A0A061IJ91_CRIGR Loading...

Cathepsin G

AlphaFold DB , UniProt , Accession A0A061IJ91, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100767270, Length 269 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	41.9	Very low	48.3	Very low	243 Å²	243	170.6 Å²	170.6	100%	1.197	84%	0.835	S	S	*	*				0	100.2	0	-76.2	158.2	93.5	0	0	108.1
2	Q	40.4	Very low	48	Very low	186 Å²	186	168.6 Å²	168.6	87%	0.869	83%	0.829	S	S	*	*			trans	-148.6	107.9	170.2	-130.2	166.7	-12.5	0	0	106.4
3	W	41.7	Very low	47.6	Very low	252 Å²	252	168.4 Å²	168.4	96%	0.955	83%	0.832	S	S	*	*			trans	-97.3	117	-180	-86.2	33.6	0	0	0	108.5
4	F	49.2	Very low	47.5	Very low	199 Å²	199	173.3 Å²	173.3	87%	0.873	84%	0.836	S	S	*	*			trans	-80.7	126.5	166.2	-87.8	-91.7	0	0	0	109.3
5	P	51.5	Low	46.8	Very low	121 Å²	121	165.8 Å²	165.8	79%	0.786	82%	0.823	S	S	*	*			trans	-86.4	114.7	160	31.4	-24.3	0	0	0	108.7	M7	P5-M7 PolarHBondContact O-N 3.14Å; P5-M7 VanDerWaalsContact O-N 3.14Å
6	L	52.2	Low	46.5	Very low	151 Å²	151	165.3 Å²	165.3	79%	0.791	82%	0.824	S	S	*	*			trans	-67.4	101.7	169.1	-141.7	91	0	0	0	107.8	L8	L6-L8 HydrophobicContact CD2-CD1 4.32Å; L6-L8 PolarHBondContact O-N 3.05Å
7	M	53.6	Low	46.2	Very low	174 Å²	174	163.6 Å²	163.6	86%	0.857	81%	0.813	S	S	*	*			trans	-73.5	98.8	169.9	-118.8	-147.3	168.9	0	0	108.5	P5 I9	P5-M7 PolarHBondContact O-N 3.14Å; P5-M7 VanDerWaalsContact O-N 3.14Å; M7-I9 PolarHBondContact O-N 3.01Å
8	L	50.1	Low	45.6	Very low	137 Å²	137	158.1 Å²	158.1	72%	0.717	80%	0.797	S	S	*	*			trans	-69	94.1	169.8	-141.8	87.3	0	0	0	107.9	L6 L10	L6-L8 HydrophobicContact CD2-CD1 4.32Å; L6-L8 PolarHBondContact O-N 3.05Å; L8-L10 HydrophobicContact CD2-CD1 4.41Å; L8-L10 PolarHBondContact O-N 2.85Å
9	I	53.7	Low	45.1	Very low	136 Å²	136	151.1 Å²	151.1	70%	0.697	77%	0.768	S	S	*	*			trans	-70.6	100.4	168.1	-64.3	173.6	0	0	0	106.4	M7 I11	M7-I9 PolarHBondContact O-N 3.01Å; I9-I11 HydrophobicContact CG2-CG1 4.1Å; I9-I11 PolarHBondContact O-N 2.89Å
10	L	48.1	Very low	45.2	Very low	138 Å²	138	145.2 Å²	145.2	72%	0.723	74%	0.737	S	S	*	*			trans	-62.9	95.6	159.8	-99.8	97.4	0	0	0	106.9	L8 L12	L8-L10 HydrophobicContact CD2-CD1 4.41Å; L8-L10 PolarHBondContact O-N 2.85Å; L10-L12 PolarHBondContact O-N 3.04Å
11	I	49.1	Very low	45.9	Very low	140 Å²	140	138.3 Å²	138.3	72%	0.718	70%	0.702	S	S	*	*			trans	-62.6	96	159	-60.4	176.7	0	0	0	104.7	I9 L13	I9-I11 HydrophobicContact CG2-CG1 4.1Å; I9-I11 PolarHBondContact O-N 2.89Å; I11-L13 VanDerWaalsContact C-N 3.34Å; I11-L13 PolarHBondContact O-N 2.85Å
12	L	44.4	Very low	47.4	Very low	146 Å²	146	128 Å²	128	76%	0.764	65%	0.652	S	S	*	*			trans	-53	109.3	161	-72.1	169.4	0	0	0	105	L10 R14	L10-L12 PolarHBondContact O-N 3.04Å; L12-R14 PolarHBondContact O-N 2.84Å
13	L	42.3	Very low	49.3	Very low	166 Å²	166	121.3 Å²	121.3	87%	0.869	63%	0.633	S	S	*	*			trans	-52.3	93.8	161.9	-72.6	162.3	0	0	0	105.4	I11 G15	I11-L13 VanDerWaalsContact C-N 3.34Å; I11-L13 PolarHBondContact O-N 2.85Å; L13-G15 PolarHBondContact O-N 3.29Å
14	R	46.1	Very low	51.6	Low	237 Å²	237	110 Å²	110	89%	0.894	60%	0.595	S	S	*	*			trans	-60.7	96.1	156	-82.9	-176.3	173.2	172.2	-0.4	102.7	L12 D16	L12-R14 PolarHBondContact O-N 2.84Å; R14-D16 VanDerWaalsContact C-N 3.29Å; R14-D16 PolarHBondContact O-N 3.26Å
15	G	37.8	Very low	53.7	Low	61 Å²	61	107.3 Å²	107.3	63%	0.629	58%	0.579	S	S	*	*			trans	-50.1	105.9	168.7	0	0	0	0	0	105.7	L13 E17	L13-G15 PolarHBondContact O-N 3.29Å; G15-E17 VanDerWaalsContact C-N 3.27Å; G15-E17 PolarHBondContact O-N 3.37Å
16	D	42.3	Very low	55.9	Low	158 Å²	158	106 Å²	106	85%	0.845	56%	0.562	S	S	*	*			trans	-63.7	100.8	172.4	-158.2	2.7	0	0	0	104.2	R14 A18	R14-D16 VanDerWaalsContact C-N 3.29Å; R14-D16 PolarHBondContact O-N 3.26Å; D16-A18 PolarHBondContact O-N 3.28Å
17	E	40.8	Very low	58	Low	137 Å²	137	98.9 Å²	98.9	64%	0.64	53%	0.525	S	S	*	.			trans	-69.1	77.5	-174.9	-91.7	-111.1	130.4	0	0	108.3	G15 G19 K20	G15-E17 VanDerWaalsContact C-N 3.27Å; G15-E17 PolarHBondContact O-N 3.37Å; E17-G19 PolarHBondContact O-N 2.85Å; E17-K20 IonicContact OE1-NZ 3.63Å; E17-K20 PolarHBondContact OE1-NZ 3Å; E17-K20 WeakPolarHBondContact OE2-CE 3.48Å; E17-K20 IonicContact OE2-NZ 2.89Å; E17-K20 PolarHBondContact OE2-NZ 2.93Å
18	A	36	Very low	60.2	Low	64 Å²	64	100.3 Å²	100.3	53%	0.529	52%	0.521	S	S	.	.			trans	-66.9	109.1	-178.4	0	0	0	0	0	109.1	D16 R154	D16-A18 PolarHBondContact O-N 3.28Å; A18-R154 PolarHBondContact O-NH2 3.27Å
19	G	34.8	Very low	62.5	Low	24 Å²	24	97 Å²	97	25%	0.247	51%	0.508	C	S	.	.			trans	56.1	101.2	151.5	0	0	0	0	0	118.4	E17 V150 R154	E17-G19 PolarHBondContact O-N 2.85Å; G19-V150 VanDerWaalsContact C-CB 3.5Å; G19-V150 WeakPolarHBondContact O-CB 3.14Å; G19-V150 WeakPolarHBondContact O-CG2 3.31Å; G19-R154 PolarHBondContact O-NH2 3.04Å
20	K	48.2	Very low	64.6	Low	34 Å²	34	93.3 Å²	93.3	15%	0.148	49%	0.487	C	S	.	.	S	Bend	trans	-119	177.1	164.6	-66.3	120.5	162.4	-122.9	0	107.7	E17 I22 G24 R25 V150	E17-K20 IonicContact OE1-NZ 3.63Å; E17-K20 PolarHBondContact OE1-NZ 3Å; E17-K20 WeakPolarHBondContact OE2-CE 3.48Å; E17-K20 IonicContact OE2-NZ 2.89Å; E17-K20 PolarHBondContact OE2-NZ 2.93Å; K20-I22 PolarHBondContact O-N 2.71Å; K20-G24 WeakPolarHBondContact CB-O 3.29Å; K20-G24 VanDerWaalsContact CD-O 3.29Å; K20-G24 WeakPolarHBondContact CD-O 3.21Å; K20-R25 HydrophobicContact CD-CB 4.43Å; K20-R25 VanDerWaalsContact CG-CA 3.42Å; K20-V150 CarbonylContact O-C 3.54Å; K20-V150 WeakPolarHBondContact O-CA 3.34Å; K20-V150 WeakPolarHBondContact O-CB 2.93Å
21	I	59.2	Low	67	Low	0 Å²	0	89 Å²	89	0%	0	47%	0.469	C	S	.	.	S	Bend	trans	-36.6	127.4	166.9	-83.1	168.5	0	0	0	106.9	G23 G24 Q160 V162 S195	I21-G23 CarbonylContact O-C 3.58Å; I21-G23 PolarHBondContact O-N 2.81Å; I21-G24 VanDerWaalsContact O-CA 3.23Å; I21-G24 WeakPolarHBondContact O-CA 3.2Å; I21-G24 PolarHBondContact O-N 3Å; I21-Q160 HydrophobicContact CB-CB 4.02Å; I21-Q160 HydrophobicContact CD1-CB 3.65Å; I21-Q160 WeakPolarHBondContact CD1-O 3.27Å; I21-Q160 HydrophobicContact CG1-CB 3.55Å; I21-Q160 HydrophobicContact CG1-CG 4.38Å; I21-V162 HydrophobicContact CB-CG1 4.44Å; I21-V162 HydrophobicContact CG2-CB 4.01Å; I21-V162 HydrophobicContact CG2-CG1 3.44Å; I21-V162 VanDerWaalsContact CG2-CG1 3.44Å; I21-S195 WeakPolarHBondContact CG2-O 3.16Å
22	I	73.8	Confident	69.3	Low	26 Å²	26	83.2 Å²	83.2	13%	0.133	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-38.5	114.2	-156.7	-60.9	177.8	0	0	0	110.4	K20 G24 R193 K194 S195 F197	K20-I22 PolarHBondContact O-N 2.71Å; I22-G24 PolarHBondContact O-N 2.63Å; I22-R193 CarbonylContact C-O 3.51Å; I22-R193 WeakPolarHBondContact CG2-O 3.41Å; I22-K194 WeakPolarHBondContact O-CA 3.29Å; I22-S195 PolarHBondContact N-O 2.9Å; I22-S195 PolarHBondContact O-N 3.05Å; I22-S195 VanDerWaalsContact O-N 3.16Å; I22-F197 HydrophobicContact CD1-CB 3.94Å; I22-F197 HydrophobicContact CD1-CD1 3.79Å; I22-F197 HydrophobicContact CD1-CD2 4Å; I22-F197 HydrophobicContact CD1-CE1 4.33Å; I22-F197 HydrophobicContact CD1-CG 3.64Å; I22-F197 HydrophobicContact CG1-CB 4.19Å; I22-F197 HydrophobicContact CG1-CD1 4.28Å; I22-F197 HydrophobicContact CG1-CG 4.3Å
23	G	80.7	Confident	71.9	Confident	46 Å²	46	76.5 Å²	76.5	47%	0.474	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	18.9	-178.2	0	0	0	0	0	117.9	I21 R193	I21-G23 CarbonylContact O-C 3.58Å; I21-G23 PolarHBondContact O-N 2.81Å; G23-R193 WeakPolarHBondContact CA-O 3.41Å; G23-R193 PolarHBondContact N-O 2.77Å
24	G	88.8	Confident	74.6	Confident	15 Å²	15	70 Å²	70	16%	0.155	37%	0.368	C	S	.	.			trans	-96.6	-155.5	-178.4	0	0	0	0	0	113.3	K20 I21 I22 E161	K20-G24 WeakPolarHBondContact CB-O 3.29Å; K20-G24 VanDerWaalsContact CD-O 3.29Å; K20-G24 WeakPolarHBondContact CD-O 3.21Å; I21-G24 VanDerWaalsContact O-CA 3.23Å; I21-G24 WeakPolarHBondContact O-CA 3.2Å; I21-G24 PolarHBondContact O-N 3Å; I22-G24 PolarHBondContact O-N 2.63Å; G24-E161 CarbonylContact C-O 3.54Å; G24-E161 VanDerWaalsContact CA-O 3.23Å; G24-E161 WeakPolarHBondContact CA-O 3.47Å
25	R	94.1	Very high	77.1	Confident	142 Å²	142	58.9 Å²	58.9	54%	0.536	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162.9	173.5	64.1	-178.7	-178.4	-170.4	2.1	111.5	K20 A27 Q160 E161	K20-R25 HydrophobicContact CD-CB 4.43Å; K20-R25 VanDerWaalsContact CG-CA 3.42Å; R25-A27 PolarHBondContact O-N 3.24Å; R25-Q160 CarbonylContact O-C 3.47Å; R25-Q160 WeakPolarHBondContact O-CA 3.3Å; R25-Q160 PolarHBondContact O-OE1 3.03Å; R25-E161 HydrophobicContact CG-CG 3.97Å; R25-E161 IonicContact CZ-OE1 3.27Å; R25-E161 VanDerWaalsContact CZ-OE1 3.27Å; R25-E161 PolarHBondContact N-O 2.92Å; R25-E161 IonicContact NE-OE1 2.82Å; R25-E161 PolarHBondContact NE-OE1 2.82Å; R25-E161 IonicContact NH2-OE1 2.82Å; R25-E161 PolarHBondContact NH2-OE1 3.35Å; R25-E161 PolarHBondContact O-N 3.16Å
26	E	97.1	Very high	80	Confident	94 Å²	94	56 Å²	56	44%	0.439	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	130.9	168.4	-175.1	176.8	163.7	0	0	108.9	H77 V158 Q160	E26-H77 IonicContact OE1-CD2 2.69Å; E26-H77 IonicContact OE1-CE1 3.42Å; E26-H77 PolarHBondContact OE1-CE1 2.88Å; E26-H77 IonicContact OE1-NE2 3.48Å; E26-H77 PolarHBondContact OE1-NE2 2.95Å; E26-V158 HydrophobicContact CG-CB 4.37Å; E26-V158 HydrophobicContact CG-CG2 4.11Å; E26-Q160 VanDerWaalsContact N-OE1 3.11Å
27	A	97.9	Very high	82.7	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.008	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-69.6	147.3	174.5	0	0	0	0	0	109.4	R25 H77 L159 E161	R25-A27 PolarHBondContact O-N 3.24Å; A27-H77 PolarHBondContact O-CE1 2.92Å; A27-L159 HydrophobicContact CB-CB 4.29Å; A27-L159 HydrophobicContact CB-CD2 4.02Å; A27-L159 HydrophobicContact CB-CG 3.92Å; A27-L159 PolarHBondContact N-O 2.91Å; A27-E161 HydrophobicContact CB-CB 4.31Å; A27-E161 HydrophobicContact CB-CG 4.1Å
28	R	98.3	Very high	85.5	Confident	204 Å²	204	43 Å²	43	77%	0.77	23%	0.23	S	C	*	.	P	Polyproline II helix	trans	-59	131.8	168.6	174.9	179.9	171.1	-178.8	-0.2	108	H30 S31	R28-H30 PolarHBondContact O-N 3.47Å; R28-H30 VanDerWaalsContact O-N 3.16Å; R28-S31 VanDerWaalsContact O-CB 3.29Å; R28-S31 WeakPolarHBondContact O-CB 3.24Å; R28-S31 PolarHBondContact O-N 3.12Å; R28-S31 PolarHBondContact O-OG 3.35Å
29	P	98.6	Very high	88.4	Confident	68 Å²	68	43.3 Å²	43.3	44%	0.442	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	126.4	-179	-30.4	33.9	0	0	0	112.4	S31 H77	P29-S31 VanDerWaalsContact C-N 3.25Å; P29-S31 PolarHBondContact O-N 2.88Å; P29-H77 HydrophobicContact CB-CB 4.19Å
30	H	98.3	Very high	91.4	Very high	58 Å²	58	42.4 Å²	42.4	27%	0.269	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	18.6	179.5	-38.6	-64.3	0	0	0	116.3	R28 H32 G75 S85 V123	R28-H30 PolarHBondContact O-N 3.47Å; R28-H30 VanDerWaalsContact O-N 3.16Å; H30-H32 PolarHBondContact O-N 3.16Å; H30-G75 PolarHBondContact CE1-O 2.85Å; H30-G75 PolarHBondContact ND1-O 3.5Å; H30-S85 PolarHBondContact CE1-OG 2.82Å; H30-S85 VanDerWaalsContact CE1-OG 3.26Å; H30-V123 HydrophobicContact CB-CB 3.82Å; H30-V123 HydrophobicContact CB-CG1 3.46Å; H30-V123 VanDerWaalsContact CB-CG1 3.46Å
31	S	98.4	Very high	93.8	Very high	48 Å²	48	44.9 Å²	44.9	34%	0.336	22%	0.222	S	C	.	.	S	Bend	trans	-67.2	-21.2	174.2	59.5	0	0	0	0	113.8	R28 P29 P33	R28-S31 VanDerWaalsContact O-CB 3.29Å; R28-S31 WeakPolarHBondContact O-CB 3.24Å; R28-S31 PolarHBondContact O-N 3.12Å; R28-S31 PolarHBondContact O-OG 3.35Å; P29-S31 VanDerWaalsContact C-N 3.25Å; P29-S31 PolarHBondContact O-N 2.88Å; S31-P33 VanDerWaalsContact C-CD 3.41Å; S31-P33 WeakPolarHBondContact O-CD 3.34Å
32	H	98.6	Very high	95.4	Very high	19 Å²	19	46.4 Å²	46.4	9%	0.088	23%	0.232	C	C	.	.			trans	-116.7	72.2	178.2	-51.5	-77.6	0	0	0	110.9	H30 Y34 M35 L159 E161	H30-H32 PolarHBondContact O-N 3.16Å; H32-Y34 HydrophobicContact CB-CE1 4.31Å; H32-Y34 HydrophobicContact CB-CE2 3.98Å; H32-Y34 AromaticContact ND1-CZ 3.82Å; H32-Y34 PolarHBondContact ND1-OH 2.6Å; H32-Y34 PolarHBondContact O-N 2.77Å; H32-M35 HydrophobicContact CB-CB 4.5Å; H32-M35 HydrophobicContact CB-CG 3.5Å; H32-M35 WeakPolarHBondContact O-CB 3.26Å; H32-M35 WeakPolarHBondContact O-CG 3.28Å; H32-M35 PolarHBondContact O-N 2.74Å; H32-L159 HydrophobicContact CB-CD2 4.17Å; H32-E161 IonicContact CE1-OE2 3.37Å; H32-E161 PolarHBondContact CE1-OE2 3.47Å; H32-E161 VanDerWaalsContact CE1-OE2 3.28Å; H32-E161 IonicContact NE2-OE2 3Å; H32-E161 PolarHBondContact NE2-OE2 3.32Å
33	P	98.6	Very high	96.2	Very high	5 Å²	5	51.2 Å²	51.2	3%	0.032	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	0.4	-169.6	30.3	-37.1	0	0	0	114.4	S31 V123 V124 R125	S31-P33 VanDerWaalsContact C-CD 3.41Å; S31-P33 WeakPolarHBondContact O-CD 3.34Å; P33-V123 VanDerWaalsContact CA-O 3.24Å; P33-V123 WeakPolarHBondContact CA-O 3.41Å; P33-V123 WeakPolarHBondContact CB-O 3.3Å; P33-V124 CarbonylContact O-C 3.55Å; P33-V124 VanDerWaalsContact O-CA 3.26Å; P33-V124 WeakPolarHBondContact O-CA 3.32Å; P33-R125 CarbonylContact C-O 3.54Å; P33-R125 HydrophobicContact CB-CG 3.79Å; P33-R125 HydrophobicContact CG-CG 3.46Å; P33-R125 VanDerWaalsContact CG-CG 3.46Å; P33-R125 PolarHBondContact O-N 3.07Å
34	Y	98.9	Very high	96.6	Very high	29 Å²	29	56.8 Å²	56.8	11%	0.114	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-14	171.1	47	-100.1	0	0	0	112.5	H32 A36 F52 L53 R125 V127 P204 V206	H32-Y34 HydrophobicContact CB-CE1 4.31Å; H32-Y34 HydrophobicContact CB-CE2 3.98Å; H32-Y34 AromaticContact ND1-CZ 3.82Å; H32-Y34 PolarHBondContact ND1-OH 2.6Å; H32-Y34 PolarHBondContact O-N 2.77Å; Y34-A36 PolarHBondContact O-N 3.25Å; Y34-F52 HydrophobicContact CD2-CB 4.12Å; Y34-F52 CarbonylContact O-C 3.53Å; Y34-F52 WeakPolarHBondContact O-CA 3.22Å; Y34-L53 PolarHBondContact O-N 2.94Å; Y34-R125 VanDerWaalsContact CA-O 3.23Å; Y34-R125 WeakPolarHBondContact CA-O 3.41Å; Y34-R125 WeakPolarHBondContact CB-O 3.22Å; Y34-R125 PolarHBondContact N-O 3.13Å; Y34-V127 HydrophobicContact CD1-CB 3.78Å; Y34-V127 HydrophobicContact CD1-CG2 3.99Å; Y34-V127 HydrophobicContact CD2-CB 4.29Å; Y34-V127 HydrophobicContact CE1-CB 4.48Å; Y34-V127 HydrophobicContact CE1-CG2 4.2Å; Y34-V127 HydrophobicContact CG-CB 3.67Å; Y34-V127 HydrophobicContact CG-CG1 4.41Å; Y34-V127 HydrophobicContact CG-CG2 4.23Å; Y34-P204 HydrophobicContact CD2-CG 4.02Å; Y34-P204 HydrophobicContact CE2-CG 3.67Å; Y34-V206 HydrophobicContact CE2-CG2 4Å; Y34-V206 WeakPolarHBondContact OH-CG2 3.47Å
35	M	98.9	Very high	96.8	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.02	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	133.1	-175.2	-71.6	-61.9	-60.2	0	0	111.6	H32 A145 W147 L159 P204	H32-M35 HydrophobicContact CB-CB 4.5Å; H32-M35 HydrophobicContact CB-CG 3.5Å; H32-M35 WeakPolarHBondContact O-CB 3.26Å; H32-M35 WeakPolarHBondContact O-CG 3.28Å; H32-M35 PolarHBondContact O-N 2.74Å; M35-A145 HydrophobicContact CE-CB 4.39Å; M35-A145 WeakPolarHBondContact CE-O 3.31Å; M35-A145 HydrophobicContact SD-CB 4.14Å; M35-W147 HydrophobicContact CB-CH2 3.64Å; M35-W147 HydrophobicContact CB-CZ3 3.96Å; M35-W147 HydrophobicContact CE-CE3 4.3Å; M35-W147 HydrophobicContact CE-CH2 4.43Å; M35-W147 HydrophobicContact CE-CZ3 3.72Å; M35-L159 HydrophobicContact CE-CD1 4.09Å; M35-L159 HydrophobicContact CG-CD1 4.33Å; M35-L159 HydrophobicContact CG-CD2 4.13Å; M35-P204 WeakPolarHBondContact SD-CD 3.46Å; M35-P204 HydrophobicContact SD-CG 3.73Å
36	A	98.8	Very high	96.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.1	172.4	0	0	0	0	0	109.3	Y34 L38 G50 G51 V59 V72 T73 L74	Y34-A36 PolarHBondContact O-N 3.25Å; A36-L38 HydrophobicContact CB-CD2 4.35Å; A36-G50 CarbonylContact O-C 3.47Å; A36-G51 PolarHBondContact N-O 3.22Å; A36-G51 PolarHBondContact O-N 2.96Å; A36-V59 HydrophobicContact CB-CG1 3.96Å; A36-V59 HydrophobicContact CB-CG2 4.23Å; A36-V72 HydrophobicContact CB-CG1 4.08Å; A36-T73 WeakPolarHBondContact CA-O 3.5Å; A36-L74 HydrophobicContact CB-CD2 3.9Å; A36-L74 HydrophobicContact CB-CG 4.44Å
37	F	98.8	Very high	96.7	Very high	22 Å²	22	52.9 Å²	52.9	10%	0.096	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	129	166.5	177.1	-109.3	0	0	0	108.7	Q39 A48 T73 I79 W147	F37-Q39 HydrophobicContact CD1-CG 3.95Å; F37-Q39 HydrophobicContact CE1-CG 3.28Å; F37-Q39 HydrophobicContact CZ-CG 4Å; F37-A48 HydrophobicContact CE2-CB 3.94Å; F37-A48 HydrophobicContact CZ-CB 4.02Å; F37-T73 PolarHBondContact N-O 2.92Å; F37-T73 PolarHBondContact O-N 2.77Å; F37-I79 HydrophobicContact CB-CG2 3.98Å; F37-I79 HydrophobicContact CD1-CB 4.38Å; F37-I79 HydrophobicContact CD1-CG2 3.97Å; F37-I79 HydrophobicContact CD2-CG2 4.03Å; F37-I79 HydrophobicContact CE1-CB 4.43Å; F37-I79 HydrophobicContact CE1-CD1 4.21Å; F37-I79 HydrophobicContact CE1-CG2 4.44Å; F37-I79 HydrophobicContact CE2-CD1 3.98Å; F37-I79 HydrophobicContact CG-CG2 3.73Å; F37-I79 HydrophobicContact CZ-CD1 3.76Å; F37-W147 HydrophobicContact CB-CE3 4.12Å; F37-W147 HydrophobicContact CB-CH2 4.44Å; F37-W147 HydrophobicContact CB-CZ3 4.03Å; F37-W147 HydrophobicContact CD2-CB 4.32Å; F37-W147 HydrophobicContact CD2-CD2 4.39Å; F37-W147 HydrophobicContact CD2-CE3 4.17Å; F37-W147 HydrophobicContact CD2-CG 4.49Å; F37-W147 HydrophobicContact CE2-CB 4.48Å
38	L	98.7	Very high	96.6	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.8	-178.5	-52.1	-175.9	0	0	0	109.4	A36 I40 A48 C49 G50 V59 T61 I70 N71 V72 L112	A36-L38 HydrophobicContact CB-CD2 4.35Å; L38-I40 HydrophobicContact CB-CD1 4.21Å; L38-I40 HydrophobicContact CB-CG1 4.21Å; L38-A48 VanDerWaalsContact O-CA 3.24Å; L38-A48 WeakPolarHBondContact O-CA 3.22Å; L38-C49 HydrophobicContact CB-CB 4.23Å; L38-C49 WeakPolarHBondContact CB-O 3.41Å; L38-C49 HydrophobicContact CD1-CB 4.15Å; L38-C49 PolarHBondContact N-O 2.72Å; L38-C49 PolarHBondContact O-N 2.89Å; L38-C49 VanDerWaalsContact O-N 3.11Å; L38-G50 VanDerWaalsContact CD1-O 3.29Å; L38-G50 WeakPolarHBondContact CD1-O 3.41Å; L38-V59 HydrophobicContact CD2-CG1 4.39Å; L38-T61 HydrophobicContact CD1-CG2 3.84Å; L38-T61 WeakPolarHBondContact CD1-OG1 3.38Å; L38-I70 HydrophobicContact CB-CG2 4.37Å; L38-I70 HydrophobicContact CD2-CG2 4.4Å; L38-N71 WeakPolarHBondContact CA-O 3.26Å; L38-V72 HydrophobicContact CD2-CB 4.38Å; L38-V72 HydrophobicContact CD2-CG1 4.43Å; L38-V72 HydrophobicContact CD2-CG2 3.72Å; L38-L112 HydrophobicContact CD1-CD1 3.94Å; L38-L112 HydrophobicContact CD2-CD1 3.94Å
39	Q	98.1	Very high	96.6	Very high	70 Å²	70	44.9 Å²	44.9	33%	0.327	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.5	166	-63.6	177	-72.2	0	0	108	F37 L46 I70 N71	F37-Q39 HydrophobicContact CD1-CG 3.95Å; F37-Q39 HydrophobicContact CE1-CG 3.28Å; F37-Q39 HydrophobicContact CZ-CG 4Å; Q39-L46 HydrophobicContact CB-CD1 4.38Å; Q39-I70 WeakPolarHBondContact O-CA 3.4Å; Q39-N71 HydrophobicContact CB-CB 4.36Å; Q39-N71 PolarHBondContact N-O 2.74Å; Q39-N71 PolarHBondContact O-N 2.98Å
