContact O-N 3.1Å; Y84-G87 PolarHBondContact O-N 3.28Å; V85-G87 VanDerWaalsContact C-N 3.33Å
88	E	81	Confident	74.2	Confident	112 Å²	112	58.3 Å²	58.3	52%	0.523	31%	0.305	S	S	.	.			trans	-69.9	144.6	174.9	-72.3	-174.2	162.4	0	0	110.2	G83 S86 M90	G83-E88 PolarHBondContact O-N 2.62Å; G83-E88 VanDerWaalsContact O-N 3.07Å; S86-E88 PolarHBondContact O-N 3.05Å; E88-M90 WeakPolarHBondContact O-CG 3.41Å; E88-M90 PolarHBondContact O-N 3.03Å
89	N	72.4	Confident	71.4	Confident	108 Å²	108	65.7 Å²	65.7	58%	0.578	34%	0.339	S	S	*	.			trans	-68.7	116	169.9	-176.3	-6.5	0	0	0	109.5	D91	N89-D91 VanDerWaalsContact CG-OD2 3.31Å; N89-D91 PolarHBondContact ND2-OD2 3.38Å; N89-D91 PolarHBondContact O-N 3.05Å; N89-D91 PolarHBondContact OD1-N 2.95Å; N89-D91 VanDerWaalsContact OD1-N 3.07Å; N89-D91 PolarHBondContact OD1-OD1 3.21Å; N89-D91 PolarHBondContact OD1-OD2 2.95Å
90	M	71.4	Confident	68.8	Low	7 Å²	7	63.8 Å²	63.8	3%	0.034	34%	0.343	C	S	.	.			trans	-94.8	24.3	-175.7	-50.1	-151.8	81.3	0	0	114	R79 E88 W92 L93 Y153 I156	R79-M90 WeakPolarHBondContact O-CE 3.39Å; E88-M90 WeakPolarHBondContact O-CG 3.41Å; E88-M90 PolarHBondContact O-N 3.03Å; M90-W92 HydrophobicContact CE-CZ2 3.72Å; M90-W92 PolarHBondContact O-N 2.99Å; M90-L93 HydrophobicContact CB-CD1 3.89Å; M90-L93 HydrophobicContact CE-CD1 4.16Å; M90-L93 WeakPolarHBondContact O-CB 3.27Å; M90-L93 PolarHBondContact O-N 2.94Å; M90-L93 HydrophobicContact SD-CD1 4.17Å; M90-Y153 HydrophobicContact CB-CD2 4.2Å; M90-I156 HydrophobicContact SD-CD1 3.71Å; M90-I156 HydrophobicContact SD-CG2 4.38Å
91	D	70.1	Confident	66	Low	82 Å²	82	71 Å²	71	44%	0.439	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-49.7	-28.6	177.2	-76.9	-24.6	0	0	0	113.8	N89 L93 N94	N89-D91 VanDerWaalsContact CG-OD2 3.31Å; N89-D91 PolarHBondContact ND2-OD2 3.38Å; N89-D91 PolarHBondContact O-N 3.05Å; N89-D91 PolarHBondContact OD1-N 2.95Å; N89-D91 VanDerWaalsContact OD1-N 3.07Å; N89-D91 PolarHBondContact OD1-OD1 3.21Å; N89-D91 PolarHBondContact OD1-OD2 2.95Å; D91-L93 PolarHBondContact O-N 3.12Å; D91-L93 VanDerWaalsContact O-N 3.12Å; D91-N94 WeakPolarHBondContact O-CB 3.47Å; D91-N94 PolarHBondContact O-N 2.99Å
92	W	65.2	Low	63.5	Low	90 Å²	90	72.5 Å²	72.5	34%	0.341	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-58.8	-21.8	175.9	69.9	-91.1	0	0	0	114.1	R79 M90 N94 D95	R79-W92 HydrophobicContact CB-CH2 4.37Å; R79-W92 HydrophobicContact CB-CZ2 4.36Å; R79-W92 VanDerWaalsContact CD-CH2 3.46Å; R79-W92 VanDerWaalsContact CD-CZ2 3.47Å; R79-W92 HydrophobicContact CG-CH2 3.93Å; R79-W92 HydrophobicContact CG-CZ2 3.6Å; R79-W92 VanDerWaalsContact NE-CZ2 3.31Å; M90-W92 HydrophobicContact CE-CZ2 3.72Å; M90-W92 PolarHBondContact O-N 2.99Å; W92-N94 PolarHBondContact O-N 3.22Å; W92-D95 PolarHBondContact O-N 3.06Å
93	L	62.6	Low	60.5	Low	33 Å²	33	76.1 Å²	76.1	17%	0.173	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-71.4	-17.7	174.1	-73.8	167.8	0	0	0	113	M90 D91 L152 I156	M90-L93 HydrophobicContact CB-CD1 3.89Å; M90-L93 HydrophobicContact CE-CD1 4.16Å; M90-L93 WeakPolarHBondContact O-CB 3.27Å; M90-L93 PolarHBondContact O-N 2.94Å; M90-L93 HydrophobicContact SD-CD1 4.17Å; D91-L93 PolarHBondContact O-N 3.12Å; D91-L93 VanDerWaalsContact O-N 3.12Å; L93-L152 HydrophobicContact CD1-CB 4.12Å; L93-L152 HydrophobicContact CD2-CB 4.23Å; L93-L152 HydrophobicContact CD2-CD1 4.22Å; L93-I156 HydrophobicContact CD1-CD1 3.81Å
94	N	55.5	Low	57.9	Low	77 Å²	77	77.2 Å²	77.2	41%	0.412	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-94.7	-9.6	177.8	-69.3	-32	0	0	0	112.9	D91 W92 S96 S151 Y153	D91-N94 WeakPolarHBondContact O-CB 3.47Å; D91-N94 PolarHBondContact O-N 2.99Å; W92-N94 PolarHBondContact O-N 3.22Å; N94-S96 PolarHBondContact O-N 2.94Å; N94-S151 VanDerWaalsContact OD1-CB 3.22Å; N94-S151 WeakPolarHBondContact OD1-CB 3.44Å; N94-S151 PolarHBondContact OD1-OG 2.69Å; N94-Y153 WeakPolarHBondContact ND2-CD1 3.42Å; N94-Y153 WeakPolarHBondContact OD1-CB 3.26Å
95	D	54	Low	55.4	Low	83 Å²	83	81 Å²	81	44%	0.444	45%	0.454	S	S	.	.			trans	-84.8	99.5	-176.1	-156.6	-7.7	0	0	0	110.5	W92 N97 H98	W92-D95 PolarHBondContact O-N 3.06Å; D95-N97 PolarHBondContact O-N 3.18Å; D95-H98 PolarHBondContact O-N 3.47Å
96	S	43.8	Very low	53	Low	96 Å²	96	82 Å²	82	67%	0.671	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-62.9	-11.2	-178.2	46	0	0	0	0	114.1	N94	N94-S96 PolarHBondContact O-N 2.94Å
97	N	39.7	Very low	50.8	Low	140 Å²	140	82.4 Å²	82.4	75%	0.749	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-84.4	-11.4	179.9	-70.5	-44.7	0	0	0	114.5	D95	D95-N97 PolarHBondContact O-N 3.18Å
98	H	37.8	Very low	49.1	Very low	155 Å²	155	81.5 Å²	81.5	72%	0.718	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-110.7	41	172	-78.1	78	0	0	0	111.4	D95 V100	D95-H98 PolarHBondContact O-N 3.47Å; H98-V100 PolarHBondContact O-N 3.17Å
99	Q	35.7	Very low	47.2	Very low	157 Å²	157	76.6 Å²	76.6	73%	0.734	42%	0.419	S	S	*	.			trans	-65	86.5	166.6	-151.4	171.1	40.1	0	0	107.8	D101	Q99-D101 PolarHBondContact O-N 2.77Å
100	V	36.7	Very low	45.6	Very low	100 Å²	100	74.3 Å²	74.3	61%	0.606	41%	0.405	S	S	*	.			trans	-47.5	114.7	148.4	177	0	0	0	0	103.7	H98 L102	H98-V100 PolarHBondContact O-N 3.17Å; V100-L102 HydrophobicContact CB-CD1 4.04Å; V100-L102 HydrophobicContact CG1-CD1 3.68Å; V100-L102 HydrophobicContact CG1-CG 4.13Å; V100-L102 WeakPolarHBondContact O-CA 3.29Å; V100-L102 WeakPolarHBondContact O-CB 2.8Å; V100-L102 PolarHBondContact O-N 3.28Å
101	D	28.4	Very low	43.7	Very low	153 Å²	153	76 Å²	76	82%	0.818	42%	0.416	S	S	*	.	S	Bend	trans	-49.9	85.5	-172.6	-167.2	17.4	0	0	0	110.8	Q99	Q99-D101 PolarHBondContact O-N 2.77Å
102	L	39.4	Very low	42	Very low	30 Å²	30	75 Å²	75	16%	0.157	41%	0.412	C	S	.	.			trans	-132.9	84.9	-170.6	-82.7	164.9	0	0	0	107.3	R71 V73 I76 V100 C104	R71-L102 HydrophobicContact CB-CD2 4.4Å; R71-L102 WeakPolarHBondContact O-CD2 3.42Å; V73-L102 HydrophobicContact CG2-CD2 4.24Å; I76-L102 HydrophobicContact CD1-CD1 3.25Å; I76-L102 HydrophobicContact CD1-CG 4.5Å; I76-L102 HydrophobicContact CG1-CD1 3.86Å; V100-L102 HydrophobicContact CB-CD1 4.04Å; V100-L102 HydrophobicContact CG1-CD1 3.68Å; V100-L102 HydrophobicContact CG1-CG 4.13Å; V100-L102 WeakPolarHBondContact O-CA 3.29Å; V100-L102 WeakPolarHBondContact O-CB 2.8Å; V100-L102 PolarHBondContact O-N 3.28Å; L102-C104 PolarHBondContact O-N 3.42Å
103	S	31.2	Very low	40.4	Very low	99 Å²	99	76.7 Å²	76.7	69%	0.692	43%	0.428	S	S	*	.			trans	-59.1	59.5	154.3	163.4	0	0	0	0	111
104	C	34.4	Very low	38.9	Very low	23 Å²	23	76.3 Å²	76.3	16%	0.155	43%	0.432	C	S	.	.			trans	-132.2	80	170.8	-154.6	0	0	0	0	107.3	V19 V25 L102 D106	V19-C104 PolarHBondContact O-SG 3.39Å; V25-C104 VanDerWaalsContact CG2-SG 3.6Å; L102-C104 PolarHBondContact O-N 3.42Å; C104-D106 PolarHBondContact O-N 3.18Å
105	S	36.2	Very low	37.7	Very low	100 Å²	100	77.9 Å²	77.9	70%	0.699	44%	0.44	S	S	*	.			trans	-74.4	0.6	-170.4	-55.5	0	0	0	0	114.6
106	D	41.7	Very low	36.8	Very low	19 Å²	19	78.3 Å²	78.3	10%	0.102	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	78.4	-170.1	-52.2	-72.7	0	0	0	111.9	V19 G21 C104 F108	V19-D106 CarbonylContact C-O 3.21Å; V19-D106 WeakPolarHBondContact CA-O 3.4Å; V19-D106 HydrophobicContact CB-CB 3.92Å; V19-D106 WeakPolarHBondContact CB-O 3.21Å; V19-D106 HydrophobicContact CG1-CB 4.02Å; V19-D106 PolarHBondContact N-O 3.44Å; V19-D106 CarbonylContact O-C 3.52Å; V19-D106 WeakPolarHBondContact O-CB 3.25Å; V19-D106 PolarHBondContact O-N 2.98Å; G21-D106 PolarHBondContact N-OD2 3.3Å; C104-D106 PolarHBondContact O-N 3.18Å; D106-F108 HydrophobicContact CB-CD2 4.42Å; D106-F108 HydrophobicContact CB-CE2 3.65Å; D106-F108 HydrophobicContact CB-CZ 4.24Å; D106-F108 WeakPolarHBondContact O-CD2 3.43Å
107	L	45.5	Very low	36.2	Very low	12 Å²	12	79.5 Å²	79.5	6%	0.063	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	109.7	176.1	-144.6	113.2	0	0	0	110.1	I16 A17 A18 I76 L77 V146 L152	I16-L107 HydrophobicContact CG2-CD2 3.42Å; I16-L107 VanDerWaalsContact CG2-CD2 3.42Å; I16-L107 HydrophobicContact CG2-CG 4.49Å; A17-L107 CarbonylContact O-C 3.42Å; A17-L107 VanDerWaalsContact O-CA 3.27Å; A17-L107 WeakPolarHBondContact O-CA 3.48Å; A17-L107 WeakPolarHBondContact O-CG 3.33Å; A18-L107 HydrophobicContact CB-CD1 3.59Å; A18-L107 HydrophobicContact CB-CG 4.16Å; I76-L107 HydrophobicContact CG2-CD1 4.03Å; I76-L107 HydrophobicContact CG2-CD2 4.42Å; L77-L107 HydrophobicContact CD2-CD1 4.28Å; L77-L107 HydrophobicContact CD2-CD2 3.96Å; L77-L107 HydrophobicContact CD2-CG 4.29Å; L107-V146 VanDerWaalsContact O-CB 3.24Å; L107-V146 WeakPolarHBondContact O-CB 3.35Å; L107-V146 WeakPolarHBondContact O-CG2 3.45Å; L107-L152 HydrophobicContact CB-CD1 3.97Å; L107-L152 HydrophobicContact CB-CD2 3.9Å; L107-L152 HydrophobicContact CB-CG 3.96Å; L107-L152 HydrophobicContact CD1-CD1 4.34Å; L107-L152 HydrophobicContact CD2-CD1 3.66Å; L107-L152 HydrophobicContact CD2-CD2 3.2Å; L107-L152 HydrophobicContact CD2-CG 3.89Å; L107-L152 HydrophobicContact CG-CD1 4.16Å; L107-L152 HydrophobicContact CG-CD2 4.11Å; L107-L152 HydrophobicContact CG-CG 4.46Å
108	F	47.9	Very low	35.9	Very low	36 Å²	36	81.4 Å²	81.4	16%	0.158	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	165.3	-178.4	-65.7	-88.8	0	0	0	114.1	I16 A17 V19 D106 R145	I16-F108 CarbonylContact C-O 3.48Å; I16-F108 WeakPolarHBondContact CA-O 3.24Å; A17-F108 HydrophobicContact CB-CB 4.07Å; A17-F108 PolarHBondContact N-O 3.08Å; A17-F108 PolarHBondContact O-N 2.99Å; A17-F108 VanDerWaalsContact O-O 3.04Å; V19-F108 HydrophobicContact CB-CD2 3.54Å; V19-F108 HydrophobicContact CB-CE2 3.4Å; V19-F108 VanDerWaalsContact CB-CE2 3.4Å; V19-F108 HydrophobicContact CG1-CD2 4.31Å; V19-F108 HydrophobicContact CG1-CE2 3.68Å; V19-F108 HydrophobicContact CG2-CD2 3.23Å; V19-F108 HydrophobicContact CG2-CE2 3.47Å; V19-F108 VanDerWaalsContact CG2-CE2 3.47Å; V19-F108 HydrophobicContact CG2-CG 4.37Å; D106-F108 HydrophobicContact CB-CD2 4.42Å; D106-F108 HydrophobicContact CB-CE2 3.65Å; D106-F108 HydrophobicContact CB-CZ 4.24Å; D106-F108 WeakPolarHBondContact O-CD2 3.43Å; F108-R145 HydrophobicContact CD1-CB 4.37Å; F108-R145 HydrophobicContact CD1-CG 4.37Å; F108-R145 HydrophobicContact CE1-CB 3.78Å; F108-R145 HydrophobicContact CE1-CG 3.79Å
