A0A3Q0KFJ4_SCHMA Loading...

Putative alpha crystallin A chain; Putative heat shock protein hsp16

AlphaFold DB , UniProt , Accession A0A3Q0KFJ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 343 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	35.2	Very low	66.7	Low	228 Å²	228	122.9 Å²	122.9	100%	1.123	64%	0.641	S	S	*	*				0	133.3	0	-62.5	-54.2	-175.3	0	0	107.3
2	P	36.7	Very low	69.1	Low	115 Å²	115	120.3 Å²	120.3	75%	0.747	64%	0.637	S	S	*	*			trans	-63.7	140.8	171.7	28.7	-30.1	0	0	0	108.4	E4	P2-E4 PolarHBondContact O-N 3.1Å
3	D	43.8	Very low	71.3	Confident	159 Å²	159	113.5 Å²	113.5	85%	0.85	60%	0.603	S	S	*	*			trans	-51.6	97.5	171.2	-93.4	-34.5	0	0	0	108.8	K5	D3-K5 VanDerWaalsContact C-N 3.28Å; D3-K5 PolarHBondContact O-N 3.04Å
4	E	49.9	Very low	73.1	Confident	157 Å²	157	112.1 Å²	112.1	73%	0.734	60%	0.596	S	S	*	*			trans	-63	101.7	160	-88.2	-177.4	162.1	0	0	105.5	P2 H6	P2-E4 PolarHBondContact O-N 3.1Å; E4-H6 PolarHBondContact O-CD2 3.18Å; E4-H6 PolarHBondContact O-N 2.8Å
5	K	50.7	Low	74.7	Confident	198 Å²	198	110.1 Å²	110.1	86%	0.861	59%	0.593	S	S	*	*			trans	-63.1	91	167.5	-75	-176.9	176.9	180	0	106.7	D3 E7	D3-K5 VanDerWaalsContact C-N 3.28Å; D3-K5 PolarHBondContact O-N 3.04Å; K5-E7 PolarHBondContact O-N 3.04Å
6	H	65.6	Low	76	Confident	82 Å²	82	105.9 Å²	105.9	38%	0.38	57%	0.569	S	S	.	*			trans	-54.2	126.5	168	-69.5	-76.5	0	0	0	108	E4 V8 T156 D157	E4-H6 PolarHBondContact O-CD2 3.18Å; E4-H6 PolarHBondContact O-N 2.8Å; H6-V8 PolarHBondContact O-N 2.95Å; H6-T156 HydrophobicContact CB-CG2 4.24Å; H6-D157 IonicContact CE1-OD2 3.79Å; H6-D157 IonicContact CG-OD2 3.92Å; H6-D157 IonicContact ND1-OD2 2.9Å; H6-D157 PolarHBondContact ND1-OD2 3.29Å
7	E	82.4	Confident	77.3	Confident	152 Å²	152	109.5 Å²	109.5	71%	0.71	59%	0.587	S	S	*	*			trans	-63.1	123.3	179.4	-173.1	173.9	174.2	0	0	108.8	K5 V9	K5-E7 PolarHBondContact O-N 3.04Å; E7-V9 HydrophobicContact CG-CG2 4.34Å
8	V	87.1	Confident	78.4	Confident	92 Å²	92	107.9 Å²	107.9	56%	0.558	57%	0.572	S	S	*	*			trans	-92.8	112.1	177.3	-178.4	0	0	0	0	108.3	H6 T154 S155 T156	H6-V8 PolarHBondContact O-N 2.95Å; V8-T154 HydrophobicContact CG1-CG2 4.11Å; V8-S155 CarbonylContact C-O 3.54Å; V8-S155 WeakPolarHBondContact CA-O 3.48Å; V8-T156 HydrophobicContact CG2-CG2 3.89Å
9	V	92.5	Very high	79.4	Confident	76 Å²	76	105.2 Å²	105.2	46%	0.461	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.9	133.6	179.4	-177	0	0	0	0	109.9	E7 T154 S155	E7-V9 HydrophobicContact CG-CG2 4.34Å; V9-T154 CarbonylContact O-C 3.57Å; V9-T154 VanDerWaalsContact O-CA 3.28Å; V9-T154 WeakPolarHBondContact O-CA 3.37Å; V9-S155 PolarHBondContact N-O 2.76Å; V9-S155 PolarHBondContact O-N 3.39Å
10	S	94.5	Very high	80.3	Confident	80 Å²	80	100.4 Å²	100.4	56%	0.559	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	127.2	172.5	-167.4	0	0	0	0	110.1
11	I	95.8	Very high	81.1	Confident	13 Å²	13	98.5 Å²	98.5	7%	0.067	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.6	177.5	-58.7	173.1	0	0	0	108.8	V153 L194 C196 L206	I11-V153 HydrophobicContact CB-CB 4.22Å; I11-V153 HydrophobicContact CB-CG1 4.02Å; I11-V153 HydrophobicContact CD1-CG1 4.13Å; I11-V153 HydrophobicContact CG1-CG1 4.49Å; I11-V153 PolarHBondContact N-O 3.46Å; I11-L194 HydrophobicContact CD1-CB 3.91Å; I11-L194 HydrophobicContact CD1-CD1 4.43Å; I11-C196 HydrophobicContact CG2-CB 3.75Å; I11-L206 HydrophobicContact CD1-CD1 3.99Å
12	P	95.7	Very high	84	Confident	91 Å²	91	91.8 Å²	91.8	59%	0.591	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-62	137.5	176.2	-22.7	33.6	0	0	0	112.5
13	V	97.1	Very high	86.9	Confident	33 Å²	33	87.3 Å²	87.3	20%	0.2	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	103.5	176.3	-179.5	0	0	0	0	109.4	I151 V153 L198 L204	V13-I151 HydrophobicContact CG2-CG2 4.1Å; V13-V153 HydrophobicContact CG2-CG2 3.86Å; V13-L198 HydrophobicContact CG1-CB 3.83Å; V13-L198 HydrophobicContact CG1-CD2 4.35Å; V13-L204 HydrophobicContact CG1-CD1 3.72Å; V13-L204 HydrophobicContact CG2-CD1 4.49Å
14	N	96.9	Very high	89.3	Confident	93 Å²	93	80.4 Å²	80.4	50%	0.497	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	117.2	-178.7	-58.1	-67	0	0	0	110.8	C196 S197 L198	N14-C196 WeakPolarHBondContact CB-O 3.46Å; N14-C196 PolarHBondContact N-O 3.46Å; N14-C196 PolarHBondContact ND2-O 3.18Å; N14-S197 CarbonylContact O-C 3.58Å; N14-S197 WeakPolarHBondContact O-CA 3.15Å; N14-L198 PolarHBondContact O-N 3.13Å
15	C	97.1	Very high	91.6	Very high	83 Å²	83	77.9 Å²	77.9	56%	0.561	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.3	179.8	-61.8	0	0	0	0	111.7	P148	C15-P148 WeakPolarHBondContact SG-CB 3.42Å; C15-P148 VanDerWaalsContact SG-CG 3.51Å
16	E	95.6	Very high	93.8	Very high	43 Å²	43	70 Å²	70	20%	0.201	37%	0.369	C	S	.	.			trans	-122.1	148	176.9	-61.8	-167.9	-171.1	0	0	112.1	R18 Q23 S197 L198 S200	E16-R18 VanDerWaalsContact C-N 3.26Å; E16-R18 VanDerWaalsContact CD-NH2 3.28Å; E16-R18 PolarHBondContact O-N 2.9Å; E16-R18 IonicContact OE1-NH2 2.92Å; E16-R18 PolarHBondContact OE1-NH2 2.86Å; E16-R18 IonicContact OE2-CZ 3.14Å; E16-R18 VanDerWaalsContact OE2-CZ 3.22Å; E16-R18 IonicContact OE2-NE 3.32Å; E16-R18 PolarHBondContact OE2-NE 2.99Å; E16-R18 IonicContact OE2-NH2 3.32Å; E16-R18 PolarHBondContact OE2-NH2 2.89Å; E16-Q23 PolarHBondContact OE1-NE2 2.84Å; E16-Q23 VanDerWaalsContact OE1-NE2 3.11Å; E16-Q23 PolarHBondContact OE2-NE2 3.27Å; E16-S197 WeakPolarHBondContact OE1-CB 3.44Å; E16-L198 PolarHBondContact N-O 2.99Å; E16-S200 PolarHBondContact O-N 3.28Å