40	I	97.9	Very high	96.6	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	123.8	-166.9	-58.6	153.5	0	0	0	108.5	L38 T42 G47 C49 C65 S69 I70	L38-I40 HydrophobicContact CB-CD1 4.21Å; L38-I40 HydrophobicContact CB-CG1 4.21Å; I40-T42 HydrophobicContact CG2-CG2 3.95Å; I40-G47 PolarHBondContact N-O 2.82Å; I40-G47 PolarHBondContact O-N 3.16Å; I40-C49 HydrophobicContact CD1-CB 3.78Å; I40-C65 HydrophobicContact CD1-CB 3.81Å; I40-C65 WeakPolarHBondContact CD1-O 3.23Å; I40-S69 WeakPolarHBondContact CA-O 3.36Å; I40-I70 HydrophobicContact CG1-CG1 4.23Å; I40-I70 HydrophobicContact CG1-CG2 4.23Å; I40-I70 HydrophobicContact CG2-CG1 4.28Å
41	Q	97.1	Very high	96.6	Very high	86 Å²	86	38.9 Å²	38.9	40%	0.402	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	119.5	171.7	-172	64.3	51.4	0	0	109.5	G45 G67 S68 S69	Q41-G45 PolarHBondContact NE2-O 2.92Å; Q41-G67 CarbonylContact O-C 3.54Å; Q41-G67 WeakPolarHBondContact O-CA 3.21Å; Q41-S68 PolarHBondContact O-N 3.38Å; Q41-S68 PolarHBondContact O-OG 3.12Å; Q41-S69 PolarHBondContact N-O 3.37Å
42	T	93.3	Very high	96.6	Very high	32 Å²	32	36.6 Å²	36.6	20%	0.196	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	168.2	173.4	81.4	0	0	0	0	110	I40 E44 G45	I40-T42 HydrophobicContact CG2-CG2 3.95Å; T42-E44 VanDerWaalsContact CB-OE2 3.26Å; T42-E44 WeakPolarHBondContact CB-OE2 3.15Å; T42-E44 PolarHBondContact O-N 2.97Å; T42-E44 PolarHBondContact OG1-N 2.95Å; T42-E44 PolarHBondContact OG1-OE2 3.42Å; T42-G45 PolarHBondContact N-O 3.49Å; T42-G45 PolarHBondContact O-N 2.76Å; T42-G45 PolarHBondContact OG1-O 2.92Å
43	P	90.4	Very high	96.6	Very high	128 Å²	128	35.7 Å²	35.7	83%	0.831	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-29.6	172.6	-24.7	35.6	0	0	0	113.5	G45	P43-G45 VanDerWaalsContact C-N 3.33Å
44	E	89.7	Confident	96.6	Very high	163 Å²	163	36.2 Å²	36.2	76%	0.762	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-4.8	-178.7	-51.9	72	-153.1	0	0	113.1	T42	T42-E44 VanDerWaalsContact CB-OE2 3.26Å; T42-E44 WeakPolarHBondContact CB-OE2 3.15Å; T42-E44 PolarHBondContact O-N 2.97Å; T42-E44 PolarHBondContact OG1-N 2.95Å; T42-E44 PolarHBondContact OG1-OE2 3.42Å
45	G	93.1	Very high	96.6	Very high	27 Å²	27	37.5 Å²	37.5	28%	0.278	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	126.4	-149.9	178.6	0	0	0	0	0	113.2	Q41 T42 P43	Q41-G45 PolarHBondContact NE2-O 2.92Å; T42-G45 PolarHBondContact N-O 3.49Å; T42-G45 PolarHBondContact O-N 2.76Å; T42-G45 PolarHBondContact OG1-O 2.92Å; P43-G45 VanDerWaalsContact C-N 3.33Å
46	L	93.8	Very high	96.5	Very high	115 Å²	115	39.5 Å²	39.5	60%	0.602	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	109.6	-177.2	-167.8	70.4	0	0	0	110.9	Q39	Q39-L46 HydrophobicContact CB-CD1 4.38Å
47	G	93.9	Very high	96.5	Very high	26 Å²	26	39.9 Å²	39.9	27%	0.268	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	165.8	171.2	0	0	0	0	0	113	I40	I40-G47 PolarHBondContact N-O 2.82Å; I40-G47 PolarHBondContact O-N 3.16Å
48	A	95.9	Very high	96.5	Very high	25 Å²	25	38.8 Å²	38.8	21%	0.207	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	140.2	173.3	0	0	0	0	0	111.7	F37 L38	F37-A48 HydrophobicContact CE2-CB 3.94Å; F37-A48 HydrophobicContact CZ-CB 4.02Å; L38-A48 VanDerWaalsContact O-CA 3.24Å; L38-A48 WeakPolarHBondContact O-CA 3.22Å
49	C	98.4	Very high	96.5	Very high	12 Å²	12	38.8 Å²	38.8	8%	0.081	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	165.9	173.5	-78.9	0	0	0	0	110.8	L38 I40 C65 S201	L38-C49 HydrophobicContact CB-CB 4.23Å; L38-C49 WeakPolarHBondContact CB-O 3.41Å; L38-C49 HydrophobicContact CD1-CB 4.15Å; L38-C49 PolarHBondContact N-O 2.72Å; L38-C49 PolarHBondContact O-N 2.89Å; L38-C49 VanDerWaalsContact O-N 3.11Å; I40-C49 HydrophobicContact CD1-CB 3.78Å; C49-C65 HydrophobicContact CB-CB 3.7Å; C49-C65 WeakPolarHBondContact CB-SG 3.43Å; C49-C65 WeakPolarHBondContact SG-CB 3.42Å; C49-C65 CovalentContact SG-SG 2.04Å; C49-C65 PolarHBondContact SG-SG 3.36Å; C49-S201 WeakPolarHBondContact CB-O 3.39Å
50	G	98.6	Very high	96.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	166.6	160.1	0	0	0	0	0	112.3	A36 L38 T61 G199 S201 G202	A36-G50 CarbonylContact O-C 3.47Å; L38-G50 VanDerWaalsContact CD1-O 3.29Å; L38-G50 WeakPolarHBondContact CD1-O 3.41Å; G50-T61 PolarHBondContact O-OG1 3.22Å; G50-G199 PolarHBondContact N-O 2.82Å; G50-S201 WeakPolarHBondContact CA-O 3.38Å; G50-S201 PolarHBondContact N-O 3.18Å; G50-G202 CarbonylContact O-C 3.54Å; G50-G202 WeakPolarHBondContact O-CA 3.48Å
51	G	98.8	Very high	96.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	178.5	168.7	0	0	0	0	0	109	A36 M60 G202	A36-G51 PolarHBondContact N-O 3.22Å; A36-G51 PolarHBondContact O-N 2.96Å; G51-M60 CarbonylContact C-O 3.49Å; G51-M60 VanDerWaalsContact CA-O 3.26Å; G51-M60 WeakPolarHBondContact CA-O 3.35Å; G51-G202 WeakPolarHBondContact CA-O 3.23Å
52	F	98.9	Very high	96.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	141.4	175.1	53.1	-82.4	0	0	0	112.9	Y34 V54 V59 M60 V127 G202 P204 A211 I214 I231	Y34-F52 HydrophobicContact CD2-CB 4.12Å; Y34-F52 CarbonylContact O-C 3.53Å; Y34-F52 WeakPolarHBondContact O-CA 3.22Å; F52-V54 HydrophobicContact CD2-CG1 3.65Å; F52-V54 HydrophobicContact CE2-CG1 3.66Å; F52-V54 PolarHBondContact O-N 3.42Å; F52-V59 CarbonylContact O-C 3.57Å; F52-V59 WeakPolarHBondContact O-CA 3.33Å; F52-M60 HydrophobicContact CD2-CB 4.16Å; F52-M60 HydrophobicContact CE1-CB 4.24Å; F52-M60 HydrophobicContact CE1-CG 4.28Å; F52-M60 HydrophobicContact CE2-CB 3.68Å; F52-M60 HydrophobicContact CE2-CG 4.01Å; F52-M60 HydrophobicContact CE2-SD 3.64Å; F52-M60 HydrophobicContact CZ-CB 3.72Å; F52-M60 HydrophobicContact CZ-CG 3.65Å; F52-M60 HydrophobicContact CZ-SD 3.43Å; F52-M60 WeakPolarHBondContact CZ-SD 3.49Å; F52-M60 PolarHBondContact N-O 2.9Å; F52-M60 PolarHBondContact O-N 3.36Å; F52-V127 HydrophobicContact CD2-CG1 3.54Å; F52-V127 HydrophobicContact CE2-CG1 4.2Å; F52-V127 HydrophobicContact CG-CG1 4.41Å; F52-G202 WeakPolarHBondContact CD1-O 3.23Å; F52-P204 HydrophobicContact CB-CB 4.25Å; F52-P204 HydrophobicContact CB-CG 3.94Å; F52-P204 HydrophobicContact CD1-CB 3.51Å; F52-P204 HydrophobicContact CD1-CG 3.89Å; F52-P204 HydrophobicContact CD2-CB 4.33Å; F52-P204 HydrophobicContact CE1-CB 3.85Å; F52-P204 HydrophobicContact CG-CB 3.77Å; F52-P204 HydrophobicContact CG-CG 4.01Å; F52-P204 HydrophobicContact CZ-CB 4.38Å; F52-A211 HydrophobicContact CD2-CB 4.34Å; F52-A211 HydrophobicContact CE2-CB 3.93Å; F52-A211 HydrophobicContact CZ-CB 4.48Å; F52-I214 HydrophobicContact CE1-CG1 4Å; F52-I214 HydrophobicContact CE1-CG2 4.44Å; F52-I214 HydrophobicContact CZ-CD1 4.33Å; F52-I214 HydrophobicContact CZ-CG1 3.92Å; F52-I231 HydrophobicContact CE2-CD1 4.17Å; F52-I231 HydrophobicContact CZ-CD1 3.68Å
53	L	98.9	Very high	96.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.3	-179.8	-165.5	73.3	0	0	0	110.3	Y34 R55 V59 L74 L114 I118 V124 P126 V127	Y34-L53 PolarHBondContact O-N 2.94Å; L53-R55 WeakPolarHBondContact CD1-O 3.08Å; L53-R55 WeakPolarHBondContact CG-O 3.43Å; L53-V59 HydrophobicContact CD1-CG2 3.87Å; L53-L74 HydrophobicContact CB-CD2 3.97Å; L53-L74 HydrophobicContact CD1-CD1 4.13Å; L53-L74 HydrophobicContact CD1-CD2 4.25Å; L53-L74 HydrophobicContact CD2-CD2 4.5Å; L53-L74 HydrophobicContact CG-CD2 4.48Å; L53-L114 HydrophobicContact CD1-CD1 4.26Å; L53-I118 HydrophobicContact CD1-CG1 4.03Å; L53-I118 HydrophobicContact CD2-CD1 3.77Å; L53-I118 HydrophobicContact CD2-CG1 3.73Å; L53-V124 HydrophobicContact CD2-CG1 4.04Å; L53-P126 HydrophobicContact CD2-CG 3.98Å; L53-P126 HydrophobicContact CG-CG 4.23Å; L53-P126 CarbonylContact O-C 3.54Å; L53-P126 VanDerWaalsContact O-CA 3.22Å; L53-P126 WeakPolarHBondContact O-CA 3.45Å; L53-V127 PolarHBondContact O-N 2.86Å
54	V	98.6	Very high	97.3	Very high	16 Å²	16	26.9 Å²	26.9	10%	0.097	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-17.6	178.3	-62.8	0	0	0	0	112.6	F52 F58 M60 L111 V127 L129 M242	F52-V54 HydrophobicContact CD2-CG1 3.65Å; F52-V54 HydrophobicContact CE2-CG1 3.66Å; F52-V54 PolarHBondContact O-N 3.42Å; V54-F58 HydrophobicContact CG2-CB 3.89Å; V54-F58 WeakPolarHBondContact CG2-O 3.26Å; V54-F58 PolarHBondContact N-O 3.47Å; V54-M60 HydrophobicContact CG1-CB 3.84Å; V54-M60 HydrophobicContact CG1-CE 4.09Å; V54-M60 HydrophobicContact CG2-CB 4.37Å; V54-L111 HydrophobicContact CG2-CD2 4.32Å; V54-V127 HydrophobicContact CG1-CG1 4.43Å; V54-L129 HydrophobicContact CB-CD1 4.45Å; V54-L129 HydrophobicContact CB-CD2 4.44Å; V54-L129 HydrophobicContact CG1-CD2 3.82Å; V54-L129 HydrophobicContact CG1-CG 4.41Å; V54-M242 HydrophobicContact CG2-CE 4.25Å; V54-M242 HydrophobicContact CG2-SD 4.21Å
55	R	97.9	Very high	97.7	Very high	57 Å²	57	19.2 Å²	19.2	22%	0.215	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	164.7	168.1	-163.6	168.3	68.9	-175	6.5	108.5	L53 D57 F58 M242	L53-R55 WeakPolarHBondContact CD1-O 3.08Å; L53-R55 WeakPolarHBondContact CG-O 3.43Å; R55-D57 WeakPolarHBondContact CG-OD1 3.26Å; R55-D57 IonicContact CZ-OD1 3.88Å; R55-D57 IonicContact CZ-OD2 2.75Å; R55-D57 IonicContact NE-OD1 2.66Å; R55-D57 PolarHBondContact NE-OD1 2.9Å; R55-D57 IonicContact NE-OD2 3.96Å; R55-D57 IonicContact NH2-OD1 3.77Å; R55-D57 PolarHBondContact NH2-OD1 3.41Å; R55-D57 IonicContact NH2-OD2 3.24Å; R55-D57 PolarHBondContact NH2-OD2 2.97Å; R55-D57 PolarHBondContact O-N 3.25Å; R55-F58 HydrophobicContact CB-CB 4.23Å; R55-F58 PolarHBondContact N-O 3.24Å; R55-F58 PolarHBondContact O-N 3.2Å; R55-M242 HydrophobicContact CB-CE 3.53Å; R55-M242 HydrophobicContact CG-CE 4.24Å; R55-M242 PolarHBondContact NH1-O 3.01Å; R55-M242 PolarHBondContact NH2-O 2.87Å
56	E	97.7	Very high	97.9	Very high	46 Å²	46	25.3 Å²	25.3	22%	0.215	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.6	-176.4	-61.6	89	159.1	0	0	114.3	R117 I118 K120	E56-R117 HydrophobicContact CB-CB 4.44Å; E56-R117 CarbonylContact O-C 3.43Å; E56-R117 WeakPolarHBondContact O-CA 3.39Å; E56-I118 HydrophobicContact CB-CD1 4.15Å; E56-I118 HydrophobicContact CB-CG1 4.39Å; E56-I118 HydrophobicContact CG-CD1 4.11Å; E56-I118 WeakPolarHBondContact O-CG1 3.15Å; E56-I118 PolarHBondContact O-N 2.95Å; E56-K120 HydrophobicContact CG-CD 3.73Å; E56-K120 HydrophobicContact CG-CG 3.66Å; E56-K120 WeakPolarHBondContact OE1-CD 3.41Å; E56-K120 WeakPolarHBondContact OE1-CE 3.44Å; E56-K120 IonicContact OE1-NZ 2.63Å; E56-K120 PolarHBondContact OE1-NZ 3.04Å
57	D	98	Very high	98	Very high	7 Å²	7	20.3 Å²	20.3	4%	0.037	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	5.1	178.9	58.9	-27.4	0	0	0	113	R55 Q113 L114 R117	R55-D57 WeakPolarHBondContact CG-OD1 3.26Å; R55-D57 IonicContact CZ-OD1 3.88Å; R55-D57 IonicContact CZ-OD2 2.75Å; R55-D57 IonicContact NE-OD1 2.66Å; R55-D57 PolarHBondContact NE-OD1 2.9Å; R55-D57 IonicContact NE-OD2 3.96Å; R55-D57 IonicContact NH2-OD1 3.77Å; R55-D57 PolarHBondContact NH2-OD1 3.41Å; R55-D57 IonicContact NH2-OD2 3.24Å; R55-D57 PolarHBondContact NH2-OD2 2.97Å; R55-D57 PolarHBondContact O-N 3.25Å; D57-Q113 WeakPolarHBondContact O-CA 3.46Å; D57-L114 PolarHBondContact O-N 3.42Å; D57-R117 HydrophobicContact CB-CG 4.1Å
58	F	98.6	Very high	98	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	125.2	-178.2	-82.6	-87.1	0	0	0	113.2	V54 R55 I95 L111 L112 Q113 M242 L245	V54-F58 HydrophobicContact CG2-CB 3.89Å; V54-F58 WeakPolarHBondContact CG2-O 3.26Å; V54-F58 PolarHBondContact N-O 3.47Å; R55-F58 HydrophobicContact CB-CB 4.23Å; R55-F58 PolarHBondContact N-O 3.24Å; R55-F58 PolarHBondContact O-N 3.2Å; F58-I95 HydrophobicContact CE1-CD1 4.17Å; F58-L111 HydrophobicContact CD1-CB 4.08Å; F58-L111 HydrophobicContact CD1-CD2 4.38Å; F58-L111 HydrophobicContact CE1-CB 4.3Å; F58-L112 WeakPolarHBondContact CA-O 3.29Å; F58-Q113 HydrophobicContact CD1-CB 4.45Å; F58-Q113 HydrophobicContact CE1-CB 3.78Å; F58-Q113 HydrophobicContact CE1-CG 4.31Å; F58-Q113 HydrophobicContact CE2-CG 4.18Å; F58-Q113 HydrophobicContact CZ-CB 3.81Å; F58-Q113 HydrophobicContact CZ-CG 3.84Å; F58-M242 HydrophobicContact CB-CE 4.25Å; F58-M242 HydrophobicContact CD1-CG 4.15Å; F58-M242 HydrophobicContact CD2-CE 4.49Å; F58-M242 HydrophobicContact CD2-CG 4.19Å; F58-M242 HydrophobicContact CE1-CG 4.4Å; F58-M242 HydrophobicContact CE2-CG 4.49Å; F58-M242 HydrophobicContact CG-CE 4.46Å; F58-M242 HydrophobicContact CG-CG 4.04Å; F58-L245 HydrophobicContact CZ-CB 3.93Å; F58-L245 HydrophobicContact CZ-CD1 4.26Å
59	V	98.9	Very high	98.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	141.8	164.8	168.6	0	0	0	0	109	A36 L38 F52 L53 V72 L112 L114	A36-V59 HydrophobicContact CB-CG1 3.96Å; A36-V59 HydrophobicContact CB-CG2 4.23Å; L38-V59 HydrophobicContact CD2-CG1 4.39Å; F52-V59 CarbonylContact O-C 3.57Å; F52-V59 WeakPolarHBondContact O-CA 3.33Å; L53-V59 HydrophobicContact CD1-CG2 3.87Å; V59-V72 HydrophobicContact CG2-CG1 4.04Å; V59-L112 HydrophobicContact CB-CB 4.23Å; V59-L112 HydrophobicContact CG1-CD1 4.24Å; V59-L112 PolarHBondContact N-O 3.28Å; V59-L112 PolarHBondContact O-N 2.99Å; V59-L114 HydrophobicContact CB-CD2 4.48Å; V59-L114 HydrophobicContact CG2-CD1 4.28Å; V59-L114 HydrophobicContact CG2-CD2 4.09Å
60	M	98.9	Very high	98.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	141.7	171.6	-171.9	178.8	-67.6	0	0	109.5	G51 F52 V54 I109 M110 L111 L129 I214 I231 I238	G51-M60 CarbonylContact C-O 3.49Å; G51-M60 VanDerWaalsContact CA-O 3.26Å; G51-M60 WeakPolarHBondContact CA-O 3.35Å; F52-M60 HydrophobicContact CD2-CB 4.16Å; F52-M60 HydrophobicContact CE1-CB 4.24Å; F52-M60 HydrophobicContact CE1-CG 4.28Å; F52-M60 HydrophobicContact CE2-CB 3.68Å; F52-M60 HydrophobicContact CE2-CG 4.01Å; F52-M60 HydrophobicContact CE2-SD 3.64Å; F52-M60 HydrophobicContact CZ-CB 3.72Å; F52-M60 HydrophobicContact CZ-CG 3.65Å; F52-M60 HydrophobicContact CZ-SD 3.43Å; F52-M60 WeakPolarHBondContact CZ-SD 3.49Å; F52-M60 PolarHBondContact N-O 2.9Å; F52-M60 PolarHBondContact O-N 3.36Å; V54-M60 HydrophobicContact CG1-CB 3.84Å; V54-M60 HydrophobicContact CG1-CE 4.09Å; V54-M60 HydrophobicContact CG2-CB 4.37Å; M60-I109 HydrophobicContact CE-CD1 4.39Å; M60-I109 HydrophobicContact CG-CD1 4.34Å; M60-I109 HydrophobicContact CG-CG1 4.28Å; M60-I109 HydrophobicContact SD-CD1 3.93Å; M60-I109 HydrophobicContact SD-CG1 4.5Å; M60-M110 WeakPolarHBondContact CA-O 3.36Å; M60-L111 HydrophobicContact CB-CD2 4.13Å; M60-L111 HydrophobicContact CE-CD2 3.9Å; M60-L111 HydrophobicContact CG-CD2 4.28Å; M60-L129 HydrophobicContact CE-CD1 4.48Å; M60-L129 HydrophobicContact CE-CD2 3.99Å; M60-I214 HydrophobicContact CG-CD1 3.8Å; M60-I214 HydrophobicContact SD-CD1 3.79Å; M60-I214 HydrophobicContact SD-CG1 4.47Å; M60-I231 HydrophobicContact SD-CD1 4.14Å; M60-I231 HydrophobicContact SD-CG1 4.21Å; M60-I231 HydrophobicContact SD-CG2 4.4Å; M60-I238 HydrophobicContact CE-CD1 3.5Å; M60-I238 VanDerWaalsContact CE-CD1 3.5Å; M60-I238 HydrophobicContact CE-CG1 3.8Å; M60-I238 HydrophobicContact CE-CG2 3.91Å; M60-I238 HydrophobicContact SD-CD1 4.42Å
61	T	98.9	Very high	98.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	-174.5	179.7	-172.9	0	0	0	0	109.8	L38 G50 M110 L112 G202	L38-T61 HydrophobicContact CD1-CG2 3.84Å; L38-T61 WeakPolarHBondContact CD1-OG1 3.38Å; G50-T61 PolarHBondContact O-OG1 3.22Å; T61-M110 HydrophobicContact CG2-CB 4.21Å; T61-M110 HydrophobicContact CG2-CE 3.69Å; T61-M110 HydrophobicContact CG2-CG 4.41Å; T61-M110 PolarHBondContact N-O 2.96Å; T61-M110 PolarHBondContact O-N 2.95Å; T61-L112 HydrophobicContact CG2-CD1 3.88Å; T61-L112 HydrophobicContact CG2-CD2 4.47Å; T61-L112 HydrophobicContact CG2-CG 3.99Å; T61-G202 WeakPolarHBondContact OG1-CA 3.32Å
62	A	98.8	Very high	98.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.148	C	C	.	.			trans	-79.8	147	173.8	0	0	0	0	0	110.4	H64 C65 M110 G202 I214	A62-H64 VanDerWaalsContact C-N 3.34Å; A62-C65 WeakPolarHBondContact O-CB 3.39Å; A62-C65 PolarHBondContact O-N 3.43Å; A62-M110 WeakPolarHBondContact O-CE 3.08Å; A62-G202 VanDerWaalsContact N-CA 3.34Å; A62-I214 HydrophobicContact CB-CG2 4.27Å
63	A	98.8	Very high	98.1	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.008	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-68.7	-32.6	179.1	0	0	0	0	0	112.6	C65 W66 P96 Y100 D108 M110	A63-C65 PolarHBondContact O-N 2.98Å; A63-C65 VanDerWaalsContact O-N 3.11Å; A63-W66 WeakPolarHBondContact O-CB 3.43Å; A63-W66 PolarHBondContact O-N 2.81Å; A63-W66 VanDerWaalsContact O-N 3.14Å; A63-P96 HydrophobicContact CB-CB 4.01Å; A63-Y100 HydrophobicContact CB-CD1 3.79Å; A63-Y100 HydrophobicContact CB-CD2 3.58Å; A63-Y100 HydrophobicContact CB-CE1 4.1Å; A63-Y100 HydrophobicContact CB-CE2 3.91Å; A63-Y100 HydrophobicContact CB-CG 3.52Å; A63-D108 WeakPolarHBondContact CA-OD1 3.34Å; A63-D108 WeakPolarHBondContact CB-OD1 3.37Å; A63-D108 PolarHBondContact N-OD1 2.79Å; A63-M110 HydrophobicContact CB-CB 4.26Å
64	H	97.8	Very high	98.1	Very high	69 Å²	69	28.7 Å²	28.7	32%	0.319	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-66.1	-10.6	174.9	75.2	-102.3	0	0	0	113.7	A62 W66 Y100 D108 S201 S216	A62-H64 VanDerWaalsContact C-N 3.34Å; H64-W66 PolarHBondContact O-N 2.94Å; H64-Y100 VanDerWaalsContact CB-OH 3.27Å; H64-Y100 WeakPolarHBondContact CB-OH 3.44Å; H64-D108 IonicContact CE1-OD2 2.6Å; H64-D108 PolarHBondContact CE1-OD2 3.02Å; H64-D108 IonicContact CG-OD1 3.89Å; H64-D108 IonicContact CG-OD2 3.74Å; H64-D108 PolarHBondContact N-OD1 2.85Å; H64-D108 VanDerWaalsContact ND1-CG 3.35Å; H64-D108 IonicContact ND1-OD1 2.74Å; H64-D108 PolarHBondContact ND1-OD1 2.81Å; H64-D108 IonicContact ND1-OD2 2.74Å; H64-D108 PolarHBondContact ND1-OD2 2.8Å; H64-S201 WeakPolarHBondContact NE2-CB 3.3Å; H64-S201 PolarHBondContact NE2-OG 2.74Å; H64-S216 PolarHBondContact CE1-O 2.95Å
65	C	98.2	Very high	98.1	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.02	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-82.7	17.9	172	-64	0	0	0	0	113	I40 C49 A62 A63 M110	I40-C65 HydrophobicContact CD1-CB 3.81Å; I40-C65 WeakPolarHBondContact CD1-O 3.23Å; C49-C65 HydrophobicContact CB-CB 3.7Å; C49-C65 WeakPolarHBondContact CB-SG 3.43Å; C49-C65 WeakPolarHBondContact SG-CB 3.42Å; C49-C65 CovalentContact SG-SG 2.04Å; C49-C65 PolarHBondContact SG-SG 3.36Å; A62-C65 WeakPolarHBondContact O-CB 3.39Å; A62-C65 PolarHBondContact O-N 3.43Å; A63-C65 PolarHBondContact O-N 2.98Å; A63-C65 VanDerWaalsContact O-N 3.11Å; C65-M110 HydrophobicContact CB-CE 4.48Å
66	W	97.5	Very high	98.1	Very high	155 Å²	155	25.7 Å²	25.7	59%	0.587	14%	0.139	S	C	*	.			trans	-73.6	150.8	176.5	-175.3	79.8	0	0	0	112	A63 H64 M110	A63-W66 WeakPolarHBondContact O-CB 3.43Å; A63-W66 PolarHBondContact O-N 2.81Å; A63-W66 VanDerWaalsContact O-N 3.14Å; H64-W66 PolarHBondContact O-N 2.94Å; W66-M110 HydrophobicContact CB-CE 4.17Å; W66-M110 HydrophobicContact CB-SD 4.22Å; W66-M110 HydrophobicContact CG-SD 4.49Å