109	S	42.5	Very low	35.4	Very low	8 Å²	8	85.2 Å²	85.2	6%	0.056	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	141.9	173.4	173.6	0	0	0	0	111.1	S15	S15-S109 CarbonylContact O-C 3.45Å; S15-S109 WeakPolarHBondContact O-CA 3.37Å; S15-S109 WeakPolarHBondContact O-CB 3.43Å; S15-S109 PolarHBondContact O-OG 3.07Å
110	Q	37.4	Very low	35	Very low	60 Å²	60	88.1 Å²	88.1	28%	0.28	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.2	176.9	-172.7	-176.8	41	0	0	109.7	S15 V112	S15-Q110 PolarHBondContact N-O 3.2Å; S15-Q110 PolarHBondContact O-N 3.09Å; S15-Q110 WeakPolarHBondContact OG-CB 3.33Å; S15-Q110 PolarHBondContact OG-N 3.01Å; S15-Q110 PolarHBondContact OG-O 2.92Å; Q110-V112 HydrophobicContact CG-CG2 4.01Å
111	T	31.1	Very low	34.5	Very low	43 Å²	43	90.7 Å²	90.7	26%	0.264	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.4	170	-56.9	0	0	0	0	108.6	L13 L159 P160	L13-T111 VanDerWaalsContact O-CA 3.31Å; L13-T111 WeakPolarHBondContact O-CA 3.29Å; T111-L159 WeakPolarHBondContact OG1-CD2 3.42Å; T111-P160 HydrophobicContact CG2-CG 4.32Å
112	V	34.9	Very low	34.3	Very low	61 Å²	61	87.3 Å²	87.3	37%	0.37	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.8	176.3	-177.6	0	0	0	0	108.5	L13 Q110 G114	L13-V112 PolarHBondContact N-O 3.26Å; L13-V112 PolarHBondContact O-N 3.1Å; Q110-V112 HydrophobicContact CG-CG2 4.01Å; V112-G114 PolarHBondContact O-N 3.27Å
113	N	32.1	Very low	33.7	Very low	125 Å²	125	94.3 Å²	94.3	67%	0.668	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	96.1	169.4	-72.3	-15.1	0	0	0	107.9	S12	S12-N113 WeakPolarHBondContact CB-OD1 3.48Å
114	G	31.5	Very low	33.5	Very low	25 Å²	25	98.4 Å²	98.4	26%	0.258	51%	0.511	S	S	.	.			trans	-118.1	132.6	176	0	0	0	0	0	110.5	V112 L116	V112-G114 PolarHBondContact O-N 3.27Å; G114-L116 PolarHBondContact O-N 2.8Å
115	N	29.5	Very low	33	Very low	110 Å²	110	102.1 Å²	102.1	59%	0.588	54%	0.536	S	S	*	.			trans	-76.6	117	176.6	-161.2	21.7	0	0	0	109.6	D117	N115-D117 VanDerWaalsContact C-N 3.3Å; N115-D117 PolarHBondContact ND2-OD2 2.87Å; N115-D117 PolarHBondContact O-N 2.95Å; N115-D117 PolarHBondContact OD1-OD2 2.94Å
116	L	35.4	Very low	32.4	Very low	92 Å²	92	108 Å²	108	48%	0.482	54%	0.544	S	S	.	.			trans	-90.5	50.7	-171.9	-164.4	83.1	0	0	0	111.9	S11 G114	S11-L116 VanDerWaalsContact OG-CB 3.23Å; S11-L116 WeakPolarHBondContact OG-CB 3.22Å; G114-L116 PolarHBondContact O-N 2.8Å
117	D	30.5	Very low	31.6	Very low	121 Å²	121	112.4 Å²	112.4	65%	0.647	58%	0.577	S	S	*	*			trans	-96.7	2.7	-178.1	-77.4	-36.3	0	0	0	114.6	N115	N115-D117 VanDerWaalsContact C-N 3.3Å; N115-D117 PolarHBondContact ND2-OD2 2.87Å; N115-D117 PolarHBondContact O-N 2.95Å; N115-D117 PolarHBondContact OD1-OD2 2.94Å
118	H	33.2	Very low	30.6	Very low	181 Å²	181	119.5 Å²	119.5	84%	0.838	61%	0.614	S	S	*	*			trans	-117.3	9.1	-170.4	-106.8	-60.8	0	0	0	118.5	R120	H118-R120 VanDerWaalsContact C-N 3.29Å; H118-R120 PolarHBondContact O-N 3.12Å
119	Y	28.7	Very low	29.6	Very low	235 Å²	235	122.9 Å²	122.9	92%	0.922	64%	0.642	S	S	*	*			trans	-94.2	55.7	169.1	-122	-93.9	0	0	0	111.8
120	R	27.3	Very low	28.8	Very low	217 Å²	217	130.6 Å²	130.6	82%	0.819	68%	0.683	S	S	*	*			trans	-142.1	76	173.5	-123.8	-173.5	-177.7	131.8	-1.3	109.6	H118	H118-R120 VanDerWaalsContact C-N 3.29Å; H118-R120 PolarHBondContact O-N 3.12Å
121	N	25.2	Very low	28.3	Very low	154 Å²	154	133 Å²	133	82%	0.824	70%	0.702	S	S	*	*			trans	165.9	119.7	141.1	-88.5	-11.5	0	0	0	109	E123	N121-E123 PolarHBondContact O-N 2.84Å
122	G	24.4	Very low	27.9	Very low	82 Å²	82	136.8 Å²	136.8	85%	0.845	73%	0.73	S	S	*	*			trans	-79.6	108.4	164.7	0	0	0	0	0	109.3
123	E	27.1	Very low	27.5	Very low	178 Å²	178	138.8 Å²	138.8	83%	0.832	74%	0.742	S	S	*	*			trans	-146	129.9	153.6	-73.1	-167.7	125.5	0	0	108.8	N121	N121-E123 PolarHBondContact O-N 2.84Å
124	H	26.9	Very low	27	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.856	75%	0.752	S	S	*	*			trans	25.1	137.3	148.6	-95.4	-132	0	0	0	119.4
125	C	24.3	Very low	26.8	Very low	100 Å²	100	145.9 Å²	145.9	68%	0.676	78%	0.776	S	S	*	*			cis	-171.9	152.5	26.7	-126.1	0	0	0	0	108.7
126	Y	22.9	Very low	26.5	Very low	224 Å²	224	145.5 Å²	145.5	88%	0.878	78%	0.782	S	S	*	*			trans	-69.5	133.2	163.3	-94.6	-94.1	0	0	0	110.3
127	S	25.6	Very low	25.9	Very low	112 Å²	112	149.3 Å²	149.3	78%	0.783	80%	0.803	S	S	*	*			trans	-149	124.5	157.6	-70	0	0	0	0	109.1
128	D	23.8	Very low	25.8	Very low	160 Å²	160	150 Å²	150	86%	0.856	81%	0.811	S	S	*	*			trans	-64.9	131.5	174.5	-68.7	-46.2	0	0	0	111.1
129	S	28.3	Very low	25.4	Very low	107 Å²	107	146.3 Å²	146.3	75%	0.748	81%	0.806	S	S	*	*			trans	-165.8	129.7	144.7	48.1	0	0	0	0	111.4	V131	S129-V131 PolarHBondContact O-N 2.83Å
130	N	25.1	Very low	25.4	Very low	170 Å²	170	141 Å²	141	91%	0.909	80%	0.801	S	S	*	*			trans	-51.2	117.8	171.7	-62.1	-34.9	0	0	0	111.6
131	V	26.9	Very low	25.7	Very low	112 Å²	112	133.9 Å²	133.9	68%	0.679	78%	0.784	S	S	*	*			trans	-129.7	111.5	162.1	165.9	0	0	0	0	107.6	S129 T133	S129-V131 PolarHBondContact O-N 2.83Å; V131-T133 PolarHBondContact O-N 2.77Å
132	S	22.4	Very low	26.1	Very low	122 Å²	122	130.4 Å²	130.4	85%	0.853	77%	0.768	S	S	*	*			trans	-63.6	101.8	158.5	44	0	0	0	0	108.2	E134	S132-E134 PolarHBondContact O-N 2.84Å
133	T	26.8	Very low	26.8	Very low	102 Å²	102	131.4 Å²	131.4	63%	0.626	75%	0.753	S	S	*	*			trans	-91	100.8	173.4	-46.2	0	0	0	0	109.5	V131 C135	V131-T133 PolarHBondContact O-N 2.77Å; T133-C135 WeakPolarHBondContact CG2-SG 3.49Å; T133-C135 PolarHBondContact O-N 2.82Å
134	E	21.7	Very low	27.2	Very low	187 Å²	187	128.4 Å²	128.4	87%	0.874	73%	0.734	S	S	*	*			trans	-71.3	97.6	157.5	-159.7	171.8	-169.9	0	0	106.5	S132 S136	S132-E134 PolarHBondContact O-N 2.84Å; E134-S136 PolarHBondContact O-N 2.69Å
135	C	26.5	Very low	27.5	Very low	113 Å²	113	127 Å²	127	76%	0.764	72%	0.722	S	S	*	*			trans	-83.8	110.7	178.3	-84.3	0	0	0	0	110.1	T133	T133-C135 WeakPolarHBondContact CG2-SG 3.49Å; T133-C135 PolarHBondContact O-N 2.82Å
136	S	23.2	Very low	28.2	Very low	102 Å²	102	123.1 Å²	123.1	71%	0.713	69%	0.694	S	S	*	*			trans	-69.9	148.8	169.4	-47.4	0	0	0	0	112.2	E134 T138	E134-S136 PolarHBondContact O-N 2.69Å; S136-T138 PolarHBondContact O-N 3.41Å
137	D	24.1	Very low	28.9	Very low	172 Å²	172	119.8 Å²	119.8	92%	0.92	68%	0.684	S	S	*	*			trans	-46.9	110.2	-176.1	-63.2	-53.2	0	0	0	114.1
138	T	26.7	Very low	29.4	Very low	134 Å²	134	120.2 Å²	120.2	82%	0.822	68%	0.678	S	S	*	*			trans	-118.3	120.9	161.3	-41.8	0	0	0	0	106.9	S136	S136-T138 PolarHBondContact O-N 3.41Å
139	S	25.7	Very low	29.9	Very low	105 Å²	105	113.7 Å²	113.7	73%	0.734	64%	0.642	S	S	*	*			trans	10.6	125.4	173.1	-55.1	0	0	0	0	117.8	S141	S139-S141 PolarHBondContact O-N 2.9Å
140	P	28.3	Very low	30.6	Very low	124 Å²	124	118.6 Å²	118.6	81%	0.805	65%	0.65	S	S	*	*			trans	-64.6	106.6	-170.2	28.6	-32.5	0	0	0	109.8	T142	P140-T142 PolarHBondContact O-N 2.94Å
141	S	33.9	Very low	32.2	Very low	67 Å²	67	111.7 Å²	111.7	47%	0.469	62%	0.615	S	S	.	*			trans	-57.9	112.4	158.1	58.3	0	0	0	0	106.1	S139 I143	S139-S141 PolarHBondContact O-N 2.9Å; S141-I143 PolarHBondContact O-N 2.87Å
142	T	33.5	Very low	33.7	Very low	80 Å²	80	107.8 Å²	107.8	49%	0.491	59%	0.59	S	S	.	*			trans	-66.2	99.2	179.9	-46.4	0	0	0	0	108.7	P140 W144	P140-T142 PolarHBondContact O-N 2.94Å; T142-W144 HydrophobicContact CG2-CD2 3.67Å; T142-W144 VanDerWaalsContact CG2-CE2 3.41Å; T142-W144 HydrophobicContact CG2-CE3 3.82Å; T142-W144 HydrophobicContact CG2-CG 4.45Å; T142-W144 HydrophobicContact CG2-CH2 3.65Å; T142-W144 HydrophobicContact CG2-CZ2 3.42Å; T142-W144 VanDerWaalsContact CG2-CZ2 3.42Å; T142-W144 HydrophobicContact CG2-CZ3 3.83Å; T142-W144 PolarHBondContact O-N 3.4Å
143	I	38.4	Very low	35.3	Very low	103 Å²	103	105.5 Å²	105.5	53%	0.528	56%	0.563	S	S	.	*			trans	-80.3	103.8	173.2	-65.3	170.3	0	0	0	106.5	S141 R145	S141-I143 PolarHBondContact O-N 2.87Å; I143-R145 PolarHBondContact O-N 3.33Å
144	W	36.2	Very low	36.8	Very low	115 Å²	115	103.7 Å²	103.7	44%	0.436	55%	0.549	S	S	.	.	B	Isolated β-bridge	trans	-79.9	110.9	176.5	-60.8	115.8	0	0	0	109.4	T142 Y149 L155	T142-W144 HydrophobicContact CG2-CD2 3.67Å; T142-W144 VanDerWaalsContact CG2-CE2 3.41Å; T142-W144 HydrophobicContact CG2-CE3 3.82Å; T142-W144 HydrophobicContact CG2-CG 4.45Å; T142-W144 HydrophobicContact CG2-CH2 3.65Å; T142-W144 HydrophobicContact CG2-CZ2 3.42Å; T142-W144 VanDerWaalsContact CG2-CZ2 3.42Å; T142-W144 HydrophobicContact CG2-CZ3 3.83Å; T142-W144 PolarHBondContact O-N 3.4Å; W144-Y149 HydrophobicContact CB-CE2 3.86Å; W144-Y149 WeakPolarHBondContact CZ3-OH 3.47Å; W144-L155 HydrophobicContact CB-CD1 4.2Å
145	R	33.4	Very low	38.8	Very low	157 Å²	157	95 Å²	95	59%	0.592	51%	0.509	S	S	*	.			trans	-82.9	130.5	178.3	-76.9	-164.6	161.7	95.5	-3.1	110.2	F108 I143 K147 D148 Y149	F108-R145 HydrophobicContact CD1-CB 4.37Å; F108-R145 HydrophobicContact CD1-CG 4.37Å; F108-R145 HydrophobicContact CE1-CB 3.78Å; F108-R145 HydrophobicContact CE1-CG 3.79Å; I143-R145 PolarHBondContact O-N 3.33Å; R145-K147 PolarHBondContact O-N 3.44Å; R145-D148 WeakPolarHBondContact O-CB 3.45Å; R145-D148 PolarHBondContact O-N 3.47Å; R145-Y149 VanDerWaalsContact O-CD2 3.25Å; R145-Y149 WeakPolarHBondContact O-CD2 3.43Å; R145-Y149 WeakPolarHBondContact O-CE2 3.16Å