17	N	97.1	Very high	95.2	Very high	166 Å²	166	66.6 Å²	66.6	89%	0.888	35%	0.353	S	S	*	.	S	Bend	trans	-83.4	-0.7	175.7	-66.4	-29.3	0	0	0	113.5
18	R	97.3	Very high	95.8	Very high	82 Å²	82	59.4 Å²	59.4	31%	0.309	32%	0.32	S	S	.	.	S	Bend	trans	-92.3	143.3	-178.9	-64.3	177.7	-68.4	-167.8	-2.3	109.3	E16 K22 Q23 D26 T199 S200	E16-R18 VanDerWaalsContact C-N 3.26Å; E16-R18 VanDerWaalsContact CD-NH2 3.28Å; E16-R18 PolarHBondContact O-N 2.9Å; E16-R18 IonicContact OE1-NH2 2.92Å; E16-R18 PolarHBondContact OE1-NH2 2.86Å; E16-R18 IonicContact OE2-CZ 3.14Å; E16-R18 VanDerWaalsContact OE2-CZ 3.22Å; E16-R18 IonicContact OE2-NE 3.32Å; E16-R18 PolarHBondContact OE2-NE 2.99Å; E16-R18 IonicContact OE2-NH2 3.32Å; E16-R18 PolarHBondContact OE2-NH2 2.89Å; R18-K22 HydrophobicContact CB-CB 4.32Å; R18-K22 HydrophobicContact CB-CG 4.25Å; R18-K22 HydrophobicContact CG-CG 4.23Å; R18-Q23 HydrophobicContact CB-CB 4.44Å; R18-D26 WeakPolarHBondContact CD-OD2 3.38Å; R18-D26 IonicContact NH1-OD2 2.72Å; R18-T199 WeakPolarHBondContact O-CA 3.39Å; R18-T199 WeakPolarHBondContact O-CB 3.33Å; R18-S200 VanDerWaalsContact C-OG 3.3Å; R18-S200 PolarHBondContact O-N 3.33Å; R18-S200 PolarHBondContact O-OG 3.3Å
19	T	97.9	Very high	96.2	Very high	56 Å²	56	61.9 Å²	61.9	34%	0.344	32%	0.319	S	S	.	.			trans	-70.6	159.6	163.6	63.7	0	0	0	0	110.1	E21 K22 Q23 S200 D201	T19-E21 VanDerWaalsContact C-N 3.28Å; T19-E21 PolarHBondContact O-N 3.32Å; T19-K22 PolarHBondContact O-N 2.9Å; T19-K22 WeakPolarHBondContact OG1-CB 3.18Å; T19-K22 PolarHBondContact OG1-N 2.96Å; T19-Q23 PolarHBondContact O-N 2.8Å; T19-S200 PolarHBondContact N-OG 2.65Å; T19-D201 WeakPolarHBondContact CA-OD1 3.23Å; T19-D201 HydrophobicContact CG2-CB 4.36Å
20	F	97.1	Very high	96.4	Very high	9 Å²	9	60.2 Å²	60.2	4%	0.039	31%	0.309	C	S	.	.	H	α-helix	trans	-51	-46.7	175	175.8	-111.1	0	0	0	112.7	K22 Q23 R24 I66 L69 R70 M73 T199 D201 V203	F20-K22 PolarHBondContact O-N 3.15Å; F20-Q23 PolarHBondContact O-N 3.19Å; F20-R24 PolarHBondContact O-N 2.99Å; F20-I66 HydrophobicContact CE1-CD1 4.33Å; F20-L69 HydrophobicContact CE1-CB 4.19Å; F20-L69 HydrophobicContact CZ-CB 4.11Å; F20-L69 HydrophobicContact CZ-CD1 4.35Å; F20-R70 HydrophobicContact CE1-CG 4.48Å; F20-M73 HydrophobicContact CD1-CE 3.63Å; F20-M73 HydrophobicContact CD2-CE 4.08Å; F20-M73 HydrophobicContact CE1-CE 3.46Å; F20-M73 VanDerWaalsContact CE1-CE 3.46Å; F20-M73 HydrophobicContact CE2-CE 3.93Å; F20-M73 HydrophobicContact CG-CE 3.93Å; F20-M73 HydrophobicContact CZ-CE 3.62Å; F20-T199 HydrophobicContact CB-CG2 4.37Å; F20-D201 PolarHBondContact N-OD1 3.43Å; F20-V203 HydrophobicContact CB-CB 4.05Å; F20-V203 HydrophobicContact CB-CG1 4.47Å; F20-V203 HydrophobicContact CB-CG2 3.83Å; F20-V203 HydrophobicContact CD2-CB 4.28Å; F20-V203 HydrophobicContact CD2-CG1 3.81Å; F20-V203 HydrophobicContact CE2-CG1 4.34Å; F20-V203 HydrophobicContact CG-CB 4.34Å; F20-V203 HydrophobicContact CG-CG1 4.23Å; F20-V203 HydrophobicContact CG-CG2 4.21Å
21	E	97.1	Very high	96.3	Very high	61 Å²	61	56.4 Å²	56.4	29%	0.285	28%	0.282	S	S	.	.	H	α-helix	trans	-64.2	-39.9	177.7	-78.5	174.4	-138.3	0	0	112.5	T19 R24 R25 W62 I66 R70	T19-E21 VanDerWaalsContact C-N 3.28Å; T19-E21 PolarHBondContact O-N 3.32Å; E21-R24 PolarHBondContact O-N 2.96Å; E21-R25 WeakPolarHBondContact O-CG 3.43Å; E21-R25 PolarHBondContact O-N 2.91Å; E21-W62 HydrophobicContact CB-CZ2 4.18Å; E21-W62 HydrophobicContact CG-CZ2 4.33Å; E21-W62 WeakPolarHBondContact O-CH2 3.29Å; E21-I66 HydrophobicContact CG-CD1 3.91Å; E21-I66 HydrophobicContact CG-CG1 4.15Å; E21-I66 HydrophobicContact CG-CG2 3.77Å; E21-R70 IonicContact OE1-CZ 3.97Å; E21-R70 IonicContact OE1-NE 2.7Å; E21-R70 PolarHBondContact OE1-NE 3.3Å; E21-R70 IonicContact OE1-NH2 3.01Å; E21-R70 PolarHBondContact OE1-NH2 2.61Å
22	K	97.5	Very high	96.2	Very high	87 Å²	87	60.6 Å²	60.6	38%	0.378	30%	0.302	S	S	.	.	H	α-helix	trans	-66.9	-44.4	178.2	-178.9	55	174.4	150	0	111.1	R18 T19 F20 R24 R25 D26	R18-K22 HydrophobicContact CB-CB 4.32Å; R18-K22 HydrophobicContact CB-CG 4.25Å; R18-K22 HydrophobicContact CG-CG 4.23Å; T19-K22 PolarHBondContact O-N 2.9Å; T19-K22 WeakPolarHBondContact OG1-CB 3.18Å; T19-K22 PolarHBondContact OG1-N 2.96Å; F20-K22 PolarHBondContact O-N 3.15Å; K22-R24 VanDerWaalsContact C-N 3.27Å; K22-R24 PolarHBondContact O-N 3.48Å; K22-R25 PolarHBondContact O-N 3.06Å; K22-D26 WeakPolarHBondContact CE-OD1 3.37Å; K22-D26 IonicContact NZ-OD1 2.93Å; K22-D26 PolarHBondContact NZ-OD1 2.6Å; K22-D26 IonicContact NZ-OD2 2.97Å; K22-D26 PolarHBondContact O-N 2.82Å
23	Q	96.1	Very high	96.1	Very high	21 Å²	21	62.5 Å²	62.5	10%	0.098	30%	0.302	C	S	.	.	H	α-helix	trans	-54.9	-44.7	174.6	-168.1	-169.6	51.2	0	0	110.8	E16 R18 T19 F20 D26 L27 S197	E16-Q23 PolarHBondContact OE1-NE2 2.84Å; E16-Q23 VanDerWaalsContact OE1-NE2 3.11Å; E16-Q23 PolarHBondContact OE2-NE2 3.27Å; R18-Q23 HydrophobicContact CB-CB 4.44Å; T19-Q23 PolarHBondContact O-N 2.8Å; F20-Q23 PolarHBondContact O-N 3.19Å; Q23-D26 PolarHBondContact O-N 3.16Å; Q23-L27 PolarHBondContact O-N 3.19Å; Q23-S197 PolarHBondContact NE2-OG 2.92Å