67	G	95.8	Very high	98.1	Very high	9 Å²	9	24 Å²	24	9%	0.093	13%	0.131	C	C	.	.			trans	-166.4	176.7	176.5	0	0	0	0	0	111.3	Q41 S69	Q41-G67 CarbonylContact O-C 3.54Å; Q41-G67 WeakPolarHBondContact O-CA 3.21Å; G67-S69 VanDerWaalsContact C-N 3.3Å; G67-S69 PolarHBondContact O-N 3.22Å
68	S	94.9	Very high	98.1	Very high	100 Å²	100	24.7 Å²	24.7	70%	0.699	14%	0.135	S	C	*	.	S	Bend	trans	-68.7	-30.8	-175.6	60.8	0	0	0	0	112.8	Q41	Q41-S68 PolarHBondContact O-N 3.38Å; Q41-S68 PolarHBondContact O-OG 3.12Å
69	S	96.8	Very high	98.1	Very high	62 Å²	62	26.6 Å²	26.6	43%	0.434	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	141.6	174	-176.5	0	0	0	0	109.9	I40 Q41 G67	I40-S69 WeakPolarHBondContact CA-O 3.36Å; Q41-S69 PolarHBondContact N-O 3.37Å; G67-S69 VanDerWaalsContact C-N 3.3Å; G67-S69 PolarHBondContact O-N 3.22Å
70	I	98.5	Very high	97.9	Very high	5 Å²	5	33 Å²	33	3%	0.026	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.2	179.5	-54.3	176.8	0	0	0	108.9	L38 Q39 I40 V91 A94 M110 L112	L38-I70 HydrophobicContact CB-CG2 4.37Å; L38-I70 HydrophobicContact CD2-CG2 4.4Å; Q39-I70 WeakPolarHBondContact O-CA 3.4Å; I40-I70 HydrophobicContact CG1-CG1 4.23Å; I40-I70 HydrophobicContact CG1-CG2 4.23Å; I40-I70 HydrophobicContact CG2-CG1 4.28Å; I70-V91 HydrophobicContact CB-CB 4.14Å; I70-V91 HydrophobicContact CB-CG2 3.75Å; I70-V91 HydrophobicContact CG2-CG2 3.83Å; I70-V91 WeakPolarHBondContact O-CG2 3.23Å; I70-V91 PolarHBondContact O-N 2.95Å; I70-A94 HydrophobicContact CD1-CB 4.27Å; I70-M110 HydrophobicContact CD1-CE 4.26Å; I70-L112 HydrophobicContact CD1-CD2 3.84Å; I70-L112 HydrophobicContact CG2-CD1 4.12Å
71	N	98.3	Very high	97.8	Very high	65 Å²	65	41.2 Å²	41.2	35%	0.348	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132	170.7	-69.4	-24.4	0	0	0	109.4	L38 Q39 T90	L38-N71 WeakPolarHBondContact CA-O 3.26Å; Q39-N71 HydrophobicContact CB-CB 4.36Å; Q39-N71 PolarHBondContact N-O 2.74Å; Q39-N71 PolarHBondContact O-N 2.98Å; N71-T90 WeakPolarHBondContact OD1-CG2 3.41Å
72	V	98.7	Very high	97.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.4	-179.9	175.8	0	0	0	0	108.6	A36 L38 V59 L74 H88 V89 V91 L112 L114	A36-V72 HydrophobicContact CB-CG1 4.08Å; L38-V72 HydrophobicContact CD2-CB 4.38Å; L38-V72 HydrophobicContact CD2-CG1 4.43Å; L38-V72 HydrophobicContact CD2-CG2 3.72Å; V59-V72 HydrophobicContact CG2-CG1 4.04Å; V72-L74 HydrophobicContact CG1-CD1 4.07Å; V72-L74 HydrophobicContact CG1-CG 4Å; V72-H88 WeakPolarHBondContact O-CA 3.33Å; V72-V89 HydrophobicContact CB-CG1 3.84Å; V72-V89 WeakPolarHBondContact CB-O 3.09Å; V72-V89 HydrophobicContact CG1-CG1 4.08Å; V72-V89 PolarHBondContact N-O 2.81Å; V72-V89 PolarHBondContact O-N 3.2Å; V72-V91 HydrophobicContact CG2-CG2 3.75Å; V72-L112 HydrophobicContact CG2-CD1 4.42Å; V72-L114 HydrophobicContact CB-CD2 4.3Å; V72-L114 HydrophobicContact CG1-CD2 4.4Å; V72-L114 HydrophobicContact CG2-CD2 3.84Å
73	T	98.8	Very high	97.6	Very high	7 Å²	7	49.4 Å²	49.4	4%	0.043	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.1	169.6	-60.7	0	0	0	0	109.4	A36 F37 A76 Q86 Q87 H88	A36-T73 WeakPolarHBondContact CA-O 3.5Å; F37-T73 PolarHBondContact N-O 2.92Å; F37-T73 PolarHBondContact O-N 2.77Å; T73-A76 HydrophobicContact CG2-CB 4.01Å; T73-Q86 HydrophobicContact CG2-CB 4.34Å; T73-Q86 HydrophobicContact CG2-CG 4.07Å; T73-Q87 WeakPolarHBondContact CA-O 3.46Å; T73-H88 PolarHBondContact OG1-ND1 2.88Å
74	L	98.8	Very high	97.6	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	158.7	175.6	-70.1	149.5	0	0	0	110.3	A36 L53 V72 A76 Q86 Q87 I118 V124	A36-L74 HydrophobicContact CB-CD2 3.9Å; A36-L74 HydrophobicContact CB-CG 4.44Å; L53-L74 HydrophobicContact CB-CD2 3.97Å; L53-L74 HydrophobicContact CD1-CD1 4.13Å; L53-L74 HydrophobicContact CD1-CD2 4.25Å; L53-L74 HydrophobicContact CD2-CD2 4.5Å; L53-L74 HydrophobicContact CG-CD2 4.48Å; V72-L74 HydrophobicContact CG1-CD1 4.07Å; V72-L74 HydrophobicContact CG1-CG 4Å; L74-A76 PolarHBondContact O-N 2.9Å; L74-Q86 CarbonylContact O-C 3.55Å; L74-Q86 VanDerWaalsContact O-CA 3.28Å; L74-Q86 WeakPolarHBondContact O-CA 3.5Å; L74-Q87 PolarHBondContact N-O 2.87Å; L74-Q87 PolarHBondContact O-N 3.05Å; L74-I118 HydrophobicContact CD1-CB 4.27Å; L74-I118 HydrophobicContact CD1-CG1 4.32Å; L74-I118 HydrophobicContact CD1-CG2 3.56Å; L74-V124 HydrophobicContact CB-CG1 4.07Å; L74-V124 HydrophobicContact CB-CG2 4.12Å; L74-V124 HydrophobicContact CD1-CG1 4.4Å
75	G	98.6	Very high	97.6	Very high	4 Å²	4	59.7 Å²	59.7	4%	0.041	30%	0.295	C	S	.	.	S	Bend	trans	72	10	175.6	0	0	0	0	0	114.5	H30 S85	H30-G75 PolarHBondContact CE1-O 2.85Å; H30-G75 PolarHBondContact ND1-O 3.5Å; G75-S85 VanDerWaalsContact O-CB 3.31Å; G75-S85 WeakPolarHBondContact O-CB 3.39Å; G75-S85 PolarHBondContact O-OG 2.64Å
76	A	98.6	Very high	97.6	Very high	6 Å²	6	60.8 Å²	60.8	5%	0.05	30%	0.299	C	S	.	.			trans	-79	144.7	174.8	0	0	0	0	0	111.6	T73 L74 I79 E83 Q86 W147	T73-A76 HydrophobicContact CG2-CB 4.01Å; L74-A76 PolarHBondContact O-N 2.9Å; A76-I79 HydrophobicContact CB-CG2 4.25Å; A76-E83 WeakPolarHBondContact CA-OE2 3.5Å; A76-Q86 HydrophobicContact CB-CG 3.87Å; A76-W147 HydrophobicContact CB-CZ2 4.31Å
77	H	98.6	Very high	97.7	Very high	11 Å²	11	55.1 Å²	55.1	5%	0.051	28%	0.28	C	S	.	.	S	Bend	trans	-107.1	-55.8	155	-178.6	59.8	0	0	0	109.3	E26 A27 P29 E83 W147 V158 L159	E26-H77 IonicContact OE1-CD2 2.69Å; E26-H77 IonicContact OE1-CE1 3.42Å; E26-H77 PolarHBondContact OE1-CE1 2.88Å; E26-H77 IonicContact OE1-NE2 3.48Å; E26-H77 PolarHBondContact OE1-NE2 2.95Å; A27-H77 PolarHBondContact O-CE1 2.92Å; P29-H77 HydrophobicContact CB-CB 4.19Å; H77-E83 PolarHBondContact N-OE2 3.16Å; H77-W147 PolarHBondContact O-NE1 2.69Å; H77-V158 CarbonylContact O-C 3.6Å; H77-V158 VanDerWaalsContact O-CA 3.3Å; H77-V158 WeakPolarHBondContact O-CA 3.37Å; H77-L159 PolarHBondContact O-N 3.16Å
78	N	98.3	Very high	97.8	Very high	22 Å²	22	60.6 Å²	60.6	12%	0.118	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-99.2	107.9	173.4	-169.5	-39.6	0	0	0	111.5	Q80 R81 E83 Q86 N157 V158	N78-Q80 PolarHBondContact O-N 3.08Å; N78-Q80 PolarHBondContact OD1-N 2.84Å; N78-R81 HydrophobicContact CB-CB 4.19Å; N78-R81 HydrophobicContact CB-CG 4.3Å; N78-R81 PolarHBondContact O-N 3.01Å; N78-R81 PolarHBondContact OD1-N 3.23Å; N78-E83 PolarHBondContact N-OE1 3.02Å; N78-E83 PolarHBondContact N-OE2 3.01Å; N78-Q86 PolarHBondContact O-NE2 3.24Å; N78-Q86 VanDerWaalsContact O-NE2 3.16Å; N78-N157 CarbonylContact C-O 3.58Å; N78-N157 VanDerWaalsContact CA-O 3.26Å; N78-N157 WeakPolarHBondContact CA-O 3.03Å; N78-V158 HydrophobicContact CB-CG1 3.91Å
79	I	96.9	Very high	98	Very high	39 Å²	39	56.4 Å²	56.4	20%	0.2	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-12.5	-177.4	54.4	136.8	0	0	0	114.7	F37 A76 W147 N157	F37-I79 HydrophobicContact CB-CG2 3.98Å; F37-I79 HydrophobicContact CD1-CB 4.38Å; F37-I79 HydrophobicContact CD1-CG2 3.97Å; F37-I79 HydrophobicContact CD2-CG2 4.03Å; F37-I79 HydrophobicContact CE1-CB 4.43Å; F37-I79 HydrophobicContact CE1-CD1 4.21Å; F37-I79 HydrophobicContact CE1-CG2 4.44Å; F37-I79 HydrophobicContact CE2-CD1 3.98Å; F37-I79 HydrophobicContact CG-CG2 3.73Å; F37-I79 HydrophobicContact CZ-CD1 3.76Å; A76-I79 HydrophobicContact CB-CG2 4.25Å; I79-W147 HydrophobicContact CG2-CD2 4.04Å; I79-W147 HydrophobicContact CG2-CG 4.01Å; I79-W147 HydrophobicContact CG2-CZ2 4.33Å; I79-N157 WeakPolarHBondContact CG1-O 3.49Å; I79-N157 PolarHBondContact N-O 3.49Å
80	Q	95.5	Very high	98	Very high	136 Å²	136	56.1 Å²	56.1	64%	0.636	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-8.7	176.7	-69.2	-165.3	-13.9	0	0	113.1	N78 N157	N78-Q80 PolarHBondContact O-N 3.08Å; N78-Q80 PolarHBondContact OD1-N 2.84Å; Q80-N157 HydrophobicContact CB-CB 4.42Å; Q80-N157 VanDerWaalsContact CD-ND2 3.28Å; Q80-N157 HydrophobicContact CG-CB 4.14Å; Q80-N157 PolarHBondContact NE2-OD1 2.99Å; Q80-N157 VanDerWaalsContact NE2-OD1 3.08Å; Q80-N157 VanDerWaalsContact OE1-CG 3.31Å; Q80-N157 PolarHBondContact OE1-ND2 2.84Å; Q80-N157 PolarHBondContact OE1-OD1 2.86Å
81	R	96.5	Very high	98	Very high	171 Å²	171	56.9 Å²	56.9	65%	0.645	27%	0.273	S	S	*	.	S	Bend	trans	-105.2	140.8	178.4	-68.1	-172.4	178.2	-152.3	0.1	110.5	N78 E83 Q86	N78-R81 HydrophobicContact CB-CB 4.19Å; N78-R81 HydrophobicContact CB-CG 4.3Å; N78-R81 PolarHBondContact O-N 3.01Å; N78-R81 PolarHBondContact OD1-N 3.23Å; R81-E83 HydrophobicContact CB-CG 4.38Å; R81-E83 PolarHBondContact O-N 3.02Å; R81-Q86 PolarHBondContact O-NE2 2.91Å; R81-Q86 PolarHBondContact O-OE1 3.49Å
82	P	96.4	Very high	98	Very high	129 Å²	129	58 Å²	58	84%	0.838	28%	0.279	S	S	*	.			trans	-73.3	94.2	170.4	30.4	-32.9	0	0	0	109.2
83	E	98.3	Very high	97.9	Very high	43 Å²	43	63.5 Å²	63.5	20%	0.201	30%	0.3	C	S	.	.			trans	-91.6	134.4	177.5	-60.4	168.5	145.9	0	0	109.9	A76 H77 N78 R81 S85 Q86	A76-E83 WeakPolarHBondContact CA-OE2 3.5Å; H77-E83 PolarHBondContact N-OE2 3.16Å; N78-E83 PolarHBondContact N-OE1 3.02Å; N78-E83 PolarHBondContact N-OE2 3.01Å; R81-E83 HydrophobicContact CB-CG 4.38Å; R81-E83 PolarHBondContact O-N 3.02Å; E83-S85 PolarHBondContact O-N 2.86Å; E83-Q86 HydrophobicContact CB-CG 3.99Å; E83-Q86 WeakPolarHBondContact O-CB 3.32Å; E83-Q86 PolarHBondContact O-N 2.97Å; E83-Q86 PolarHBondContact OE2-NE2 3.05Å
84	R	97.9	Very high	97.9	Very high	261 Å²	261	64.5 Å²	64.5	99%	0.985	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.6	179.2	-65.4	-177.5	179.4	-178.5	-0.5	113.8	Q86	R84-Q86 VanDerWaalsContact C-N 3.32Å
85	S	98.1	Very high	97.9	Very high	25 Å²	25	65.8 Å²	65.8	18%	0.175	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-18.2	176.4	51.4	0	0	0	0	113.8	H30 G75 E83	H30-S85 PolarHBondContact CE1-OG 2.82Å; H30-S85 VanDerWaalsContact CE1-OG 3.26Å; G75-S85 VanDerWaalsContact O-CB 3.31Å; G75-S85 WeakPolarHBondContact O-CB 3.39Å; G75-S85 PolarHBondContact O-OG 2.64Å; E83-S85 PolarHBondContact O-N 2.86Å
86	Q	98.6	Very high	97.9	Very high	26 Å²	26	67.9 Å²	67.9	12%	0.121	33%	0.328	C	S	.	.			trans	-70.2	138.3	-172.7	-75	169.1	10.7	0	0	111.6	T73 L74 A76 N78 R81 E83 R84 H88	T73-Q86 HydrophobicContact CG2-CB 4.34Å; T73-Q86 HydrophobicContact CG2-CG 4.07Å; L74-Q86 CarbonylContact O-C 3.55Å; L74-Q86 VanDerWaalsContact O-CA 3.28Å; L74-Q86 WeakPolarHBondContact O-CA 3.5Å; A76-Q86 HydrophobicContact CB-CG 3.87Å; N78-Q86 PolarHBondContact O-NE2 3.24Å; N78-Q86 VanDerWaalsContact O-NE2 3.16Å; R81-Q86 PolarHBondContact O-NE2 2.91Å; R81-Q86 PolarHBondContact O-OE1 3.49Å; E83-Q86 HydrophobicContact CB-CG 3.99Å; E83-Q86 WeakPolarHBondContact O-CB 3.32Å; E83-Q86 PolarHBondContact O-N 2.97Å; E83-Q86 PolarHBondContact OE2-NE2 3.05Å; R84-Q86 VanDerWaalsContact C-N 3.32Å; Q86-H88 PolarHBondContact OE1-CE1 2.94Å; Q86-H88 PolarHBondContact OE1-NE2 2.81Å
87	Q	98.6	Very high	97.9	Very high	36 Å²	36	68.6 Å²	68.6	17%	0.168	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	114.7	168.9	-68.4	-179.4	57.4	0	0	107.9	T73 L74 R119	T73-Q87 WeakPolarHBondContact CA-O 3.46Å; L74-Q87 PolarHBondContact N-O 2.87Å; L74-Q87 PolarHBondContact O-N 3.05Å; Q87-R119 PolarHBondContact NE2-O 2.85Å
88	H	98.4	Very high	97.9	Very high	124 Å²	124	72.8 Å²	72.8	57%	0.574	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	129.7	175.8	-53	-73.4	0	0	0	109.4	V72 T73 Q86	V72-H88 WeakPolarHBondContact O-CA 3.33Å; T73-H88 PolarHBondContact OG1-ND1 2.88Å; Q86-H88 PolarHBondContact OE1-CE1 2.94Å; Q86-H88 PolarHBondContact OE1-NE2 2.81Å
89	V	98.1	Very high	97.9	Very high	12 Å²	12	76.7 Å²	76.7	7%	0.073	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	136.7	-179.4	59.9	0	0	0	0	110	V72 L114 S116 I118	V72-V89 HydrophobicContact CB-CG1 3.84Å; V72-V89 WeakPolarHBondContact CB-O 3.09Å; V72-V89 HydrophobicContact CG1-CG1 4.08Å; V72-V89 PolarHBondContact N-O 2.81Å; V72-V89 PolarHBondContact O-N 3.2Å; V89-L114 HydrophobicContact CG1-CD1 4.06Å; V89-L114 HydrophobicContact CG1-CD2 4.07Å; V89-L114 HydrophobicContact CG1-CG 4.43Å; V89-L114 HydrophobicContact CG2-CB 4.05Å; V89-S116 WeakPolarHBondContact CG2-OG 3.28Å; V89-I118 HydrophobicContact CG1-CG2 4.26Å
90	T	98	Very high	98	Very high	57 Å²	57	77.5 Å²	77.5	35%	0.35	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	151.2	175.4	60	0	0	0	0	110.4	N71 R115	N71-T90 WeakPolarHBondContact OD1-CG2 3.41Å; T90-R115 WeakPolarHBondContact O-CB 3.08Å; T90-R115 PolarHBondContact O-N 2.89Å; T90-R115 WeakPolarHBondContact OG1-CD 3.46Å; T90-R115 PolarHBondContact OG1-NE 3.49Å
91	V	98.3	Very high	98.1	Very high	21 Å²	21	73.4 Å²	73.4	13%	0.127	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.4	173	173.9	0	0	0	0	109.7	I70 V72 R93 A94 L112	I70-V91 HydrophobicContact CB-CB 4.14Å; I70-V91 HydrophobicContact CB-CG2 3.75Å; I70-V91 HydrophobicContact CG2-CG2 3.83Å; I70-V91 WeakPolarHBondContact O-CG2 3.23Å; I70-V91 PolarHBondContact O-N 2.95Å; V72-V91 HydrophobicContact CG2-CG2 3.75Å; V91-R93 VanDerWaalsContact CG1-C 3.42Å; V91-R93 WeakPolarHBondContact CG1-O 3.4Å; V91-A94 HydrophobicContact CG1-CB 4.42Å; V91-L112 HydrophobicContact CG1-CB 4.28Å; V91-L112 HydrophobicContact CG1-CD2 4.18Å; V91-L112 HydrophobicContact CG2-CB 4.01Å; V91-L112 HydrophobicContact CG2-CD1 4.09Å; V91-L112 HydrophobicContact CG2-CD2 4.36Å; V91-L112 HydrophobicContact CG2-CG 4.38Å
92	L	97.5	Very high	98.1	Very high	88 Å²	88	69.4 Å²	69.4	46%	0.461	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-42.3	170.5	176.8	62.4	0	0	0	111.1	Q113 R115	L92-Q113 HydrophobicContact CD2-CG 4.46Å; L92-Q113 PolarHBondContact N-O 2.97Å; L92-R115 HydrophobicContact CB-CB 4.26Å
93	R	97.1	Very high	98.1	Very high	116 Å²	116	71.6 Å²	71.6	44%	0.438	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	127.3	-178.7	-168.1	-178.4	-71	114.4	-2.6	110.6	V91 I95 Q113	V91-R93 VanDerWaalsContact CG1-C 3.42Å; V91-R93 WeakPolarHBondContact CG1-O 3.4Å; R93-I95 HydrophobicContact CB-CG1 4.38Å; R93-I95 HydrophobicContact CG-CD1 4.28Å; R93-I95 HydrophobicContact CG-CG1 3.72Å; R93-Q113 HydrophobicContact CB-CB 4.21Å; R93-Q113 PolarHBondContact N-O 3.06Å; R93-Q113 PolarHBondContact O-N 2.62Å
94	A	98.3	Very high	98	Very high	27 Å²	27	71.5 Å²	71.5	22%	0.223	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.6	168.5	0	0	0	0	0	109	I70 V91 M110 L112	I70-A94 HydrophobicContact CD1-CB 4.27Å; V91-A94 HydrophobicContact CG1-CB 4.42Å; A94-M110 HydrophobicContact CB-SD 3.81Å; A94-L112 HydrophobicContact CB-CD2 3.75Å
95	I	98.6	Very high	98	Very high	28 Å²	28	61.4 Å²	61.4	14%	0.144	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	82.2	-169.5	-50	152.3	0	0	0	107.9	F58 R93 M110 L111 W237 T241 L245	F58-I95 HydrophobicContact CE1-CD1 4.17Å; R93-I95 HydrophobicContact CB-CG1 4.38Å; R93-I95 HydrophobicContact CG-CD1 4.28Å; R93-I95 HydrophobicContact CG-CG1 3.72Å; I95-M110 WeakPolarHBondContact O-CA 3.49Å; I95-L111 HydrophobicContact CB-CB 4.5Å; I95-L111 WeakPolarHBondContact CB-O 3.08Å; I95-L111 PolarHBondContact N-O 3.49Å; I95-L111 PolarHBondContact O-N 3.5Å; I95-W237 HydrophobicContact CG2-CZ2 4.37Å; I95-T241 HydrophobicContact CD1-CG2 3.96Å; I95-T241 HydrophobicContact CG2-CG2 3.97Å; I95-L245 HydrophobicContact CD1-CD1 3.24Å; I95-L245 HydrophobicContact CG1-CD1 4.37Å
96	P	98.8	Very high	98	Very high	48 Å²	48	61.6 Å²	61.6	31%	0.312	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	157.7	171.9	28.6	-34.1	0	0	0	110.1	A63 M110	A63-P96 HydrophobicContact CB-CB 4.01Å; P96-M110 HydrophobicContact CB-CB 4.49Å; P96-M110 HydrophobicContact CB-SD 4.44Å
97	H	98.8	Very high	98	Very high	20 Å²	20	61.8 Å²	61.8	9%	0.093	33%	0.329	C	S	.	.			trans	-56.5	135.5	169.4	-162.2	-90.6	0	0	0	109.4	D99 Y100 N107 I109 F234 W237	H97-D99 IonicContact CE1-OD2 3.27Å; H97-D99 PolarHBondContact CE1-OD2 3.42Å; H97-D99 VanDerWaalsContact CE1-OD2 3.27Å; H97-D99 PolarHBondContact ND1-N 3.24Å; H97-D99 IonicContact ND1-OD2 3.75Å; H97-D99 PolarHBondContact O-N 3.02Å; H97-Y100 VanDerWaalsContact O-CB 3.29Å; H97-Y100 WeakPolarHBondContact O-CB 3.48Å; H97-Y100 PolarHBondContact O-N 3.01Å; H97-N107 HydrophobicContact CB-CB 4.2Å; H97-N107 WeakPolarHBondContact CB-O 3.42Å; H97-I109 HydrophobicContact CB-CG2 3.85Å; H97-I109 PolarHBondContact N-O 2.87Å; H97-F234 AromaticContact CD2-CD1 3.58Å; H97-F234 AromaticContact CD2-CE1 3.87Å; H97-F234 AromaticContact NE2-CD1 3.64Å; H97-F234 AromaticContact NE2-CE1 3.86Å; H97-W237 HydrophobicContact CB-CZ2 4.42Å; H97-W237 AromaticContact CD2-CD1 3.92Å; H97-W237 AromaticContact CD2-CD2 3.55Å; H97-W237 AromaticContact CD2-CE2 3.75Å; H97-W237 AromaticContact CD2-CE3 3.95Å; H97-W237 AromaticContact CD2-CG 3.72Å; H97-W237 AromaticContact CD2-NE1 3.95Å; H97-W237 AromaticContact NE2-CD1 3.96Å; H97-W237 AromaticContact NE2-CG 3.82Å
98	P	98.3	Very high	98	Very high	100 Å²	100	60.1 Å²	60.1	65%	0.649	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.7	-178.3	23.6	-34.8	0	0	0	112.8
99	D	98.4	Very high	98	Very high	104 Å²	104	54.2 Å²	54.2	56%	0.556	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	18.9	178.7	-46.5	-43.8	0	0	0	112.8	H97 D101 N107	H97-D99 IonicContact CE1-OD2 3.27Å; H97-D99 PolarHBondContact CE1-OD2 3.42Å; H97-D99 VanDerWaalsContact CE1-OD2 3.27Å; H97-D99 PolarHBondContact ND1-N 3.24Å; H97-D99 IonicContact ND1-OD2 3.75Å; H97-D99 PolarHBondContact O-N 3.02Å; D99-D101 PolarHBondContact O-N 2.89Å; D99-N107 PolarHBondContact O-ND2 3.41Å
100	Y	98.7	Very high	98	Very high	56 Å²	56	53.6 Å²	53.6	22%	0.22	29%	0.29	C	S	.	.			trans	-64.5	125.8	172.6	169.5	-114.9	0	0	0	110	A63 H64 H97 P102 S106 D108	A63-Y100 HydrophobicContact CB-CD1 3.79Å; A63-Y100 HydrophobicContact CB-CD2 3.58Å; A63-Y100 HydrophobicContact CB-CE1 4.1Å; A63-Y100 HydrophobicContact CB-CE2 3.91Å; A63-Y100 HydrophobicContact CB-CG 3.52Å; H64-Y100 VanDerWaalsContact CB-OH 3.27Å; H64-Y100 WeakPolarHBondContact CB-OH 3.44Å; H97-Y100 VanDerWaalsContact O-CB 3.29Å; H97-Y100 WeakPolarHBondContact O-CB 3.48Å; H97-Y100 PolarHBondContact O-N 3.01Å; Y100-P102 HydrophobicContact CE1-CB 4.07Å; Y100-S106 WeakPolarHBondContact CA-O 3.45Å; Y100-S106 VanDerWaalsContact CD2-O 3.29Å; Y100-S106 WeakPolarHBondContact CD2-O 3.48Å; Y100-D108 HydrophobicContact CD2-CB 4.21Å; Y100-D108 HydrophobicContact CE2-CB 4.01Å
101	D	98.3	Very high	98.1	Very high	50 Å²	50	50.9 Å²	50.9	27%	0.267	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-118.3	113.4	176.3	172	13.5	0	0	0	110.1	D99 Q103 T104 I105 S106	D99-D101 PolarHBondContact O-N 2.89Å; D101-Q103 VanDerWaalsContact C-N 3.27Å; D101-Q103 PolarHBondContact O-N 2.69Å; D101-Q103 WeakPolarHBondContact OD1-CB 3.49Å; D101-Q103 PolarHBondContact OD1-N 2.93Å; D101-T104 WeakPolarHBondContact CB-OG1 3.46Å; D101-T104 VanDerWaalsContact CG-OG1 3.27Å; D101-T104 WeakPolarHBondContact OD2-CB 3.42Å; D101-T104 VanDerWaalsContact OD2-CG2 3.3Å; D101-T104 WeakPolarHBondContact OD2-CG2 3.38Å; D101-T104 PolarHBondContact OD2-OG1 3.01Å; D101-I105 WeakPolarHBondContact O-CA 3.15Å; D101-I105 PolarHBondContact O-N 3Å; D101-S106 PolarHBondContact N-O 2.83Å; D101-S106 VanDerWaalsContact N-O 3.16Å; D101-S106 PolarHBondContact O-N 2.83Å