146	V	39.4	Very low	40.7	Very low	17 Å²	17	90.4 Å²	90.4	10%	0.103	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-65.3	-8.7	176.8	158.4	0	0	0	0	115.3	L107 D148 Y149 L155	L107-V146 VanDerWaalsContact O-CB 3.24Å; L107-V146 WeakPolarHBondContact O-CB 3.35Å; L107-V146 WeakPolarHBondContact O-CG2 3.45Å; V146-D148 PolarHBondContact O-N 3.29Å; V146-Y149 HydrophobicContact CG2-CD2 4.21Å; V146-Y149 CarbonylContact O-C 3.44Å; V146-Y149 PolarHBondContact O-N 2.97Å; V146-L155 HydrophobicContact CG2-CB 4.08Å; V146-L155 HydrophobicContact CG2-CD1 3.84Å; V146-L155 HydrophobicContact CG2-CD2 3.56Å; V146-L155 HydrophobicContact CG2-CG 4.04Å
147	K	36.1	Very low	42.6	Very low	154 Å²	154	89.2 Å²	89.2	67%	0.67	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-65.1	-17.8	165	-69.2	-175.3	177.4	173.4	0	113.9	R145	R145-K147 PolarHBondContact O-N 3.44Å
148	D	36.2	Very low	44.8	Very low	121 Å²	121	85.3 Å²	85.3	65%	0.647	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-89	-2.4	174	-60.7	-41.6	0	0	0	113	R145 V146	R145-D148 WeakPolarHBondContact O-CB 3.45Å; R145-D148 PolarHBondContact O-N 3.47Å; V146-D148 PolarHBondContact O-N 3.29Å
149	Y	35.3	Very low	46.9	Very low	24 Å²	24	79.7 Å²	79.7	9%	0.094	41%	0.406	C	S	.	.	S	Bend	trans	-131.8	118.2	-170.4	-57.3	-60.1	0	0	0	111.2	W144 R145 V146 S151 L155 Q158	W144-Y149 HydrophobicContact CB-CE2 3.86Å; W144-Y149 WeakPolarHBondContact CZ3-OH 3.47Å; R145-Y149 VanDerWaalsContact O-CD2 3.25Å; R145-Y149 WeakPolarHBondContact O-CD2 3.43Å; R145-Y149 WeakPolarHBondContact O-CE2 3.16Å; V146-Y149 HydrophobicContact CG2-CD2 4.21Å; V146-Y149 CarbonylContact O-C 3.44Å; V146-Y149 PolarHBondContact O-N 2.97Å; Y149-S151 PolarHBondContact O-N 3.07Å; Y149-L155 HydrophobicContact CD2-CD1 3.9Å; Y149-L155 HydrophobicContact CE2-CD1 4.12Å; Y149-Q158 HydrophobicContact CE1-CG 4.43Å; Y149-Q158 PolarHBondContact OH-OE1 3.07Å
150	K	43.7	Very low	49.1	Very low	210 Å²	210	77.4 Å²	77.4	91%	0.913	39%	0.389	S	S	*	.	S	Bend	trans	-57.9	-18.9	-177.7	-88.8	-176.2	174.6	-179.4	0	115.3
151	S	57.4	Low	51.3	Low	25 Å²	25	80.9 Å²	80.9	18%	0.175	39%	0.394	C	S	.	.	S	Bend	trans	-161.4	161.5	179.7	65.2	0	0	0	0	112	N94 Y149 Y153 N154 L155	N94-S151 VanDerWaalsContact OD1-CB 3.22Å; N94-S151 WeakPolarHBondContact OD1-CB 3.44Å; N94-S151 PolarHBondContact OD1-OG 2.69Å; Y149-S151 PolarHBondContact O-N 3.07Å; S151-Y153 PolarHBondContact O-N 3.21Å; S151-Y153 WeakPolarHBondContact OG-CB 3.07Å; S151-N154 VanDerWaalsContact O-CB 3.29Å; S151-N154 WeakPolarHBondContact O-CB 3.44Å; S151-N154 PolarHBondContact O-N 2.91Å; S151-L155 PolarHBondContact O-N 2.87Å
152	L	57.8	Low	53.5	Low	30 Å²	30	79 Å²	79	16%	0.157	38%	0.38	C	S	.	.	H	α-helix	trans	-52.5	-35.4	171.6	-100.9	164.3	0	0	0	113.3	I76 L93 L107 N154 L155 I156	I76-L152 HydrophobicContact CG2-CD1 4.03Å; L93-L152 HydrophobicContact CD1-CB 4.12Å; L93-L152 HydrophobicContact CD2-CB 4.23Å; L93-L152 HydrophobicContact CD2-CD1 4.22Å; L107-L152 HydrophobicContact CB-CD1 3.97Å; L107-L152 HydrophobicContact CB-CD2 3.9Å; L107-L152 HydrophobicContact CB-CG 3.96Å; L107-L152 HydrophobicContact CD1-CD1 4.34Å; L107-L152 HydrophobicContact CD2-CD1 3.66Å; L107-L152 HydrophobicContact CD2-CD2 3.2Å; L107-L152 HydrophobicContact CD2-CG 3.89Å; L107-L152 HydrophobicContact CG-CD1 4.16Å; L107-L152 HydrophobicContact CG-CD2 4.11Å; L107-L152 HydrophobicContact CG-CG 4.46Å; L152-N154 VanDerWaalsContact C-N 3.29Å; L152-N154 PolarHBondContact O-N 2.71Å; L152-L155 HydrophobicContact CD2-CD2 4.26Å; L152-L155 WeakPolarHBondContact O-CB 3.45Å; L152-L155 PolarHBondContact O-N 3.49Å; L152-I156 WeakPolarHBondContact O-CG1 3.38Å; L152-I156 PolarHBondContact O-N 3.25Å
153	Y	56.7	Low	56	Low	73 Å²	73	78 Å²	78	29%	0.286	38%	0.376	S	S	.	.	H	α-helix	trans	-56.2	-45.9	174.3	176.6	-93.2	0	0	0	111.3	M90 N94 S151 L155 I156 T157	M90-Y153 HydrophobicContact CB-CD2 4.2Å; N94-Y153 WeakPolarHBondContact ND2-CD1 3.42Å; N94-Y153 WeakPolarHBondContact OD1-CB 3.26Å; S151-Y153 PolarHBondContact O-N 3.21Å; S151-Y153 WeakPolarHBondContact OG-CB 3.07Å; Y153-L155 VanDerWaalsContact C-N 3.3Å; Y153-L155 PolarHBondContact O-N 3Å; Y153-I156 PolarHBondContact O-N 3.49Å; Y153-T157 HydrophobicContact CD1-CG2 4.24Å; Y153-T157 HydrophobicContact CE1-CG2 3.85Å; Y153-T157 HydrophobicContact CE2-CG2 4.42Å; Y153-T157 WeakPolarHBondContact O-CG2 3.33Å; Y153-T157 PolarHBondContact O-N 2.95Å; Y153-T157 PolarHBondContact O-OG1 3.29Å
154	N	58.4	Low	58.5	Low	64 Å²	64	76.5 Å²	76.5	34%	0.342	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-36.8	-179.2	-134.3	-29.7	0	0	0	111.8	S151 L152 T157 Q158	S151-N154 VanDerWaalsContact O-CB 3.29Å; S151-N154 WeakPolarHBondContact O-CB 3.44Å; S151-N154 PolarHBondContact O-N 2.91Å; L152-N154 VanDerWaalsContact C-N 3.29Å; L152-N154 PolarHBondContact O-N 2.71Å; N154-T157 WeakPolarHBondContact CA-OG1 3.31Å; N154-T157 PolarHBondContact O-OG1 3.37Å; N154-Q158 WeakPolarHBondContact O-CG 3.24Å; N154-Q158 PolarHBondContact O-N 3.42Å
155	L	64	Low	61.2	Low	5 Å²	5	71 Å²	71	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-66.2	-45	174.6	-175.1	72.8	0	0	0	111.9	W144 V146 Y149 S151 L152 Y153 T157 Q158	W144-L155 HydrophobicContact CB-CD1 4.2Å; V146-L155 HydrophobicContact CG2-CB 4.08Å; V146-L155 HydrophobicContact CG2-CD1 3.84Å; V146-L155 HydrophobicContact CG2-CD2 3.56Å; V146-L155 HydrophobicContact CG2-CG 4.04Å; Y149-L155 HydrophobicContact CD2-CD1 3.9Å; Y149-L155 HydrophobicContact CE2-CD1 4.12Å; S151-L155 PolarHBondContact O-N 2.87Å; L152-L155 HydrophobicContact CD2-CD2 4.26Å; L152-L155 WeakPolarHBondContact O-CB 3.45Å; L152-L155 PolarHBondContact O-N 3.49Å; Y153-L155 VanDerWaalsContact C-N 3.3Å; Y153-L155 PolarHBondContact O-N 3Å; L155-T157 VanDerWaalsContact C-N 3.29Å; L155-T157 PolarHBondContact O-N 3.5Å; L155-Q158 PolarHBondContact O-N 3.18Å; L155-Q158 VanDerWaalsContact O-N 3.1Å
156	I	65.3	Low	64.2	Low	17 Å²	17	68.5 Å²	68.5	9%	0.087	34%	0.342	C	S	.	.	H	α-helix	trans	-64.8	-36.3	179.6	-67.1	170.5	0	0	0	110.6	Y84 M90 L93 L152 Y153 Q158 L159	Y84-I156 HydrophobicContact CD2-CG2 3.74Å; Y84-I156 HydrophobicContact CG-CG2 4.21Å; M90-I156 HydrophobicContact SD-CD1 3.71Å; M90-I156 HydrophobicContact SD-CG2 4.38Å; L93-I156 HydrophobicContact CD1-CD1 3.81Å; L152-I156 WeakPolarHBondContact O-CG1 3.38Å; L152-I156 PolarHBondContact O-N 3.25Å; Y153-I156 PolarHBondContact O-N 3.49Å; I156-Q158 PolarHBondContact O-N 2.75Å; I156-L159 WeakPolarHBondContact O-CB 3.4Å; I156-L159 PolarHBondContact O-N 3.15Å; I156-L159 VanDerWaalsContact O-N 3.13Å
157	T	65	Low	66.9	Low	76 Å²	76	67.7 Å²	67.7	47%	0.466	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-13.4	175.6	54.4	0	0	0	0	114.3	Y153 N154 L155	Y153-T157 HydrophobicContact CD1-CG2 4.24Å; Y153-T157 HydrophobicContact CE1-CG2 3.85Å; Y153-T157 HydrophobicContact CE2-CG2 4.42Å; Y153-T157 WeakPolarHBondContact O-CG2 3.33Å; Y153-T157 PolarHBondContact O-N 2.95Å; Y153-T157 PolarHBondContact O-OG1 3.29Å; N154-T157 WeakPolarHBondContact CA-OG1 3.31Å; N154-T157 PolarHBondContact O-OG1 3.37Å; L155-T157 VanDerWaalsContact C-N 3.29Å; L155-T157 PolarHBondContact O-N 3.5Å
158	Q	69.6	Low	69.7	Low	90 Å²	90	60.3 Å²	60.3	42%	0.421	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-9.5	174.4	-66.6	-159	-13.1	0	0	114	Y149 N154 L155 I156	Y149-Q158 HydrophobicContact CE1-CG 4.43Å; Y149-Q158 PolarHBondContact OH-OE1 3.07Å; N154-Q158 WeakPolarHBondContact O-CG 3.24Å; N154-Q158 PolarHBondContact O-N 3.42Å; L155-Q158 PolarHBondContact O-N 3.18Å; L155-Q158 VanDerWaalsContact O-N 3.1Å; I156-Q158 PolarHBondContact O-N 2.75Å
159	L	70	Confident	72.6	Confident	16 Å²	16	55.2 Å²	55.2	8%	0.084	28%	0.277	C	S	.	.	S	Bend	trans	-68.5	150	172.9	-71.4	171.3	0	0	0	110	I14 Y84 T111 I156 H161	I14-L159 HydrophobicContact CG2-CD1 4.22Å; I14-L159 HydrophobicContact CG2-CD2 4.46Å; Y84-L159 HydrophobicContact CD1-CD1 4.16Å; Y84-L159 HydrophobicContact CD2-CB 4.08Å; Y84-L159 HydrophobicContact CD2-CD1 3.82Å; Y84-L159 HydrophobicContact CE1-CD1 4.09Å; Y84-L159 HydrophobicContact CE2-CB 3.27Å; Y84-L159 HydrophobicContact CE2-CD1 3.73Å; Y84-L159 HydrophobicContact CE2-CG 4.14Å; Y84-L159 HydrophobicContact CG-CD1 4.02Å; T111-L159 WeakPolarHBondContact OG1-CD2 3.42Å; I156-L159 WeakPolarHBondContact O-CB 3.4Å; I156-L159 PolarHBondContact O-N 3.15Å; I156-L159 VanDerWaalsContact O-N 3.13Å; L159-H161 PolarHBondContact O-N 2.74Å
160	P	72	Confident	75.5	Confident	58 Å²	58	54.2 Å²	54.2	38%	0.377	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-53	137.5	176.5	-23.1	32.2	0	0	0	111.1	Y84 T111 V162	Y84-P160 PolarHBondContact OH-O 2.72Å; T111-P160 HydrophobicContact CG2-CG 4.32Å; P160-V162 PolarHBondContact O-N 3.21Å
161	H	73.8	Confident	78	Confident	196 Å²	196	46.1 Å²	46.1	91%	0.907	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-61.7	118.5	174.6	-95.6	-70.2	0	0	0	110.2	L159	L159-H161 PolarHBondContact O-N 2.74Å
162	V	81.2	Confident	79.7	Confident	28 Å²	28	45.3 Å²	45.3	17%	0.17	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-101.1	140.1	171.7	-69.6	0	0	0	0	109.5	V32 Y84 P160	V32-V162 HydrophobicContact CB-CG1 4.4Å; V32-V162 HydrophobicContact CG2-CB 4.45Å; V32-V162 HydrophobicContact CG2-CG1 4.14Å; Y84-V162 HydrophobicContact CD1-CG2 4.43Å; Y84-V162 HydrophobicContact CE1-CG1 4.37Å; Y84-V162 HydrophobicContact CE1-CG2 3.91Å; Y84-V162 HydrophobicContact CE2-CG2 4.09Å; P160-V162 PolarHBondContact O-N 3.21Å
163	S	85.5	Confident	81.5	Confident	59 Å²	59	46 Å²	46	41%	0.413	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-64.9	134.3	170.8	57.5	0	0	0	0	109.6	V165	S163-V165 PolarHBondContact O-N 3.42Å
164	P	90.8	Very high	83.2	Confident	71 Å²	71	46 Å²	46	46%	0.461	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-52	120.3	-177.8	-30.5	36.7	0	0	0	113.3	V85 S86 N215	V85-P164 WeakPolarHBondContact O-CA 3.46Å; S86-P164 WeakPolarHBondContact O-CB 3.37Å; P164-N215 WeakPolarHBondContact CB-ND2 3.18Å