24	R	95.6	Very high	95.9	Very high	14 Å²	14	64 Å²	64	5%	0.053	31%	0.306	C	S	.	.	H	α-helix	trans	-69.9	-37.1	178.4	-169.5	-178.4	-176.7	72.4	3.9	113.7	F20 E21 K22 D26 L27 L28 W62 E128	F20-R24 PolarHBondContact O-N 2.99Å; E21-R24 PolarHBondContact O-N 2.96Å; K22-R24 VanDerWaalsContact C-N 3.27Å; K22-R24 PolarHBondContact O-N 3.48Å; R24-D26 VanDerWaalsContact C-N 3.28Å; R24-D26 PolarHBondContact O-N 2.59Å; R24-L27 WeakPolarHBondContact O-CB 3.33Å; R24-L27 PolarHBondContact O-N 2.89Å; R24-L28 PolarHBondContact O-N 3.24Å; R24-L28 VanDerWaalsContact O-N 3.14Å; R24-W62 HydrophobicContact CB-CH2 3.94Å; R24-W62 HydrophobicContact CB-CZ3 4.44Å; R24-W62 HydrophobicContact CG-CH2 4.03Å; R24-W62 HydrophobicContact CG-CZ3 4.04Å; R24-E128 IonicContact CZ-OE2 3.61Å; R24-E128 IonicContact NH1-OE2 3.95Å; R24-E128 PolarHBondContact NH1-OE2 3.07Å; R24-E128 IonicContact NH2-OE2 3.43Å
25	R	97.1	Very high	95.6	Very high	104 Å²	104	60.3 Å²	60.3	39%	0.392	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-40.8	173.3	-73.9	-174.5	180	-167.2	-0.2	111.5	E21 K22 L28 R29 W59 W62	E21-R25 WeakPolarHBondContact O-CG 3.43Å; E21-R25 PolarHBondContact O-N 2.91Å; K22-R25 PolarHBondContact O-N 3.06Å; R25-L28 PolarHBondContact O-N 2.97Å; R25-R29 WeakPolarHBondContact O-CG 3.44Å; R25-R29 PolarHBondContact O-N 3.17Å; R25-R29 VanDerWaalsContact O-N 3.08Å; R25-W59 HydrophobicContact CB-CH2 4.04Å; R25-W59 HydrophobicContact CG-CH2 3.92Å; R25-W59 HydrophobicContact CG-CZ3 4.05Å; R25-W62 HydrophobicContact CB-CH2 4.28Å; R25-W62 HydrophobicContact CG-CH2 3.3Å; R25-W62 HydrophobicContact CG-CZ2 3.55Å; R25-W62 HydrophobicContact CG-CZ3 3.95Å
26	D	96.7	Very high	95.1	Very high	32 Å²	32	59.7 Å²	59.7	17%	0.171	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-41.8	179.5	-64.8	-16.7	0	0	0	110.3	R18 K22 Q23 R24 L28 R29 T30	R18-D26 WeakPolarHBondContact CD-OD2 3.38Å; R18-D26 IonicContact NH1-OD2 2.72Å; K22-D26 WeakPolarHBondContact CE-OD1 3.37Å; K22-D26 IonicContact NZ-OD1 2.93Å; K22-D26 PolarHBondContact NZ-OD1 2.6Å; K22-D26 IonicContact NZ-OD2 2.97Å; K22-D26 PolarHBondContact O-N 2.82Å; Q23-D26 PolarHBondContact O-N 3.16Å; R24-D26 VanDerWaalsContact C-N 3.28Å; R24-D26 PolarHBondContact O-N 2.59Å; D26-L28 PolarHBondContact O-N 2.94Å; D26-R29 PolarHBondContact O-N 3.01Å; D26-T30 WeakPolarHBondContact O-CB 3.2Å; D26-T30 PolarHBondContact O-N 2.85Å; D26-T30 PolarHBondContact O-OG1 3.5Å
27	L	95.1	Very high	94.8	Very high	10 Å²	10	61.6 Å²	61.6	5%	0.052	31%	0.306	C	S	.	.	H	α-helix	trans	-53.1	-53.1	171.7	171.8	64.7	0	0	0	112.1	Q23 R24 R29 T30 L31 E128 E131	Q23-L27 PolarHBondContact O-N 3.19Å; R24-L27 WeakPolarHBondContact O-CB 3.33Å; R24-L27 PolarHBondContact O-N 2.89Å; L27-R29 VanDerWaalsContact C-N 3.33Å; L27-R29 PolarHBondContact O-N 2.83Å; L27-T30 PolarHBondContact O-N 2.79Å; L27-L31 HydrophobicContact CD1-CD1 4.04Å; L27-L31 HydrophobicContact CD1-CG 4.31Å; L27-L31 HydrophobicContact CG-CD1 4.25Å; L27-L31 PolarHBondContact O-N 2.84Å; L27-E128 HydrophobicContact CD2-CG 4.4Å; L27-E131 HydrophobicContact CD1-CB 4.41Å; L27-E131 HydrophobicContact CD1-CG 3.56Å
28	L	95.4	Very high	94.2	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-40.1	-178.2	-68.4	-180	0	0	0	112.2	R24 R25 D26 L31 E32 W54 W59 W62	R24-L28 PolarHBondContact O-N 3.24Å; R24-L28 VanDerWaalsContact O-N 3.14Å; R25-L28 PolarHBondContact O-N 2.97Å; D26-L28 PolarHBondContact O-N 2.94Å; L28-L31 PolarHBondContact O-N 3.33Å; L28-E32 WeakPolarHBondContact O-CB 3.44Å; L28-E32 PolarHBondContact O-N 2.99Å; L28-W54 HydrophobicContact CD2-CE3 4.43Å; L28-W54 HydrophobicContact CD2-CH2 3.9Å; L28-W54 HydrophobicContact CD2-CZ3 3.62Å; L28-W59 HydrophobicContact CB-CH2 4.33Å; L28-W59 HydrophobicContact CB-CZ2 3.58Å; L28-W59 HydrophobicContact CD1-CD2 4.11Å; L28-W59 HydrophobicContact CD1-CE3 4.39Å; L28-W59 HydrophobicContact CD1-CH2 4.27Å; L28-W59 HydrophobicContact CD1-CZ2 4Å; L28-W59 HydrophobicContact CD1-CZ3 4.46Å; L28-W59 HydrophobicContact CG-CZ2 4.46Å; L28-W62 HydrophobicContact CD1-CE3 4.11Å; L28-W62 HydrophobicContact CD1-CZ3 3.78Å
29	R	96.2	Very high	93.6	Very high	145 Å²	145	56.3 Å²	56.3	55%	0.547	30%	0.304	S	S	.	.	H	α-helix	trans	-67.1	-40.7	176.7	-73	179.8	-179	-156.6	-2.1	112.5	R25 D26 L27 L31 E32 H33 W59	R25-R29 WeakPolarHBondContact O-CG 3.44Å; R25-R29 PolarHBondContact O-N 3.17Å; R25-R29 VanDerWaalsContact O-N 3.08Å; D26-R29 PolarHBondContact O-N 3.01Å; L27-R29 VanDerWaalsContact C-N 3.33Å; L27-R29 PolarHBondContact O-N 2.83Å; R29-L31 VanDerWaalsContact C-N 3.31Å; R29-E32 PolarHBondContact O-N 2.9Å; R29-H33 WeakPolarHBondContact O-CB 3.32Å; R29-H33 PolarHBondContact O-N 2.89Å; R29-W59 HydrophobicContact CG-CZ2 4.1Å