102	P	96.7	Very high	98.1	Very high	86 Å²	86	49.9 Å²	49.9	56%	0.558	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.1	-179.9	29.5	-35.5	0	0	0	113.9	Y100	Y100-P102 HydrophobicContact CE1-CB 4.07Å
103	Q	96.3	Very high	98.1	Very high	176 Å²	176	46.5 Å²	46.5	82%	0.822	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-43.4	178.2	-62.1	-172.8	-7.6	0	0	111.2	D101	D101-Q103 VanDerWaalsContact C-N 3.27Å; D101-Q103 PolarHBondContact O-N 2.69Å; D101-Q103 WeakPolarHBondContact OD1-CB 3.49Å; D101-Q103 PolarHBondContact OD1-N 2.93Å
104	T	96.4	Very high	98.2	Very high	41 Å²	41	41.2 Å²	41.2	25%	0.252	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-12.3	-180	58.7	0	0	0	0	113.6	D101 S106 T178	D101-T104 WeakPolarHBondContact CB-OG1 3.46Å; D101-T104 VanDerWaalsContact CG-OG1 3.27Å; D101-T104 WeakPolarHBondContact OD2-CB 3.42Å; D101-T104 VanDerWaalsContact OD2-CG2 3.3Å; D101-T104 WeakPolarHBondContact OD2-CG2 3.38Å; D101-T104 PolarHBondContact OD2-OG1 3.01Å; T104-S106 PolarHBondContact O-N 2.93Å; T104-S106 WeakPolarHBondContact OG1-CB 3.45Å; T104-S106 PolarHBondContact OG1-N 2.88Å; T104-S106 PolarHBondContact OG1-OG 3.02Å; T104-T178 HydrophobicContact CG2-CG2 3.98Å; T104-T178 PolarHBondContact O-OG1 3.37Å; T104-T178 VanDerWaalsContact O-OG1 3.09Å
105	I	97.1	Very high	98.1	Very high	49 Å²	49	48 Å²	48	25%	0.251	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	35	-170.2	-41.4	176.5	0	0	0	110.3	D101 D108 Q184 Y217	D101-I105 WeakPolarHBondContact O-CA 3.15Å; D101-I105 PolarHBondContact O-N 3Å; I105-D108 HydrophobicContact CG2-CB 3.94Å; I105-Q184 PolarHBondContact O-NE2 3.45Å; I105-Y217 HydrophobicContact CB-CD1 3.94Å; I105-Y217 HydrophobicContact CB-CE1 4.21Å; I105-Y217 HydrophobicContact CD1-CD1 4.23Å; I105-Y217 HydrophobicContact CD1-CG 4.1Å; I105-Y217 HydrophobicContact CG2-CD1 3.72Å; I105-Y217 HydrophobicContact CG2-CE1 4.33Å; I105-Y217 HydrophobicContact CG2-CG 4.5Å
106	S	97.9	Very high	98	Very high	28 Å²	28	50 Å²	50	20%	0.196	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-86.4	148.5	176.9	68.9	0	0	0	0	110.6	Y100 D101 T104 D108	Y100-S106 WeakPolarHBondContact CA-O 3.45Å; Y100-S106 VanDerWaalsContact CD2-O 3.29Å; Y100-S106 WeakPolarHBondContact CD2-O 3.48Å; D101-S106 PolarHBondContact N-O 2.83Å; D101-S106 VanDerWaalsContact N-O 3.16Å; D101-S106 PolarHBondContact O-N 2.83Å; T104-S106 PolarHBondContact O-N 2.93Å; T104-S106 WeakPolarHBondContact OG1-CB 3.45Å; T104-S106 PolarHBondContact OG1-N 2.88Å; T104-S106 PolarHBondContact OG1-OG 3.02Å; S106-D108 PolarHBondContact O-N 2.87Å
107	N	98.6	Very high	97.9	Very high	31 Å²	31	54.8 Å²	54.8	17%	0.166	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	37.4	-176.8	-50.3	-55	0	0	0	113.8	H97 D99 I109 F234	H97-N107 HydrophobicContact CB-CB 4.2Å; H97-N107 WeakPolarHBondContact CB-O 3.42Å; D99-N107 PolarHBondContact O-ND2 3.41Å; N107-I109 PolarHBondContact O-N 2.86Å; N107-F234 HydrophobicContact CB-CE1 4.01Å; N107-F234 HydrophobicContact CB-CZ 4.2Å; N107-F234 WeakPolarHBondContact OD1-CE1 3.26Å; N107-F234 WeakPolarHBondContact OD1-CZ 3.5Å
108	D	98.8	Very high	97.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.			trans	-73.8	73.9	-178.3	-174.4	27.2	0	0	0	112	A63 H64 Y100 I105 S106 S216 T229	A63-D108 WeakPolarHBondContact CA-OD1 3.34Å; A63-D108 WeakPolarHBondContact CB-OD1 3.37Å; A63-D108 PolarHBondContact N-OD1 2.79Å; H64-D108 IonicContact CE1-OD2 2.6Å; H64-D108 PolarHBondContact CE1-OD2 3.02Å; H64-D108 IonicContact CG-OD1 3.89Å; H64-D108 IonicContact CG-OD2 3.74Å; H64-D108 PolarHBondContact N-OD1 2.85Å; H64-D108 VanDerWaalsContact ND1-CG 3.35Å; H64-D108 IonicContact ND1-OD1 2.74Å; H64-D108 PolarHBondContact ND1-OD1 2.81Å; H64-D108 IonicContact ND1-OD2 2.74Å; H64-D108 PolarHBondContact ND1-OD2 2.8Å; Y100-D108 HydrophobicContact CD2-CB 4.21Å; Y100-D108 HydrophobicContact CE2-CB 4.01Å; I105-D108 HydrophobicContact CG2-CB 3.94Å; S106-D108 PolarHBondContact O-N 2.87Å; D108-S216 WeakPolarHBondContact CB-OG 3.32Å; D108-S216 WeakPolarHBondContact OD2-CB 3.37Å; D108-S216 PolarHBondContact OD2-OG 3.28Å; D108-T229 PolarHBondContact O-OG1 3.06Å
109	I	98.9	Very high	97.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.282	C	S	.	.			trans	-143.9	137.4	178.3	-179	171.8	0	0	0	109.9	M60 H97 N107 I214 T229 F234 W237 I238	M60-I109 HydrophobicContact CE-CD1 4.39Å; M60-I109 HydrophobicContact CG-CD1 4.34Å; M60-I109 HydrophobicContact CG-CG1 4.28Å; M60-I109 HydrophobicContact SD-CD1 3.93Å; M60-I109 HydrophobicContact SD-CG1 4.5Å; H97-I109 HydrophobicContact CB-CG2 3.85Å; H97-I109 PolarHBondContact N-O 2.87Å; N107-I109 PolarHBondContact O-N 2.86Å; I109-I214 HydrophobicContact CB-CD1 3.98Å; I109-I214 HydrophobicContact CD1-CD1 3.7Å; I109-I214 HydrophobicContact CG1-CD1 3.52Å; I109-T229 HydrophobicContact CB-CG2 4.14Å; I109-T229 HydrophobicContact CG2-CG2 4.48Å; I109-F234 HydrophobicContact CD1-CB 4.01Å; I109-F234 HydrophobicContact CD1-CD2 4.49Å; I109-F234 HydrophobicContact CD1-CG 4.28Å; I109-F234 HydrophobicContact CG2-CD1 3.86Å; I109-F234 HydrophobicContact CG2-CD2 4.34Å; I109-F234 HydrophobicContact CG2-CE1 4.06Å; I109-F234 HydrophobicContact CG2-CG 4Å; I109-F234 HydrophobicContact CG2-CZ 4.41Å; I109-W237 HydrophobicContact CD1-CE3 4.41Å; I109-W237 HydrophobicContact CD1-CZ3 3.87Å; I109-W237 HydrophobicContact CG1-CH2 4.45Å; I109-W237 HydrophobicContact CG1-CZ3 3.85Å; I109-W237 HydrophobicContact CG2-CZ3 4.09Å; I109-I238 HydrophobicContact CD1-CD1 4.05Å; I109-I238 HydrophobicContact CD1-CG1 4.22Å
110	M	98.9	Very high	97.7	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.9	176.8	172.5	165.9	65.6	0	0	111.2	M60 T61 A62 A63 C65 W66 I70 A94 I95 P96 L112	M60-M110 WeakPolarHBondContact CA-O 3.36Å; T61-M110 HydrophobicContact CG2-CB 4.21Å; T61-M110 HydrophobicContact CG2-CE 3.69Å; T61-M110 HydrophobicContact CG2-CG 4.41Å; T61-M110 PolarHBondContact N-O 2.96Å; T61-M110 PolarHBondContact O-N 2.95Å; A62-M110 WeakPolarHBondContact O-CE 3.08Å; A63-M110 HydrophobicContact CB-CB 4.26Å; C65-M110 HydrophobicContact CB-CE 4.48Å; W66-M110 HydrophobicContact CB-CE 4.17Å; W66-M110 HydrophobicContact CB-SD 4.22Å; W66-M110 HydrophobicContact CG-SD 4.49Å; I70-M110 HydrophobicContact CD1-CE 4.26Å; A94-M110 HydrophobicContact CB-SD 3.81Å; I95-M110 WeakPolarHBondContact O-CA 3.49Å; P96-M110 HydrophobicContact CB-CB 4.49Å; P96-M110 HydrophobicContact CB-SD 4.44Å; M110-L112 HydrophobicContact CE-CD2 3.79Å; M110-L112 HydrophobicContact CG-CD2 3.99Å; M110-L112 HydrophobicContact SD-CD2 3.93Å
111	L	98.9	Very high	97.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.4	168.5	-73.7	173.3	0	0	0	109.7	V54 F58 M60 I95 W237 I238 T241 M242	V54-L111 HydrophobicContact CG2-CD2 4.32Å; F58-L111 HydrophobicContact CD1-CB 4.08Å; F58-L111 HydrophobicContact CD1-CD2 4.38Å; F58-L111 HydrophobicContact CE1-CB 4.3Å; M60-L111 HydrophobicContact CB-CD2 4.13Å; M60-L111 HydrophobicContact CE-CD2 3.9Å; M60-L111 HydrophobicContact CG-CD2 4.28Å; I95-L111 HydrophobicContact CB-CB 4.5Å; I95-L111 WeakPolarHBondContact CB-O 3.08Å; I95-L111 PolarHBondContact N-O 3.49Å; I95-L111 PolarHBondContact O-N 3.5Å; L111-W237 HydrophobicContact CB-CH2 4.31Å; L111-W237 HydrophobicContact CD1-CH2 4.03Å; L111-W237 HydrophobicContact CD1-CZ3 4Å; L111-W237 HydrophobicContact CG-CH2 3.88Å; L111-W237 HydrophobicContact CG-CZ3 3.96Å; L111-I238 HydrophobicContact CD1-CG2 4.43Å; L111-T241 HydrophobicContact CD1-CG2 3.76Å; L111-M242 HydrophobicContact CD1-CG 3.99Å
112	L	98.8	Very high	97.6	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	110.8	174.6	-57.9	179.7	0	0	0	108.2	L38 F58 V59 T61 I70 V72 V91 A94 M110	L38-L112 HydrophobicContact CD1-CD1 3.94Å; L38-L112 HydrophobicContact CD2-CD1 3.94Å; F58-L112 WeakPolarHBondContact CA-O 3.29Å; V59-L112 HydrophobicContact CB-CB 4.23Å; V59-L112 HydrophobicContact CG1-CD1 4.24Å; V59-L112 PolarHBondContact N-O 3.28Å; V59-L112 PolarHBondContact O-N 2.99Å; T61-L112 HydrophobicContact CG2-CD1 3.88Å; T61-L112 HydrophobicContact CG2-CD2 4.47Å; T61-L112 HydrophobicContact CG2-CG 3.99Å; I70-L112 HydrophobicContact CD1-CD2 3.84Å; I70-L112 HydrophobicContact CG2-CD1 4.12Å; V72-L112 HydrophobicContact CG2-CD1 4.42Å; V91-L112 HydrophobicContact CG1-CB 4.28Å; V91-L112 HydrophobicContact CG1-CD2 4.18Å; V91-L112 HydrophobicContact CG2-CB 4.01Å; V91-L112 HydrophobicContact CG2-CD1 4.09Å; V91-L112 HydrophobicContact CG2-CD2 4.36Å; V91-L112 HydrophobicContact CG2-CG 4.38Å; A94-L112 HydrophobicContact CB-CD2 3.75Å; M110-L112 HydrophobicContact CE-CD2 3.79Å; M110-L112 HydrophobicContact CG-CD2 3.99Å; M110-L112 HydrophobicContact SD-CD2 3.93Å
113	Q	98.4	Very high	97.7	Very high	16 Å²	16	67.1 Å²	67.1	8%	0.075	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	121.3	169.4	-174.9	173.7	20.5	0	0	108.8	D57 F58 L92 R93 L245	D57-Q113 WeakPolarHBondContact O-CA 3.46Å; F58-Q113 HydrophobicContact CD1-CB 4.45Å; F58-Q113 HydrophobicContact CE1-CB 3.78Å; F58-Q113 HydrophobicContact CE1-CG 4.31Å; F58-Q113 HydrophobicContact CE2-CG 4.18Å; F58-Q113 HydrophobicContact CZ-CB 3.81Å; F58-Q113 HydrophobicContact CZ-CG 3.84Å; L92-Q113 HydrophobicContact CD2-CG 4.46Å; L92-Q113 PolarHBondContact N-O 2.97Å; R93-Q113 HydrophobicContact CB-CB 4.21Å; R93-Q113 PolarHBondContact N-O 3.06Å; R93-Q113 PolarHBondContact O-N 2.62Å; Q113-L245 PolarHBondContact NE2-O 2.93Å
114	L	98.3	Very high	97.8	Very high	6 Å²	6	58.8 Å²	58.8	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	145.7	-179.7	-52.5	-178.6	0	0	0	110.6	L53 D57 V59 V72 V89 S116 I118	L53-L114 HydrophobicContact CD1-CD1 4.26Å; D57-L114 PolarHBondContact O-N 3.42Å; V59-L114 HydrophobicContact CB-CD2 4.48Å; V59-L114 HydrophobicContact CG2-CD1 4.28Å; V59-L114 HydrophobicContact CG2-CD2 4.09Å; V72-L114 HydrophobicContact CB-CD2 4.3Å; V72-L114 HydrophobicContact CG1-CD2 4.4Å; V72-L114 HydrophobicContact CG2-CD2 3.84Å; V89-L114 HydrophobicContact CG1-CD1 4.06Å; V89-L114 HydrophobicContact CG1-CD2 4.07Å; V89-L114 HydrophobicContact CG1-CG 4.43Å; V89-L114 HydrophobicContact CG2-CB 4.05Å; L114-S116 VanDerWaalsContact C-N 3.26Å; L114-S116 WeakPolarHBondContact CB-O 3.15Å; L114-S116 PolarHBondContact O-N 2.88Å; L114-I118 HydrophobicContact CD1-CG2 3.63Å
115	R	97.1	Very high	97.9	Very high	168 Å²	168	63.7 Å²	63.7	63%	0.634	28%	0.275	S	S	*	.	S	Bend	trans	-66.6	-28.9	178.2	-171.8	175.7	-70	-133	-1.8	113	T90 L92	T90-R115 WeakPolarHBondContact O-CB 3.08Å; T90-R115 PolarHBondContact O-N 2.89Å; T90-R115 WeakPolarHBondContact OG1-CD 3.46Å; T90-R115 PolarHBondContact OG1-NE 3.49Å; L92-R115 HydrophobicContact CB-CB 4.26Å
116	S	96.1	Very high	98	Very high	70 Å²	70	63.3 Å²	63.3	49%	0.49	28%	0.275	S	S	.	.	S	Bend	trans	-134.8	150.8	173.3	55.8	0	0	0	0	110.3	V89 L114	V89-S116 WeakPolarHBondContact CG2-OG 3.28Å; L114-S116 VanDerWaalsContact C-N 3.26Å; L114-S116 WeakPolarHBondContact CB-O 3.15Å; L114-S116 PolarHBondContact O-N 2.88Å
117	R	96.3	Very high	98	Very high	149 Å²	149	62.5 Å²	62.5	56%	0.562	27%	0.269	S	S	*	.			trans	-66.6	135.2	172.3	-72.3	-178.7	-179.3	-156.2	4.7	109.4	E56 D57	E56-R117 HydrophobicContact CB-CB 4.44Å; E56-R117 CarbonylContact O-C 3.43Å; E56-R117 WeakPolarHBondContact O-CA 3.39Å; D57-R117 HydrophobicContact CB-CG 4.1Å
118	I	96.1	Very high	98	Very high	13 Å²	13	65.1 Å²	65.1	7%	0.067	29%	0.287	C	S	.	.			trans	-74.6	155.7	175.5	68.6	59.4	0	0	0	110.4	L53 E56 L74 V89 L114 K120 V124	L53-I118 HydrophobicContact CD1-CG1 4.03Å; L53-I118 HydrophobicContact CD2-CD1 3.77Å; L53-I118 HydrophobicContact CD2-CG1 3.73Å; E56-I118 HydrophobicContact CB-CD1 4.15Å; E56-I118 HydrophobicContact CB-CG1 4.39Å; E56-I118 HydrophobicContact CG-CD1 4.11Å; E56-I118 WeakPolarHBondContact O-CG1 3.15Å; E56-I118 PolarHBondContact O-N 2.95Å; L74-I118 HydrophobicContact CD1-CB 4.27Å; L74-I118 HydrophobicContact CD1-CG1 4.32Å; L74-I118 HydrophobicContact CD1-CG2 3.56Å; V89-I118 HydrophobicContact CG1-CG2 4.26Å; L114-I118 HydrophobicContact CD1-CG2 3.63Å; I118-K120 HydrophobicContact CD1-CG 3.83Å; I118-K120 PolarHBondContact O-N 2.91Å; I118-V124 HydrophobicContact CD1-CG1 3.77Å; I118-V124 HydrophobicContact CG1-CG1 4.03Å
119	R	97.4	Very high	97.9	Very high	205 Å²	205	67.1 Å²	67.1	77%	0.774	30%	0.297	S	S	*	.			trans	-88.7	107.3	174.1	-65.3	-179.4	177.8	179.1	-1.1	108.9	Q87 N121	Q87-R119 PolarHBondContact NE2-O 2.85Å; R119-N121 PolarHBondContact O-N 3.29Å
120	K	97.8	Very high	97.7	Very high	126 Å²	126	67.4 Å²	67.4	55%	0.548	30%	0.299	S	S	.	.			trans	-61.7	135.6	174.8	-70.3	-171.7	-61.6	-164.9	0	110.6	E56 I118 V124	E56-K120 HydrophobicContact CG-CD 3.73Å; E56-K120 HydrophobicContact CG-CG 3.66Å; E56-K120 WeakPolarHBondContact OE1-CD 3.41Å; E56-K120 WeakPolarHBondContact OE1-CE 3.44Å; E56-K120 IonicContact OE1-NZ 2.63Å; E56-K120 PolarHBondContact OE1-NZ 3.04Å; I118-K120 HydrophobicContact CD1-CG 3.83Å; I118-K120 PolarHBondContact O-N 2.91Å; K120-V124 WeakPolarHBondContact CA-O 3.33Å
121	N	97.9	Very high	97.3	Very high	69 Å²	69	74.5 Å²	74.5	37%	0.369	33%	0.33	S	S	.	.			trans	-155.2	-167	174.3	63.8	39.3	0	0	0	109.7	R119 V123 V124	R119-N121 PolarHBondContact O-N 3.29Å; N121-V123 PolarHBondContact O-N 2.8Å; N121-V123 WeakPolarHBondContact OD1-CA 3.44Å; N121-V123 WeakPolarHBondContact OD1-CG2 3.47Å; N121-V123 PolarHBondContact OD1-N 3.47Å; N121-V124 PolarHBondContact N-O 3.04Å; N121-V124 CarbonylContact O-C 3.6Å; N121-V124 VanDerWaalsContact O-O 3.07Å; N121-V124 PolarHBondContact OD1-N 2.81Å
122	R	97.8	Very high	96.2	Very high	233 Å²	233	78.3 Å²	78.3	88%	0.879	36%	0.361	S	S	*	.	S	Bend	trans	-63.9	-26.8	-178.5	-66.4	-177.4	178.9	178.7	-0.2	113.8
123	V	98.3	Very high	95.2	Very high	30 Å²	30	84.1 Å²	84.1	18%	0.182	40%	0.396	C	S	.	.	S	Bend	trans	-111	-6.8	-173.6	-57	0	0	0	0	113.4	H30 P33 N121	H30-V123 HydrophobicContact CB-CB 3.82Å; H30-V123 HydrophobicContact CB-CG1 3.46Å; H30-V123 VanDerWaalsContact CB-CG1 3.46Å; P33-V123 VanDerWaalsContact CA-O 3.24Å; P33-V123 WeakPolarHBondContact CA-O 3.41Å; P33-V123 WeakPolarHBondContact CB-O 3.3Å; N121-V123 PolarHBondContact O-N 2.8Å; N121-V123 WeakPolarHBondContact OD1-CA 3.44Å; N121-V123 WeakPolarHBondContact OD1-CG2 3.47Å; N121-V123 PolarHBondContact OD1-N 3.47Å
124	V	98.7	Very high	94.2	Very high	0 Å²	0	86.2 Å²	86.2	0%	0	41%	0.408	C	S	.	.	S	Bend	trans	-132.5	104.4	172.7	-177.3	0	0	0	0	109.2	P33 L53 L74 I118 K120 N121	P33-V124 CarbonylContact O-C 3.55Å; P33-V124 VanDerWaalsContact O-CA 3.26Å; P33-V124 WeakPolarHBondContact O-CA 3.32Å; L53-V124 HydrophobicContact CD2-CG1 4.04Å; L74-V124 HydrophobicContact CB-CG1 4.07Å; L74-V124 HydrophobicContact CB-CG2 4.12Å; L74-V124 HydrophobicContact CD1-CG1 4.4Å; I118-V124 HydrophobicContact CD1-CG1 3.77Å; I118-V124 HydrophobicContact CG1-CG1 4.03Å; K120-V124 WeakPolarHBondContact CA-O 3.33Å; N121-V124 PolarHBondContact N-O 3.04Å; N121-V124 CarbonylContact O-C 3.6Å; N121-V124 VanDerWaalsContact O-O 3.07Å; N121-V124 PolarHBondContact OD1-N 2.81Å
125	R	98.3	Very high	93.6	Very high	145 Å²	145	94.4 Å²	94.4	55%	0.547	44%	0.439	S	S	.	.			trans	-151.9	147.5	174.5	57.9	176.9	171.6	-179.3	-4.6	111.8	P33 Y34	P33-R125 CarbonylContact C-O 3.54Å; P33-R125 HydrophobicContact CB-CG 3.79Å; P33-R125 HydrophobicContact CG-CG 3.46Å; P33-R125 VanDerWaalsContact CG-CG 3.46Å; P33-R125 PolarHBondContact O-N 3.07Å; Y34-R125 VanDerWaalsContact CA-O 3.23Å; Y34-R125 WeakPolarHBondContact CA-O 3.41Å; Y34-R125 WeakPolarHBondContact CB-O 3.22Å; Y34-R125 PolarHBondContact N-O 3.13Å
126	P	98.5	Very high	93.4	Very high	41 Å²	41	87.9 Å²	87.9	27%	0.266	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-62.5	148.9	179.1	-23.3	34	0	0	0	113.7	L53	L53-P126 HydrophobicContact CD2-CG 3.98Å; L53-P126 HydrophobicContact CG-CG 4.23Å; L53-P126 CarbonylContact O-C 3.54Å; L53-P126 VanDerWaalsContact O-CA 3.22Å; L53-P126 WeakPolarHBondContact O-CA 3.45Å
127	V	98.4	Very high	93.3	Very high	11 Å²	11	93.1 Å²	93.1	7%	0.067	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-84.9	151.4	167.8	68.8	0	0	0	0	110.7	Y34 F52 L53 V54 A211	Y34-V127 HydrophobicContact CD1-CB 3.78Å; Y34-V127 HydrophobicContact CD1-CG2 3.99Å; Y34-V127 HydrophobicContact CD2-CB 4.29Å; Y34-V127 HydrophobicContact CE1-CB 4.48Å; Y34-V127 HydrophobicContact CE1-CG2 4.2Å; Y34-V127 HydrophobicContact CG-CB 3.67Å; Y34-V127 HydrophobicContact CG-CG1 4.41Å; Y34-V127 HydrophobicContact CG-CG2 4.23Å; F52-V127 HydrophobicContact CD2-CG1 3.54Å; F52-V127 HydrophobicContact CE2-CG1 4.2Å; F52-V127 HydrophobicContact CG-CG1 4.41Å; L53-V127 PolarHBondContact O-N 2.86Å; V54-V127 HydrophobicContact CG1-CG1 4.43Å; V127-A211 HydrophobicContact CG1-CB 3.71Å; V127-A211 HydrophobicContact CG2-CB 4Å
128	T	97.6	Very high	93.4	Very high	86 Å²	86	89.5 Å²	89.5	53%	0.528	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-74.8	132.9	175.8	-60.8	0	0	0	0	111	V210 A211	T128-V210 HydrophobicContact CG2-CG2 4.29Å; T128-V210 WeakPolarHBondContact O-CA 3.12Å; T128-A211 PolarHBondContact O-N 2.96Å
129	L	97.4	Very high	93.4	Very high	42 Å²	42	90.6 Å²	90.6	22%	0.22	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-83.8	152.3	172.7	-67.7	-178.8	0	0	0	111.6	V54 M60 I231 I235 I238	V54-L129 HydrophobicContact CB-CD1 4.45Å; V54-L129 HydrophobicContact CB-CD2 4.44Å; V54-L129 HydrophobicContact CG1-CD2 3.82Å; V54-L129 HydrophobicContact CG1-CG 4.41Å; M60-L129 HydrophobicContact CE-CD1 4.48Å; M60-L129 HydrophobicContact CE-CD2 3.99Å; L129-I231 HydrophobicContact CD2-CG2 4.1Å; L129-I235 HydrophobicContact CB-CD1 4.22Å; L129-I238 HydrophobicContact CD1-CG2 3.93Å
130	P	95.3	Very high	93.4	Very high	5 Å²	5	83.5 Å²	83.5	3%	0.032	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-70.6	141.1	-176	26.8	-30.7	0	0	0	111	N134 V210 A211 I231 Q232 I235	P130-N134 HydrophobicContact CB-CB 4.39Å; P130-V210 HydrophobicContact CB-CG1 3.83Å; P130-A211 WeakPolarHBondContact CD-O 3.25Å; P130-I231 HydrophobicContact CG-CB 4.11Å; P130-I231 HydrophobicContact CG-CG2 3.76Å; P130-Q232 HydrophobicContact CG-CB 4.3Å; P130-I235 HydrophobicContact CG-CD1 4.18Å; P130-I235 WeakPolarHBondContact O-CD1 3.43Å
131	K	90.4	Very high	93.4	Very high	150 Å²	150	80.6 Å²	80.6	65%	0.652	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-89.6	166.8	166.1	-58.2	-179.6	-179.1	179.6	0	109.4	T133 N134	K131-T133 PolarHBondContact O-N 2.83Å; K131-N134 PolarHBondContact O-N 3.31Å
132	A	76.2	Confident	93.4	Very high	80 Å²	80	77.3 Å²	77.3	66%	0.661	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-29.6	179.9	0	0	0	0	0	113.8	Q232	A132-Q232 PolarHBondContact O-NE2 2.03Å