165	V	94	Very high	84.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-76.8	154.2	-179	-56.2	0	0	0	0	111.6	V32 G55 A57 V85 S163 V168 T214 N215	V32-V165 HydrophobicContact CG1-CG1 3.79Å; V32-V165 HydrophobicContact CG2-CG1 4.41Å; G55-V165 WeakPolarHBondContact O-CA 3.14Å; G55-V165 WeakPolarHBondContact O-CB 3.22Å; A57-V165 HydrophobicContact CB-CG1 4.3Å; A57-V165 HydrophobicContact CB-CG2 4.14Å; V85-V165 HydrophobicContact CB-CG1 4.27Å; V85-V165 HydrophobicContact CB-CG2 3.87Å; V85-V165 HydrophobicContact CG2-CG2 3.67Å; V85-V165 WeakPolarHBondContact O-CG2 3.35Å; V85-V165 PolarHBondContact O-N 2.92Å; S163-V165 PolarHBondContact O-N 3.42Å; V165-V168 HydrophobicContact CG2-CG2 4.13Å; V165-T214 PolarHBondContact O-OG1 3.1Å; V165-N215 PolarHBondContact O-ND2 3.43Å
166	R	95.2	Very high	86.3	Confident	104 Å²	104	50.4 Å²	50.4	39%	0.392	27%	0.27	S	S	.	.	S	Bend	trans	-95.1	-14.3	176.7	-62.5	-67.6	177.7	147.8	4	113.5	L46 F50 T54 G55 T214 N215 G217	L46-R166 HydrophobicContact CD1-CB 4.03Å; L46-R166 HydrophobicContact CD2-CB 4.04Å; F50-R166 HydrophobicContact CE1-CG 4.32Å; T54-R166 HydrophobicContact CG2-CB 3.72Å; T54-R166 HydrophobicContact CG2-CG 3.41Å; T54-R166 VanDerWaalsContact CG2-CG 3.41Å; G55-R166 PolarHBondContact O-N 2.77Å; R166-T214 CarbonylContact C-O 3.51Å; R166-T214 VanDerWaalsContact C-OG1 3.25Å; R166-T214 VanDerWaalsContact CA-O 3.31Å; R166-T214 WeakPolarHBondContact CA-O 3.36Å; R166-T214 PolarHBondContact O-N 3.2Å; R166-N215 WeakPolarHBondContact CD-O 3.46Å; R166-N215 PolarHBondContact NH1-O 3.27Å; R166-G217 WeakPolarHBondContact O-CA 3.42Å
167	A	95.9	Very high	87.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	146.3	175.6	0	0	0	0	0	111.1	L46 V56 A57 V211 L212 T214	L46-A167 HydrophobicContact CD2-CB 4.09Å; L46-A167 HydrophobicContact CG-CB 4.33Å; V56-A167 CarbonylContact C-O 3.56Å; V56-A167 WeakPolarHBondContact CA-O 3.41Å; V56-A167 HydrophobicContact CG1-CB 4.19Å; A57-A167 PolarHBondContact N-O 2.65Å; A167-V211 HydrophobicContact CB-CG2 3.85Å; A167-L212 CarbonylContact C-O 3.54Å; A167-L212 WeakPolarHBondContact CA-O 3.12Å; A167-T214 PolarHBondContact N-OG1 2.68Å
168	V	96.5	Very high	89	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.6	165.9	-174.6	0	0	0	0	107.5	A57 I59 F81 I82 V85 V165 F188 V211 L212 T214	A57-V168 HydrophobicContact CB-CG1 4.34Å; A57-V168 HydrophobicContact CB-CG2 4.2Å; A57-V168 CarbonylContact O-C 3.58Å; A57-V168 VanDerWaalsContact O-CA 3.31Å; A57-V168 WeakPolarHBondContact O-CA 3.42Å; I59-V168 HydrophobicContact CD1-CG1 3.81Å; I59-V168 HydrophobicContact CG1-CG1 4.05Å; F81-V168 HydrophobicContact CD1-CG1 4.48Å; F81-V168 HydrophobicContact CE1-CG1 4.14Å; I82-V168 HydrophobicContact CG1-CG2 4.39Å; V85-V168 HydrophobicContact CG2-CG2 3.72Å; V165-V168 HydrophobicContact CG2-CG2 4.13Å; V168-F188 HydrophobicContact CB-CE1 4.49Å; V168-F188 HydrophobicContact CG1-CE1 4.36Å; V168-F188 HydrophobicContact CG1-CZ 4.29Å; V168-V211 CarbonylContact O-C 3.59Å; V168-V211 WeakPolarHBondContact O-CA 3.26Å; V168-L212 PolarHBondContact N-O 2.85Å; V168-L212 PolarHBondContact O-N 3.13Å; V168-T214 HydrophobicContact CG2-CG2 4.19Å
169	Y	96.8	Very high	90.2	Very high	13 Å²	13	54.3 Å²	54.3	5%	0.051	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	159.8	-177.1	80.8	-77.1	0	0	0	112.9	D42 L45 V56 A57 Y58 I59 T209 Y210	D42-Y169 HydrophobicContact CB-CE2 4.49Å; L45-Y169 HydrophobicContact CD1-CD1 3.48Å; L45-Y169 VanDerWaalsContact CD1-CD1 3.48Å; L45-Y169 HydrophobicContact CD1-CD2 3.74Å; L45-Y169 HydrophobicContact CD1-CE1 3.71Å; L45-Y169 HydrophobicContact CD1-CE2 3.95Å; L45-Y169 HydrophobicContact CD1-CG 3.49Å; L45-Y169 VanDerWaalsContact CD1-CG 3.49Å; L45-Y169 VanDerWaalsContact CD2-CB 3.48Å; L45-Y169 HydrophobicContact CD2-CD1 4.49Å; L45-Y169 HydrophobicContact CD2-CD2 4.03Å; L45-Y169 HydrophobicContact CD2-CG 3.78Å; L45-Y169 HydrophobicContact CG-CD2 4.49Å; L45-Y169 HydrophobicContact CG-CG 4.3Å; V56-Y169 HydrophobicContact CG2-CE1 4.19Å; A57-Y169 VanDerWaalsContact O-CD1 3.26Å; A57-Y169 WeakPolarHBondContact O-CD1 3.47Å; A57-Y169 PolarHBondContact O-N 3.38Å; Y58-Y169 WeakPolarHBondContact CA-O 3.34Å; Y58-Y169 HydrophobicContact CD2-CD1 4.28Å; Y58-Y169 AromaticContact CD2-CD2 3.68Å; Y58-Y169 HydrophobicContact CD2-CD2 3.68Å; Y58-Y169 AromaticContact CD2-CE1 3.94Å; Y58-Y169 HydrophobicContact CD2-CE1 3.94Å; Y58-Y169 AromaticContact CD2-CE2 3.28Å; Y58-Y169 HydrophobicContact CD2-CE2 3.28Å; Y58-Y169 HydrophobicContact CD2-CG 4.17Å; Y58-Y169 AromaticContact CD2-CZ 3.42Å; Y58-Y169 VanDerWaalsContact CD2-CZ 3.42Å; Y58-Y169 WeakPolarHBondContact CD2-O 3.25Å; Y58-Y169 HydrophobicContact CE2-CD2 4.15Å; Y58-Y169 AromaticContact CE2-CE2 3.75Å; Y58-Y169 HydrophobicContact CE2-CE2 3.75Å; Y58-Y169 HydrophobicContact CG-CE1 4.15Å; Y58-Y169 HydrophobicContact CG-CE2 4.11Å; Y58-Y169 AromaticContact CG-CZ 3.77Å; I59-Y169 PolarHBondContact N-O 3.3Å; Y169-T209 HydrophobicContact CD2-CG2 4.36Å; Y169-Y210 CarbonylContact C-O 3.54Å; Y169-Y210 WeakPolarHBondContact CA-O 3.43Å; Y169-Y210 WeakPolarHBondContact CB-O 3.38Å
170	L	96.3	Very high	91.4	Very high	3 Å²	3	56 Å²	56	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	161	179.7	65.8	114.1	0	0	0	112.2	I59 V172 Y183 F188 Y210	I59-L170 HydrophobicContact CB-CB 4.03Å; I59-L170 HydrophobicContact CD1-CD2 4.05Å; L170-V172 HydrophobicContact CD1-CG2 3.22Å; L170-V172 HydrophobicContact CG-CG2 4.47Å; L170-Y183 HydrophobicContact CD1-CD1 4.34Å; L170-Y183 HydrophobicContact CD1-CD2 3.83Å; L170-Y183 HydrophobicContact CD1-CE1 3.92Å; L170-Y183 HydrophobicContact CD1-CE2 3.37Å; L170-Y183 HydrophobicContact CD1-CG 4.31Å; L170-Y183 VanDerWaalsContact CD1-CZ 3.41Å; L170-Y183 HydrophobicContact CD2-CD1 3.78Å; L170-Y183 HydrophobicContact CD2-CE1 3.58Å; L170-Y183 HydrophobicContact CD2-CG 4.33Å; L170-Y183 HydrophobicContact CG-CE1 4.43Å; L170-F188 HydrophobicContact CD2-CD1 3.9Å; L170-F188 HydrophobicContact CD2-CE1 3.52Å; L170-F188 HydrophobicContact CD2-CZ 4.09Å; L170-Y210 PolarHBondContact N-O 3.07Å; L170-Y210 PolarHBondContact O-N 3.43Å
171	H	94.9	Very high	92.6	Very high	41 Å²	41	60 Å²	60	19%	0.19	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.7	174.4	-62.2	130.6	0	0	0	111	D42 Y58 Y198 C208 T209	D42-H171 IonicContact OD1-NE2 3.56Å; Y58-H171 AromaticContact CE2-ND1 3.81Å; Y58-H171 AromaticContact CZ-ND1 3.92Å; Y58-H171 PolarHBondContact OH-ND1 3Å; H171-Y198 WeakPolarHBondContact CB-OH 3.4Å; H171-C208 WeakPolarHBondContact CA-O 3.28Å; H171-T209 PolarHBondContact CD2-OG1 3.34Å; H171-T209 PolarHBondContact NE2-OG1 3.46Å
172	V	94.3	Very high	93.6	Very high	8 Å²	8	52.5 Å²	52.5	5%	0.048	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.5	177.8	-169.7	0	0	0	0	109	L170 H174 N176 A179 R180 Y183 G207 C208 Y210	L170-V172 HydrophobicContact CD1-CG2 3.22Å; L170-V172 HydrophobicContact CG-CG2 4.47Å; V172-H174 PolarHBondContact O-N 3.38Å; V172-N176 HydrophobicContact CG1-CB 4.13Å; V172-A179 HydrophobicContact CG1-CB 3.64Å; V172-R180 HydrophobicContact CG1-CG 4.07Å; V172-Y183 HydrophobicContact CG2-CD2 3.72Å; V172-Y183 HydrophobicContact CG2-CE2 3.59Å; V172-G207 CarbonylContact O-C 3.55Å; V172-G207 WeakPolarHBondContact O-CA 3.42Å; V172-C208 PolarHBondContact N-O 3.1Å; V172-C208 PolarHBondContact O-N 2.89Å; V172-Y210 HydrophobicContact CB-CD2 4.29Å; V172-Y210 HydrophobicContact CB-CE2 4.36Å; V172-Y210 HydrophobicContact CG2-CD2 3.85Å; V172-Y210 HydrophobicContact CG2-CE2 4.29Å
173	L	94.4	Very high	94.3	Very high	45 Å²	45	51.9 Å²	51.9	24%	0.236	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	129.3	165.9	-89.1	147	0	0	0	111.3	S175 N176 Y198 I200 A205	L173-S175 PolarHBondContact O-N 2.97Å; L173-N176 HydrophobicContact CB-CB 3.97Å; L173-N176 WeakPolarHBondContact O-CB 3.26Å; L173-N176 PolarHBondContact O-N 2.85Å; L173-Y198 HydrophobicContact CD2-CD2 3.9Å; L173-Y198 HydrophobicContact CD2-CG 4.12Å; L173-Y198 HydrophobicContact CG-CD2 4Å; L173-Y198 HydrophobicContact CG-CE2 4.24Å; L173-Y198 HydrophobicContact CG-CG 4.3Å; L173-I200 HydrophobicContact CD1-CD1 3.69Å; L173-I200 HydrophobicContact CD2-CD1 3.34Å; L173-I200 HydrophobicContact CD2-CG1 4.37Å; L173-I200 HydrophobicContact CG-CD1 4.12Å; L173-A205 HydrophobicContact CD2-CB 3.79Å
174	H	93.1	Very high	94.8	Very high	71 Å²	71	52.8 Å²	52.8	33%	0.329	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.7	-179.4	-175.1	78.8	0	0	0	111.9	V172 N176 R180 D206 C208	V172-H174 PolarHBondContact O-N 3.38Å; H174-N176 VanDerWaalsContact C-N 3.32Å; H174-N176 PolarHBondContact O-N 3Å; H174-R180 PolarHBondContact CE1-NH1 2.85Å; H174-R180 VanDerWaalsContact O-CD 3.25Å; H174-R180 WeakPolarHBondContact O-CD 3.46Å; H174-R180 PolarHBondContact O-NH1 3.01Å; H174-D206 HydrophobicContact CB-CB 3.83Å; H174-D206 VanDerWaalsContact CB-O 3.27Å; H174-D206 WeakPolarHBondContact CB-O 3.14Å; H174-D206 PolarHBondContact N-O 2.85Å; H174-C208 PolarHBondContact ND1-SG 2.79Å
175	S	93.3	Very high	95	Very high	94 Å²	94	55.7 Å²	55.7	66%	0.657	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-16.8	176.8	57.6	0	0	0	0	114.3	L173 L177	L173-S175 PolarHBondContact O-N 2.97Å; S175-L177 VanDerWaalsContact C-N 3.3Å; S175-L177 PolarHBondContact O-N 2.87Å