30	T	95.5	Very high	92.8	Very high	41 Å²	41	54 Å²	54	25%	0.252	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-44.4	175.8	-64.3	0	0	0	0	110.4	D26 L27 H33 K34 E131	D26-T30 WeakPolarHBondContact O-CB 3.2Å; D26-T30 PolarHBondContact O-N 2.85Å; D26-T30 PolarHBondContact O-OG1 3.5Å; L27-T30 PolarHBondContact O-N 2.79Å; T30-H33 PolarHBondContact O-N 3.01Å; T30-K34 HydrophobicContact CG2-CD 4.01Å; T30-K34 HydrophobicContact CG2-CG 4.39Å; T30-K34 WeakPolarHBondContact O-CB 3.14Å; T30-K34 WeakPolarHBondContact O-CG 3.45Å; T30-K34 PolarHBondContact O-N 2.82Å; T30-E131 HydrophobicContact CG2-CB 4.18Å; T30-E131 HydrophobicContact CG2-CG 4.24Å
31	L	93.8	Very high	91.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.6	-44	176.6	-78.6	175	0	0	0	112.8	L27 L28 R29 H33 K34 N35 I40 L51 W54 I55 I129 G130	L27-L31 HydrophobicContact CD1-CD1 4.04Å; L27-L31 HydrophobicContact CD1-CG 4.31Å; L27-L31 HydrophobicContact CG-CD1 4.25Å; L27-L31 PolarHBondContact O-N 2.84Å; L28-L31 PolarHBondContact O-N 3.33Å; R29-L31 VanDerWaalsContact C-N 3.31Å; L31-H33 VanDerWaalsContact C-N 3.3Å; L31-H33 PolarHBondContact O-N 2.81Å; L31-K34 PolarHBondContact O-N 3.17Å; L31-N35 VanDerWaalsContact O-CB 3.23Å; L31-N35 WeakPolarHBondContact O-CB 3.25Å; L31-N35 PolarHBondContact O-N 2.64Å; L31-I40 HydrophobicContact CD2-CD1 3.74Å; L31-L51 HydrophobicContact CD2-CD2 4.49Å; L31-W54 HydrophobicContact CD1-CH2 4.36Å; L31-W54 HydrophobicContact CD1-CZ3 3.75Å; L31-I55 HydrophobicContact CB-CD1 3.87Å; L31-I55 HydrophobicContact CB-CG1 4.45Å; L31-I129 HydrophobicContact CD1-CB 4.19Å; L31-I129 HydrophobicContact CD1-CG2 4.13Å; L31-I129 HydrophobicContact CD2-CG2 3.97Å; L31-G130 WeakPolarHBondContact CD2-O 3.47Å
32	E	93.6	Very high	90.4	Very high	101 Å²	101	60.7 Å²	60.7	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-57.6	-45.3	176.3	-175.5	178.7	-166.4	0	0	111.2	L28 R29 G36 I55	L28-E32 WeakPolarHBondContact O-CB 3.44Å; L28-E32 PolarHBondContact O-N 2.99Å; R29-E32 PolarHBondContact O-N 2.9Å; E32-G36 PolarHBondContact O-N 2.77Å; E32-G36 VanDerWaalsContact O-N 3.13Å; E32-I55 HydrophobicContact CB-CD1 4.46Å; E32-I55 HydrophobicContact CB-CG2 4.43Å
33	H	93.7	Very high	89.4	Confident	131 Å²	131	59 Å²	59	61%	0.606	32%	0.315	S	S	*	.	H	α-helix	trans	-64.7	-51.4	177.5	-176.3	55.4	0	0	0	112.4	R29 T30 L31 N35 G36 D37	R29-H33 WeakPolarHBondContact O-CB 3.32Å; R29-H33 PolarHBondContact O-N 2.89Å; T30-H33 PolarHBondContact O-N 3.01Å; L31-H33 VanDerWaalsContact C-N 3.3Å; L31-H33 PolarHBondContact O-N 2.81Å; H33-N35 VanDerWaalsContact C-N 3.32Å; H33-N35 PolarHBondContact O-N 3.21Å; H33-G36 PolarHBondContact O-N 3.14Å; H33-D37 IonicContact NE2-OD2 3.82Å; H33-D37 PolarHBondContact O-N 3.45Å; H33-D37 VanDerWaalsContact O-N 3.07Å
34	K	91.8	Very high	88.6	Confident	63 Å²	63	59.2 Å²	59.2	27%	0.274	32%	0.318	S	S	.	.	H	α-helix	trans	-68	-29.5	-177.6	-70.7	-175.7	177.8	-175.7	0	113.3	T30 L31 D37 G38 S39 I40 E131	T30-K34 HydrophobicContact CG2-CD 4.01Å; T30-K34 HydrophobicContact CG2-CG 4.39Å; T30-K34 WeakPolarHBondContact O-CB 3.14Å; T30-K34 WeakPolarHBondContact O-CG 3.45Å; T30-K34 PolarHBondContact O-N 2.82Å; L31-K34 PolarHBondContact O-N 3.17Å; K34-D37 VanDerWaalsContact CA-OD1 3.28Å; K34-D37 WeakPolarHBondContact CA-OD1 3.36Å; K34-G38 PolarHBondContact O-N 3.36Å; K34-S39 PolarHBondContact O-N 2.81Å; K34-I40 HydrophobicContact CB-CD1 4.03Å; K34-I40 HydrophobicContact CB-CG1 3.64Å; K34-I40 PolarHBondContact O-N 3.46Å; K34-E131 VanDerWaalsContact CD-O 3.3Å; K34-E131 WeakPolarHBondContact CD-O 3.32Å; K34-E131 PolarHBondContact NZ-O 3.27Å
35	N	89.7	Confident	88	Confident	16 Å²	16	66.1 Å²	66.1	9%	0.086	36%	0.356	C	S	.	.	H	α-helix	trans	-72.9	-37.5	174.3	-159.9	39	0	0	0	110.6	L31 H33 I40 P48 L51 N52	L31-N35 VanDerWaalsContact O-CB 3.23Å; L31-N35 WeakPolarHBondContact O-CB 3.25Å; L31-N35 PolarHBondContact O-N 2.64Å; H33-N35 VanDerWaalsContact C-N 3.32Å; H33-N35 PolarHBondContact O-N 3.21Å; N35-I40 HydrophobicContact CB-CD1 3.78Å; N35-P48 PolarHBondContact ND2-O 2.88Å; N35-L51 HydrophobicContact CB-CD2 4.17Å; N35-N52 PolarHBondContact ND2-ND2 3.34Å; N35-N52 PolarHBondContact ND2-OD1 3.09Å
36	G	87.8	Confident	87.3	Confident	71 Å²	71	66.2 Å²	66.2	73%	0.732	36%	0.361	S	S	*	.	H	α-helix	trans	-70.2	-30.9	179.2	0	0	0	0	0	114.6	E32 H33	E32-G36 PolarHBondContact O-N 2.77Å; E32-G36 VanDerWaalsContact O-N 3.13Å; H33-G36 PolarHBondContact O-N 3.14Å
37	D	89.8	Confident	86.7	Confident	83 Å²	83	64.7 Å²	64.7	44%	0.444	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-3.1	178	72.1	8.1	0	0	0	114.2	H33 K34 S39	H33-D37 IonicContact NE2-OD2 3.82Å; H33-D37 PolarHBondContact O-N 3.45Å; H33-D37 VanDerWaalsContact O-N 3.07Å; K34-D37 VanDerWaalsContact CA-OD1 3.28Å; K34-D37 WeakPolarHBondContact CA-OD1 3.36Å; D37-S39 WeakPolarHBondContact OD1-CB 3.49Å; D37-S39 PolarHBondContact OD1-N 3.06Å; D37-S39 PolarHBondContact OD1-OG 3.02Å; D37-S39 PolarHBondContact OD2-OG 3.22Å
38	G	83.5	Confident	86.3	Confident	59 Å²	59	65.7 Å²	65.7	61%	0.608	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	14.8	-179	0	0	0	0	0	114.8	K34 I40	K34-G38 PolarHBondContact O-N 3.36Å; G38-I40 PolarHBondContact O-N 2.83Å
39	S	85.1	Confident	86	Confident	78 Å²	78	72.9 Å²	72.9	55%	0.545	39%	0.394	S	S	.	.			trans	-74.9	-10.3	176.8	-59.5	0	0	0	0	114	K34 D37	K34-S39 PolarHBondContact O-N 2.81Å; D37-S39 WeakPolarHBondContact OD1-CB 3.49Å; D37-S39 PolarHBondContact OD1-N 3.06Å; D37-S39 PolarHBondContact OD1-OG 3.02Å; D37-S39 PolarHBondContact OD2-OG 3.22Å