133	T	76.6	Confident	93.5	Very high	121 Å²	121	67.7 Å²	67.7	74%	0.742	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-19.8	179.4	48.4	0	0	0	0	114.3	K131 R135	K131-T133 PolarHBondContact O-N 2.83Å; T133-R135 VanDerWaalsContact C-N 3.3Å; T133-R135 PolarHBondContact O-N 3.04Å; T133-R135 VanDerWaalsContact O-N 3.07Å
134	N	77.9	Confident	93.5	Very high	60 Å²	60	66.3 Å²	66.3	32%	0.321	35%	0.346	S	S	.	.			trans	-91.1	58.9	-170.2	-67.7	62.3	0	0	0	111.2	P130 K131 Q212	P130-N134 HydrophobicContact CB-CB 4.39Å; K131-N134 PolarHBondContact O-N 3.31Å; N134-Q212 PolarHBondContact O-NE2 2.78Å; N134-Q212 PolarHBondContact O-OE1 3.06Å; N134-Q212 VanDerWaalsContact O-OE1 3.13Å
135	R	84.9	Confident	93.4	Very high	179 Å²	179	66.4 Å²	66.4	68%	0.675	35%	0.346	S	S	*	.			trans	-80.5	133.3	178.5	-64.7	-176.8	-178.2	-175.3	0.1	110.9	T133	T133-R135 VanDerWaalsContact C-N 3.3Å; T133-R135 PolarHBondContact O-N 3.04Å; T133-R135 VanDerWaalsContact O-N 3.07Å
136	V	93.3	Very high	93.4	Very high	30 Å²	30	59.5 Å²	59.5	18%	0.182	32%	0.32	C	S	.	.			trans	-75.9	147.4	166.8	-66.4	0	0	0	0	110.8	D140 V166 I185 C207 Q212	V136-D140 WeakPolarHBondContact CA-OD2 3.32Å; V136-V166 HydrophobicContact CB-CG2 4.28Å; V136-I185 HydrophobicContact CG2-CD1 4.03Å; V136-I185 HydrophobicContact CG2-CG2 4.23Å; V136-C207 HydrophobicContact CG1-CB 4.22Å; V136-Q212 HydrophobicContact CG1-CB 3.68Å; V136-Q212 HydrophobicContact CG1-CG 3.47Å; V136-Q212 VanDerWaalsContact CG1-CG 3.47Å
137	R	95.3	Very high	93.3	Very high	181 Å²	181	57.9 Å²	57.9	68%	0.683	31%	0.309	S	S	*	.			trans	-123.6	151.1	178.6	-61.3	-178.5	-177	-168.3	-0	110.6	G139 D140 V166	R137-G139 PolarHBondContact O-N 3.48Å; R137-D140 PolarHBondContact N-OD2 3.26Å; R137-D140 VanDerWaalsContact O-CB 3.25Å; R137-D140 WeakPolarHBondContact O-CB 3.4Å; R137-D140 VanDerWaalsContact O-CG 3.24Å; R137-D140 PolarHBondContact O-N 2.96Å; R137-V166 WeakPolarHBondContact O-CB 3.42Å
138	P	97.5	Very high	93	Very high	72 Å²	72	57.3 Å²	57.3	47%	0.468	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	131.7	170.5	-26.7	35.6	0	0	0	111.6	V166 R168	P138-V166 WeakPolarHBondContact CA-O 3.22Å; P138-R168 HydrophobicContact CB-CG 3.85Å; P138-R168 HydrophobicContact CG-CG 3.97Å
139	G	96.9	Very high	92.6	Very high	37 Å²	37	54.4 Å²	54.4	38%	0.381	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.1	-23.2	-175.4	0	0	0	0	0	114.4	R137 L141 R165 V166	R137-G139 PolarHBondContact O-N 3.48Å; G139-L141 PolarHBondContact O-N 3.24Å; G139-R165 PolarHBondContact O-NH1 2.79Å; G139-V166 PolarHBondContact N-O 3.38Å
140	D	97.4	Very high	92	Very high	56 Å²	56	52.7 Å²	52.7	30%	0.299	28%	0.278	S	S	.	.			trans	-56.3	136.9	176.8	-74.3	-10.3	0	0	0	110.7	V136 R137 R165 V166	V136-D140 WeakPolarHBondContact CA-OD2 3.32Å; R137-D140 PolarHBondContact N-OD2 3.26Å; R137-D140 VanDerWaalsContact O-CB 3.25Å; R137-D140 WeakPolarHBondContact O-CB 3.4Å; R137-D140 VanDerWaalsContact O-CG 3.24Å; R137-D140 PolarHBondContact O-N 2.96Å; D140-R165 CarbonylContact O-C 3.34Å; D140-R165 VanDerWaalsContact O-CA 3.31Å; D140-R165 WeakPolarHBondContact O-CA 3.34Å; D140-V166 HydrophobicContact CB-CB 4.41Å; D140-V166 HydrophobicContact CB-CG2 4.13Å; D140-V166 PolarHBondContact O-N 2.85Å
141	L	97.5	Very high	91.4	Very high	65 Å²	65	54.9 Å²	54.9	34%	0.34	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.3	-178.6	-170.7	61.6	0	0	0	109.8	G139 R163 R165	G139-L141 PolarHBondContact O-N 3.24Å; L141-R163 HydrophobicContact CD1-CB 3.84Å; L141-R163 HydrophobicContact CG-CB 4.16Å; L141-R165 HydrophobicContact CD1-CG 3.84Å
142	C	98.3	Very high	91	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	162.7	-176.3	-55.2	0	0	0	0	110.5	R163 L164 L205 V206 C207	C142-R163 CarbonylContact O-C 3.58Å; C142-R163 VanDerWaalsContact O-CA 3.23Å; C142-R163 WeakPolarHBondContact O-CA 3.35Å; C142-L164 PolarHBondContact N-O 2.9Å; C142-L164 PolarHBondContact O-N 2.76Å; C142-L205 HydrophobicContact CB-CD1 3.49Å; C142-L205 VanDerWaalsContact CB-CD1 3.49Å; C142-L205 HydrophobicContact CB-CD2 4.49Å; C142-L205 HydrophobicContact CB-CG 3.83Å; C142-V206 CarbonylContact C-O 3.46Å; C142-V206 WeakPolarHBondContact CA-O 3.2Å; C142-V206 WeakPolarHBondContact CB-O 3.32Å; C142-C207 HydrophobicContact CB-CB 4.03Å; C142-C207 WeakPolarHBondContact CB-SG 3.45Å; C142-C207 WeakPolarHBondContact SG-CB 3.35Å; C142-C207 CovalentContact SG-SG 2.03Å; C142-C207 PolarHBondContact SG-SG 2.75Å
143	T	98.4	Very high	91.3	Very high	31 Å²	31	55.2 Å²	55.2	19%	0.19	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.1	178.4	-52.8	0	0	0	0	109.7	E161 V162 V206	T143-E161 HydrophobicContact CG2-CB 4.03Å; T143-V162 WeakPolarHBondContact CA-O 3.39Å; T143-V206 PolarHBondContact N-O 2.8Å; T143-V206 PolarHBondContact O-N 2.98Å
144	V	98	Very high	91.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.1	167.1	179.4	0	0	0	0	107.6	E161 V162 L164 A196 L205 V215 F228	V144-E161 CarbonylContact O-C 3.55Å; V144-E161 VanDerWaalsContact O-CA 3.26Å; V144-E161 WeakPolarHBondContact O-CA 3.38Å; V144-V162 HydrophobicContact CB-CG1 4.33Å; V144-V162 PolarHBondContact N-O 2.78Å; V144-V162 PolarHBondContact O-N 2.84Å; V144-L164 HydrophobicContact CB-CD1 4.47Å; V144-L164 HydrophobicContact CG2-CD1 3.94Å; V144-A196 HydrophobicContact CG1-CB 4.15Å; V144-L205 HydrophobicContact CG2-CB 4.38Å; V144-L205 HydrophobicContact CG2-CD1 3.45Å; V144-L205 VanDerWaalsContact CG2-CD1 3.45Å; V144-V215 HydrophobicContact CG1-CG2 3.72Å; V144-F228 HydrophobicContact CG1-CE1 4.44Å; V144-F228 HydrophobicContact CG2-CE1 3.65Å; V144-F228 HydrophobicContact CG2-CZ 3.71Å
145	A	97.8	Very high	92.2	Very high	2 Å²	2	58.4 Å²	58.4	2%	0.017	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	153	176.8	0	0	0	0	0	110.6	M35 L159 Q160 E161	M35-A145 HydrophobicContact CE-CB 4.39Å; M35-A145 WeakPolarHBondContact CE-O 3.31Å; M35-A145 HydrophobicContact SD-CB 4.14Å; A145-L159 HydrophobicContact CB-CD1 4.12Å; A145-Q160 CarbonylContact C-O 3.51Å; A145-Q160 WeakPolarHBondContact CA-O 3.04Å; A145-Q160 VanDerWaalsContact CB-O 3.26Å; A145-Q160 WeakPolarHBondContact CB-O 3.49Å; A145-E161 HydrophobicContact CB-CB 4.21Å
146	G	97.5	Very high	92.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.2	173	-173.5	0	0	0	0	0	114.1	Q160 D200	G146-Q160 PolarHBondContact N-O 2.86Å; G146-Q160 PolarHBondContact O-N 2.96Å; G146-D200 WeakPolarHBondContact CA-OD1 3.06Å
147	W	97.3	Very high	92.6	Very high	7 Å²	7	51.7 Å²	51.7	3%	0.027	26%	0.26	C	S	.	.	S	Bend	trans	-112.4	22.6	177.3	-64.1	-92.8	0	0	0	111.5	M35 F37 A76 H77 I79 L159	M35-W147 HydrophobicContact CB-CH2 3.64Å; M35-W147 HydrophobicContact CB-CZ3 3.96Å; M35-W147 HydrophobicContact CE-CE3 4.3Å; M35-W147 HydrophobicContact CE-CH2 4.43Å; M35-W147 HydrophobicContact CE-CZ3 3.72Å; F37-W147 HydrophobicContact CB-CE3 4.12Å; F37-W147 HydrophobicContact CB-CH2 4.44Å; F37-W147 HydrophobicContact CB-CZ3 4.03Å; F37-W147 HydrophobicContact CD2-CB 4.32Å; F37-W147 HydrophobicContact CD2-CD2 4.39Å; F37-W147 HydrophobicContact CD2-CE3 4.17Å; F37-W147 HydrophobicContact CD2-CG 4.49Å; F37-W147 HydrophobicContact CE2-CB 4.48Å; A76-W147 HydrophobicContact CB-CZ2 4.31Å; H77-W147 PolarHBondContact O-NE1 2.69Å; I79-W147 HydrophobicContact CG2-CD2 4.04Å; I79-W147 HydrophobicContact CG2-CG 4.01Å; I79-W147 HydrophobicContact CG2-CZ2 4.33Å; W147-L159 HydrophobicContact CD2-CD1 3.83Å; W147-L159 HydrophobicContact CE3-CD1 3.93Å; W147-L159 HydrophobicContact CH2-CD1 3.82Å; W147-L159 HydrophobicContact CZ2-CB 3.84Å; W147-L159 HydrophobicContact CZ2-CD1 3.68Å; W147-L159 HydrophobicContact CZ2-CD2 4.32Å; W147-L159 HydrophobicContact CZ2-CG 4.15Å; W147-L159 HydrophobicContact CZ3-CD1 3.93Å; W147-L159 VanDerWaalsContact NE1-N 3.17Å
148	G	92.6	Very high	92.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-68.2	-171.1	178.7	0	0	0	0	0	113.6	T156 R198 D200	G148-T156 WeakPolarHBondContact O-CG2 3.26Å; G148-R198 CarbonylContact C-O 3.53Å; G148-R198 WeakPolarHBondContact CA-O 3.02Å; G148-D200 VanDerWaalsContact CA-OD1 3.28Å; G148-D200 WeakPolarHBondContact CA-OD1 3.43Å; G148-D200 PolarHBondContact N-OD1 3.22Å
149	L	88.4	Confident	92.7	Very high	24 Å²	24	41.2 Å²	41.2	13%	0.126	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.5	175	-69.8	-172.4	0	0	0	111	S151 R154 R155 F197 R198	L149-S151 WeakPolarHBondContact CB-O 3.38Å; L149-R154 CarbonylContact C-O 3.54Å; L149-R154 WeakPolarHBondContact CA-O 3.43Å; L149-R154 WeakPolarHBondContact CD2-O 3.42Å; L149-R155 HydrophobicContact CD2-CB 3.8Å; L149-F197 HydrophobicContact CB-CD1 3.57Å; L149-F197 HydrophobicContact CB-CE1 4.03Å; L149-F197 HydrophobicContact CD1-CD1 4.37Å; L149-F197 HydrophobicContact CD1-CE1 4.04Å; L149-R198 HydrophobicContact CD1-CB 3.89Å; L149-R198 HydrophobicContact CD1-CG 4.36Å; L149-R198 HydrophobicContact CG-CB 4.13Å; L149-R198 PolarHBondContact N-O 2.03Å
150	V	84.6	Confident	92.8	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-12.8	179.2	-60	0	0	0	0	113	G19 K20 R154 T156 Q160	G19-V150 VanDerWaalsContact C-CB 3.5Å; G19-V150 WeakPolarHBondContact O-CB 3.14Å; G19-V150 WeakPolarHBondContact O-CG2 3.31Å; K20-V150 CarbonylContact O-C 3.54Å; K20-V150 WeakPolarHBondContact O-CA 3.34Å; K20-V150 WeakPolarHBondContact O-CB 2.93Å; V150-R154 HydrophobicContact CG2-CB 3.89Å; V150-R154 HydrophobicContact CG2-CG 3.97Å; V150-R154 VanDerWaalsContact CG2-O 3.32Å; V150-R154 WeakPolarHBondContact CG2-O 3.47Å; V150-R154 PolarHBondContact N-O 3.25Å; V150-T156 HydrophobicContact CG1-CG2 3.82Å; V150-Q160 HydrophobicContact CG1-CG 4.07Å
151	S	82.1	Confident	92.8	Very high	50 Å²	50	38 Å²	38	35%	0.35	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	178.6	168	72.5	0	0	0	0	108.2	L149 N153 R154	L149-S151 WeakPolarHBondContact CB-O 3.38Å; S151-N153 PolarHBondContact O-N 3.37Å; S151-R154 PolarHBondContact O-N 3.13Å; S151-R154 WeakPolarHBondContact OG-CB 3.33Å; S151-R154 PolarHBondContact OG-N 2.77Å
152	Q	81.8	Confident	92.7	Very high	78 Å²	78	35.3 Å²	35.3	36%	0.364	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-35.5	-178.2	-70.3	-60	-40.6	0	0	114.1	N221	Q152-N221 VanDerWaalsContact NE2-C 3.34Å; Q152-N221 PolarHBondContact NE2-O 3.24Å
153	N	83.4	Confident	92.7	Very high	160 Å²	160	41.8 Å²	41.8	86%	0.856	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126	9.5	-170.9	-60.3	-27.9	0	0	0	113.8	S151	S151-N153 PolarHBondContact O-N 3.37Å
154	R	85.8	Confident	92.6	Very high	102 Å²	102	40.5 Å²	40.5	39%	0.385	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.6	-173.9	-161.6	174.6	80	165.5	21.8	111.7	A18 G19 L149 V150 S151	A18-R154 PolarHBondContact O-NH2 3.27Å; G19-R154 PolarHBondContact O-NH2 3.04Å; L149-R154 CarbonylContact C-O 3.54Å; L149-R154 WeakPolarHBondContact CA-O 3.43Å; L149-R154 WeakPolarHBondContact CD2-O 3.42Å; V150-R154 HydrophobicContact CG2-CB 3.89Å; V150-R154 HydrophobicContact CG2-CG 3.97Å; V150-R154 VanDerWaalsContact CG2-O 3.32Å; V150-R154 WeakPolarHBondContact CG2-O 3.47Å; V150-R154 PolarHBondContact N-O 3.25Å; S151-R154 PolarHBondContact O-N 3.13Å; S151-R154 WeakPolarHBondContact OG-CB 3.33Å; S151-R154 PolarHBondContact OG-N 2.77Å
155	R	86.8	Confident	92.6	Very high	146 Å²	146	45.9 Å²	45.9	55%	0.551	21%	0.21	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	150.6	171.6	-173.4	168.6	-79.1	175.5	-4.4	110.3	L149	L149-R155 HydrophobicContact CD2-CB 3.8Å
156	T	92.1	Very high	92.6	Very high	14 Å²	14	46 Å²	46	9%	0.086	21%	0.211	C	C	.	.			trans	-102.5	147.5	171.1	-177.2	0	0	0	0	111	G148 V150 V158 Q160	G148-T156 WeakPolarHBondContact O-CG2 3.26Å; V150-T156 HydrophobicContact CG1-CG2 3.82Å; T156-V158 WeakPolarHBondContact CG2-O 3.17Å; T156-V158 WeakPolarHBondContact OG1-CG2 3.44Å; T156-V158 PolarHBondContact OG1-N 2.99Å; T156-V158 VanDerWaalsContact OG1-N 3.16Å; T156-V158 PolarHBondContact OG1-O 2.81Å; T156-Q160 HydrophobicContact CG2-CG 3.63Å; T156-Q160 PolarHBondContact OG1-NE2 2.91Å
157	N	94.7	Very high	92.7	Very high	54 Å²	54	47.5 Å²	47.5	29%	0.289	22%	0.218	S	C	.	.	S	Bend	trans	-94.6	-23.2	170.4	-61.1	-27.4	0	0	0	111.9	N78 I79 Q80	N78-N157 CarbonylContact C-O 3.58Å; N78-N157 VanDerWaalsContact CA-O 3.26Å; N78-N157 WeakPolarHBondContact CA-O 3.03Å; I79-N157 WeakPolarHBondContact CG1-O 3.49Å; I79-N157 PolarHBondContact N-O 3.49Å; Q80-N157 HydrophobicContact CB-CB 4.42Å; Q80-N157 VanDerWaalsContact CD-ND2 3.28Å; Q80-N157 HydrophobicContact CG-CB 4.14Å; Q80-N157 PolarHBondContact NE2-OD1 2.99Å; Q80-N157 VanDerWaalsContact NE2-OD1 3.08Å; Q80-N157 VanDerWaalsContact OE1-CG 3.31Å; Q80-N157 PolarHBondContact OE1-ND2 2.84Å; Q80-N157 PolarHBondContact OE1-OD1 2.86Å
158	V	97.5	Very high	92.7	Very high	29 Å²	29	56.2 Å²	56.2	18%	0.176	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-101.6	146.1	-178.6	-73.2	0	0	0	0	111.1	E26 H77 N78 T156 Q160	E26-V158 HydrophobicContact CG-CB 4.37Å; E26-V158 HydrophobicContact CG-CG2 4.11Å; H77-V158 CarbonylContact O-C 3.6Å; H77-V158 VanDerWaalsContact O-CA 3.3Å; H77-V158 WeakPolarHBondContact O-CA 3.37Å; N78-V158 HydrophobicContact CB-CG1 3.91Å; T156-V158 WeakPolarHBondContact CG2-O 3.17Å; T156-V158 WeakPolarHBondContact OG1-CG2 3.44Å; T156-V158 PolarHBondContact OG1-N 2.99Å; T156-V158 VanDerWaalsContact OG1-N 3.16Å; T156-V158 PolarHBondContact OG1-O 2.81Å; V158-Q160 PolarHBondContact O-N 2.78Å; V158-Q160 PolarHBondContact O-NE2 2.94Å; V158-Q160 VanDerWaalsContact O-NE2 3.12Å
159	L	98.3	Very high	93	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.016	27%	0.268	C	S	.	.			trans	-60.2	130.9	-178.7	-178.7	64.6	0	0	0	110.2	A27 H32 M35 H77 A145 W147	A27-L159 HydrophobicContact CB-CB 4.29Å; A27-L159 HydrophobicContact CB-CD2 4.02Å; A27-L159 HydrophobicContact CB-CG 3.92Å; A27-L159 PolarHBondContact N-O 2.91Å; H32-L159 HydrophobicContact CB-CD2 4.17Å; M35-L159 HydrophobicContact CE-CD1 4.09Å; M35-L159 HydrophobicContact CG-CD1 4.33Å; M35-L159 HydrophobicContact CG-CD2 4.13Å; H77-L159 PolarHBondContact O-N 3.16Å; A145-L159 HydrophobicContact CB-CD1 4.12Å; W147-L159 HydrophobicContact CD2-CD1 3.83Å; W147-L159 HydrophobicContact CE3-CD1 3.93Å; W147-L159 HydrophobicContact CH2-CD1 3.82Å; W147-L159 HydrophobicContact CZ2-CB 3.84Å; W147-L159 HydrophobicContact CZ2-CD1 3.68Å; W147-L159 HydrophobicContact CZ2-CD2 4.32Å; W147-L159 HydrophobicContact CZ2-CG 4.15Å; W147-L159 HydrophobicContact CZ3-CD1 3.93Å; W147-L159 VanDerWaalsContact NE1-N 3.17Å
160	Q	97.9	Very high	93.4	Very high	5 Å²	5	66.9 Å²	66.9	2%	0.023	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	155.5	175.9	-58.3	-59.5	-56.5	0	0	109.9	I21 R25 E26 A145 G146 V150 T156 V158	I21-Q160 HydrophobicContact CB-CB 4.02Å; I21-Q160 HydrophobicContact CD1-CB 3.65Å; I21-Q160 WeakPolarHBondContact CD1-O 3.27Å; I21-Q160 HydrophobicContact CG1-CB 3.55Å; I21-Q160 HydrophobicContact CG1-CG 4.38Å; R25-Q160 CarbonylContact O-C 3.47Å; R25-Q160 WeakPolarHBondContact O-CA 3.3Å; R25-Q160 PolarHBondContact O-OE1 3.03Å; E26-Q160 VanDerWaalsContact N-OE1 3.11Å; A145-Q160 CarbonylContact C-O 3.51Å; A145-Q160 WeakPolarHBondContact CA-O 3.04Å; A145-Q160 VanDerWaalsContact CB-O 3.26Å; A145-Q160 WeakPolarHBondContact CB-O 3.49Å; G146-Q160 PolarHBondContact N-O 2.86Å; G146-Q160 PolarHBondContact O-N 2.96Å; V150-Q160 HydrophobicContact CG1-CG 4.07Å; T156-Q160 HydrophobicContact CG2-CG 3.63Å; T156-Q160 PolarHBondContact OG1-NE2 2.91Å; V158-Q160 PolarHBondContact O-N 2.78Å; V158-Q160 PolarHBondContact O-NE2 2.94Å; V158-Q160 VanDerWaalsContact O-NE2 3.12Å
161	E	97.4	Very high	94	Very high	22 Å²	22	73.2 Å²	73.2	10%	0.103	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	150.6	170.8	63.2	166.3	-162.3	0	0	111.6	G24 R25 A27 H32 T143 V144 A145	G24-E161 CarbonylContact C-O 3.54Å; G24-E161 VanDerWaalsContact CA-O 3.23Å; G24-E161 WeakPolarHBondContact CA-O 3.47Å; R25-E161 HydrophobicContact CG-CG 3.97Å; R25-E161 IonicContact CZ-OE1 3.27Å; R25-E161 VanDerWaalsContact CZ-OE1 3.27Å; R25-E161 PolarHBondContact N-O 2.92Å; R25-E161 IonicContact NE-OE1 2.82Å; R25-E161 PolarHBondContact NE-OE1 2.82Å; R25-E161 IonicContact NH2-OE1 2.82Å; R25-E161 PolarHBondContact NH2-OE1 3.35Å; R25-E161 PolarHBondContact O-N 3.16Å; A27-E161 HydrophobicContact CB-CB 4.31Å; A27-E161 HydrophobicContact CB-CG 4.1Å; H32-E161 IonicContact CE1-OE2 3.37Å; H32-E161 PolarHBondContact CE1-OE2 3.47Å; H32-E161 VanDerWaalsContact CE1-OE2 3.28Å; H32-E161 IonicContact NE2-OE2 3Å; H32-E161 PolarHBondContact NE2-OE2 3.32Å; T143-E161 HydrophobicContact CG2-CB 4.03Å; V144-E161 CarbonylContact O-C 3.55Å; V144-E161 VanDerWaalsContact O-CA 3.26Å; V144-E161 WeakPolarHBondContact O-CA 3.38Å; A145-E161 HydrophobicContact CB-CB 4.21Å
162	V	96.3	Very high	94.8	Very high	7 Å²	7	70.9 Å²	70.9	4%	0.042	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	143.1	172	66.5	0	0	0	0	110.1	I21 T143 V144 L164 K194	I21-V162 HydrophobicContact CB-CG1 4.44Å; I21-V162 HydrophobicContact CG2-CB 4.01Å; I21-V162 HydrophobicContact CG2-CG1 3.44Å; I21-V162 VanDerWaalsContact CG2-CG1 3.44Å; T143-V162 WeakPolarHBondContact CA-O 3.39Å; V144-V162 HydrophobicContact CB-CG1 4.33Å; V144-V162 PolarHBondContact N-O 2.78Å; V144-V162 PolarHBondContact O-N 2.84Å; V162-L164 HydrophobicContact CG1-CD1 4.19Å; V162-L164 HydrophobicContact CG1-CD2 4.08Å; V162-L164 HydrophobicContact CG1-CG 3.96Å; V162-L164 HydrophobicContact CG2-CD2 3.99Å; V162-K194 HydrophobicContact CG2-CB 3.95Å; V162-K194 HydrophobicContact CG2-CD 3.87Å; V162-K194 HydrophobicContact CG2-CG 4.01Å
163	R	97.2	Very high	95.5	Very high	137 Å²	137	70 Å²	70	52%	0.517	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.4	172	-60.2	-176.1	80.4	175	5.7	109.8	L141 C142	L141-R163 HydrophobicContact CD1-CB 3.84Å; L141-R163 HydrophobicContact CG-CB 4.16Å; C142-R163 CarbonylContact O-C 3.58Å; C142-R163 VanDerWaalsContact O-CA 3.23Å; C142-R163 WeakPolarHBondContact O-CA 3.35Å
164	L	97.5	Very high	96.1	Very high	4 Å²	4	67.1 Å²	67.1	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.9	-179.2	-56.9	177.5	0	0	0	110.5	C142 V144 V162 V187 K194	C142-L164 PolarHBondContact N-O 2.9Å; C142-L164 PolarHBondContact O-N 2.76Å; V144-L164 HydrophobicContact CB-CD1 4.47Å; V144-L164 HydrophobicContact CG2-CD1 3.94Å; V162-L164 HydrophobicContact CG1-CD1 4.19Å; V162-L164 HydrophobicContact CG1-CD2 4.08Å; V162-L164 HydrophobicContact CG1-CG 3.96Å; V162-L164 HydrophobicContact CG2-CD2 3.99Å; L164-V187 HydrophobicContact CB-CG1 3.54Å; L164-V187 HydrophobicContact CD1-CG1 3.98Å; L164-V187 HydrophobicContact CG-CG1 4.41Å; L164-K194 HydrophobicContact CD2-CB 3.6Å; L164-K194 VanDerWaalsContact CD2-O 3.27Å; L164-K194 WeakPolarHBondContact CD2-O 3.24Å