176	N	94.4	Very high	95	Very high	68 Å²	68	60 Å²	60	36%	0.364	29%	0.286	S	S	.	.			trans	-81.5	75.4	-177.7	-170.8	-13.1	0	0	0	111.4	V172 L173 H174 H178 A179 R180	V172-N176 HydrophobicContact CG1-CB 4.13Å; L173-N176 HydrophobicContact CB-CB 3.97Å; L173-N176 WeakPolarHBondContact O-CB 3.26Å; L173-N176 PolarHBondContact O-N 2.85Å; H174-N176 VanDerWaalsContact C-N 3.32Å; H174-N176 PolarHBondContact O-N 3Å; N176-H178 PolarHBondContact O-N 2.66Å; N176-A179 HydrophobicContact CB-CB 4.29Å; N176-A179 VanDerWaalsContact CG-CB 3.47Å; N176-A179 WeakPolarHBondContact ND2-CB 3.34Å; N176-A179 PolarHBondContact O-N 3.04Å; N176-A179 WeakPolarHBondContact OD1-CB 3.39Å; N176-A179 PolarHBondContact OD1-N 2.85Å; N176-A179 VanDerWaalsContact OD1-N 3.08Å; N176-R180 VanDerWaalsContact O-CG 3.29Å; N176-R180 WeakPolarHBondContact O-CG 3.35Å; N176-R180 PolarHBondContact O-N 2.8Å
177	L	94.2	Very high	95	Very high	80 Å²	80	57.2 Å²	57.2	42%	0.419	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-33.5	-177.7	-173.6	62.4	0	0	0	113.2	S175 R181	S175-L177 VanDerWaalsContact C-N 3.3Å; S175-L177 PolarHBondContact O-N 2.87Å; L177-R181 HydrophobicContact CD1-CG 4.22Å; L177-R181 HydrophobicContact CG-CG 4.44Å; L177-R181 WeakPolarHBondContact O-CB 3.46Å; L177-R181 WeakPolarHBondContact O-CG 3.32Å; L177-R181 PolarHBondContact O-N 2.85Å
178	H	93.6	Very high	95	Very high	166 Å²	166	57.5 Å²	57.5	77%	0.769	29%	0.29	S	S	*	.	H	α-helix	trans	-63.9	-48.6	178.2	-76.6	-71.4	0	0	0	111.8	N176 F182	N176-H178 PolarHBondContact O-N 2.66Å; H178-F182 WeakPolarHBondContact O-CB 3.49Å; H178-F182 PolarHBondContact O-N 2.87Å
179	A	94.5	Very high	94.9	Very high	19 Å²	19	61 Å²	61	16%	0.157	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-44.6	177.4	0	0	0	0	0	111.2	V172 N176 R181 F182 Y183	V172-A179 HydrophobicContact CG1-CB 3.64Å; N176-A179 HydrophobicContact CB-CB 4.29Å; N176-A179 VanDerWaalsContact CG-CB 3.47Å; N176-A179 WeakPolarHBondContact ND2-CB 3.34Å; N176-A179 PolarHBondContact O-N 3.04Å; N176-A179 WeakPolarHBondContact OD1-CB 3.39Å; N176-A179 PolarHBondContact OD1-N 2.85Å; N176-A179 VanDerWaalsContact OD1-N 3.08Å; A179-R181 PolarHBondContact O-N 3.11Å; A179-F182 WeakPolarHBondContact O-CA 3.49Å; A179-F182 WeakPolarHBondContact O-CB 3.38Å; A179-F182 PolarHBondContact O-N 2.9Å; A179-F182 VanDerWaalsContact O-N 3.08Å; A179-Y183 HydrophobicContact CB-CD2 4.41Å; A179-Y183 HydrophobicContact CB-CE2 4.03Å; A179-Y183 WeakPolarHBondContact O-CD2 3.38Å; A179-Y183 PolarHBondContact O-N 3.44Å
180	R	95.4	Very high	94.8	Very high	51 Å²	51	63 Å²	63	19%	0.192	32%	0.324	C	S	.	.	H	α-helix	trans	-54.9	-53.4	177.6	-71	176.7	57.3	-172.5	-4.6	112.2	V172 H174 N176 F182 Y183 E184 Y210	V172-R180 HydrophobicContact CG1-CG 4.07Å; H174-R180 PolarHBondContact CE1-NH1 2.85Å; H174-R180 VanDerWaalsContact O-CD 3.25Å; H174-R180 WeakPolarHBondContact O-CD 3.46Å; H174-R180 PolarHBondContact O-NH1 3.01Å; N176-R180 VanDerWaalsContact O-CG 3.29Å; N176-R180 WeakPolarHBondContact O-CG 3.35Å; N176-R180 PolarHBondContact O-N 2.8Å; R180-F182 VanDerWaalsContact C-N 3.27Å; R180-F182 PolarHBondContact O-N 3.5Å; R180-Y183 PolarHBondContact O-N 2.97Å; R180-E184 WeakPolarHBondContact O-CB 3.44Å; R180-E184 VanDerWaalsContact O-CG 3.25Å; R180-E184 WeakPolarHBondContact O-CG 3.41Å; R180-E184 PolarHBondContact O-N 2.91Å; R180-Y210 WeakPolarHBondContact CB-OH 3.21Å; R180-Y210 HydrophobicContact CG-CE2 3.95Å; R180-Y210 WeakPolarHBondContact CG-OH 3.4Å; R180-Y210 PolarHBondContact NE-OH 3.07Å
181	R	95.7	Very high	94.5	Very high	142 Å²	142	65 Å²	65	54%	0.536	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-36.8	176	-72.9	178.5	175.9	173.5	-1.2	112.4	L177 A179 N185	L177-R181 HydrophobicContact CD1-CG 4.22Å; L177-R181 HydrophobicContact CG-CG 4.44Å; L177-R181 WeakPolarHBondContact O-CB 3.46Å; L177-R181 WeakPolarHBondContact O-CG 3.32Å; L177-R181 PolarHBondContact O-N 2.85Å; A179-R181 PolarHBondContact O-N 3.11Å; R181-N185 WeakPolarHBondContact O-CB 3.24Å; R181-N185 PolarHBondContact O-N 3.45Å; R181-N185 PolarHBondContact O-ND2 2.74Å
182	F	95.3	Very high	94.3	Very high	39 Å²	39	65.3 Å²	65.3	17%	0.171	34%	0.336	C	S	.	.	H	α-helix	trans	-61.1	-44	176.9	170.3	-91.9	0	0	0	111.9	L62 A74 L78 H178 A179 R180 R186	L62-F182 HydrophobicContact CD2-CE1 3.68Å; L62-F182 HydrophobicContact CD2-CZ 4.18Å; A74-F182 HydrophobicContact CB-CE2 3.72Å; A74-F182 HydrophobicContact CB-CZ 3.65Å; L78-F182 HydrophobicContact CB-CZ 4.46Å; L78-F182 HydrophobicContact CD2-CE1 3.6Å; L78-F182 HydrophobicContact CD2-CZ 3.95Å; H178-F182 WeakPolarHBondContact O-CB 3.49Å; H178-F182 PolarHBondContact O-N 2.87Å; A179-F182 WeakPolarHBondContact O-CA 3.49Å; A179-F182 WeakPolarHBondContact O-CB 3.38Å; A179-F182 PolarHBondContact O-N 2.9Å; A179-F182 VanDerWaalsContact O-N 3.08Å; R180-F182 VanDerWaalsContact C-N 3.27Å; R180-F182 PolarHBondContact O-N 3.5Å; F182-R186 WeakPolarHBondContact O-CD 3.01Å; F182-R186 PolarHBondContact O-NH1 2.98Å
183	Y	96.7	Very high	94.1	Very high	16 Å²	16	68 Å²	68	6%	0.063	35%	0.352	C	S	.	.	H	α-helix	trans	-74.9	-44.1	178.3	-63.6	-61.9	0	0	0	112.4	L62 L78 L170 V172 A179 R180 N185 R186 G187 F188	L62-Y183 HydrophobicContact CD2-CE1 4.09Å; L78-Y183 HydrophobicContact CD2-CD1 4.14Å; L78-Y183 HydrophobicContact CD2-CE1 4.18Å; L170-Y183 HydrophobicContact CD1-CD1 4.34Å; L170-Y183 HydrophobicContact CD1-CD2 3.83Å; L170-Y183 HydrophobicContact CD1-CE1 3.92Å; L170-Y183 HydrophobicContact CD1-CE2 3.37Å; L170-Y183 HydrophobicContact CD1-CG 4.31Å; L170-Y183 VanDerWaalsContact CD1-CZ 3.41Å; L170-Y183 HydrophobicContact CD2-CD1 3.78Å; L170-Y183 HydrophobicContact CD2-CE1 3.58Å; L170-Y183 HydrophobicContact CD2-CG 4.33Å; L170-Y183 HydrophobicContact CG-CE1 4.43Å; V172-Y183 HydrophobicContact CG2-CD2 3.72Å; V172-Y183 HydrophobicContact CG2-CE2 3.59Å; A179-Y183 HydrophobicContact CB-CD2 4.41Å; A179-Y183 HydrophobicContact CB-CE2 4.03Å; A179-Y183 WeakPolarHBondContact O-CD2 3.38Å; A179-Y183 PolarHBondContact O-N 3.44Å; R180-Y183 PolarHBondContact O-N 2.97Å; Y183-N185 VanDerWaalsContact C-N 3.34Å; Y183-N185 PolarHBondContact O-N 3.41Å; Y183-R186 CarbonylContact O-C 3.47Å; Y183-R186 WeakPolarHBondContact O-CA 3.26Å; Y183-R186 PolarHBondContact O-N 3.42Å; Y183-G187 PolarHBondContact O-N 2.74Å; Y183-F188 HydrophobicContact CD1-CD2 4.27Å; Y183-F188 HydrophobicContact CD1-CE2 4.4Å; Y183-F188 WeakPolarHBondContact O-CB 3.46Å; Y183-F188 PolarHBondContact O-N 2.87Å; Y183-F188 VanDerWaalsContact O-N 3.14Å
184	E	95.2	Very high	93.7	Very high	77 Å²	77	69 Å²	69	36%	0.36	35%	0.352	S	S	.	.	H	α-helix	trans	-57.6	-45.4	178	-72.3	167.7	-177.7	0	0	111.7	R180 R186 G187 Y210	R180-E184 WeakPolarHBondContact O-CB 3.44Å; R180-E184 VanDerWaalsContact O-CG 3.25Å; R180-E184 WeakPolarHBondContact O-CG 3.41Å; R180-E184 PolarHBondContact O-N 2.91Å; E184-R186 PolarHBondContact O-N 3.16Å; E184-G187 PolarHBondContact O-N 2.87Å; E184-Y210 HydrophobicContact CG-CE1 3.57Å; E184-Y210 PolarHBondContact OE1-OH 2.94Å
185	N	95.5	Very high	93.4	Very high	133 Å²	133	70.7 Å²	70.7	71%	0.711	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-6.6	177	-69	-10.1	0	0	0	113.6	R181 Y183	R181-N185 WeakPolarHBondContact O-CB 3.24Å; R181-N185 PolarHBondContact O-N 3.45Å; R181-N185 PolarHBondContact O-ND2 2.74Å; Y183-N185 VanDerWaalsContact C-N 3.34Å; Y183-N185 PolarHBondContact O-N 3.41Å
186	R	94.5	Very high	92.9	Very high	91 Å²	91	67.8 Å²	67.8	34%	0.343	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	17	177.3	-71.6	170.1	-177.9	63.8	6.7	112.3	S75 F182 Y183 E184 F188	S75-R186 PolarHBondContact OG-NH2 3.4Å; F182-R186 WeakPolarHBondContact O-CD 3.01Å; F182-R186 PolarHBondContact O-NH1 2.98Å; Y183-R186 CarbonylContact O-C 3.47Å; Y183-R186 WeakPolarHBondContact O-CA 3.26Å; Y183-R186 PolarHBondContact O-N 3.42Å; E184-R186 PolarHBondContact O-N 3.16Å; R186-F188 VanDerWaalsContact C-N 3.35Å; R186-F188 HydrophobicContact CB-CD2 4.43Å
187	G	95.1	Very high	92.5	Very high	45 Å²	45	67.1 Å²	67.1	46%	0.464	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	2.9	173.5	0	0	0	0	0	114.7	Y183 E184 L212	Y183-G187 PolarHBondContact O-N 2.74Å; E184-G187 PolarHBondContact O-N 2.87Å; G187-L212 WeakPolarHBondContact O-CD1 3.25Å
188	F	96.4	Very high	92.1	Very high	5 Å²	5	66.5 Å²	66.5	2%	0.022	35%	0.348	C	S	.	.			trans	-69.9	134.6	170.3	-74	-103.5	0	0	0	109.7	L78 I82 V168 L170 Y183 R186 Y210 V211 L212	L78-F188 HydrophobicContact CD1-CE2 4.4Å; L78-F188 HydrophobicContact CD1-CZ 4.24Å; L78-F188 HydrophobicContact CD2-CE2 4.04Å; I82-F188 HydrophobicContact CD1-CE2 4.02Å; I82-F188 HydrophobicContact CD1-CZ 4.1Å; V168-F188 HydrophobicContact CB-CE1 4.49Å; V168-F188 HydrophobicContact CG1-CE1 4.36Å; V168-F188 HydrophobicContact CG1-CZ 4.29Å; L170-F188 HydrophobicContact CD2-CD1 3.9Å; L170-F188 HydrophobicContact CD2-CE1 3.52Å; L170-F188 HydrophobicContact CD2-CZ 4.09Å; Y183-F188 HydrophobicContact CD1-CD2 4.27Å; Y183-F188 HydrophobicContact CD1-CE2 4.4Å; Y183-F188 WeakPolarHBondContact O-CB 3.46Å; Y183-F188 PolarHBondContact O-N 2.87Å; Y183-F188 VanDerWaalsContact O-N 3.14Å; R186-F188 VanDerWaalsContact C-N 3.35Å; R186-F188 HydrophobicContact CB-CD2 4.43Å; F188-Y210 HydrophobicContact CB-CD1 3.93Å; F188-V211 CarbonylContact C-O 3.51Å; F188-V211 WeakPolarHBondContact CA-O 3.3Å; F188-L212 HydrophobicContact CD1-CB 3.68Å; F188-L212 HydrophobicContact CD2-CB 4.03Å; F188-L212 HydrophobicContact CD2-CD2 4.45Å; F188-L212 HydrophobicContact CE1-CB 3.55Å; F188-L212 HydrophobicContact CE2-CB 3.9Å; F188-L212 HydrophobicContact CE2-CD2 3.86Å; F188-L212 HydrophobicContact CE2-CG 4.42Å; F188-L212 HydrophobicContact CG-CB 3.91Å; F188-L212 HydrophobicContact CZ-CB 3.66Å; F188-L212 HydrophobicContact CZ-CD2 4.02Å; F188-L212 HydrophobicContact CZ-CG 4.48Å
189	I	93.9	Very high	92	Very high	75 Å²	75	64 Å²	64	39%	0.385	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	137.4	175.2	59.1	173.4	0	0	0	109.8	L191 Y210 V211 L219	I189-L191 PolarHBondContact O-N 3.28Å; I189-Y210 VanDerWaalsContact O-CA 3.32Å; I189-Y210 WeakPolarHBondContact O-CA 3.35Å; I189-V211 HydrophobicContact CD1-CG1 3.99Å; I189-V211 HydrophobicContact CG1-CG1 3.54Å; I189-V211 WeakPolarHBondContact CG1-O 3.13Å; I189-V211 PolarHBondContact N-O 3.4Å; I189-V211 PolarHBondContact O-N 2.95Å; I189-L219 HydrophobicContact CD1-CD1 3.71Å; I189-L219 HydrophobicContact CD1-CG 4.42Å