40	I	81.7	Confident	85.5	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	38%	0.377	C	S	.	.	S	Bend	trans	-83.3	130.7	174.4	-66.6	-177.1	0	0	0	109.9	L31 K34 N35 G38 L42 L51	L31-I40 HydrophobicContact CD2-CD1 3.74Å; K34-I40 HydrophobicContact CB-CD1 4.03Å; K34-I40 HydrophobicContact CB-CG1 3.64Å; K34-I40 PolarHBondContact O-N 3.46Å; N35-I40 HydrophobicContact CB-CD1 3.78Å; G38-I40 PolarHBondContact O-N 2.83Å; I40-L42 PolarHBondContact O-N 2.97Å; I40-L51 HydrophobicContact CD1-CD2 3.33Å; I40-L51 HydrophobicContact CG2-CD2 4.33Å
41	E	75.7	Confident	85.2	Confident	100 Å²	100	66.6 Å²	66.6	47%	0.467	37%	0.365	S	S	.	.			trans	-57.1	125.4	172.2	-76.1	177.3	-177.4	0	0	110.5	Y43 K134	E41-Y43 HydrophobicContact CB-CE1 4.07Å; E41-Y43 HydrophobicContact CB-CE2 4.45Å; E41-Y43 WeakPolarHBondContact CB-OH 3.33Å; E41-Y43 WeakPolarHBondContact O-CE2 3.48Å; E41-Y43 PolarHBondContact O-N 3Å; E41-Y43 PolarHBondContact OE2-OH 2.87Å; E41-K134 IonicContact OE1-NZ 3.63Å; E41-K134 PolarHBondContact OE1-NZ 2.88Å; E41-K134 WeakPolarHBondContact OE2-CE 2.9Å; E41-K134 IonicContact OE2-NZ 3.22Å; E41-K134 PolarHBondContact OE2-NZ 3.49Å
42	L	67.5	Low	85.1	Confident	112 Å²	112	69.8 Å²	69.8	59%	0.586	38%	0.382	S	S	*	.			trans	-84.2	106.3	178	-58.1	-176.9	0	0	0	109.7	I40 P48	I40-L42 PolarHBondContact O-N 2.97Å; L42-P48 HydrophobicContact CD2-CG 3.28Å
43	Y	76	Confident	85	Confident	50 Å²	50	66.9 Å²	66.9	20%	0.196	38%	0.379	C	S	.	.	S	Bend	trans	-82.9	-28.8	175.7	-55	-66.6	0	0	0	113.2	E41 W47 G133 K134 Y215	E41-Y43 HydrophobicContact CB-CE1 4.07Å; E41-Y43 HydrophobicContact CB-CE2 4.45Å; E41-Y43 WeakPolarHBondContact CB-OH 3.33Å; E41-Y43 WeakPolarHBondContact O-CE2 3.48Å; E41-Y43 PolarHBondContact O-N 3Å; E41-Y43 PolarHBondContact OE2-OH 2.87Å; Y43-W47 AromaticContact CD2-CD1 3.8Å; Y43-W47 HydrophobicContact CD2-CD2 4.42Å; Y43-W47 HydrophobicContact CD2-CG 4.29Å; Y43-W47 AromaticContact CD2-NE1 3.61Å; Y43-W47 AromaticContact CE2-NE1 3.99Å; Y43-G133 WeakPolarHBondContact CE2-O 3.47Å; Y43-K134 VanDerWaalsContact OH-CE 3.26Å; Y43-K134 WeakPolarHBondContact OH-CE 3.39Å; Y43-K134 WeakPolarHBondContact OH-CG 3.38Å; Y43-Y215 HydrophobicContact CD1-CD1 4.19Å; Y43-Y215 AromaticContact CD1-CD2 3.46Å; Y43-Y215 HydrophobicContact CD1-CD2 3.46Å; Y43-Y215 VanDerWaalsContact CD1-CD2 3.46Å; Y43-Y215 HydrophobicContact CD1-CE1 4.38Å; Y43-Y215 AromaticContact CD1-CE2 3.63Å; Y43-Y215 HydrophobicContact CD1-CE2 3.63Å; Y43-Y215 AromaticContact CD1-CG 3.77Å; Y43-Y215 HydrophobicContact CD1-CG 3.77Å; Y43-Y215 AromaticContact CD2-CD1 3.3Å; Y43-Y215 HydrophobicContact CD2-CD1 3.3Å; Y43-Y215 HydrophobicContact CD2-CD2 4.14Å; Y43-Y215 AromaticContact CD2-CE1 3.45Å; Y43-Y215 HydrophobicContact CD2-CE1 3.45Å; Y43-Y215 VanDerWaalsContact CD2-CE1 3.45Å; Y43-Y215 HydrophobicContact CD2-CE2 4.21Å; Y43-Y215 AromaticContact CD2-CG 3.71Å; Y43-Y215 HydrophobicContact CD2-CG 3.71Å; Y43-Y215 AromaticContact CD2-CZ 3.93Å; Y43-Y215 AromaticContact CE1-CD2 3.96Å; Y43-Y215 HydrophobicContact CE1-CD2 3.96Å; Y43-Y215 HydrophobicContact CE1-CE1 4.43Å; Y43-Y215 AromaticContact CE1-CE2 3.61Å; Y43-Y215 HydrophobicContact CE1-CE2 3.61Å; Y43-Y215 HydrophobicContact CE1-CG 4.49Å; Y43-Y215 AromaticContact CE1-CZ 3.92Å; Y43-Y215 AromaticContact CE2-CD1 3.88Å; Y43-Y215 HydrophobicContact CE2-CD1 3.88Å; Y43-Y215 AromaticContact CE2-CE1 3.48Å; Y43-Y215 HydrophobicContact CE2-CE1 3.48Å; Y43-Y215 VanDerWaalsContact CE2-CE1 3.48Å; Y43-Y215 HydrophobicContact CE2-CE2 4.17Å; Y43-Y215 HydrophobicContact CE2-CG 4.43Å; Y43-Y215 AromaticContact CE2-CZ 3.66Å; Y43-Y215 AromaticContact CG-CD1 3.51Å; Y43-Y215 HydrophobicContact CG-CD1 3.51Å; Y43-Y215 AromaticContact CG-CD2 3.6Å; Y43-Y215 HydrophobicContact CG-CD2 3.6Å; Y43-Y215 AromaticContact CG-CE1 3.95Å; Y43-Y215 HydrophobicContact CG-CE1 3.95Å; Y43-Y215 AromaticContact CG-CE2 3.98Å; Y43-Y215 HydrophobicContact CG-CE2 3.98Å; Y43-Y215 AromaticContact CG-CG 3.36Å; Y43-Y215 HydrophobicContact CG-CG 3.36Å; Y43-Y215 AromaticContact CZ-CE2 3.91Å; Y43-Y215 AromaticContact CZ-CZ 3.7Å
44	T	79.2	Confident	84.9	Confident	27 Å²	27	60.8 Å²	60.8	17%	0.166	35%	0.351	C	S	.	.	S	Bend	trans	-146.3	156.4	172	64.8	0	0	0	0	108.6	E46 W47 Q216	T44-E46 PolarHBondContact O-N 3.03Å; T44-W47 VanDerWaalsContact O-CB 3.24Å; T44-W47 WeakPolarHBondContact O-CB 3.06Å; T44-W47 PolarHBondContact O-N 3.46Å; T44-W47 WeakPolarHBondContact OG1-CB 3.24Å; T44-W47 PolarHBondContact OG1-N 3.32Å; T44-Q216 HydrophobicContact CG2-CB 4.46Å; T44-Q216 HydrophobicContact CG2-CG 3.99Å
45	D	82.2	Confident	85	Confident	159 Å²	159	57.9 Å²	57.9	85%	0.85	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.8	178.8	-62.5	-29.2	0	0	0	112.5
46	E	83.9	Confident	85.2	Confident	106 Å²	106	60.9 Å²	60.9	50%	0.495	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-7	-179.8	-63.8	172.3	163	0	0	112.9	T44 E49 R50	T44-E46 PolarHBondContact O-N 3.03Å; E46-E49 PolarHBondContact O-N 2.82Å; E46-R50 WeakPolarHBondContact O-CG 3.39Å; E46-R50 PolarHBondContact O-N 2.69Å; E46-R50 VanDerWaalsContact O-N 3.13Å; E46-R50 IonicContact OE2-CZ 2.77Å; E46-R50 IonicContact OE2-NH1 2.85Å; E46-R50 PolarHBondContact OE2-NH1 3.43Å; E46-R50 IonicContact OE2-NH2 3.29Å; E46-R50 PolarHBondContact OE2-NH2 2.76Å