165	R	97.8	Very high	96.6	Very high	112 Å²	112	67.3 Å²	67.3	42%	0.423	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	132.2	175.8	-70.4	-178.3	-179.7	-93.9	7.7	111	G139 D140 L141 Q167 G188	G139-R165 PolarHBondContact O-NH1 2.79Å; D140-R165 CarbonylContact O-C 3.34Å; D140-R165 VanDerWaalsContact O-CA 3.31Å; D140-R165 WeakPolarHBondContact O-CA 3.34Å; L141-R165 HydrophobicContact CD1-CG 3.84Å; R165-Q167 PolarHBondContact O-N 2.98Å; R165-Q167 PolarHBondContact O-NE2 3.31Å; R165-G188 PolarHBondContact O-N 3.01Å
166	V	98.4	Very high	97.1	Very high	6 Å²	6	61.7 Å²	61.7	4%	0.036	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-61.2	133.2	166.6	179.4	0	0	0	0	108.8	V136 R137 P138 G139 D140 I185	V136-V166 HydrophobicContact CB-CG2 4.28Å; R137-V166 WeakPolarHBondContact O-CB 3.42Å; P138-V166 WeakPolarHBondContact CA-O 3.22Å; G139-V166 PolarHBondContact N-O 3.38Å; D140-V166 HydrophobicContact CB-CB 4.41Å; D140-V166 HydrophobicContact CB-CG2 4.13Å; D140-V166 PolarHBondContact O-N 2.85Å; V166-I185 HydrophobicContact CG1-CG2 4.01Å
167	Q	98.4	Very high	97.2	Very high	31 Å²	31	68.9 Å²	68.9	15%	0.145	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-102.2	166.5	179.9	-60.5	-54.9	-60.6	0	0	110.9	R165 R171 C186 G188 P225	R165-Q167 PolarHBondContact O-N 2.98Å; R165-Q167 PolarHBondContact O-NE2 3.31Å; Q167-R171 HydrophobicContact CB-CB 4.24Å; Q167-R171 HydrophobicContact CB-CG 4.32Å; Q167-C186 HydrophobicContact CB-CB 4.12Å; Q167-C186 PolarHBondContact N-O 3.08Å; Q167-G188 WeakPolarHBondContact CG-O 3.47Å; Q167-P225 HydrophobicContact CG-CB 4.49Å
168	R	98	Very high	97.3	Very high	189 Å²	189	69.5 Å²	69.5	71%	0.713	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-66.8	140.3	166.5	-66.8	-179.1	178.1	153.4	-0.5	109.1	P138 R170 R171	P138-R168 HydrophobicContact CB-CG 3.85Å; P138-R168 HydrophobicContact CG-CG 3.97Å; R168-R170 PolarHBondContact O-N 3.11Å; R168-R170 VanDerWaalsContact O-N 3.09Å; R168-R171 WeakPolarHBondContact O-CB 3.29Å; R168-R171 PolarHBondContact O-N 2.96Å
169	D	98.1	Very high	97.4	Very high	67 Å²	67	69.2 Å²	69.2	36%	0.358	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-39.8	179.1	-68	-56.3	0	0	0	113	R171 C172 S173 Y179 S181	D169-R171 PolarHBondContact O-N 2.77Å; D169-C172 PolarHBondContact O-N 3.44Å; D169-S173 PolarHBondContact O-N 3.23Å; D169-Y179 HydrophobicContact CB-CE1 3.92Å; D169-Y179 PolarHBondContact OD1-OH 2.04Å; D169-S181 VanDerWaalsContact CG-CB 3.44Å; D169-S181 WeakPolarHBondContact OD1-CB 3.04Å
170	R	97.5	Very high	97.4	Very high	181 Å²	181	72.1 Å²	72.1	68%	0.683	32%	0.324	S	S	*	.	H	α-helix	trans	-51	-34.7	177.3	-172.1	172	176.9	174.6	2.5	113.6	R168 C172 S173 D174	R168-R170 PolarHBondContact O-N 3.11Å; R168-R170 VanDerWaalsContact O-N 3.09Å; R170-C172 VanDerWaalsContact C-N 3.27Å; R170-C172 PolarHBondContact O-N 2.89Å; R170-S173 VanDerWaalsContact CA-OG 3.28Å; R170-S173 WeakPolarHBondContact CA-OG 3.32Å; R170-S173 PolarHBondContact O-N 3.42Å; R170-S173 PolarHBondContact O-OG 3.25Å; R170-S173 VanDerWaalsContact O-OG 3.13Å; R170-D174 WeakPolarHBondContact CG-OD2 3.42Å; R170-D174 IonicContact NE-OD1 3.66Å; R170-D174 IonicContact NE-OD2 3.28Å; R170-D174 WeakPolarHBondContact O-CB 3.4Å; R170-D174 PolarHBondContact O-N 3.01Å
171	R	97.1	Very high	97.3	Very high	141 Å²	141	74.3 Å²	74.3	53%	0.532	34%	0.34	S	S	.	.	H	α-helix	trans	-64.3	-31.6	179.3	-66.9	-60.3	-172.1	-160.6	0.3	113.3	Q167 R168 D169 P225	Q167-R171 HydrophobicContact CB-CB 4.24Å; Q167-R171 HydrophobicContact CB-CG 4.32Å; R168-R171 WeakPolarHBondContact O-CB 3.29Å; R168-R171 PolarHBondContact O-N 2.96Å; D169-R171 PolarHBondContact O-N 2.77Å; R171-P225 HydrophobicContact CB-CG 4.5Å
172	C	98	Very high	97.3	Very high	0 Å²	0	80.1 Å²	80.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-89.4	-37.7	176.1	-76.6	0	0	0	0	111.4	D169 R170 D174 R175 F176 Y179 C186 V227	D169-C172 PolarHBondContact O-N 3.44Å; R170-C172 VanDerWaalsContact C-N 3.27Å; R170-C172 PolarHBondContact O-N 2.89Å; C172-D174 VanDerWaalsContact C-N 3.25Å; C172-D174 PolarHBondContact O-N 2.99Å; C172-R175 PolarHBondContact O-N 3.18Å; C172-F176 HydrophobicContact CB-CD2 4Å; C172-F176 PolarHBondContact O-N 2.99Å; C172-Y179 HydrophobicContact CB-CD1 3.96Å; C172-Y179 HydrophobicContact CB-CD2 3.57Å; C172-Y179 HydrophobicContact CB-CE1 4.08Å; C172-Y179 HydrophobicContact CB-CE2 3.68Å; C172-Y179 HydrophobicContact CB-CG 3.71Å; C172-C186 HydrophobicContact CB-CB 3.65Å; C172-C186 WeakPolarHBondContact CB-SG 3.48Å; C172-C186 PolarHBondContact N-SG 3.47Å; C172-C186 WeakPolarHBondContact SG-CA 3.45Å; C172-C186 WeakPolarHBondContact SG-CB 3.49Å; C172-C186 CovalentContact SG-SG 2.03Å; C172-C186 PolarHBondContact SG-SG 3.37Å; C172-V227 HydrophobicContact CB-CG2 4.29Å
173	S	97.5	Very high	97.4	Very high	59 Å²	59	80.8 Å²	80.8	41%	0.413	37%	0.371	S	S	.	.	H	α-helix	trans	-63.5	-31.3	175.6	65.8	0	0	0	0	113	D169 R170 R175	D169-S173 PolarHBondContact O-N 3.23Å; R170-S173 VanDerWaalsContact CA-OG 3.28Å; R170-S173 WeakPolarHBondContact CA-OG 3.32Å; R170-S173 PolarHBondContact O-N 3.42Å; R170-S173 PolarHBondContact O-OG 3.25Å; R170-S173 VanDerWaalsContact O-OG 3.13Å; S173-R175 PolarHBondContact O-N 3.06Å
174	D	96.6	Very high	97.5	Very high	101 Å²	101	74.4 Å²	74.4	54%	0.54	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-13	175.2	-65.4	-10.4	0	0	0	112.6	R170 C172	R170-D174 WeakPolarHBondContact CG-OD2 3.42Å; R170-D174 IonicContact NE-OD1 3.66Å; R170-D174 IonicContact NE-OD2 3.28Å; R170-D174 WeakPolarHBondContact O-CB 3.4Å; R170-D174 PolarHBondContact O-N 3.01Å; C172-D174 VanDerWaalsContact C-N 3.25Å; C172-D174 PolarHBondContact O-N 2.99Å
175	R	95.8	Very high	97.5	Very high	105 Å²	105	74.5 Å²	74.5	40%	0.396	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-30.1	-174.2	-173.8	178.9	-176	90.1	3.5	113.9	C172 S173 D219	C172-R175 PolarHBondContact O-N 3.18Å; S173-R175 PolarHBondContact O-N 3.06Å; R175-D219 IonicContact CZ-OD2 3.49Å; R175-D219 IonicContact NH2-OD1 2.97Å; R175-D219 IonicContact NH2-OD2 3.89Å; R175-D219 PolarHBondContact NH2-OD2 3.38Å
176	F	96.4	Very high	97.5	Very high	29 Å²	29	69.2 Å²	69.2	13%	0.127	33%	0.327	C	S	.	.			trans	-129.6	104	-172.4	-54.7	-67.9	0	0	0	108.7	C172 T178 Y179 Y217 P225 V227	C172-F176 HydrophobicContact CB-CD2 4Å; C172-F176 PolarHBondContact O-N 2.99Å; F176-T178 PolarHBondContact O-N 3.12Å; F176-T178 VanDerWaalsContact O-N 3.15Å; F176-Y179 WeakPolarHBondContact O-CB 3.39Å; F176-Y179 PolarHBondContact O-N 3.43Å; F176-Y217 HydrophobicContact CB-CE2 4.08Å; F176-Y217 HydrophobicContact CD1-CD2 4.31Å; F176-Y217 AromaticContact CD1-CE2 3.85Å; F176-Y217 HydrophobicContact CD1-CE2 3.85Å; F176-Y217 HydrophobicContact CD2-CE2 4.36Å; F176-Y217 HydrophobicContact CE1-CD2 4.4Å; F176-Y217 HydrophobicContact CE1-CE2 4.34Å; F176-Y217 AromaticContact CG-CE2 3.86Å; F176-Y217 HydrophobicContact CG-CE2 3.86Å; F176-P225 HydrophobicContact CE2-CG 4.44Å; F176-P225 WeakPolarHBondContact CZ-O 3.29Å; F176-V227 HydrophobicContact CD2-CG2 3.54Å; F176-V227 HydrophobicContact CE2-CG2 3.73Å; F176-V227 HydrophobicContact CG-CG2 4.24Å
177	D	95.6	Very high	97.5	Very high	165 Å²	165	69 Å²	69	88%	0.882	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.9	-172.6	-59.8	-26.2	0	0	0	113.5	Y179	D177-Y179 VanDerWaalsContact C-N 3.33Å
178	T	96.6	Very high	97.5	Very high	66 Å²	66	67.5 Å²	67.5	41%	0.405	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	3.6	179.8	62.6	0	0	0	0	113.7	T104 F176 N180	T104-T178 HydrophobicContact CG2-CG2 3.98Å; T104-T178 PolarHBondContact O-OG1 3.37Å; T104-T178 VanDerWaalsContact O-OG1 3.09Å; F176-T178 PolarHBondContact O-N 3.12Å; F176-T178 VanDerWaalsContact O-N 3.15Å; T178-N180 PolarHBondContact O-N 2.85Å
179	Y	98.4	Very high	97.2	Very high	24 Å²	24	60.3 Å²	60.3	9%	0.094	30%	0.295	C	S	.	.			trans	-64.6	126.9	-177.7	178	-100.2	0	0	0	112.1	D169 C172 F176 D177 Q184 C186 V227	D169-Y179 HydrophobicContact CB-CE1 3.92Å; D169-Y179 PolarHBondContact OD1-OH 2.04Å; C172-Y179 HydrophobicContact CB-CD1 3.96Å; C172-Y179 HydrophobicContact CB-CD2 3.57Å; C172-Y179 HydrophobicContact CB-CE1 4.08Å; C172-Y179 HydrophobicContact CB-CE2 3.68Å; C172-Y179 HydrophobicContact CB-CG 3.71Å; F176-Y179 WeakPolarHBondContact O-CB 3.39Å; F176-Y179 PolarHBondContact O-N 3.43Å; D177-Y179 VanDerWaalsContact C-N 3.33Å; Y179-Q184 VanDerWaalsContact CA-OE1 3.32Å; Y179-Q184 HydrophobicContact CD2-CB 4.07Å; Y179-Q184 HydrophobicContact CE2-CB 3.68Å; Y179-C186 HydrophobicContact CE2-CB 4.38Å; Y179-C186 PolarHBondContact OH-N 3.22Å; Y179-V227 HydrophobicContact CD2-CG1 3.88Å; Y179-V227 HydrophobicContact CD2-CG2 3.89Å; Y179-V227 HydrophobicContact CE2-CG1 4.03Å; Y179-V227 HydrophobicContact CE2-CG2 4.33Å
180	N	98.1	Very high	96.8	Very high	64 Å²	64	60.1 Å²	60.1	34%	0.342	30%	0.298	S	S	.	.			trans	-121	106.6	176.1	-174.1	-13.9	0	0	0	111.3	T178 Q182 T183 Q184	T178-N180 PolarHBondContact O-N 2.85Å; N180-Q182 PolarHBondContact O-N 3.47Å; N180-Q182 VanDerWaalsContact OD1-CB 3.26Å; N180-Q182 WeakPolarHBondContact OD1-CB 2.98Å; N180-Q182 PolarHBondContact OD1-N 3.01Å; N180-T183 PolarHBondContact O-N 3.01Å; N180-T183 VanDerWaalsContact O-N 3.08Å; N180-Q184 WeakPolarHBondContact O-CB 3.38Å; N180-Q184 PolarHBondContact O-N 3.47Å
181	S	97.4	Very high	96.5	Very high	51 Å²	51	62.6 Å²	62.6	36%	0.357	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-17	177.5	66.6	0	0	0	0	114.5	D169 K230	D169-S181 VanDerWaalsContact CG-CB 3.44Å; D169-S181 WeakPolarHBondContact OD1-CB 3.04Å; S181-K230 PolarHBondContact O-NZ 2.59Å
182	Q	96.9	Very high	96.1	Very high	143 Å²	143	58.4 Å²	58.4	67%	0.668	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-31.4	176.5	-62	-177.8	-19.1	0	0	112.3	N180 S233	N180-Q182 PolarHBondContact O-N 3.47Å; N180-Q182 VanDerWaalsContact OD1-CB 3.26Å; N180-Q182 WeakPolarHBondContact OD1-CB 2.98Å; N180-Q182 PolarHBondContact OD1-N 3.01Å; Q182-S233 WeakPolarHBondContact O-CB 3.2Å; Q182-S233 PolarHBondContact O-OG 3.45Å
183	T	97.9	Very high	95.6	Very high	22 Å²	22	69 Å²	69	14%	0.135	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-3.6	-174.2	57.6	0	0	0	0	113.2	N180 K230 F234	N180-T183 PolarHBondContact O-N 3.01Å; N180-T183 VanDerWaalsContact O-N 3.08Å; T183-K230 VanDerWaalsContact C-CB 3.48Å; T183-K230 VanDerWaalsContact O-CB 3.29Å; T183-K230 WeakPolarHBondContact O-CB 3.27Å; T183-K230 PolarHBondContact O-N 2.92Å; T183-F234 HydrophobicContact CG2-CZ 4.06Å
184	Q	98.7	Very high	95.2	Very high	3 Å²	3	69.6 Å²	69.6	1%	0.014	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	164	-177.5	-63.7	166.8	-24.2	0	0	112.7	I105 Y179 N180 V227 F228 K230	I105-Q184 PolarHBondContact O-NE2 3.45Å; Y179-Q184 VanDerWaalsContact CA-OE1 3.32Å; Y179-Q184 HydrophobicContact CD2-CB 4.07Å; Y179-Q184 HydrophobicContact CE2-CB 3.68Å; N180-Q184 WeakPolarHBondContact O-CB 3.38Å; N180-Q184 PolarHBondContact O-N 3.47Å; Q184-V227 HydrophobicContact CB-CG1 3.74Å; Q184-V227 HydrophobicContact CG-CG1 3.9Å; Q184-F228 CarbonylContact C-O 3.42Å; Q184-F228 WeakPolarHBondContact CA-O 3.24Å; Q184-K230 WeakPolarHBondContact O-CE 3.26Å; Q184-K230 PolarHBondContact O-NZ 3.03Å
185	I	98.5	Very high	95	Very high	5 Å²	5	64.9 Å²	64.9	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.2	179.5	-49.9	171.2	0	0	0	108.2	V136 V166 V187 L205 Q212 F228 K230	V136-I185 HydrophobicContact CG2-CD1 4.03Å; V136-I185 HydrophobicContact CG2-CG2 4.23Å; V166-I185 HydrophobicContact CG1-CG2 4.01Å; I185-V187 HydrophobicContact CB-CG2 4.27Å; I185-V187 HydrophobicContact CG2-CG2 3.69Å; I185-L205 HydrophobicContact CD1-CD2 4.38Å; I185-Q212 WeakPolarHBondContact CD1-O 3.26Å; I185-F228 HydrophobicContact CB-CB 4.33Å; I185-F228 PolarHBondContact N-O 2.91Å; I185-F228 PolarHBondContact O-N 2.6Å; I185-K230 HydrophobicContact CD1-CB 4.17Å; I185-K230 HydrophobicContact CD1-CG 4.16Å; I185-K230 HydrophobicContact CG1-CB 3.75Å; I185-K230 HydrophobicContact CG1-CD 4.48Å; I185-K230 HydrophobicContact CG1-CG 3.96Å
186	C	98.4	Very high	94.7	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.007	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.3	172.5	-164	0	0	0	0	111.1	Q167 C172 Y179	Q167-C186 HydrophobicContact CB-CB 4.12Å; Q167-C186 PolarHBondContact N-O 3.08Å; C172-C186 HydrophobicContact CB-CB 3.65Å; C172-C186 WeakPolarHBondContact CB-SG 3.48Å; C172-C186 PolarHBondContact N-SG 3.47Å; C172-C186 WeakPolarHBondContact SG-CA 3.45Å; C172-C186 WeakPolarHBondContact SG-CB 3.49Å; C172-C186 CovalentContact SG-SG 2.03Å; C172-C186 PolarHBondContact SG-SG 3.37Å; Y179-C186 HydrophobicContact CE2-CB 4.38Å; Y179-C186 PolarHBondContact OH-N 3.22Å
187	V	98.4	Very high	94.5	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	139.2	-171.2	-174.8	0	0	0	0	111.7	L164 I185 L205 P225 A226 F228	L164-V187 HydrophobicContact CB-CG1 3.54Å; L164-V187 HydrophobicContact CD1-CG1 3.98Å; L164-V187 HydrophobicContact CG-CG1 4.41Å; I185-V187 HydrophobicContact CB-CG2 4.27Å; I185-V187 HydrophobicContact CG2-CG2 3.69Å; V187-L205 HydrophobicContact CG1-CD1 3.96Å; V187-L205 HydrophobicContact CG2-CD1 4.48Å; V187-L205 HydrophobicContact CG2-CD2 3.75Å; V187-P225 CarbonylContact O-C 3.59Å; V187-P225 VanDerWaalsContact O-CA 3.3Å; V187-P225 WeakPolarHBondContact O-CA 3.44Å; V187-P225 WeakPolarHBondContact O-CB 3.44Å; V187-A226 PolarHBondContact N-O 2.98Å; V187-A226 PolarHBondContact O-N 3.06Å; V187-F228 HydrophobicContact CB-CD2 3.68Å; V187-F228 HydrophobicContact CB-CE2 3.67Å; V187-F228 HydrophobicContact CG1-CD2 4.47Å; V187-F228 HydrophobicContact CG1-CE2 4.11Å; V187-F228 HydrophobicContact CG2-CB 4.46Å; V187-F228 HydrophobicContact CG2-CD2 3.59Å; V187-F228 HydrophobicContact CG2-CE2 4.05Å; V187-F228 HydrophobicContact CG2-CG 4.09Å
188	G	97.2	Very high	94.2	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.01	27%	0.268	C	S	.	.	S	Bend	trans	104.3	129.1	177.2	0	0	0	0	0	112.1	R165 Q167 P190	R165-G188 PolarHBondContact O-N 3.01Å; Q167-G188 WeakPolarHBondContact CG-O 3.47Å; G188-P190 WeakPolarHBondContact O-CD 3.31Å
189	N	93.2	Very high	93.9	Very high	38 Å²	38	56.2 Å²	56.2	20%	0.203	26%	0.257	C	S	.	.			trans	-79.9	121.5	179.2	179.8	-2.6	0	0	0	109.2	R191 E192	N189-R191 PolarHBondContact O-N 3.44Å; N189-R191 WeakPolarHBondContact OD1-CB 3.28Å; N189-R191 PolarHBondContact OD1-N 3.46Å; N189-R191 VanDerWaalsContact OD1-N 3.09Å; N189-E192 HydrophobicContact CB-CB 4.24Å; N189-E192 HydrophobicContact CB-CG 4.04Å; N189-E192 PolarHBondContact ND2-OE1 2.8Å; N189-E192 PolarHBondContact O-N 3.19Å
190	P	89.6	Confident	93.8	Very high	63 Å²	63	55 Å²	55	41%	0.409	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.2	-180	-24.2	34.4	0	0	0	114.4	G188 E192	G188-P190 WeakPolarHBondContact O-CD 3.31Å; P190-E192 VanDerWaalsContact C-N 3.33Å
191	R	90	Very high	93.7	Very high	232 Å²	232	53 Å²	53	88%	0.875	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.2	176.6	-59.3	-179	-179.9	170.4	-1.7	113.3	N189	N189-R191 PolarHBondContact O-N 3.44Å; N189-R191 WeakPolarHBondContact OD1-CB 3.28Å; N189-R191 PolarHBondContact OD1-N 3.46Å; N189-R191 VanDerWaalsContact OD1-N 3.09Å
192	E	88.4	Confident	93.8	Very high	54 Å²	54	50.6 Å²	50.6	25%	0.252	23%	0.227	S	C	.	.	S	Bend	trans	-106.7	139.3	177.8	-66.4	178.3	-131.3	0	0	109.2	N189 P190 K194 P224	N189-E192 HydrophobicContact CB-CB 4.24Å; N189-E192 HydrophobicContact CB-CG 4.04Å; N189-E192 PolarHBondContact ND2-OE1 2.8Å; N189-E192 PolarHBondContact O-N 3.19Å; P190-E192 VanDerWaalsContact C-N 3.33Å; E192-K194 HydrophobicContact CB-CB 4.35Å; E192-K194 HydrophobicContact CB-CG 4.37Å; E192-K194 PolarHBondContact O-N 3.46Å; E192-K194 WeakPolarHBondContact OE2-CD 3.37Å; E192-K194 IonicContact OE2-NZ 4Å; E192-K194 PolarHBondContact OE2-NZ 3.3Å; E192-P224 WeakPolarHBondContact O-CG 3.27Å
193	R	87.3	Confident	93.9	Very high	223 Å²	223	43.8 Å²	43.8	84%	0.842	20%	0.195	S	C	*	.	S	Bend	trans	-82.4	60.2	171	-62	-175.1	76.1	-174.2	4.8	109.5	I22 G23	I22-R193 CarbonylContact C-O 3.51Å; I22-R193 WeakPolarHBondContact CG2-O 3.41Å; G23-R193 WeakPolarHBondContact CA-O 3.41Å; G23-R193 PolarHBondContact N-O 2.77Å
194	K	90.6	Very high	93.9	Very high	70 Å²	70	42.8 Å²	42.8	30%	0.304	19%	0.189	S	C	.	.			trans	-133.6	116.9	-177.3	-67.6	-177.4	-169.2	153.7	0	113.1	I22 V162 L164 E192 P224	I22-K194 WeakPolarHBondContact O-CA 3.29Å; V162-K194 HydrophobicContact CG2-CB 3.95Å; V162-K194 HydrophobicContact CG2-CD 3.87Å; V162-K194 HydrophobicContact CG2-CG 4.01Å; L164-K194 HydrophobicContact CD2-CB 3.6Å; L164-K194 VanDerWaalsContact CD2-O 3.27Å; L164-K194 WeakPolarHBondContact CD2-O 3.24Å; E192-K194 HydrophobicContact CB-CB 4.35Å; E192-K194 HydrophobicContact CB-CG 4.37Å; E192-K194 PolarHBondContact O-N 3.46Å; E192-K194 WeakPolarHBondContact OE2-CD 3.37Å; E192-K194 IonicContact OE2-NZ 4Å; E192-K194 PolarHBondContact OE2-NZ 3.3Å; K194-P224 WeakPolarHBondContact O-CG 3.46Å
195	S	90.8	Very high	93.9	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.021	19%	0.188	C	C	.	.			trans	-154.3	152.9	179.9	-165.5	0	0	0	0	112.1	I21 I22 G222	I21-S195 WeakPolarHBondContact CG2-O 3.16Å; I22-S195 PolarHBondContact N-O 2.9Å; I22-S195 PolarHBondContact O-N 3.05Å; I22-S195 VanDerWaalsContact O-N 3.16Å; S195-G222 VanDerWaalsContact CB-O 3.3Å; S195-G222 WeakPolarHBondContact CB-O 3.49Å
196	A	90.8	Very high	93.9	Very high	7 Å²	7	42.9 Å²	42.9	6%	0.058	19%	0.19	C	C	.	.			trans	-63.9	150.9	153.9	0	0	0	0	0	109.4	V144 D200 V215 F228	V144-A196 HydrophobicContact CG1-CB 4.15Å; A196-D200 HydrophobicContact CB-CB 4.15Å; A196-V215 HydrophobicContact CB-CG1 3.79Å; A196-V215 HydrophobicContact CB-CG2 3.97Å; A196-F228 HydrophobicContact CB-CZ 4.12Å
197	F	91.6	Very high	93.9	Very high	14 Å²	14	43 Å²	43	6%	0.061	19%	0.191	C	C	.	.			trans	-143.3	-166	-176.8	-160.2	-137.8	0	0	0	112.4	I22 L149 G199 D200 R220 G222	I22-F197 HydrophobicContact CD1-CB 3.94Å; I22-F197 HydrophobicContact CD1-CD1 3.79Å; I22-F197 HydrophobicContact CD1-CD2 4Å; I22-F197 HydrophobicContact CD1-CE1 4.33Å; I22-F197 HydrophobicContact CD1-CG 3.64Å; I22-F197 HydrophobicContact CG1-CB 4.19Å; I22-F197 HydrophobicContact CG1-CD1 4.28Å; I22-F197 HydrophobicContact CG1-CG 4.3Å; L149-F197 HydrophobicContact CB-CD1 3.57Å; L149-F197 HydrophobicContact CB-CE1 4.03Å; L149-F197 HydrophobicContact CD1-CD1 4.37Å; L149-F197 HydrophobicContact CD1-CE1 4.04Å; F197-G199 PolarHBondContact O-N 3.09Å; F197-D200 PolarHBondContact N-OD2 2.87Å; F197-D200 WeakPolarHBondContact O-CB 3.45Å; F197-D200 PolarHBondContact O-N 2.93Å; F197-R220 WeakPolarHBondContact CE2-O 3.38Å; F197-G222 VanDerWaalsContact CE2-N 3.35Å
198	R	88.8	Confident	93.7	Very high	144 Å²	144	50 Å²	50	54%	0.543	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	125.1	-172.7	-58.6	-175.1	-174.3	-162.5	3.5	110.9	G148 L149	G148-R198 CarbonylContact C-O 3.53Å; G148-R198 WeakPolarHBondContact CA-O 3.02Å; L149-R198 HydrophobicContact CD1-CB 3.89Å; L149-R198 HydrophobicContact CD1-CG 4.36Å; L149-R198 HydrophobicContact CG-CB 4.13Å; L149-R198 PolarHBondContact N-O 2.03Å