190	C	93.3	Very high	91.6	Very high	55 Å²	55	66.3 Å²	66.3	37%	0.372	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	112	171	-178.4	0	0	0	0	108.6	Y210	C190-Y210 HydrophobicContact CB-CD1 4.22Å; C190-Y210 HydrophobicContact CB-CE1 3.71Å; C190-Y210 HydrophobicContact CB-CE2 4.38Å
191	L	91.3	Very high	91.4	Very high	43 Å²	43	71.3 Å²	71.3	23%	0.225	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-49.5	-178.4	-175.6	66	0	0	0	111.5	K44 L45 I189 T209 V211 L219	K44-L191 HydrophobicContact CB-CD2 4.07Å; K44-L191 WeakPolarHBondContact O-CD2 3.31Å; L45-L191 HydrophobicContact CD2-CD2 4.09Å; I189-L191 PolarHBondContact O-N 3.28Å; L191-T209 PolarHBondContact N-O 2.94Å; L191-V211 HydrophobicContact CB-CG1 4.33Å; L191-L219 HydrophobicContact CD1-CD1 3.75Å; L191-L219 HydrophobicContact CD1-CD2 3.69Å; L191-L219 HydrophobicContact CD1-CG 4.39Å
192	H	89.6	Confident	91.1	Very high	49 Å²	49	67.9 Å²	67.9	23%	0.227	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	158.6	178.3	61.7	-84	0	0	0	111.7	R194 C208 T209	H192-R194 VanDerWaalsContact CD2-CG 3.43Å; H192-R194 WeakPolarHBondContact CD2-CG 3.19Å; H192-R194 WeakPolarHBondContact NE2-CG 3.27Å; H192-C208 WeakPolarHBondContact O-CA 3.28Å; H192-T209 PolarHBondContact CE1-OG1 3.29Å; H192-T209 PolarHBondContact NE2-OG1 2.89Å; H192-T209 PolarHBondContact O-N 3.48Å
193	V	90.7	Very high	90.8	Very high	65 Å²	65	75.5 Å²	75.5	39%	0.394	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	133.8	170.7	-174.8	0	0	0	0	107.9	D206 G207	V193-D206 HydrophobicContact CG1-CB 4.07Å; V193-G207 CarbonylContact C-O 3.46Å; V193-G207 VanDerWaalsContact CA-O 3.3Å; V193-G207 WeakPolarHBondContact CA-O 3.43Å; V193-G207 WeakPolarHBondContact CG1-O 3.36Å
194	R	86.2	Confident	90.6	Very high	64 Å²	64	79.3 Å²	79.3	24%	0.242	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	104.2	175.7	-67.3	179	73.1	-177.8	6.6	108.8	D41 H192 G196 C197 D206 G207	D41-R194 IonicContact OD2-CZ 3.45Å; D41-R194 IonicContact OD2-NE 3.73Å; D41-R194 IonicContact OD2-NH2 2.77Å; D41-R194 PolarHBondContact OD2-NH2 3.43Å; H192-R194 VanDerWaalsContact CD2-CG 3.43Å; H192-R194 WeakPolarHBondContact CD2-CG 3.19Å; H192-R194 WeakPolarHBondContact NE2-CG 3.27Å; R194-G196 PolarHBondContact O-N 3.29Å; R194-C197 HydrophobicContact CB-CB 3.88Å; R194-C197 PolarHBondContact O-SG 2.84Å; R194-D206 WeakPolarHBondContact O-CA 3.43Å; R194-G207 PolarHBondContact N-O 3.45Å; R194-G207 PolarHBondContact O-N 2.61Å
195	P	86.7	Confident	90.5	Very high	107 Å²	107	76.5 Å²	76.5	70%	0.695	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	132.1	-179.8	-20.9	32.5	0	0	0	111.4	C197 D206	P195-C197 VanDerWaalsContact C-N 3.25Å; P195-C197 PolarHBondContact O-N 2.84Å; P195-D206 WeakPolarHBondContact CA-OD1 3.47Å
196	G	83.5	Confident	90.4	Very high	34 Å²	34	73.3 Å²	73.3	35%	0.351	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.6	22.6	173.6	0	0	0	0	0	116.7	R194 Y198 A205 D206	R194-G196 PolarHBondContact O-N 3.29Å; G196-Y198 PolarHBondContact O-N 2.9Å; G196-A205 CarbonylContact C-O 3.42Å; G196-A205 WeakPolarHBondContact CA-O 3.4Å; G196-D206 PolarHBondContact N-OD1 3.03Å
197	C	85.4	Confident	90.4	Very high	53 Å²	53	69 Å²	69	36%	0.358	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-6.4	179	70.8	0	0	0	0	114	R194 P195 A205 G207	R194-C197 HydrophobicContact CB-CB 3.88Å; R194-C197 PolarHBondContact O-SG 2.84Å; P195-C197 VanDerWaalsContact C-N 3.25Å; P195-C197 PolarHBondContact O-N 2.84Å; C197-A205 PolarHBondContact N-O 3.38Å; C197-G207 WeakPolarHBondContact SG-CA 3.48Å; C197-G207 PolarHBondContact SG-N 3.46Å
198	Y	85.7	Confident	90.3	Very high	68 Å²	68	67 Å²	67	27%	0.267	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	150.6	171.9	-67.8	-75.2	0	0	0	110.8	H171 L173 G196 S204 A205	H171-Y198 WeakPolarHBondContact CB-OH 3.4Å; L173-Y198 HydrophobicContact CD2-CD2 3.9Å; L173-Y198 HydrophobicContact CD2-CG 4.12Å; L173-Y198 HydrophobicContact CG-CD2 4Å; L173-Y198 HydrophobicContact CG-CE2 4.24Å; L173-Y198 HydrophobicContact CG-CG 4.3Å; G196-Y198 PolarHBondContact O-N 2.9Å; Y198-S204 CarbonylContact O-C 3.6Å; Y198-S204 WeakPolarHBondContact O-CA 3.49Å; Y198-A205 PolarHBondContact N-O 2.9Å; Y198-A205 PolarHBondContact O-N 3.21Å
199	T	90.5	Very high	90.2	Very high	112 Å²	112	66.7 Å²	66.7	69%	0.687	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	113.8	167.8	-56.8	0	0	0	0	108.1	R203	T199-R203 CarbonylContact C-O 3.58Å; T199-R203 WeakPolarHBondContact CA-O 3.31Å
200	I	87.4	Confident	90.3	Very high	68 Å²	68	63.1 Å²	63.1	35%	0.349	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.6	175.5	-59.1	177.3	0	0	0	107.4	L173 G202 R203 A205	L173-I200 HydrophobicContact CD1-CD1 3.69Å; L173-I200 HydrophobicContact CD2-CD1 3.34Å; L173-I200 HydrophobicContact CD2-CG1 4.37Å; L173-I200 HydrophobicContact CG-CD1 4.12Å; I200-G202 PolarHBondContact O-N 3.46Å; I200-R203 PolarHBondContact N-O 3.48Å; I200-R203 WeakPolarHBondContact O-CB 3.45Å; I200-R203 PolarHBondContact O-N 3.46Å; I200-A205 HydrophobicContact CD1-CB 4.07Å; I200-A205 HydrophobicContact CG1-CB 4.31Å
201	D	89.9	Confident	90.4	Very high	156 Å²	156	60.5 Å²	60.5	83%	0.834	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	42.2	179.7	-54.8	-36.2	0	0	0	112.7	R203	D201-R203 PolarHBondContact O-N 2.92Å
202	G	89.4	Confident	90.7	Very high	71 Å²	71	59.9 Å²	59.9	73%	0.732	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	0.8	-178.7	0	0	0	0	0	115.3	I200	I200-G202 PolarHBondContact O-N 3.46Å
203	R	90.2	Very high	90.9	Very high	199 Å²	199	59.9 Å²	59.9	75%	0.751	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	139.1	176.2	-62.5	-178.6	-177.9	-112.3	-0.5	110.7	T199 I200 D201	T199-R203 CarbonylContact C-O 3.58Å; T199-R203 WeakPolarHBondContact CA-O 3.31Å; I200-R203 PolarHBondContact N-O 3.48Å; I200-R203 WeakPolarHBondContact O-CB 3.45Å; I200-R203 PolarHBondContact O-N 3.46Å; D201-R203 PolarHBondContact O-N 2.92Å
204	S	92.8	Very high	91.1	Very high	95 Å²	95	57.4 Å²	57.4	66%	0.664	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	137	170.2	56.3	0	0	0	0	110.2	Y198	Y198-S204 CarbonylContact O-C 3.6Å; Y198-S204 WeakPolarHBondContact O-CA 3.49Å
205	A	92.3	Very high	91.5	Very high	19 Å²	19	57.4 Å²	57.4	16%	0.157	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	142.6	177.4	0	0	0	0	0	109.9	L173 G196 C197 Y198 I200	L173-A205 HydrophobicContact CD2-CB 3.79Å; G196-A205 CarbonylContact C-O 3.42Å; G196-A205 WeakPolarHBondContact CA-O 3.4Å; C197-A205 PolarHBondContact N-O 3.38Å; Y198-A205 PolarHBondContact N-O 2.9Å; Y198-A205 PolarHBondContact O-N 3.21Å; I200-A205 HydrophobicContact CD1-CB 4.07Å; I200-A205 HydrophobicContact CG1-CB 4.31Å
206	D	94.1	Very high	91.7	Very high	66 Å²	66	55.1 Å²	55.1	35%	0.353	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	143.2	-176.5	-59.5	-12.6	0	0	0	110.7	H174 V193 R194 P195 G196	H174-D206 HydrophobicContact CB-CB 3.83Å; H174-D206 VanDerWaalsContact CB-O 3.27Å; H174-D206 WeakPolarHBondContact CB-O 3.14Å; H174-D206 PolarHBondContact N-O 2.85Å; V193-D206 HydrophobicContact CG1-CB 4.07Å; R194-D206 WeakPolarHBondContact O-CA 3.43Å; P195-D206 WeakPolarHBondContact CA-OD1 3.47Å; G196-D206 PolarHBondContact N-OD1 3.03Å
207	G	93.3	Very high	92.1	Very high	1 Å²	1	54 Å²	54	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	163.5	171.1	0	0	0	0	0	112.1	V172 V193 R194 C197	V172-G207 CarbonylContact O-C 3.55Å; V172-G207 WeakPolarHBondContact O-CA 3.42Å; V193-G207 CarbonylContact C-O 3.46Å; V193-G207 VanDerWaalsContact CA-O 3.3Å; V193-G207 WeakPolarHBondContact CA-O 3.43Å; V193-G207 WeakPolarHBondContact CG1-O 3.36Å; R194-G207 PolarHBondContact N-O 3.45Å; R194-G207 PolarHBondContact O-N 2.61Å; C197-G207 WeakPolarHBondContact SG-CA 3.48Å; C197-G207 PolarHBondContact SG-N 3.46Å
208	C	93.3	Very high	92.5	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.007	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.8	173.4	-65.5	0	0	0	0	108.5	H171 V172 H174 H192 Y210	H171-C208 WeakPolarHBondContact CA-O 3.28Å; V172-C208 PolarHBondContact N-O 3.1Å; V172-C208 PolarHBondContact O-N 2.89Å; H174-C208 PolarHBondContact ND1-SG 2.79Å; H192-C208 WeakPolarHBondContact O-CA 3.28Å; C208-Y210 HydrophobicContact CB-CD2 4.09Å; C208-Y210 HydrophobicContact CB-CE2 3.67Å
209	T	94.8	Very high	92.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	120.1	171.6	-53.3	0	0	0	0	108.7	L45 Y169 H171 L191 H192	L45-T209 HydrophobicContact CD2-CG2 4.16Å; Y169-T209 HydrophobicContact CD2-CG2 4.36Å; H171-T209 PolarHBondContact CD2-OG1 3.34Å; H171-T209 PolarHBondContact NE2-OG1 3.46Å; L191-T209 PolarHBondContact N-O 2.94Å; H192-T209 PolarHBondContact CE1-OG1 3.29Å; H192-T209 PolarHBondContact NE2-OG1 2.89Å; H192-T209 PolarHBondContact O-N 3.48Å
210	Y	96.1	Very high	92.5	Very high	0 Å²	0	54 Å²	54	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.9	174	-81.6	-92.8	0	0	0	109.8	Y169 L170 V172 R180 E184 F188 I189 C190 C208	Y169-Y210 CarbonylContact C-O 3.54Å; Y169-Y210 WeakPolarHBondContact CA-O 3.43Å; Y169-Y210 WeakPolarHBondContact CB-O 3.38Å; L170-Y210 PolarHBondContact N-O 3.07Å; L170-Y210 PolarHBondContact O-N 3.43Å; V172-Y210 HydrophobicContact CB-CD2 4.29Å; V172-Y210 HydrophobicContact CB-CE2 4.36Å; V172-Y210 HydrophobicContact CG2-CD2 3.85Å; V172-Y210 HydrophobicContact CG2-CE2 4.29Å; R180-Y210 WeakPolarHBondContact CB-OH 3.21Å; R180-Y210 HydrophobicContact CG-CE2 3.95Å; R180-Y210 WeakPolarHBondContact CG-OH 3.4Å; R180-Y210 PolarHBondContact NE-OH 3.07Å; E184-Y210 HydrophobicContact CG-CE1 3.57Å; E184-Y210 PolarHBondContact OE1-OH 2.94Å; F188-Y210 HydrophobicContact CB-CD1 3.93Å; I189-Y210 VanDerWaalsContact O-CA 3.32Å; I189-Y210 WeakPolarHBondContact O-CA 3.35Å; C190-Y210 HydrophobicContact CB-CD1 4.22Å; C190-Y210 HydrophobicContact CB-CE1 3.71Å; C190-Y210 HydrophobicContact CB-CE2 4.38Å; C208-Y210 HydrophobicContact CB-CD2 4.09Å; C208-Y210 HydrophobicContact CB-CE2 3.67Å