47	W	83.6	Confident	85.4	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-42.6	-176.3	-170.8	-113.9	0	0	0	113.6	Y43 T44 E49 R50 L51 I129 Y215 L218 F220	Y43-W47 AromaticContact CD2-CD1 3.8Å; Y43-W47 HydrophobicContact CD2-CD2 4.42Å; Y43-W47 HydrophobicContact CD2-CG 4.29Å; Y43-W47 AromaticContact CD2-NE1 3.61Å; Y43-W47 AromaticContact CE2-NE1 3.99Å; T44-W47 VanDerWaalsContact O-CB 3.24Å; T44-W47 WeakPolarHBondContact O-CB 3.06Å; T44-W47 PolarHBondContact O-N 3.46Å; T44-W47 WeakPolarHBondContact OG1-CB 3.24Å; T44-W47 PolarHBondContact OG1-N 3.32Å; W47-E49 VanDerWaalsContact C-N 3.33Å; W47-E49 PolarHBondContact O-N 2.91Å; W47-R50 PolarHBondContact O-N 3.18Å; W47-L51 WeakPolarHBondContact O-CB 3.47Å; W47-L51 PolarHBondContact O-N 3.11Å; W47-I129 HydrophobicContact CH2-CD1 4.06Å; W47-I129 HydrophobicContact CZ2-CD1 3.71Å; W47-I129 HydrophobicContact CZ2-CG1 4.41Å; W47-Y215 HydrophobicContact CH2-CD1 4.36Å; W47-Y215 HydrophobicContact CZ2-CD1 4.24Å; W47-Y215 HydrophobicContact CZ2-CE1 4.35Å; W47-L218 HydrophobicContact CH2-CB 4.29Å; W47-L218 HydrophobicContact CZ3-CB 4.05Å; W47-F220 HydrophobicContact CH2-CE2 4.22Å; W47-F220 AromaticContact CH2-CZ 3.99Å; W47-F220 HydrophobicContact CH2-CZ 3.99Å; W47-F220 HydrophobicContact CZ3-CE2 4.39Å
48	P	87	Confident	85.5	Confident	31 Å²	31	55.4 Å²	55.4	20%	0.201	31%	0.311	C	S	.	.	H	α-helix	trans	-59.1	-41.5	177.9	-28.7	38.8	0	0	0	113.5	N35 L42 L51 N52	N35-P48 PolarHBondContact ND2-O 2.88Å; L42-P48 HydrophobicContact CD2-CG 3.28Å; P48-L51 PolarHBondContact O-N 3.29Å; P48-N52 WeakPolarHBondContact O-CB 3.36Å; P48-N52 PolarHBondContact O-N 2.9Å; P48-N52 PolarHBondContact O-ND2 3.42Å
49	E	88.2	Confident	86.1	Confident	152 Å²	152	56.3 Å²	56.3	71%	0.71	30%	0.297	S	S	*	.	H	α-helix	trans	-67.4	-41.8	178.5	-65.1	-174.1	172.4	0	0	111.1	E46 W47 N52 G53	E46-E49 PolarHBondContact O-N 2.82Å; W47-E49 VanDerWaalsContact C-N 3.33Å; W47-E49 PolarHBondContact O-N 2.91Å; E49-N52 PolarHBondContact O-N 2.83Å; E49-G53 PolarHBondContact O-N 2.99Å
50	R	87.2	Confident	86.6	Confident	54 Å²	54	61 Å²	61	20%	0.204	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-44.8	174.3	-72.7	-175.9	175.8	107.4	14	112.1	E46 W47 G53 W54 R229	E46-R50 WeakPolarHBondContact O-CG 3.39Å; E46-R50 PolarHBondContact O-N 2.69Å; E46-R50 VanDerWaalsContact O-N 3.13Å; E46-R50 IonicContact OE2-CZ 2.77Å; E46-R50 IonicContact OE2-NH1 2.85Å; E46-R50 PolarHBondContact OE2-NH1 3.43Å; E46-R50 IonicContact OE2-NH2 3.29Å; E46-R50 PolarHBondContact OE2-NH2 2.76Å; W47-R50 PolarHBondContact O-N 3.18Å; R50-G53 PolarHBondContact O-N 2.86Å; R50-W54 WeakPolarHBondContact O-CB 3.34Å; R50-W54 PolarHBondContact O-N 2.89Å; R50-R229 VanDerWaalsContact CZ-NH1 3.26Å; R50-R229 VanDerWaalsContact NE-NH2 3.2Å; R50-R229 VanDerWaalsContact NH2-CZ 3.33Å
51	L	89	Confident	87.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-43.7	178.1	-179.7	59.4	0	0	0	111	L31 N35 I40 W47 P48 G53 W54 I55 I129	L31-L51 HydrophobicContact CD2-CD2 4.49Å; N35-L51 HydrophobicContact CB-CD2 4.17Å; I40-L51 HydrophobicContact CD1-CD2 3.33Å; I40-L51 HydrophobicContact CG2-CD2 4.33Å; W47-L51 WeakPolarHBondContact O-CB 3.47Å; W47-L51 PolarHBondContact O-N 3.11Å; P48-L51 PolarHBondContact O-N 3.29Å; L51-G53 PolarHBondContact O-N 3.31Å; L51-W54 HydrophobicContact CD1-CE3 3.96Å; L51-W54 HydrophobicContact CD1-CZ3 4.46Å; L51-W54 WeakPolarHBondContact O-CB 3.29Å; L51-W54 PolarHBondContact O-N 3.06Å; L51-I55 HydrophobicContact CD1-CD1 4.28Å; L51-I55 HydrophobicContact CD1-CG1 4.32Å; L51-I55 HydrophobicContact CG-CD1 4Å; L51-I55 HydrophobicContact CG-CG1 4.48Å; L51-I55 VanDerWaalsContact O-CG1 3.28Å; L51-I55 WeakPolarHBondContact O-CG1 3.44Å; L51-I55 PolarHBondContact O-N 2.81Å; L51-I129 HydrophobicContact CD1-CB 4.25Å; L51-I129 HydrophobicContact CD1-CG1 4.08Å; L51-I129 HydrophobicContact CD1-CG2 4.04Å
52	N	91.2	Very high	88	Confident	66 Å²	66	58.7 Å²	58.7	35%	0.353	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-45.6	173.8	-78	-23.7	0	0	0	111.7	N35 P48 E49 W54 I55 D56	N35-N52 PolarHBondContact ND2-ND2 3.34Å; N35-N52 PolarHBondContact ND2-OD1 3.09Å; P48-N52 WeakPolarHBondContact O-CB 3.36Å; P48-N52 PolarHBondContact O-N 2.9Å; P48-N52 PolarHBondContact O-ND2 3.42Å; E49-N52 PolarHBondContact O-N 2.83Å; N52-W54 VanDerWaalsContact C-N 3.27Å; N52-W54 PolarHBondContact O-N 2.91Å; N52-I55 PolarHBondContact O-N 2.97Å; N52-D56 WeakPolarHBondContact O-CB 3.42Å; N52-D56 PolarHBondContact O-N 2.89Å
53	G	91	Very high	89.3	Confident	40 Å²	40	59.2 Å²	59.2	41%	0.412	30%	0.303	S	S	.	.	H	α-helix	trans	-59.6	-37.7	175	0	0	0	0	0	112.9	E49 R50 L51 S57	E49-G53 PolarHBondContact O-N 2.99Å; R50-G53 PolarHBondContact O-N 2.86Å; L51-G53 PolarHBondContact O-N 3.31Å; G53-S57 VanDerWaalsContact O-CB 3.31Å; G53-S57 WeakPolarHBondContact O-CB 3.37Å; G53-S57 PolarHBondContact O-N 3.47Å; G53-S57 PolarHBondContact O-OG 3.49Å