199	G	90.3	Very high	93.6	Very high	17 Å²	17	56.5 Å²	56.5	18%	0.175	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	-10.8	-177.1	0	0	0	0	0	114.7	G50 F197 S201	G50-G199 PolarHBondContact N-O 2.82Å; F197-G199 PolarHBondContact O-N 3.09Å; G199-S201 VanDerWaalsContact C-N 3.32Å
200	D	96.3	Very high	93.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.257	C	S	.	.			trans	-82.9	-13	169.6	-60.5	-43.1	0	0	0	112.4	G146 G148 A196 F197 G202 G203 V215	G146-D200 WeakPolarHBondContact CA-OD1 3.06Å; G148-D200 VanDerWaalsContact CA-OD1 3.28Å; G148-D200 WeakPolarHBondContact CA-OD1 3.43Å; G148-D200 PolarHBondContact N-OD1 3.22Å; A196-D200 HydrophobicContact CB-CB 4.15Å; F197-D200 PolarHBondContact N-OD2 2.87Å; F197-D200 WeakPolarHBondContact O-CB 3.45Å; F197-D200 PolarHBondContact O-N 2.93Å; D200-G202 PolarHBondContact O-N 2.94Å; D200-G203 WeakPolarHBondContact O-CA 3.07Å; D200-G203 PolarHBondContact O-N 3.24Å; D200-V215 HydrophobicContact CB-CG1 4.41Å; D200-V215 WeakPolarHBondContact O-CB 3.48Å; D200-V215 WeakPolarHBondContact O-CG2 2.95Å
201	S	97.6	Very high	94.2	Very high	21 Å²	21	52.3 Å²	52.3	15%	0.147	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.6	136	174.8	-69.8	0	0	0	0	112.2	C49 G50 H64 G199 G203	C49-S201 WeakPolarHBondContact CB-O 3.39Å; G50-S201 WeakPolarHBondContact CA-O 3.38Å; G50-S201 PolarHBondContact N-O 3.18Å; H64-S201 WeakPolarHBondContact NE2-CB 3.3Å; H64-S201 PolarHBondContact NE2-OG 2.74Å; G199-S201 VanDerWaalsContact C-N 3.32Å; S201-G203 PolarHBondContact O-N 2.83Å
202	G	98.7	Very high	94.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	-14.8	-175.1	0	0	0	0	0	115.2	G50 G51 F52 T61 A62 D200 V215	G50-G202 CarbonylContact O-C 3.54Å; G50-G202 WeakPolarHBondContact O-CA 3.48Å; G51-G202 WeakPolarHBondContact CA-O 3.23Å; F52-G202 WeakPolarHBondContact CD1-O 3.23Å; T61-G202 WeakPolarHBondContact OG1-CA 3.32Å; A62-G202 VanDerWaalsContact N-CA 3.34Å; D200-G202 PolarHBondContact O-N 2.94Å; G202-V215 PolarHBondContact N-O 2.86Å
203	G	98.7	Very high	95.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.186	C	C	.	.			trans	-65.5	156.3	173.3	0	0	0	0	0	112.8	D200 S201 I214 V215	D200-G203 WeakPolarHBondContact O-CA 3.07Å; D200-G203 PolarHBondContact O-N 3.24Å; S201-G203 PolarHBondContact O-N 2.83Å; G203-I214 CarbonylContact O-C 3.56Å; G203-I214 WeakPolarHBondContact O-CA 3.47Å; G203-V215 WeakPolarHBondContact O-CG2 3.45Å; G203-V215 PolarHBondContact O-N 3.43Å
204	P	98.7	Very high	95.7	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	144.7	-176.9	32.2	-32.3	0	0	0	112.8	Y34 M35 F52 V206 A211 G213	Y34-P204 HydrophobicContact CD2-CG 4.02Å; Y34-P204 HydrophobicContact CE2-CG 3.67Å; M35-P204 WeakPolarHBondContact SD-CD 3.46Å; M35-P204 HydrophobicContact SD-CG 3.73Å; F52-P204 HydrophobicContact CB-CB 4.25Å; F52-P204 HydrophobicContact CB-CG 3.94Å; F52-P204 HydrophobicContact CD1-CB 3.51Å; F52-P204 HydrophobicContact CD1-CG 3.89Å; F52-P204 HydrophobicContact CD2-CB 4.33Å; F52-P204 HydrophobicContact CE1-CB 3.85Å; F52-P204 HydrophobicContact CG-CB 3.77Å; F52-P204 HydrophobicContact CG-CG 4.01Å; F52-P204 HydrophobicContact CZ-CB 4.38Å; P204-V206 HydrophobicContact CB-CG2 3.84Å; P204-V206 HydrophobicContact CG-CG2 4.06Å; P204-A211 HydrophobicContact CB-CB 4.37Å; P204-G213 CarbonylContact C-O 3.59Å; P204-G213 WeakPolarHBondContact CA-O 3.44Å
205	L	98.7	Very high	96	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.7	156.1	-179.3	75	0	0	0	108.5	C142 V144 I185 V187 A211 Q212 G213 F228	C142-L205 HydrophobicContact CB-CD1 3.49Å; C142-L205 VanDerWaalsContact CB-CD1 3.49Å; C142-L205 HydrophobicContact CB-CD2 4.49Å; C142-L205 HydrophobicContact CB-CG 3.83Å; V144-L205 HydrophobicContact CG2-CB 4.38Å; V144-L205 HydrophobicContact CG2-CD1 3.45Å; V144-L205 VanDerWaalsContact CG2-CD1 3.45Å; I185-L205 HydrophobicContact CD1-CD2 4.38Å; V187-L205 HydrophobicContact CG1-CD1 3.96Å; V187-L205 HydrophobicContact CG2-CD1 4.48Å; V187-L205 HydrophobicContact CG2-CD2 3.75Å; L205-A211 CarbonylContact O-C 3.5Å; L205-Q212 PolarHBondContact O-N 3.44Å; L205-G213 PolarHBondContact N-O 3.05Å; L205-G213 PolarHBondContact O-N 3.13Å; L205-F228 HydrophobicContact CB-CD1 3.65Å; L205-F228 HydrophobicContact CB-CE1 3.84Å; L205-F228 HydrophobicContact CD1-CE1 4.21Å; L205-F228 HydrophobicContact CD2-CD1 4.41Å; L205-F228 HydrophobicContact CG-CD1 4.43Å
206	V	98.5	Very high	96.4	Very high	10 Å²	10	25.6 Å²	25.6	6%	0.061	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.2	-177.1	-177.9	0	0	0	0	110.9	Y34 C142 T143 P204 V210	Y34-V206 HydrophobicContact CE2-CG2 4Å; Y34-V206 WeakPolarHBondContact OH-CG2 3.47Å; C142-V206 CarbonylContact C-O 3.46Å; C142-V206 WeakPolarHBondContact CA-O 3.2Å; C142-V206 WeakPolarHBondContact CB-O 3.32Å; T143-V206 PolarHBondContact N-O 2.8Å; T143-V206 PolarHBondContact O-N 2.98Å; P204-V206 HydrophobicContact CB-CG2 3.84Å; P204-V206 HydrophobicContact CG-CG2 4.06Å; V206-V210 WeakPolarHBondContact CA-O 3.35Å
207	C	97.1	Very high	96.8	Very high	5 Å²	5	26.9 Å²	26.9	3%	0.034	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.1	175.4	-39.9	0	0	0	0	108	V136 C142 N209 V210 Q212	V136-C207 HydrophobicContact CG1-CB 4.22Å; C142-C207 HydrophobicContact CB-CB 4.03Å; C142-C207 WeakPolarHBondContact CB-SG 3.45Å; C142-C207 WeakPolarHBondContact SG-CB 3.35Å; C142-C207 CovalentContact SG-SG 2.03Å; C142-C207 PolarHBondContact SG-SG 2.75Å; C207-N209 VanDerWaalsContact C-N 3.27Å; C207-N209 PolarHBondContact O-N 2.72Å; C207-V210 PolarHBondContact N-O 3.18Å; C207-V210 PolarHBondContact O-N 3.37Å; C207-Q212 HydrophobicContact CB-CG 3.85Å
208	N	94.4	Very high	96.9	Very high	147 Å²	147	27.8 Å²	27.8	79%	0.786	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	46.2	-178.4	-58.1	-32.1	0	0	0	113.1	V210	N208-V210 PolarHBondContact O-N 3.24Å
209	N	95.1	Very high	97	Very high	137 Å²	137	22.5 Å²	22.5	73%	0.733	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	14.3	-178.7	-54.8	-45.1	0	0	0	116	C207	C207-N209 VanDerWaalsContact C-N 3.27Å; C207-N209 PolarHBondContact O-N 2.72Å
210	V	98	Very high	96.9	Very high	13 Å²	13	31.5 Å²	31.5	8%	0.079	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.5	175.2	178.5	0	0	0	0	109.4	T128 P130 V206 C207 N208 Q212	T128-V210 HydrophobicContact CG2-CG2 4.29Å; T128-V210 WeakPolarHBondContact O-CA 3.12Å; P130-V210 HydrophobicContact CB-CG1 3.83Å; V206-V210 WeakPolarHBondContact CA-O 3.35Å; C207-V210 PolarHBondContact N-O 3.18Å; C207-V210 PolarHBondContact O-N 3.37Å; N208-V210 PolarHBondContact O-N 3.24Å; V210-Q212 HydrophobicContact CG1-CG 4.42Å; V210-Q212 PolarHBondContact O-N 3.24Å
211	A	98.4	Very high	96.5	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	104.4	173.5	0	0	0	0	0	109.6	F52 V127 T128 P130 P204 L205 I231	F52-A211 HydrophobicContact CD2-CB 4.34Å; F52-A211 HydrophobicContact CE2-CB 3.93Å; F52-A211 HydrophobicContact CZ-CB 4.48Å; V127-A211 HydrophobicContact CG1-CB 3.71Å; V127-A211 HydrophobicContact CG2-CB 4Å; T128-A211 PolarHBondContact O-N 2.96Å; P130-A211 WeakPolarHBondContact CD-O 3.25Å; P204-A211 HydrophobicContact CB-CB 4.37Å; L205-A211 CarbonylContact O-C 3.5Å; A211-I231 HydrophobicContact CB-CD1 4Å; A211-I231 WeakPolarHBondContact O-CD1 3.45Å
212	Q	98.5	Very high	95.9	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-28.9	-174.5	-68.1	-69.3	-3.6	0	0	112.8	N134 V136 I185 L205 C207 V210 I231	N134-Q212 PolarHBondContact O-NE2 2.78Å; N134-Q212 PolarHBondContact O-OE1 3.06Å; N134-Q212 VanDerWaalsContact O-OE1 3.13Å; V136-Q212 HydrophobicContact CG1-CB 3.68Å; V136-Q212 HydrophobicContact CG1-CG 3.47Å; V136-Q212 VanDerWaalsContact CG1-CG 3.47Å; I185-Q212 WeakPolarHBondContact CD1-O 3.26Å; L205-Q212 PolarHBondContact O-N 3.44Å; C207-Q212 HydrophobicContact CB-CG 3.85Å; V210-Q212 HydrophobicContact CG1-CG 4.42Å; V210-Q212 PolarHBondContact O-N 3.24Å; Q212-I231 PolarHBondContact O-N 2.92Å; Q212-I231 VanDerWaalsContact O-N 3.13Å
213	G	98.5	Very high	95.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	172.8	178.5	0	0	0	0	0	114.3	P204 L205 T229	P204-G213 CarbonylContact C-O 3.59Å; P204-G213 WeakPolarHBondContact CA-O 3.44Å; L205-G213 PolarHBondContact N-O 3.05Å; L205-G213 PolarHBondContact O-N 3.13Å; G213-T229 CarbonylContact C-O 3.59Å; G213-T229 WeakPolarHBondContact CA-O 3.11Å
214	I	98.9	Very high	95.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.7	177.7	-50.3	178.7	0	0	0	107.1	F52 M60 A62 I109 G203 S216 F228 T229 I231	F52-I214 HydrophobicContact CE1-CG1 4Å; F52-I214 HydrophobicContact CE1-CG2 4.44Å; F52-I214 HydrophobicContact CZ-CD1 4.33Å; F52-I214 HydrophobicContact CZ-CG1 3.92Å; M60-I214 HydrophobicContact CG-CD1 3.8Å; M60-I214 HydrophobicContact SD-CD1 3.79Å; M60-I214 HydrophobicContact SD-CG1 4.47Å; A62-I214 HydrophobicContact CB-CG2 4.27Å; I109-I214 HydrophobicContact CB-CD1 3.98Å; I109-I214 HydrophobicContact CD1-CD1 3.7Å; I109-I214 HydrophobicContact CG1-CD1 3.52Å; G203-I214 CarbonylContact O-C 3.56Å; G203-I214 WeakPolarHBondContact O-CA 3.47Å; I214-S216 PolarHBondContact O-N 3.32Å; I214-F228 VanDerWaalsContact C-CD1 3.48Å; I214-F228 CarbonylContact O-C 3.41Å; I214-F228 WeakPolarHBondContact O-CA 3.5Å; I214-F228 VanDerWaalsContact O-CB 3.32Å; I214-F228 WeakPolarHBondContact O-CB 3.39Å; I214-T229 PolarHBondContact N-O 2.62Å; I214-T229 PolarHBondContact O-N 3.29Å; I214-I231 HydrophobicContact CD1-CD1 4.49Å; I214-I231 HydrophobicContact CD1-CG1 4.09Å; I214-I231 HydrophobicContact CG1-CD1 3.81Å; I214-I231 HydrophobicContact CG1-CG1 3.69Å
215	V	98.8	Very high	95.3	Very high	7 Å²	7	39.6 Å²	39.6	4%	0.042	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	122.3	173.6	-179	0	0	0	0	108.2	V144 A196 D200 G202 G203 F228	V144-V215 HydrophobicContact CG1-CG2 3.72Å; A196-V215 HydrophobicContact CB-CG1 3.79Å; A196-V215 HydrophobicContact CB-CG2 3.97Å; D200-V215 HydrophobicContact CB-CG1 4.41Å; D200-V215 WeakPolarHBondContact O-CB 3.48Å; D200-V215 WeakPolarHBondContact O-CG2 2.95Å; G202-V215 PolarHBondContact N-O 2.86Å; G203-V215 WeakPolarHBondContact O-CG2 3.45Å; G203-V215 PolarHBondContact O-N 3.43Å; V215-F228 HydrophobicContact CB-CD1 4.38Å; V215-F228 HydrophobicContact CB-CE1 3.99Å; V215-F228 HydrophobicContact CB-CZ 4.43Å; V215-F228 HydrophobicContact CG2-CD1 4.06Å; V215-F228 HydrophobicContact CG2-CE1 3.27Å; V215-F228 HydrophobicContact CG2-CZ 3.76Å
216	S	98.6	Very high	95.2	Very high	4 Å²	4	39.8 Å²	39.8	3%	0.028	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-74.4	-176.8	178.2	0	0	0	0	110.7	H64 D108 I214 V227	H64-S216 PolarHBondContact CE1-O 2.95Å; D108-S216 WeakPolarHBondContact CB-OG 3.32Å; D108-S216 WeakPolarHBondContact OD2-CB 3.37Å; D108-S216 PolarHBondContact OD2-OG 3.28Å; I214-S216 PolarHBondContact O-N 3.32Å; S216-V227 WeakPolarHBondContact CB-O 3.47Å; S216-V227 PolarHBondContact N-O 3.28Å
217	Y	97.8	Very high	95.2	Very high	34 Å²	34	39.3 Å²	39.3	13%	0.133	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	170.1	179.8	65.8	-86.5	0	0	0	112.1	I105 F176 V227	I105-Y217 HydrophobicContact CB-CD1 3.94Å; I105-Y217 HydrophobicContact CB-CE1 4.21Å; I105-Y217 HydrophobicContact CD1-CD1 4.23Å; I105-Y217 HydrophobicContact CD1-CG 4.1Å; I105-Y217 HydrophobicContact CG2-CD1 3.72Å; I105-Y217 HydrophobicContact CG2-CE1 4.33Å; I105-Y217 HydrophobicContact CG2-CG 4.5Å; F176-Y217 HydrophobicContact CB-CE2 4.08Å; F176-Y217 HydrophobicContact CD1-CD2 4.31Å; F176-Y217 AromaticContact CD1-CE2 3.85Å; F176-Y217 HydrophobicContact CD1-CE2 3.85Å; F176-Y217 HydrophobicContact CD2-CE2 4.36Å; F176-Y217 HydrophobicContact CE1-CD2 4.4Å; F176-Y217 HydrophobicContact CE1-CE2 4.34Å; F176-Y217 AromaticContact CG-CE2 3.86Å; F176-Y217 HydrophobicContact CG-CE2 3.86Å; Y217-V227 HydrophobicContact CD1-CB 4.01Å; Y217-V227 HydrophobicContact CD1-CG1 4.2Å; Y217-V227 HydrophobicContact CD2-CB 4.11Å; Y217-V227 HydrophobicContact CD2-CG2 4.2Å; Y217-V227 HydrophobicContact CE1-CB 3.61Å; Y217-V227 HydrophobicContact CE1-CG1 3.47Å; Y217-V227 VanDerWaalsContact CE1-CG1 3.47Å; Y217-V227 HydrophobicContact CE1-CG2 4.23Å; Y217-V227 HydrophobicContact CE2-CB 3.75Å; Y217-V227 HydrophobicContact CE2-CG1 4.33Å; Y217-V227 HydrophobicContact CE2-CG2 3.54Å; Y217-V227 HydrophobicContact CG-CB 4.24Å; Y217-V227 VanDerWaalsContact CZ-CB 3.49Å; Y217-V227 PolarHBondContact N-O 3.31Å; Y217-V227 PolarHBondContact O-N 2.71Å
218	G	94.9	Very high	95.3	Very high	33 Å²	33	39.1 Å²	39.1	34%	0.34	20%	0.201	S	C	.	.			trans	-170.5	-167.8	177.6	0	0	0	0	0	111.1
219	D	91.3	Very high	95.5	Very high	33 Å²	33	32.2 Å²	32.2	18%	0.176	16%	0.164	C	C	.	.			trans	-63.6	143.2	177.5	-176.9	-104.6	0	0	0	112.6	R175 N221 G222 I223	R175-D219 IonicContact CZ-OD2 3.49Å; R175-D219 IonicContact NH2-OD1 2.97Å; R175-D219 IonicContact NH2-OD2 3.89Å; R175-D219 PolarHBondContact NH2-OD2 3.38Å; D219-N221 PolarHBondContact O-N 2.93Å; D219-N221 VanDerWaalsContact O-N 3.13Å; D219-N221 WeakPolarHBondContact OD1-CA 3.18Å; D219-N221 VanDerWaalsContact OD1-CB 3.26Å; D219-N221 WeakPolarHBondContact OD1-CB 3.36Å; D219-N221 PolarHBondContact OD1-N 2.87Å; D219-G222 PolarHBondContact O-N 3.47Å; D219-I223 HydrophobicContact CB-CB 4.08Å; D219-I223 WeakPolarHBondContact CB-O 3.05Å; D219-I223 PolarHBondContact OD1-N 3.21Å
220	R	87.4	Confident	95.7	Very high	207 Å²	207	27.7 Å²	27.7	78%	0.781	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-27.2	-178.8	-66	-177.5	180	-171.4	0.4	113.3	F197	F197-R220 WeakPolarHBondContact CE2-O 3.38Å
221	N	87.3	Confident	95.7	Very high	95 Å²	95	27.1 Å²	27.1	51%	0.508	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	5	178.7	-56.9	-39.7	0	0	0	112.7	Q152 D219 I223	Q152-N221 VanDerWaalsContact NE2-C 3.34Å; Q152-N221 PolarHBondContact NE2-O 3.24Å; D219-N221 PolarHBondContact O-N 2.93Å; D219-N221 VanDerWaalsContact O-N 3.13Å; D219-N221 WeakPolarHBondContact OD1-CA 3.18Å; D219-N221 VanDerWaalsContact OD1-CB 3.26Å; D219-N221 WeakPolarHBondContact OD1-CB 3.36Å; D219-N221 PolarHBondContact OD1-N 2.87Å; N221-I223 VanDerWaalsContact C-N 3.31Å; N221-I223 HydrophobicContact CB-CD1 4.2Å; N221-I223 HydrophobicContact CB-CG1 4.17Å
222	G	86.6	Confident	95.6	Very high	5 Å²	5	29 Å²	29	5%	0.052	14%	0.144	C	C	.	.			trans	71.9	25.2	-179.7	0	0	0	0	0	113.4	S195 F197 D219	S195-G222 VanDerWaalsContact CB-O 3.3Å; S195-G222 WeakPolarHBondContact CB-O 3.49Å; F197-G222 VanDerWaalsContact CE2-N 3.35Å; D219-G222 PolarHBondContact O-N 3.47Å
223	I	91.9	Very high	95.5	Very high	81 Å²	81	30.9 Å²	30.9	42%	0.415	16%	0.158	S	C	.	.	P	Polyproline II helix	trans	-79	123.9	174.6	-59.4	172.1	0	0	0	109.2	D219 N221	D219-I223 HydrophobicContact CB-CB 4.08Å; D219-I223 WeakPolarHBondContact CB-O 3.05Å; D219-I223 PolarHBondContact OD1-N 3.21Å; N221-I223 VanDerWaalsContact C-N 3.31Å; N221-I223 HydrophobicContact CB-CD1 4.2Å; N221-I223 HydrophobicContact CB-CG1 4.17Å
224	P	93.8	Very high	95.5	Very high	6 Å²	6	31.3 Å²	31.3	4%	0.039	16%	0.16	C	C	.	.	S	Bend	trans	-65.6	153.6	177.2	-22.1	35.1	0	0	0	113.2	E192 K194	E192-P224 WeakPolarHBondContact O-CG 3.27Å; K194-P224 WeakPolarHBondContact O-CG 3.46Å
225	P	96.8	Very high	95.4	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.032	17%	0.166	C	C	.	.	P	Polyproline II helix	cis	-83.7	161.5	4.7	35	-32.8	0	0	0	112.8	Q167 R171 F176 V187	Q167-P225 HydrophobicContact CG-CB 4.49Å; R171-P225 HydrophobicContact CB-CG 4.5Å; F176-P225 HydrophobicContact CE2-CG 4.44Å; F176-P225 WeakPolarHBondContact CZ-O 3.29Å; V187-P225 CarbonylContact O-C 3.59Å; V187-P225 VanDerWaalsContact O-CA 3.3Å; V187-P225 WeakPolarHBondContact O-CA 3.44Å; V187-P225 WeakPolarHBondContact O-CB 3.44Å
226	A	97.4	Very high	95.3	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.033	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	158.7	166.6	0	0	0	0	0	110.1	V187 F228	V187-A226 PolarHBondContact N-O 2.98Å; V187-A226 PolarHBondContact O-N 3.06Å; A226-F228 HydrophobicContact CB-CE2 4.05Å
227	V	98.5	Very high	95.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.4	-178.1	-178.9	0	0	0	0	110.1	C172 F176 Y179 Q184 S216 Y217	C172-V227 HydrophobicContact CB-CG2 4.29Å; F176-V227 HydrophobicContact CD2-CG2 3.54Å; F176-V227 HydrophobicContact CE2-CG2 3.73Å; F176-V227 HydrophobicContact CG-CG2 4.24Å; Y179-V227 HydrophobicContact CD2-CG1 3.88Å; Y179-V227 HydrophobicContact CD2-CG2 3.89Å; Y179-V227 HydrophobicContact CE2-CG1 4.03Å; Y179-V227 HydrophobicContact CE2-CG2 4.33Å; Q184-V227 HydrophobicContact CB-CG1 3.74Å; Q184-V227 HydrophobicContact CG-CG1 3.9Å; S216-V227 WeakPolarHBondContact CB-O 3.47Å; S216-V227 PolarHBondContact N-O 3.28Å; Y217-V227 HydrophobicContact CD1-CB 4.01Å; Y217-V227 HydrophobicContact CD1-CG1 4.2Å; Y217-V227 HydrophobicContact CD2-CB 4.11Å; Y217-V227 HydrophobicContact CD2-CG2 4.2Å; Y217-V227 HydrophobicContact CE1-CB 3.61Å; Y217-V227 HydrophobicContact CE1-CG1 3.47Å; Y217-V227 VanDerWaalsContact CE1-CG1 3.47Å; Y217-V227 HydrophobicContact CE1-CG2 4.23Å; Y217-V227 HydrophobicContact CE2-CB 3.75Å; Y217-V227 HydrophobicContact CE2-CG1 4.33Å; Y217-V227 HydrophobicContact CE2-CG2 3.54Å; Y217-V227 HydrophobicContact CG-CB 4.24Å; Y217-V227 VanDerWaalsContact CZ-CB 3.49Å; Y217-V227 PolarHBondContact N-O 3.31Å; Y217-V227 PolarHBondContact O-N 2.71Å
228	F	98.8	Very high	95.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142	179	-72.1	-115	0	0	0	109.8	V144 Q184 I185 V187 A196 L205 I214 V215 A226 K230	V144-F228 HydrophobicContact CG1-CE1 4.44Å; V144-F228 HydrophobicContact CG2-CE1 3.65Å; V144-F228 HydrophobicContact CG2-CZ 3.71Å; Q184-F228 CarbonylContact C-O 3.42Å; Q184-F228 WeakPolarHBondContact CA-O 3.24Å; I185-F228 HydrophobicContact CB-CB 4.33Å; I185-F228 PolarHBondContact N-O 2.91Å; I185-F228 PolarHBondContact O-N 2.6Å; V187-F228 HydrophobicContact CB-CD2 3.68Å; V187-F228 HydrophobicContact CB-CE2 3.67Å; V187-F228 HydrophobicContact CG1-CD2 4.47Å; V187-F228 HydrophobicContact CG1-CE2 4.11Å; V187-F228 HydrophobicContact CG2-CB 4.46Å; V187-F228 HydrophobicContact CG2-CD2 3.59Å; V187-F228 HydrophobicContact CG2-CE2 4.05Å; V187-F228 HydrophobicContact CG2-CG 4.09Å; A196-F228 HydrophobicContact CB-CZ 4.12Å; L205-F228 HydrophobicContact CB-CD1 3.65Å; L205-F228 HydrophobicContact CB-CE1 3.84Å; L205-F228 HydrophobicContact CD1-CE1 4.21Å; L205-F228 HydrophobicContact CD2-CD1 4.41Å; L205-F228 HydrophobicContact CG-CD1 4.43Å; I214-F228 VanDerWaalsContact C-CD1 3.48Å; I214-F228 CarbonylContact O-C 3.41Å; I214-F228 WeakPolarHBondContact O-CA 3.5Å; I214-F228 VanDerWaalsContact O-CB 3.32Å; I214-F228 WeakPolarHBondContact O-CB 3.39Å; V215-F228 HydrophobicContact CB-CD1 4.38Å; V215-F228 HydrophobicContact CB-CE1 3.99Å; V215-F228 HydrophobicContact CB-CZ 4.43Å; V215-F228 HydrophobicContact CG2-CD1 4.06Å; V215-F228 HydrophobicContact CG2-CE1 3.27Å; V215-F228 HydrophobicContact CG2-CZ 3.76Å; A226-F228 HydrophobicContact CB-CE2 4.05Å; F228-K230 PolarHBondContact O-N 3.09Å