211	V	96	Very high	91.6	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140	177.4	64.3	0	0	0	0	110.5	L45 A167 V168 F188 I189 L191	L45-V211 HydrophobicContact CD2-CB 3.8Å; L45-V211 HydrophobicContact CD2-CG2 3.8Å; A167-V211 HydrophobicContact CB-CG2 3.85Å; V168-V211 CarbonylContact O-C 3.59Å; V168-V211 WeakPolarHBondContact O-CA 3.26Å; F188-V211 CarbonylContact C-O 3.51Å; F188-V211 WeakPolarHBondContact CA-O 3.3Å; I189-V211 HydrophobicContact CD1-CG1 3.99Å; I189-V211 HydrophobicContact CG1-CG1 3.54Å; I189-V211 WeakPolarHBondContact CG1-O 3.13Å; I189-V211 PolarHBondContact N-O 3.4Å; I189-V211 PolarHBondContact O-N 2.95Å; L191-V211 HydrophobicContact CB-CG1 4.33Å
212	L	96.6	Very high	90.3	Very high	30 Å²	30	58.3 Å²	58.3	16%	0.157	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.8	167.3	176.5	70.9	0	0	0	107.3	I82 A167 V168 G187 F188 T214	I82-L212 HydrophobicContact CD1-CD2 3.66Å; I82-L212 HydrophobicContact CG1-CD2 4.3Å; I82-L212 HydrophobicContact CG2-CD2 4.17Å; A167-L212 CarbonylContact C-O 3.54Å; A167-L212 WeakPolarHBondContact CA-O 3.12Å; V168-L212 PolarHBondContact N-O 2.85Å; V168-L212 PolarHBondContact O-N 3.13Å; G187-L212 WeakPolarHBondContact O-CD1 3.25Å; F188-L212 HydrophobicContact CD1-CB 3.68Å; F188-L212 HydrophobicContact CD2-CB 4.03Å; F188-L212 HydrophobicContact CD2-CD2 4.45Å; F188-L212 HydrophobicContact CE1-CB 3.55Å; F188-L212 HydrophobicContact CE2-CB 3.9Å; F188-L212 HydrophobicContact CE2-CD2 3.86Å; F188-L212 HydrophobicContact CE2-CG 4.42Å; F188-L212 HydrophobicContact CG-CB 3.91Å; F188-L212 HydrophobicContact CZ-CB 3.66Å; F188-L212 HydrophobicContact CZ-CD2 4.02Å; F188-L212 HydrophobicContact CZ-CG 4.48Å; L212-T214 HydrophobicContact CD2-CG2 4.45Å; L212-T214 HydrophobicContact CG-CG2 4.41Å
213	H	95.3	Very high	88.4	Confident	48 Å²	48	60.6 Å²	60.6	22%	0.222	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	133.3	175.4	-66	97.8	0	0	0	111	L45 G217 H218	L45-H213 PolarHBondContact O-NE2 3.42Å; H213-G217 VanDerWaalsContact CB-O 3.22Å; H213-G217 WeakPolarHBondContact CB-O 3.16Å; H213-H218 PolarHBondContact CD2-N 3.44Å
214	T	93.8	Very high	86.4	Confident	13 Å²	13	59.6 Å²	59.6	8%	0.08	34%	0.343	C	S	.	.			trans	-126.4	158.1	-179	54.1	0	0	0	0	108.7	I82 S86 V165 R166 A167 V168 L212 G216 G217	I82-T214 HydrophobicContact CG2-CG2 4.43Å; S86-T214 WeakPolarHBondContact OG-CG2 3.4Å; V165-T214 PolarHBondContact O-OG1 3.1Å; R166-T214 CarbonylContact C-O 3.51Å; R166-T214 VanDerWaalsContact C-OG1 3.25Å; R166-T214 VanDerWaalsContact CA-O 3.31Å; R166-T214 WeakPolarHBondContact CA-O 3.36Å; R166-T214 PolarHBondContact O-N 3.2Å; A167-T214 PolarHBondContact N-OG1 2.68Å; V168-T214 HydrophobicContact CG2-CG2 4.19Å; L212-T214 HydrophobicContact CD2-CG2 4.45Å; L212-T214 HydrophobicContact CG-CG2 4.41Å; T214-G216 PolarHBondContact O-N 3.47Å; T214-G217 PolarHBondContact O-N 3.48Å
215	N	93.7	Very high	84.5	Confident	65 Å²	65	65 Å²	65	35%	0.348	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	39.7	174.5	-63.8	-48.1	0	0	0	113.8	S86 P164 V165 R166 G217	S86-N215 PolarHBondContact O-ND2 3.18Å; S86-N215 PolarHBondContact O-OD1 3.19Å; P164-N215 WeakPolarHBondContact CB-ND2 3.18Å; V165-N215 PolarHBondContact O-ND2 3.43Å; R166-N215 WeakPolarHBondContact CD-O 3.46Å; R166-N215 PolarHBondContact NH1-O 3.27Å; N215-G217 VanDerWaalsContact C-N 3.31Å; N215-G217 PolarHBondContact O-N 3.09Å
216	G	91.2	Very high	82.5	Confident	58 Å²	58	68.2 Å²	68.2	60%	0.598	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	11.4	180	0	0	0	0	0	116	T214 H218	T214-G216 PolarHBondContact O-N 3.47Å; G216-H218 PolarHBondContact O-ND1 3.08Å
217	G	92.8	Very high	80.5	Confident	11 Å²	11	69.7 Å²	69.7	11%	0.113	38%	0.384	C	S	.	.			trans	-53.9	147.4	162	0	0	0	0	0	110.8	R166 H213 T214 N215	R166-G217 WeakPolarHBondContact O-CA 3.42Å; H213-G217 VanDerWaalsContact CB-O 3.22Å; H213-G217 WeakPolarHBondContact CB-O 3.16Å; T214-G217 PolarHBondContact O-N 3.48Å; N215-G217 VanDerWaalsContact C-N 3.31Å; N215-G217 PolarHBondContact O-N 3.09Å
218	H	93.4	Very high	78.7	Confident	91 Å²	91	72.7 Å²	72.7	42%	0.421	41%	0.405	S	S	.	.			trans	-157.4	162.5	176.6	58.1	-80.3	0	0	0	109.5	L46 A47 F50 H213 G216	L46-H218 CarbonylContact C-O 3.6Å; L46-H218 WeakPolarHBondContact CA-O 3.23Å; A47-H218 PolarHBondContact N-O 3.2Å; F50-H218 AromaticContact CE2-CE1 3.36Å; F50-H218 WeakPolarHBondContact CE2-CE1 3.23Å; F50-H218 AromaticContact CE2-ND1 3.42Å; F50-H218 WeakPolarHBondContact CE2-ND1 3.45Å; F50-H218 AromaticContact CZ-CE1 3.58Å; F50-H218 AromaticContact CZ-ND1 3.52Å; H213-H218 PolarHBondContact CD2-N 3.44Å; G216-H218 PolarHBondContact O-ND1 3.08Å
219	L	91	Very high	77.1	Confident	54 Å²	54	76 Å²	76	28%	0.283	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-83.3	158.8	169.7	-59.6	177.9	0	0	0	110.3	K44 L45 I189 L191 C221	K44-L219 VanDerWaalsContact O-CD2 3.24Å; K44-L219 WeakPolarHBondContact O-CD2 3.42Å; L45-L219 WeakPolarHBondContact O-CD2 3.24Å; I189-L219 HydrophobicContact CD1-CD1 3.71Å; I189-L219 HydrophobicContact CD1-CG 4.42Å; L191-L219 HydrophobicContact CD1-CD1 3.75Å; L191-L219 HydrophobicContact CD1-CD2 3.69Å; L191-L219 HydrophobicContact CD1-CG 4.39Å; L219-C221 PolarHBondContact O-N 3.22Å; L219-C221 VanDerWaalsContact O-N 3.11Å
220	D	86.1	Confident	75.7	Confident	89 Å²	89	81.5 Å²	81.5	48%	0.476	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-55.2	123.2	165.6	-77.3	-42	0	0	0	109.2	A47 S48 K222	A47-D220 WeakPolarHBondContact CA-OD1 3.46Å; A47-D220 VanDerWaalsContact CB-OD1 3.25Å; A47-D220 WeakPolarHBondContact CB-OD1 3.36Å; S48-D220 VanDerWaalsContact N-CG 3.33Å; S48-D220 PolarHBondContact N-OD1 3.4Å; S48-D220 PolarHBondContact N-OD2 3.47Å; D220-K222 PolarHBondContact O-N 3.04Å
221	C	68.5	Low	74.3	Confident	121 Å²	121	84.1 Å²	84.1	82%	0.818	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-57.3	118.3	165	-105.9	0	0	0	0	106.2	L219 P223	L219-C221 PolarHBondContact O-N 3.22Å; L219-C221 VanDerWaalsContact O-N 3.11Å; C221-P223 VanDerWaalsContact O-N 3.12Å
222	K	60.7	Low	73.4	Confident	192 Å²	192	87.9 Å²	87.9	84%	0.835	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-47.9	128.6	163.9	-73.7	-179.5	179.1	167.7	0	105.8	D220 M224	D220-K222 PolarHBondContact O-N 3.04Å; K222-M224 PolarHBondContact O-N 3.26Å
223	P	49.8	Very low	72.6	Confident	120 Å²	120	91.3 Å²	91.3	78%	0.779	52%	0.516	S	S	*	.			trans	-59.8	98.3	179.1	22.5	-30.3	0	0	0	106.4	C221 Y225	C221-P223 VanDerWaalsContact O-N 3.12Å; P223-Y225 VanDerWaalsContact C-N 3.35Å; P223-Y225 PolarHBondContact O-N 2.93Å
224	M	48.6	Very low	71.9	Confident	177 Å²	177	94.1 Å²	94.1	87%	0.872	53%	0.532	S	S	*	.			trans	-67.8	107.3	171.1	-163.5	149.1	73.5	0	0	102.1	K222	K222-M224 PolarHBondContact O-N 3.26Å
225	Y	53.5	Low	71.4	Confident	208 Å²	208	98.4 Å²	98.4	82%	0.816	55%	0.554	S	S	*	*			trans	-41.4	122.4	178.2	-70.8	-83.3	0	0	0	107.1	P223 C227	P223-Y225 VanDerWaalsContact C-N 3.35Å; P223-Y225 PolarHBondContact O-N 2.93Å; Y225-C227 PolarHBondContact O-N 3.23Å
226	P	49.7	Very low	70.9	Confident	87 Å²	87	98.9 Å²	98.9	57%	0.565	56%	0.558	S	S	*	*			trans	-64.1	114	-177.2	28.2	-34.4	0	0	0	105.5	S228 S229	P226-S228 WeakPolarHBondContact CB-OG 3.26Å; P226-S228 PolarHBondContact O-N 2.72Å; P226-S229 PolarHBondContact O-N 3.19Å; P226-S229 PolarHBondContact O-OG 2.91Å; P226-S229 VanDerWaalsContact O-OG 3.07Å
227	C	52.5	Low	70.5	Confident	98 Å²	98	100.4 Å²	100.4	66%	0.662	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	12.2	173.7	-156.7	0	0	0	0	111.1	Y225	Y225-C227 PolarHBondContact O-N 3.23Å
228	S	56.2	Low	69.9	Low	64 Å²	64	104.1 Å²	104.1	45%	0.448	57%	0.569	S	S	.	*	H	α-helix	trans	-73.4	-25.2	162.1	57.4	0	0	0	0	112.4	P226 S231 V232	P226-S228 WeakPolarHBondContact CB-OG 3.26Å; P226-S228 PolarHBondContact O-N 2.72Å; S228-S231 PolarHBondContact O-N 3.06Å; S228-S231 PolarHBondContact O-OG 2.99Å; S228-V232 VanDerWaalsContact O-CB 3.25Å; S228-V232 WeakPolarHBondContact O-CB 3.44Å; S228-V232 WeakPolarHBondContact O-CG2 3.25Å; S228-V232 PolarHBondContact O-N 3.04Å
229	S	58.1	Low	69.1	Low	70 Å²	70	107 Å²	107	49%	0.49	58%	0.581	S	S	.	*	H	α-helix	trans	-66.7	-38.1	177.6	55.8	0	0	0	0	112.5	P226 L233	P226-S229 PolarHBondContact O-N 3.19Å; P226-S229 PolarHBondContact O-OG 2.91Å; P226-S229 VanDerWaalsContact O-OG 3.07Å; S229-L233 WeakPolarHBondContact O-CB 3.4Å; S229-L233 PolarHBondContact O-N 2.99Å
230	L	65.2	Low	68.3	Low	115 Å²	115	109.9 Å²	109.9	60%	0.602	60%	0.595	S	S	*	*	H	α-helix	trans	-74.3	-37.7	175.7	-84.9	150.7	0	0	0	112.6	L233 L234	L230-L233 PolarHBondContact O-N 2.95Å; L230-L234 VanDerWaalsContact O-CB 3.27Å; L230-L234 WeakPolarHBondContact O-CB 3.33Å; L230-L234 PolarHBondContact O-N 2.86Å
231	S	68.1	Low	67.8	Low	55 Å²	55	111 Å²	111	39%	0.385	61%	0.605	S	S	.	*	H	α-helix	trans	-70.2	-38.3	176.4	73.9	0	0	0	0	112	S228 L234 L235	S228-S231 PolarHBondContact O-N 3.06Å; S228-S231 PolarHBondContact O-OG 2.99Å; S231-L234 PolarHBondContact O-N 2.84Å; S231-L235 WeakPolarHBondContact O-CB 3.44Å; S231-L235 VanDerWaalsContact O-CG 3.26Å; S231-L235 WeakPolarHBondContact O-CG 3.48Å; S231-L235 PolarHBondContact O-N 3.25Å