54	W	91.5	Very high	90	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.015	32%	0.315	C	S	.	.	H	α-helix	trans	-67.6	-44.4	173.4	179.8	86.2	0	0	0	112.5	L28 L31 R50 L51 N52 S57 S58 R65 E128 I129 F220 G224	L28-W54 HydrophobicContact CD2-CE3 4.43Å; L28-W54 HydrophobicContact CD2-CH2 3.9Å; L28-W54 HydrophobicContact CD2-CZ3 3.62Å; L31-W54 HydrophobicContact CD1-CH2 4.36Å; L31-W54 HydrophobicContact CD1-CZ3 3.75Å; R50-W54 WeakPolarHBondContact O-CB 3.34Å; R50-W54 PolarHBondContact O-N 2.89Å; L51-W54 HydrophobicContact CD1-CE3 3.96Å; L51-W54 HydrophobicContact CD1-CZ3 4.46Å; L51-W54 WeakPolarHBondContact O-CB 3.29Å; L51-W54 PolarHBondContact O-N 3.06Å; N52-W54 VanDerWaalsContact C-N 3.27Å; N52-W54 PolarHBondContact O-N 2.91Å; W54-S57 WeakPolarHBondContact CA-OG 3.17Å; W54-S57 PolarHBondContact O-OG 2.96Å; W54-S58 WeakPolarHBondContact O-CB 3.31Å; W54-S58 PolarHBondContact O-N 3.28Å; W54-S58 PolarHBondContact O-OG 3.39Å; W54-R65 VanDerWaalsContact CE2-NH2 3.27Å; W54-E128 HydrophobicContact CZ2-CB 4.28Å; W54-I129 HydrophobicContact CH2-CB 4.45Å; W54-I129 HydrophobicContact CZ3-CB 4.43Å; W54-F220 HydrophobicContact CB-CD2 3.95Å; W54-F220 HydrophobicContact CB-CE1 4.48Å; W54-F220 HydrophobicContact CB-CE2 3.87Å; W54-F220 HydrophobicContact CB-CG 4.31Å; W54-F220 HydrophobicContact CB-CZ 4.14Å; W54-F220 AromaticContact CD1-CD1 3.26Å; W54-F220 AromaticContact CD1-CE1 3.45Å; W54-F220 VanDerWaalsContact CD1-CE1 3.45Å; W54-F220 AromaticContact CD1-CG 3.59Å; W54-F220 AromaticContact CD1-CZ 3.96Å; W54-F220 HydrophobicContact CD2-CE1 4.42Å; W54-F220 HydrophobicContact CG-CD1 4.05Å; W54-F220 HydrophobicContact CG-CD2 4.28Å; W54-F220 AromaticContact CG-CE1 3.9Å; W54-F220 HydrophobicContact CG-CE1 3.9Å; W54-F220 HydrophobicContact CG-CE2 4.17Å; W54-F220 HydrophobicContact CG-CG 4.23Å; W54-F220 AromaticContact CG-CZ 3.97Å; W54-F220 HydrophobicContact CG-CZ 3.97Å; W54-F220 AromaticContact NE1-CD1 3.68Å; W54-F220 AromaticContact NE1-CE1 3.67Å; W54-G224 PolarHBondContact NE1-O 3.37Å
55	I	93.5	Very high	90.6	Very high	2 Å²	2	60 Å²	60	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-47.3	176.1	-66.2	165.9	0	0	0	110.2	L31 E32 L51 N52 S57 S58 W59	L31-I55 HydrophobicContact CB-CD1 3.87Å; L31-I55 HydrophobicContact CB-CG1 4.45Å; E32-I55 HydrophobicContact CB-CD1 4.46Å; E32-I55 HydrophobicContact CB-CG2 4.43Å; L51-I55 HydrophobicContact CD1-CD1 4.28Å; L51-I55 HydrophobicContact CD1-CG1 4.32Å; L51-I55 HydrophobicContact CG-CD1 4Å; L51-I55 HydrophobicContact CG-CG1 4.48Å; L51-I55 VanDerWaalsContact O-CG1 3.28Å; L51-I55 WeakPolarHBondContact O-CG1 3.44Å; L51-I55 PolarHBondContact O-N 2.81Å; N52-I55 PolarHBondContact O-N 2.97Å; I55-S57 PolarHBondContact O-N 2.92Å; I55-S58 WeakPolarHBondContact O-CA 3.3Å; I55-S58 WeakPolarHBondContact O-CB 3.45Å; I55-S58 PolarHBondContact O-N 2.85Å; I55-S58 VanDerWaalsContact O-N 3.13Å; I55-W59 VanDerWaalsContact O-CD1 3.29Å; I55-W59 PolarHBondContact O-N 3.38Å
56	D	94.1	Very high	91.1	Very high	79 Å²	79	52.9 Å²	52.9	42%	0.422	27%	0.271	S	S	.	.	H	α-helix	trans	-62.2	-46.2	179.7	-78.5	-8.9	0	0	0	112.1	N52 S58 W59 K60	N52-D56 WeakPolarHBondContact O-CB 3.42Å; N52-D56 PolarHBondContact O-N 2.89Å; D56-S58 PolarHBondContact O-N 2.87Å; D56-W59 PolarHBondContact O-N 2.78Å; D56-K60 WeakPolarHBondContact O-CB 3.28Å; D56-K60 VanDerWaalsContact O-CG 3.27Å; D56-K60 WeakPolarHBondContact O-CG 3.2Å; D56-K60 PolarHBondContact O-N 3.2Å
57	S	92.2	Very high	91.5	Very high	38 Å²	38	54 Å²	54	27%	0.266	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-32.9	175.9	59	0	0	0	0	111.8	G53 W54 I55 K60 S61	G53-S57 VanDerWaalsContact O-CB 3.31Å; G53-S57 WeakPolarHBondContact O-CB 3.37Å; G53-S57 PolarHBondContact O-N 3.47Å; G53-S57 PolarHBondContact O-OG 3.49Å; W54-S57 WeakPolarHBondContact CA-OG 3.17Å; W54-S57 PolarHBondContact O-OG 2.96Å; I55-S57 PolarHBondContact O-N 2.92Å; S57-K60 PolarHBondContact O-N 3.14Å; S57-S61 WeakPolarHBondContact O-CB 3.29Å; S57-S61 PolarHBondContact O-N 2.98Å; S57-S61 PolarHBondContact O-OG 2.7Å
58	S	92.9	Very high	91.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-41.5	174.9	-57.8	0	0	0	0	112.7	W54 I55 D56 W62 R65	W54-S58 WeakPolarHBondContact O-CB 3.31Å; W54-S58 PolarHBondContact O-N 3.28Å; W54-S58 PolarHBondContact O-OG 3.39Å; I55-S58 WeakPolarHBondContact O-CA 3.3Å; I55-S58 WeakPolarHBondContact O-CB 3.45Å; I55-S58 PolarHBondContact O-N 2.85Å; I55-S58 VanDerWaalsContact O-N 3.13Å; D56-S58 PolarHBondContact O-N 2.87Å; S58-W62 VanDerWaalsContact O-CA 3.27Å; S58-W62 WeakPolarHBondContact O-CA 3.39Å; S58-W62 PolarHBondContact O-N 2.7Å; S58-W62 VanDerWaalsContact O-N 3.15Å; S58-R65 VanDerWaalsContact CB-NH1 3.33Å; S58-R65 PolarHBondContact OG-NH1 2.89Å
59	W	95	Very high	92	Very high	78 Å²	78	55.8 Å²	55.8	30%	0.295	27%	0.274	S	S	.	.	H	α-helix	trans	-70.2	-43.6	174.9	-73.7	123.6	0	0	0	112	R25 L28 R29 I55 D56 S61 W62	R25-W59 HydrophobicContact CB-CH2 4.04Å; R25-W59 HydrophobicContact CG-CH2 3.92Å; R25-W59 HydrophobicContact CG-CZ3 4.05Å; L28-W59 HydrophobicContact CB-CH2 4.33Å; L28-W59 HydrophobicContact CB-CZ2 3.58Å; L28-W59 HydrophobicContact CD1-CD2 4.11Å; L28-W59 HydrophobicContact CD1-CE3 4.39Å; L28-W59 HydrophobicContact CD1-CH2 4.27Å; L28-W59 HydrophobicContact CD1-CZ2 4Å; L28-W59 HydrophobicContact CD1-CZ3 4.46Å; L28-W59 HydrophobicContact CG-CZ2 4.46Å; R29-W59 HydrophobicContact CG-CZ2 4.1Å; I55-W59 VanDerWaalsContact O-CD1 3.29Å; I55-W59 PolarHBondContact O-N 3.38Å; D56-W59 PolarHBondContact O-N 2.78Å; W59-S61 VanDerWaalsContact C-N 3.34Å; W59-S61 PolarHBondContact O-N 2.69Å; W59-W62 HydrophobicContact CE3-CE3 4.18Å; W59-W62 HydrophobicContact CZ3-CE3 4.06Å; W59-W62 HydrophobicContact CZ3-CZ3 4.28Å; W59-W62 WeakPolarHBondContact O-CB 3.35Å; W59-W62 PolarHBondContact O-N 2.93Å