229	T	98.8	Very high	95.4	Very high	2 Å²	2	41 Å²	41	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	130.2	171.2	-53	0	0	0	0	109.6	D108 I109 G213 I214 I231 F234	D108-T229 PolarHBondContact O-OG1 3.06Å; I109-T229 HydrophobicContact CB-CG2 4.14Å; I109-T229 HydrophobicContact CG2-CG2 4.48Å; G213-T229 CarbonylContact C-O 3.59Å; G213-T229 WeakPolarHBondContact CA-O 3.11Å; I214-T229 PolarHBondContact N-O 2.62Å; I214-T229 PolarHBondContact O-N 3.29Å; T229-I231 PolarHBondContact O-N 2.94Å; T229-F234 HydrophobicContact CG2-CD2 3.93Å; T229-F234 HydrophobicContact CG2-CE2 3.41Å; T229-F234 VanDerWaalsContact CG2-CE2 3.41Å; T229-F234 HydrophobicContact CG2-CZ 4.12Å
230	K	98.3	Very high	95.7	Very high	43 Å²	43	48 Å²	48	19%	0.187	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	98.2	-179.2	-175.4	175.7	-71.9	172.8	0	110.6	S181 T183 Q184 I185 F228 Q232 S233 F234	S181-K230 PolarHBondContact O-NZ 2.59Å; T183-K230 VanDerWaalsContact C-CB 3.48Å; T183-K230 VanDerWaalsContact O-CB 3.29Å; T183-K230 WeakPolarHBondContact O-CB 3.27Å; T183-K230 PolarHBondContact O-N 2.92Å; Q184-K230 WeakPolarHBondContact O-CE 3.26Å; Q184-K230 PolarHBondContact O-NZ 3.03Å; I185-K230 HydrophobicContact CD1-CB 4.17Å; I185-K230 HydrophobicContact CD1-CG 4.16Å; I185-K230 HydrophobicContact CG1-CB 3.75Å; I185-K230 HydrophobicContact CG1-CD 4.48Å; I185-K230 HydrophobicContact CG1-CG 3.96Å; F228-K230 PolarHBondContact O-N 3.09Å; K230-Q232 HydrophobicContact CG-CB 4.34Å; K230-Q232 PolarHBondContact O-N 2.87Å; K230-Q232 VanDerWaalsContact O-N 3.12Å; K230-S233 WeakPolarHBondContact CD-OG 3.34Å; K230-S233 PolarHBondContact O-N 3.31Å; K230-F234 VanDerWaalsContact O-CD2 3.24Å; K230-F234 WeakPolarHBondContact O-CD2 3.33Å
231	I	98.3	Very high	96.2	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-56.2	-36.7	-173.9	-67.3	169.4	0	0	0	112.2	F52 M60 L129 P130 A211 Q212 I214 T229 S233 F234 I235 I238	F52-I231 HydrophobicContact CE2-CD1 4.17Å; F52-I231 HydrophobicContact CZ-CD1 3.68Å; M60-I231 HydrophobicContact SD-CD1 4.14Å; M60-I231 HydrophobicContact SD-CG1 4.21Å; M60-I231 HydrophobicContact SD-CG2 4.4Å; L129-I231 HydrophobicContact CD2-CG2 4.1Å; P130-I231 HydrophobicContact CG-CB 4.11Å; P130-I231 HydrophobicContact CG-CG2 3.76Å; A211-I231 HydrophobicContact CB-CD1 4Å; A211-I231 WeakPolarHBondContact O-CD1 3.45Å; Q212-I231 PolarHBondContact O-N 2.92Å; Q212-I231 VanDerWaalsContact O-N 3.13Å; I214-I231 HydrophobicContact CD1-CD1 4.49Å; I214-I231 HydrophobicContact CD1-CG1 4.09Å; I214-I231 HydrophobicContact CG1-CD1 3.81Å; I214-I231 HydrophobicContact CG1-CG1 3.69Å; T229-I231 PolarHBondContact O-N 2.94Å; I231-S233 PolarHBondContact O-N 3.34Å; I231-F234 PolarHBondContact O-N 2.82Å; I231-I235 HydrophobicContact CG2-CD1 4.24Å; I231-I235 PolarHBondContact O-N 2.76Å; I231-I238 HydrophobicContact CG2-CD1 3.9Å
232	Q	96.7	Very high	96.6	Very high	40 Å²	40	35.3 Å²	35.3	19%	0.187	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-52.6	-39.8	179.3	-179.3	176.4	4.9	0	0	112.9	P130 A132 K230 F234 I235	P130-Q232 HydrophobicContact CG-CB 4.3Å; A132-Q232 PolarHBondContact O-NE2 2.03Å; K230-Q232 HydrophobicContact CG-CB 4.34Å; K230-Q232 PolarHBondContact O-N 2.87Å; K230-Q232 VanDerWaalsContact O-N 3.12Å; Q232-F234 PolarHBondContact O-N 3.22Å; Q232-I235 WeakPolarHBondContact O-CG1 3.32Å; Q232-I235 PolarHBondContact O-N 3.08Å
233	S	96.9	Very high	97	Very high	50 Å²	50	39.1 Å²	39.1	35%	0.35	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-67.7	-20.6	-177.5	-52.7	0	0	0	0	112.6	Q182 K230 I231	Q182-S233 WeakPolarHBondContact O-CB 3.2Å; Q182-S233 PolarHBondContact O-OG 3.45Å; K230-S233 WeakPolarHBondContact CD-OG 3.34Å; K230-S233 PolarHBondContact O-N 3.31Å; I231-S233 PolarHBondContact O-N 3.34Å
234	F	97.9	Very high	97	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.035	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-105.1	1.9	-176.5	-59.8	-82.3	0	0	0	113.5	H97 N107 I109 T183 T229 K230 I231 Q232 P236 W237 I238	H97-F234 AromaticContact CD2-CD1 3.58Å; H97-F234 AromaticContact CD2-CE1 3.87Å; H97-F234 AromaticContact NE2-CD1 3.64Å; H97-F234 AromaticContact NE2-CE1 3.86Å; N107-F234 HydrophobicContact CB-CE1 4.01Å; N107-F234 HydrophobicContact CB-CZ 4.2Å; N107-F234 WeakPolarHBondContact OD1-CE1 3.26Å; N107-F234 WeakPolarHBondContact OD1-CZ 3.5Å; I109-F234 HydrophobicContact CD1-CB 4.01Å; I109-F234 HydrophobicContact CD1-CD2 4.49Å; I109-F234 HydrophobicContact CD1-CG 4.28Å; I109-F234 HydrophobicContact CG2-CD1 3.86Å; I109-F234 HydrophobicContact CG2-CD2 4.34Å; I109-F234 HydrophobicContact CG2-CE1 4.06Å; I109-F234 HydrophobicContact CG2-CG 4Å; I109-F234 HydrophobicContact CG2-CZ 4.41Å; T183-F234 HydrophobicContact CG2-CZ 4.06Å; T229-F234 HydrophobicContact CG2-CD2 3.93Å; T229-F234 HydrophobicContact CG2-CE2 3.41Å; T229-F234 VanDerWaalsContact CG2-CE2 3.41Å; T229-F234 HydrophobicContact CG2-CZ 4.12Å; K230-F234 VanDerWaalsContact O-CD2 3.24Å; K230-F234 WeakPolarHBondContact O-CD2 3.33Å; I231-F234 PolarHBondContact O-N 2.82Å; Q232-F234 PolarHBondContact O-N 3.22Å; F234-P236 VanDerWaalsContact C-CD 3.48Å; F234-P236 VanDerWaalsContact C-N 3.34Å; F234-W237 HydrophobicContact CB-CE3 4.39Å; F234-W237 PolarHBondContact O-N 2.91Å; F234-I238 HydrophobicContact CB-CD1 4.02Å; F234-I238 HydrophobicContact CB-CG1 4.28Å; F234-I238 VanDerWaalsContact O-CG1 3.28Å; F234-I238 WeakPolarHBondContact O-CG1 3.37Å; F234-I238 PolarHBondContact O-N 2.94Å
235	I	97.2	Very high	96.7	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.138	23%	0.227	C	C	.	.	H	α-helix	trans	-52.5	-43.1	-177.9	-68.4	-67.3	0	0	0	113.5	L129 P130 I231 Q232 W237 I238 K239	L129-I235 HydrophobicContact CB-CD1 4.22Å; P130-I235 HydrophobicContact CG-CD1 4.18Å; P130-I235 WeakPolarHBondContact O-CD1 3.43Å; I231-I235 HydrophobicContact CG2-CD1 4.24Å; I231-I235 PolarHBondContact O-N 2.76Å; Q232-I235 WeakPolarHBondContact O-CG1 3.32Å; Q232-I235 PolarHBondContact O-N 3.08Å; I235-W237 PolarHBondContact O-N 3.02Å; I235-I238 HydrophobicContact CD1-CD1 4.2Å; I235-I238 PolarHBondContact O-N 3.14Å; I235-K239 HydrophobicContact CG2-CD 4.01Å; I235-K239 HydrophobicContact CG2-CG 4.35Å; I235-K239 WeakPolarHBondContact O-CB 3.28Å; I235-K239 WeakPolarHBondContact O-CG 3.35Å; I235-K239 PolarHBondContact O-N 3.2Å
236	P	96.6	Very high	95.6	Very high	82 Å²	82	49.1 Å²	49.1	53%	0.532	24%	0.241	S	C	.	.	H	α-helix	trans	-59.3	-44.2	175.4	-25.3	35.9	0	0	0	113.1	F234 R240	F234-P236 VanDerWaalsContact C-CD 3.48Å; F234-P236 VanDerWaalsContact C-N 3.34Å; P236-R240 VanDerWaalsContact O-CB 3.31Å; P236-R240 WeakPolarHBondContact O-CB 3.21Å; P236-R240 PolarHBondContact O-N 2.85Å; P236-R240 VanDerWaalsContact O-N 3.08Å
237	W	98	Very high	94.1	Very high	34 Å²	34	52.2 Å²	52.2	13%	0.129	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-47.7	177.2	171.7	84.4	0	0	0	111.4	I95 H97 I109 L111 F234 I235 K239 R240 T241	I95-W237 HydrophobicContact CG2-CZ2 4.37Å; H97-W237 HydrophobicContact CB-CZ2 4.42Å; H97-W237 AromaticContact CD2-CD1 3.92Å; H97-W237 AromaticContact CD2-CD2 3.55Å; H97-W237 AromaticContact CD2-CE2 3.75Å; H97-W237 AromaticContact CD2-CE3 3.95Å; H97-W237 AromaticContact CD2-CG 3.72Å; H97-W237 AromaticContact CD2-NE1 3.95Å; H97-W237 AromaticContact NE2-CD1 3.96Å; H97-W237 AromaticContact NE2-CG 3.82Å; I109-W237 HydrophobicContact CD1-CE3 4.41Å; I109-W237 HydrophobicContact CD1-CZ3 3.87Å; I109-W237 HydrophobicContact CG1-CH2 4.45Å; I109-W237 HydrophobicContact CG1-CZ3 3.85Å; I109-W237 HydrophobicContact CG2-CZ3 4.09Å; L111-W237 HydrophobicContact CB-CH2 4.31Å; L111-W237 HydrophobicContact CD1-CH2 4.03Å; L111-W237 HydrophobicContact CD1-CZ3 4Å; L111-W237 HydrophobicContact CG-CH2 3.88Å; L111-W237 HydrophobicContact CG-CZ3 3.96Å; F234-W237 HydrophobicContact CB-CE3 4.39Å; F234-W237 PolarHBondContact O-N 2.91Å; I235-W237 PolarHBondContact O-N 3.02Å; W237-K239 PolarHBondContact O-N 2.66Å; W237-R240 PolarHBondContact O-N 3.03Å; W237-T241 WeakPolarHBondContact O-CB 3.19Å; W237-T241 PolarHBondContact O-N 3.13Å; W237-T241 PolarHBondContact O-OG1 2.58Å; W237-T241 VanDerWaalsContact O-OG1 3.06Å
238	I	98.1	Very high	92.1	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-54	-52.6	179	-66.2	161.1	0	0	0	110.4	M60 I109 L111 L129 I231 F234 I235 T241 M242	M60-I238 HydrophobicContact CE-CD1 3.5Å; M60-I238 VanDerWaalsContact CE-CD1 3.5Å; M60-I238 HydrophobicContact CE-CG1 3.8Å; M60-I238 HydrophobicContact CE-CG2 3.91Å; M60-I238 HydrophobicContact SD-CD1 4.42Å; I109-I238 HydrophobicContact CD1-CD1 4.05Å; I109-I238 HydrophobicContact CD1-CG1 4.22Å; L111-I238 HydrophobicContact CD1-CG2 4.43Å; L129-I238 HydrophobicContact CD1-CG2 3.93Å; I231-I238 HydrophobicContact CG2-CD1 3.9Å; F234-I238 HydrophobicContact CB-CD1 4.02Å; F234-I238 HydrophobicContact CB-CG1 4.28Å; F234-I238 VanDerWaalsContact O-CG1 3.28Å; F234-I238 WeakPolarHBondContact O-CG1 3.37Å; F234-I238 PolarHBondContact O-N 2.94Å; I235-I238 HydrophobicContact CD1-CD1 4.2Å; I235-I238 PolarHBondContact O-N 3.14Å; I238-T241 PolarHBondContact O-N 3.35Å; I238-M242 HydrophobicContact CG2-CG 4.45Å; I238-M242 HydrophobicContact CG2-SD 3.57Å; I238-M242 VanDerWaalsContact CG2-SD 3.57Å; I238-M242 WeakPolarHBondContact O-CB 3.29Å; I238-M242 VanDerWaalsContact O-CG 3.27Å; I238-M242 WeakPolarHBondContact O-CG 3.46Å; I238-M242 PolarHBondContact O-N 3.11Å
239	K	96.9	Very high	89.8	Confident	138 Å²	138	72 Å²	72	60%	0.6	34%	0.342	S	S	*	.	H	α-helix	trans	-61.8	-46.5	-179.7	-73.4	-178.7	175.5	-176.4	0	111.8	I235 W237 T241 M242 S243	I235-K239 HydrophobicContact CG2-CD 4.01Å; I235-K239 HydrophobicContact CG2-CG 4.35Å; I235-K239 WeakPolarHBondContact O-CB 3.28Å; I235-K239 WeakPolarHBondContact O-CG 3.35Å; I235-K239 PolarHBondContact O-N 3.2Å; W237-K239 PolarHBondContact O-N 2.66Å; K239-T241 PolarHBondContact O-N 2.82Å; K239-M242 PolarHBondContact O-N 2.83Å; K239-S243 WeakPolarHBondContact O-CB 3.49Å; K239-S243 PolarHBondContact O-N 3.23Å; K239-S243 PolarHBondContact O-OG 3.33Å; K239-S243 VanDerWaalsContact O-OG 3.04Å
240	R	97.3	Very high	87.1	Confident	179 Å²	179	80.9 Å²	80.9	68%	0.675	38%	0.384	S	S	*	.	H	α-helix	trans	-60.1	-46.8	-179.5	-167	-168	-50.9	-94.3	2.7	111.3	P236 W237 S243 R244	P236-R240 VanDerWaalsContact O-CB 3.31Å; P236-R240 WeakPolarHBondContact O-CB 3.21Å; P236-R240 PolarHBondContact O-N 2.85Å; P236-R240 VanDerWaalsContact O-N 3.08Å; W237-R240 PolarHBondContact O-N 3.03Å; R240-S243 PolarHBondContact O-N 2.95Å; R240-R244 WeakPolarHBondContact O-CB 3.3Å; R240-R244 PolarHBondContact O-N 2.76Å
241	T	97.4	Very high	84.4	Confident	19 Å²	19	81 Å²	81	12%	0.117	40%	0.398	C	S	.	.	H	α-helix	trans	-64.1	-49.1	179.9	-61.4	0	0	0	0	111.4	I95 L111 W237 I238 K239 S243 R244 L245	I95-T241 HydrophobicContact CD1-CG2 3.96Å; I95-T241 HydrophobicContact CG2-CG2 3.97Å; L111-T241 HydrophobicContact CD1-CG2 3.76Å; W237-T241 WeakPolarHBondContact O-CB 3.19Å; W237-T241 PolarHBondContact O-N 3.13Å; W237-T241 PolarHBondContact O-OG1 2.58Å; W237-T241 VanDerWaalsContact O-OG1 3.06Å; I238-T241 PolarHBondContact O-N 3.35Å; K239-T241 PolarHBondContact O-N 2.82Å; T241-S243 VanDerWaalsContact C-N 3.31Å; T241-S243 PolarHBondContact O-N 3.42Å; T241-R244 PolarHBondContact O-N 2.98Å; T241-L245 HydrophobicContact CG2-CD1 4.19Å; T241-L245 WeakPolarHBondContact O-CG 3.46Å; T241-L245 PolarHBondContact O-N 3.15Å
242	M	95.9	Very high	82	Confident	17 Å²	17	87 Å²	87	8%	0.084	44%	0.436	C	S	.	.	H	α-helix	trans	-66	-31	-179.7	-71.4	175.9	64.9	0	0	113.4	V54 R55 F58 L111 I238 K239 A246	V54-M242 HydrophobicContact CG2-CE 4.25Å; V54-M242 HydrophobicContact CG2-SD 4.21Å; R55-M242 HydrophobicContact CB-CE 3.53Å; R55-M242 HydrophobicContact CG-CE 4.24Å; R55-M242 PolarHBondContact NH1-O 3.01Å; R55-M242 PolarHBondContact NH2-O 2.87Å; F58-M242 HydrophobicContact CB-CE 4.25Å; F58-M242 HydrophobicContact CD1-CG 4.15Å; F58-M242 HydrophobicContact CD2-CE 4.49Å; F58-M242 HydrophobicContact CD2-CG 4.19Å; F58-M242 HydrophobicContact CE1-CG 4.4Å; F58-M242 HydrophobicContact CE2-CG 4.49Å; F58-M242 HydrophobicContact CG-CE 4.46Å; F58-M242 HydrophobicContact CG-CG 4.04Å; L111-M242 HydrophobicContact CD1-CG 3.99Å; I238-M242 HydrophobicContact CG2-CG 4.45Å; I238-M242 HydrophobicContact CG2-SD 3.57Å; I238-M242 VanDerWaalsContact CG2-SD 3.57Å; I238-M242 WeakPolarHBondContact O-CB 3.29Å; I238-M242 VanDerWaalsContact O-CG 3.27Å; I238-M242 WeakPolarHBondContact O-CG 3.46Å; I238-M242 PolarHBondContact O-N 3.11Å; K239-M242 PolarHBondContact O-N 2.83Å; M242-A246 PolarHBondContact O-N 3.27Å
243	S	94.5	Very high	79.5	Confident	85 Å²	85	91.2 Å²	91.2	59%	0.594	47%	0.465	S	S	*	.	H	α-helix	trans	-76.2	-44.3	176.2	-67.1	0	0	0	0	112.3	K239 R240 T241 L245 A246	K239-S243 WeakPolarHBondContact O-CB 3.49Å; K239-S243 PolarHBondContact O-N 3.23Å; K239-S243 PolarHBondContact O-OG 3.33Å; K239-S243 VanDerWaalsContact O-OG 3.04Å; R240-S243 PolarHBondContact O-N 2.95Å; T241-S243 VanDerWaalsContact C-N 3.31Å; T241-S243 PolarHBondContact O-N 3.42Å; S243-L245 PolarHBondContact O-N 3.35Å; S243-A246 WeakPolarHBondContact O-CB 3.37Å; S243-A246 PolarHBondContact O-N 3.01Å
244	R	92.3	Very high	76.9	Confident	224 Å²	224	95.9 Å²	95.9	85%	0.845	49%	0.486	S	S	*	.	H	α-helix	trans	-60.7	-31.8	179.3	-176.8	177.1	178.6	176.4	0.7	112.5	R240 T241	R240-R244 WeakPolarHBondContact O-CB 3.3Å; R240-R244 PolarHBondContact O-N 2.76Å; T241-R244 PolarHBondContact O-N 2.98Å
245	L	88.2	Confident	74.4	Confident	40 Å²	40	100.9 Å²	100.9	21%	0.209	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	4.9	-175.6	-60.7	-179.5	0	0	0	113.6	F58 I95 Q113 T241 S243	F58-L245 HydrophobicContact CZ-CB 3.93Å; F58-L245 HydrophobicContact CZ-CD1 4.26Å; I95-L245 HydrophobicContact CD1-CD1 3.24Å; I95-L245 HydrophobicContact CG1-CD1 4.37Å; Q113-L245 PolarHBondContact NE2-O 2.93Å; T241-L245 HydrophobicContact CG2-CD1 4.19Å; T241-L245 WeakPolarHBondContact O-CG 3.46Å; T241-L245 PolarHBondContact O-N 3.15Å; S243-L245 PolarHBondContact O-N 3.35Å
246	A	74.3	Confident	71.9	Confident	39 Å²	39	107.2 Å²	107.2	32%	0.322	56%	0.556	S	S	.	*	S	Bend	trans	-58.5	137	169.6	0	0	0	0	0	108.7	M242 S243 R248	M242-A246 PolarHBondContact O-N 3.27Å; S243-A246 WeakPolarHBondContact O-CB 3.37Å; S243-A246 PolarHBondContact O-N 3.01Å; A246-R248 PolarHBondContact O-N 3.48Å
247	P	64.8	Low	69.3	Low	69 Å²	69	108.6 Å²	108.6	45%	0.448	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-53.6	118.1	172.8	-22.9	32.4	0	0	0	108.3	H249	P247-H249 PolarHBondContact O-N 3.16Å; P247-H249 VanDerWaalsContact O-N 3.16Å
248	R	57.7	Low	66.5	Low	235 Å²	235	110.8 Å²	110.8	89%	0.887	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-60.5	122.4	167.2	-70.6	-173.2	179.6	-168.9	-0.4	105.4	A246 Q250	A246-R248 PolarHBondContact O-N 3.48Å; R248-Q250 VanDerWaalsContact C-N 3.27Å; R248-Q250 PolarHBondContact O-N 3.34Å
249	H	48.8	Very low	63.8	Low	179 Å²	179	115 Å²	115	83%	0.829	64%	0.635	S	S	*	*			trans	-58.4	102.7	161.5	-81.2	-76.7	0	0	0	105.7	P247 G251	P247-H249 PolarHBondContact O-N 3.16Å; P247-H249 VanDerWaalsContact O-N 3.16Å; H249-G251 PolarHBondContact O-N 3.29Å
250	Q	43.5	Very low	61.1	Low	189 Å²	189	118 Å²	118	88%	0.883	65%	0.651	S	S	*	*			trans	-66.1	98.6	155.4	-75.5	176.1	-7.8	0	0	103.8	R248	R248-Q250 VanDerWaalsContact C-N 3.27Å; R248-Q250 PolarHBondContact O-N 3.34Å
251	G	41.1	Very low	58.5	Low	47 Å²	47	115.6 Å²	115.6	49%	0.485	66%	0.657	S	S	.	*			trans	-57.9	161.7	162.9	0	0	0	0	0	109.1	H249 T253	H249-G251 PolarHBondContact O-N 3.29Å; G251-T253 PolarHBondContact O-N 3.37Å
252	P	47.3	Very low	56.1	Low	124 Å²	124	120.4 Å²	120.4	81%	0.805	69%	0.691	S	S	*	*			trans	-51.9	121.4	176	-17.2	29	0	0	0	108.3	D254	P252-D254 PolarHBondContact O-N 3.09Å
253	T	45.2	Very low	53.6	Low	130 Å²	130	125.3 Å²	125.3	80%	0.798	73%	0.727	S	S	*	*			trans	-63.1	104.2	163.1	42.7	0	0	0	0	106	G251 S255	G251-T253 PolarHBondContact O-N 3.37Å; T253-S255 VanDerWaalsContact C-N 3.29Å; T253-S255 PolarHBondContact O-N 3.36Å
254	D	42.2	Very low	51.2	Low	147 Å²	147	125.4 Å²	125.4	79%	0.786	74%	0.742	S	S	*	*			trans	-59.4	97.8	166.5	-80.2	-27.5	0	0	0	107.6	P252 L256	P252-D254 PolarHBondContact O-N 3.09Å; D254-L256 PolarHBondContact O-N 2.82Å
255	S	44.9	Very low	48.6	Very low	113 Å²	113	118.4 Å²	118.4	79%	0.79	74%	0.739	S	S	*	*			trans	-72.2	84.1	164.3	51.9	0	0	0	0	107.7	T253 S257	T253-S255 VanDerWaalsContact C-N 3.29Å; T253-S255 PolarHBondContact O-N 3.36Å; S255-S257 PolarHBondContact O-N 2.66Å
256	L	44.7	Very low	46.5	Very low	161 Å²	161	125.9 Å²	125.9	84%	0.843	77%	0.77	S	S	*	*			trans	-76	103.6	161.8	-88.2	162.6	0	0	0	108.2	D254 G258	D254-L256 PolarHBondContact O-N 2.82Å; L256-G258 PolarHBondContact O-N 2.86Å
257	S	43.1	Very low	45.6	Very low	110 Å²	110	130 Å²	130	77%	0.769	79%	0.794	S	S	*	*			trans	-55.2	108.8	165.9	52	0	0	0	0	111	S255	S255-S257 PolarHBondContact O-N 2.66Å
258	G	38.1	Very low	44.7	Very low	80 Å²	80	134.3 Å²	134.3	83%	0.825	81%	0.808	S	S	*	*			trans	-97.1	78.3	161.1	0	0	0	0	0	109.8	L256	L256-G258 PolarHBondContact O-N 2.86Å
259	A	41.2	Very low	45	Very low	90 Å²	90	132 Å²	132	74%	0.744	82%	0.823	S	S	*	*			trans	-90.9	98.5	165.2	0	0	0	0	0	108.1
260	Q	41.7	Very low	44.8	Very low	200 Å²	200	129.6 Å²	129.6	94%	0.935	82%	0.823	S	S	*	*			trans	-96.9	102.9	161.3	-85.3	-177.6	-17.8	0	0	107.8
261	T	42.4	Very low	44.8	Very low	129 Å²	129	126.5 Å²	126.5	79%	0.791	82%	0.82	S	S	*	*			trans	-76.9	127	167.4	42.6	0	0	0	0	109.8
262	S	45.7	Very low	45	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	84%	0.838	S	S	*	*			trans	-62.4	134	165.4	52.8	0	0	0	0	112.2
263	S	44.6	Very low	44.9	Very low	119 Å²	119	131.3 Å²	131.3	83%	0.832	84%	0.84	S	S	*	*			trans	-148.1	110.4	154.2	57.8	0	0	0	0	109.5
264	G	43.2	Very low	44.9	Very low	88 Å²	88	131.4 Å²	131.4	91%	0.907	84%	0.843	S	S	*	*			trans	-76.3	161	166.8	0	0	0	0	0	111.8
265	G	37.4	Very low	45.1	Very low	77 Å²	77	130.3 Å²	130.3	79%	0.794	85%	0.847	S	S	*	*			trans	171.3	91	172.3	0	0	0	0	0	112.5
266	F	45.2	Very low	45.1	Very low	196 Å²	196	131.6 Å²	131.6	86%	0.86	85%	0.851	S	S	*	*			trans	-61.6	152.3	155.1	-100.1	-86.7	0	0	0	109.3
267	P	54.3	Low	45.1	Very low	126 Å²	126	129.3 Å²	129.3	82%	0.818	85%	0.852	S	S	*	*				-146.9	162.1	82	32.6	-11.2	0	0	0	117.2
268	Q	47.5	Very low	45.3	Very low	160 Å²	160	130.9 Å²	130.9	75%	0.748	86%	0.858	S	S	*	*			trans	-58.1	173.9	166.3	-90.9	-148.3	-28.7	0	0	114.3
269	P	62.3	Low	45.9	Very low	185 Å²	185	135.5 Å²	135.5	100%	1.201	86%	0.861	S	S	*	*			cis	-95.9	0	30.8	1.8	19.8	0	0	0	116.2

Retrieved 269 of 269 residues in 184.1 ms (Link to these results)

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