232	V	77.2	Confident	67.6	Low	80 Å²	80	115.7 Å²	115.7	49%	0.485	61%	0.606	S	S	.	*	H	α-helix	trans	-67.8	-42.4	173.9	173.4	0	0	0	0	110.6	S228 L234 L235 V236	S228-V232 VanDerWaalsContact O-CB 3.25Å; S228-V232 WeakPolarHBondContact O-CB 3.44Å; S228-V232 WeakPolarHBondContact O-CG2 3.25Å; S228-V232 PolarHBondContact O-N 3.04Å; V232-L234 VanDerWaalsContact C-N 3.34Å; V232-L234 PolarHBondContact O-N 2.84Å; V232-L235 PolarHBondContact O-N 2.93Å; V232-V236 HydrophobicContact CG1-CG2 4.27Å; V232-V236 WeakPolarHBondContact O-CB 3.46Å; V232-V236 WeakPolarHBondContact O-CG2 3.42Å; V232-V236 PolarHBondContact O-N 3.19Å
233	L	78.2	Confident	67.7	Low	102 Å²	102	111.7 Å²	111.7	53%	0.534	59%	0.593	S	S	.	*	H	α-helix	trans	-62.2	-41.3	175.5	-170.6	78	0	0	0	111.7	S229 L230 V236 L237	S229-L233 WeakPolarHBondContact O-CB 3.4Å; S229-L233 PolarHBondContact O-N 2.99Å; L230-L233 PolarHBondContact O-N 2.95Å; L233-V236 PolarHBondContact O-N 2.78Å; L233-L237 HydrophobicContact CG-CD1 4.19Å; L233-L237 WeakPolarHBondContact O-CB 3.36Å; L233-L237 WeakPolarHBondContact O-CG 3.42Å; L233-L237 PolarHBondContact O-N 2.9Å
234	L	80.6	Confident	68.1	Low	106 Å²	106	110 Å²	110	56%	0.555	58%	0.582	S	S	*	*	H	α-helix	trans	-65.3	-42	175.4	-172.6	72.5	0	0	0	111.7	L230 S231 V232 L237 L238	L230-L234 VanDerWaalsContact O-CB 3.27Å; L230-L234 WeakPolarHBondContact O-CB 3.33Å; L230-L234 PolarHBondContact O-N 2.86Å; S231-L234 PolarHBondContact O-N 2.84Å; V232-L234 VanDerWaalsContact C-N 3.34Å; V232-L234 PolarHBondContact O-N 2.84Å; L234-L237 PolarHBondContact O-N 3.38Å; L234-L238 HydrophobicContact CG-CD1 4.22Å; L234-L238 WeakPolarHBondContact O-CB 3.35Å; L234-L238 VanDerWaalsContact O-CG 3.26Å; L234-L238 WeakPolarHBondContact O-CG 3.21Å; L234-L238 PolarHBondContact O-N 3.05Å
235	L	83.2	Confident	68.6	Low	104 Å²	104	109.3 Å²	109.3	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-65.6	-39.6	175.7	-76.7	168.8	0	0	0	112.3	S231 V232 L238 F239	S231-L235 WeakPolarHBondContact O-CB 3.44Å; S231-L235 VanDerWaalsContact O-CG 3.26Å; S231-L235 WeakPolarHBondContact O-CG 3.48Å; S231-L235 PolarHBondContact O-N 3.25Å; V232-L235 PolarHBondContact O-N 2.93Å; L235-L238 PolarHBondContact O-N 3.42Å; L235-F239 WeakPolarHBondContact O-CB 3.27Å; L235-F239 PolarHBondContact O-N 2.95Å
236	V	84.2	Confident	68.7	Low	74 Å²	74	103.6 Å²	103.6	45%	0.448	57%	0.565	S	S	.	*	H	α-helix	trans	-66.1	-43.5	175.2	170.1	0	0	0	0	110.6	V232 L233 F239 I240	V232-V236 HydrophobicContact CG1-CG2 4.27Å; V232-V236 WeakPolarHBondContact O-CB 3.46Å; V232-V236 WeakPolarHBondContact O-CG2 3.42Å; V232-V236 PolarHBondContact O-N 3.19Å; L233-V236 PolarHBondContact O-N 2.78Å; V236-F239 PolarHBondContact O-N 3.4Å; V236-I240 HydrophobicContact CG1-CD1 3.91Å; V236-I240 VanDerWaalsContact O-CG1 3.27Å; V236-I240 WeakPolarHBondContact O-CG1 3.19Å; V236-I240 PolarHBondContact O-N 3.45Å
237	L	82.7	Confident	68.9	Low	91 Å²	91	106.3 Å²	106.3	48%	0.476	57%	0.57	S	S	.	*	H	α-helix	trans	-63.3	-43	174.4	-83.3	161.2	0	0	0	112.1	L233 L234 F239 I240 V241	L233-L237 HydrophobicContact CG-CD1 4.19Å; L233-L237 WeakPolarHBondContact O-CB 3.36Å; L233-L237 WeakPolarHBondContact O-CG 3.42Å; L233-L237 PolarHBondContact O-N 2.9Å; L234-L237 PolarHBondContact O-N 3.38Å; L237-F239 VanDerWaalsContact C-N 3.32Å; L237-F239 PolarHBondContact O-N 3.41Å; L237-I240 PolarHBondContact O-N 2.93Å; L237-V241 VanDerWaalsContact O-CG2 3.28Å; L237-V241 WeakPolarHBondContact O-CG2 3.32Å; L237-V241 PolarHBondContact O-N 2.84Å
238	L	79.2	Confident	69.1	Low	89 Å²	89	106.8 Å²	106.8	47%	0.466	57%	0.565	S	S	.	*	H	α-helix	trans	-62.6	-39.8	174.6	-76.2	169.3	0	0	0	111.4	L234 L235 V241 W242	L234-L238 HydrophobicContact CG-CD1 4.22Å; L234-L238 WeakPolarHBondContact O-CB 3.35Å; L234-L238 VanDerWaalsContact O-CG 3.26Å; L234-L238 WeakPolarHBondContact O-CG 3.21Å; L234-L238 PolarHBondContact O-N 3.05Å; L235-L238 PolarHBondContact O-N 3.42Å; L238-V241 PolarHBondContact O-N 3.37Å; L238-W242 VanDerWaalsContact O-CB 3.28Å; L238-W242 WeakPolarHBondContact O-CB 3.09Å; L238-W242 PolarHBondContact O-N 3.33Å
239	F	77.5	Confident	68.9	Low	152 Å²	152	111.5 Å²	111.5	67%	0.667	58%	0.58	S	S	*	*	H	α-helix	trans	-63.1	-42.9	174.1	-114.7	-93	0	0	0	112.3	L235 V236 L237 V241 W242 L243	L235-F239 WeakPolarHBondContact O-CB 3.27Å; L235-F239 PolarHBondContact O-N 2.95Å; V236-F239 PolarHBondContact O-N 3.4Å; L237-F239 VanDerWaalsContact C-N 3.32Å; L237-F239 PolarHBondContact O-N 3.41Å; F239-V241 VanDerWaalsContact C-N 3.35Å; F239-W242 PolarHBondContact O-N 2.93Å; F239-L243 HydrophobicContact CD1-CD1 4.17Å; F239-L243 WeakPolarHBondContact O-CD1 3.22Å; F239-L243 PolarHBondContact O-N 2.79Å
240	I	74.6	Confident	68.6	Low	113 Å²	113	110 Å²	110	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-65.4	-39.1	177.9	-67.6	164.3	0	0	0	111.1	V236 L237	V236-I240 HydrophobicContact CG1-CD1 3.91Å; V236-I240 VanDerWaalsContact O-CG1 3.27Å; V236-I240 WeakPolarHBondContact O-CG1 3.19Å; V236-I240 PolarHBondContact O-N 3.45Å; L237-I240 PolarHBondContact O-N 2.93Å
241	V	75.3	Confident	68.1	Low	112 Å²	112	110 Å²	110	68%	0.679	58%	0.575	S	S	*	*	H	α-helix	trans	-74.7	-30.4	178.5	174.7	0	0	0	0	112.2	L237 L238 F239	L237-V241 VanDerWaalsContact O-CG2 3.28Å; L237-V241 WeakPolarHBondContact O-CG2 3.32Å; L237-V241 PolarHBondContact O-N 2.84Å; L238-V241 PolarHBondContact O-N 3.37Å; F239-V241 VanDerWaalsContact C-N 3.35Å
242	W	64.9	Low	67.4	Low	220 Å²	220	111.1 Å²	111.1	83%	0.833	58%	0.583	S	S	*	*	H	α-helix	trans	-89	-6.1	176.7	-89.3	33.5	0	0	0	114.6	L238 F239 P244	L238-W242 VanDerWaalsContact O-CB 3.28Å; L238-W242 WeakPolarHBondContact O-CB 3.09Å; L238-W242 PolarHBondContact O-N 3.33Å; F239-W242 PolarHBondContact O-N 2.93Å; W242-P244 WeakPolarHBondContact O-CD 3.47Å; W242-P244 VanDerWaalsContact O-N 3.09Å
243	L	61.2	Low	66.2	Low	109 Å²	109	111 Å²	111	57%	0.571	59%	0.586	S	S	*	*	S	Bend	trans	-64.5	112.4	170.5	-111.9	90.6	0	0	0	108	F239 F245	F239-L243 HydrophobicContact CD1-CD1 4.17Å; F239-L243 WeakPolarHBondContact O-CD1 3.22Å; F239-L243 PolarHBondContact O-N 2.79Å; L243-F245 PolarHBondContact O-N 3.13Å; L243-F245 VanDerWaalsContact O-N 3.16Å
244	P	59.6	Low	64.9	Low	85 Å²	85	114.4 Å²	114.4	55%	0.552	60%	0.596	S	S	*	*			trans	-67	124.4	-179.2	29.6	-32.1	0	0	0	107.2	W242 S246 Q247	W242-P244 WeakPolarHBondContact O-CD 3.47Å; W242-P244 VanDerWaalsContact O-N 3.09Å; P244-S246 PolarHBondContact O-N 2.66Å; P244-Q247 PolarHBondContact O-N 3.4Å
245	F	58.4	Low	63.5	Low	161 Å²	161	114.6 Å²	114.6	71%	0.706	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-58.4	-2.4	179.8	-142.9	-98.3	0	0	0	113.5	L243 Q247 I248	L243-F245 PolarHBondContact O-N 3.13Å; L243-F245 VanDerWaalsContact O-N 3.16Å; F245-Q247 VanDerWaalsContact C-N 3.32Å; F245-Q247 PolarHBondContact O-N 3.24Å; F245-I248 HydrophobicContact CD2-CD1 4.4Å; F245-I248 HydrophobicContact CE2-CD1 4.34Å
246	S	55.8	Low	62.2	Low	88 Å²	88	115.6 Å²	115.6	62%	0.615	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-73.1	-12.1	179	58	0	0	0	0	115.1	P244	P244-S246 PolarHBondContact O-N 2.66Å
247	Q	55	Low	60.7	Low	144 Å²	144	120 Å²	120	67%	0.673	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-93.9	-15.3	176.7	-69.5	-66.5	-34.6	0	0	114.2	P244 F245	P244-Q247 PolarHBondContact O-N 3.4Å; F245-Q247 VanDerWaalsContact C-N 3.32Å; F245-Q247 PolarHBondContact O-N 3.24Å
248	I	56.6	Low	59.2	Low	108 Å²	108	122.9 Å²	122.9	55%	0.554	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-23.2	-176.7	-60.5	174.7	0	0	0	111.7	F245	F245-I248 HydrophobicContact CD2-CD1 4.4Å; F245-I248 HydrophobicContact CE2-CD1 4.34Å
249	Q	52	Low	58	Low	163 Å²	163	124.6 Å²	124.6	76%	0.762	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-14.5	176.6	-66.8	-123	-49.5	0	0	114.2
250	G	51.3	Low	56.6	Low	39 Å²	39	125.1 Å²	125.1	40%	0.402	67%	0.669	S	S	.	*	H	α-helix	trans	-84.5	-12.2	-177.4	0	0	0	0	0	115.7	S253	G250-S253 PolarHBondContact O-OG 3.48Å
251	I	54	Low	55.7	Low	115 Å²	115	125.8 Å²	125.8	59%	0.59	67%	0.673	S	S	*	*	H	α-helix	trans	-88.9	-26.3	-176.6	-58	168.7	0	0	0	111.1	L255	I251-L255 HydrophobicContact CG2-CD1 4.35Å; I251-L255 PolarHBondContact O-N 3.4Å
252	S	53	Low	54.7	Low	79 Å²	79	126.5 Å²	126.5	55%	0.552	67%	0.673	S	S	*	*	H	α-helix	trans	-69.8	-32.2	177.1	-174.8	0	0	0	0	112.7	I256	S252-I256 WeakPolarHBondContact O-CG1 3.46Å
253	S	52.2	Low	54.2	Low	77 Å²	77	121.3 Å²	121.3	54%	0.538	66%	0.664	S	S	.	*	H	α-helix	trans	-78.8	-25.1	180	61.2	0	0	0	0	114.2	G250	G250-S253 PolarHBondContact O-OG 3.48Å
254	K	52.2	Low	53.7	Low	173 Å²	173	122 Å²	122	75%	0.752	67%	0.669	S	S	*	*	H	α-helix	trans	-82	-20.3	175.9	-81.1	-172.3	174	-177.6	0	114.1
255	L	51.4	Low	53.4	Low	111 Å²	111	124.3 Å²	124.3	58%	0.581	68%	0.677	S	S	*	*	H	α-helix	trans	-82.5	-27.4	177.1	-108.8	145.2	0	0	0	113.1	I251 H257 L258	I251-L255 HydrophobicContact CG2-CD1 4.35Å; I251-L255 PolarHBondContact O-N 3.4Å; L255-H257 VanDerWaalsContact C-N 3.29Å; L255-H257 PolarHBondContact O-N 3.43Å; L255-L258 PolarHBondContact O-N 3.47Å
256	I	54.4	Low	53	Low	124 Å²	124	121.9 Å²	121.9	64%	0.636	68%	0.675	S	S	*	*	H	α-helix	trans	-72.5	-25.3	176.6	-62	167.1	0	0	0	111.4	S252	S252-I256 WeakPolarHBondContact O-CG1 3.46Å
257	H	52.9	Low	52.8	Low	168 Å²	168	124.3 Å²	124.3	78%	0.778	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-1.8	177.9	-117.9	-74.5	0	0	0	114.9	L255	L255-H257 VanDerWaalsContact C-N 3.29Å; L255-H257 PolarHBondContact O-N 3.43Å
258	L	51.4	Low	52.7	Low	150 Å²	150	122.8 Å²	122.8	79%	0.785	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	-2.7	178.2	-152.7	77.8	0	0	0	112.9	L255	L255-L258 PolarHBondContact O-N 3.47Å
259	V	54.6	Low	52.3	Low	125 Å²	125	124 Å²	124	76%	0.758	69%	0.69	S	S	*	*			trans	-122.5	11.2	-176.1	-176.9	0	0	0	0	112.3
260	S	48.7	Very low	52.4	Low	164 Å²	164	120.5 Å²	120.5	100%	1.147	68%	0.684	S	S	*	*			trans	-123	0	168.9	-174.4	0	0	0	0	110.9

Retrieved 260 of 260 residues in 74.8 ms (Link to these results)

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