60	K	95.1	Very high	92.2	Very high	178 Å²	178	52.7 Å²	52.7	77%	0.774	26%	0.256	S	S	*	.	H	α-helix	trans	-60.7	-41.2	179.1	-74	169.4	-176.3	168.6	0	112.5	D56 S57	D56-K60 WeakPolarHBondContact O-CB 3.28Å; D56-K60 VanDerWaalsContact O-CG 3.27Å; D56-K60 WeakPolarHBondContact O-CG 3.2Å; D56-K60 PolarHBondContact O-N 3.2Å; S57-K60 PolarHBondContact O-N 3.14Å
61	S	92.7	Very high	92.2	Very high	38 Å²	38	52.9 Å²	52.9	27%	0.266	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	22.2	-178.3	65.3	0	0	0	0	113.7	S57 W59 N63 D64 R65	S57-S61 WeakPolarHBondContact O-CB 3.29Å; S57-S61 PolarHBondContact O-N 2.98Å; S57-S61 PolarHBondContact O-OG 2.7Å; W59-S61 VanDerWaalsContact C-N 3.34Å; W59-S61 PolarHBondContact O-N 2.69Å; S61-N63 PolarHBondContact O-N 2.89Å; S61-D64 PolarHBondContact O-N 2.9Å; S61-D64 VanDerWaalsContact O-N 3.14Å; S61-R65 WeakPolarHBondContact O-CB 3.25Å; S61-R65 PolarHBondContact O-N 2.63Å
62	W	94.4	Very high	92.2	Very high	18 Å²	18	54.4 Å²	54.4	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-47.9	-52.5	-170.3	174.1	-95.1	0	0	0	114.1	E21 R24 R25 L28 S58 W59 D64 R65 I66	E21-W62 HydrophobicContact CB-CZ2 4.18Å; E21-W62 HydrophobicContact CG-CZ2 4.33Å; E21-W62 WeakPolarHBondContact O-CH2 3.29Å; R24-W62 HydrophobicContact CB-CH2 3.94Å; R24-W62 HydrophobicContact CB-CZ3 4.44Å; R24-W62 HydrophobicContact CG-CH2 4.03Å; R24-W62 HydrophobicContact CG-CZ3 4.04Å; R25-W62 HydrophobicContact CB-CH2 4.28Å; R25-W62 HydrophobicContact CG-CH2 3.3Å; R25-W62 HydrophobicContact CG-CZ2 3.55Å; R25-W62 HydrophobicContact CG-CZ3 3.95Å; L28-W62 HydrophobicContact CD1-CE3 4.11Å; L28-W62 HydrophobicContact CD1-CZ3 3.78Å; S58-W62 VanDerWaalsContact O-CA 3.27Å; S58-W62 WeakPolarHBondContact O-CA 3.39Å; S58-W62 PolarHBondContact O-N 2.7Å; S58-W62 VanDerWaalsContact O-N 3.15Å; W59-W62 HydrophobicContact CE3-CE3 4.18Å; W59-W62 HydrophobicContact CZ3-CE3 4.06Å; W59-W62 HydrophobicContact CZ3-CZ3 4.28Å; W59-W62 WeakPolarHBondContact O-CB 3.35Å; W59-W62 PolarHBondContact O-N 2.93Å; W62-D64 PolarHBondContact O-N 2.73Å; W62-R65 PolarHBondContact O-N 3.34Å; W62-I66 HydrophobicContact CD2-CG1 3.96Å; W62-I66 VanDerWaalsContact CE2-CG1 3.47Å; W62-I66 HydrophobicContact CE3-CG1 4.46Å; W62-I66 HydrophobicContact CG-CG1 4.46Å; W62-I66 HydrophobicContact CH2-CD1 3.77Å; W62-I66 HydrophobicContact CH2-CG1 4.11Å; W62-I66 HydrophobicContact CZ2-CD1 3.63Å; W62-I66 HydrophobicContact CZ2-CG1 3.56Å; W62-I66 HydrophobicContact CZ3-CD1 4.34Å; W62-I66 WeakPolarHBondContact O-CG1 3.38Å; W62-I66 PolarHBondContact O-N 3.44Å
63	N	95.1	Very high	92.4	Very high	124 Å²	124	51.5 Å²	51.5	66%	0.663	26%	0.26	S	S	*	.	H	α-helix	trans	-63.4	-44	-176	-70.5	-23.7	0	0	0	112	S61 R65 R67	S61-N63 PolarHBondContact O-N 2.89Å; N63-R65 VanDerWaalsContact C-N 3.32Å; N63-R67 VanDerWaalsContact O-CB 3.27Å; N63-R67 WeakPolarHBondContact O-CB 3.46Å; N63-R67 PolarHBondContact O-N 2.88Å
64	D	92.1	Very high	92.5	Very high	83 Å²	83	49.7 Å²	49.7	44%	0.444	24%	0.24	S	C	.	.	H	α-helix	trans	-66.2	-39	178.6	-65.2	-38.6	0	0	0	111	S61 W62 R67 R68	S61-D64 PolarHBondContact O-N 2.9Å; S61-D64 VanDerWaalsContact O-N 3.14Å; W62-D64 PolarHBondContact O-N 2.73Å; D64-R67 PolarHBondContact O-N 2.92Å; D64-R67 IonicContact OD1-CZ 3.08Å; D64-R67 IonicContact OD1-NH1 2.7Å; D64-R67 PolarHBondContact OD1-NH1 3.47Å; D64-R67 IonicContact OD1-NH2 2.63Å; D64-R67 PolarHBondContact OD1-NH2 3.29Å; D64-R68 WeakPolarHBondContact O-CB 3.34Å; D64-R68 PolarHBondContact O-N 3.22Å
65	R	90.7	Very high	92.5	Very high	11 Å²	11	51.7 Å²	51.7	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-67.7	-46.4	179	-153	167.3	-171.3	-126.8	-4.7	111.7	W54 S58 S61 W62 N63 R68 L69 G224	W54-R65 VanDerWaalsContact CE2-NH2 3.27Å; S58-R65 VanDerWaalsContact CB-NH1 3.33Å; S58-R65 PolarHBondContact OG-NH1 2.89Å; S61-R65 WeakPolarHBondContact O-CB 3.25Å; S61-R65 PolarHBondContact O-N 2.63Å; W62-R65 PolarHBondContact O-N 3.34Å; N63-R65 VanDerWaalsContact C-N 3.32Å; R65-R68 PolarHBondContact O-N 2.97Å; R65-L69 VanDerWaalsContact O-CG 3.27Å; R65-L69 WeakPolarHBondContact O-CG 3.25Å; R65-L69 PolarHBondContact O-N 2.99Å; R65-G224 PolarHBondContact NH2-O 3.43Å
66	I	93.5	Very high	92.5	Very high	8 Å²	8	52.3 Å²	52.3	4%	0.041	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-44.8	173.6	-70.8	-59.2	0	0	0	111.2	F20 E21 W62 R68 L69 R70	F20-I66 HydrophobicContact CE1-CD1 4.33Å; E21-I66 HydrophobicContact CG-CD1 3.91Å; E21-I66 HydrophobicContact CG-CG1 4.15Å; E21-I66 HydrophobicContact CG-CG2 3.77Å; W62-I66 HydrophobicContact CD2-CG1 3.96Å; W62-I66 VanDerWaalsContact CE2-CG1 3.47Å; W62-I66 HydrophobicContact CE3-CG1 4.46Å; W62-I66 HydrophobicContact CG-CG1 4.46Å; W62-I66 HydrophobicContact CH2-CD1 3.77Å; W62-I66 HydrophobicContact CH2-CG1 4.11Å; W62-I66 HydrophobicContact CZ2-CD1 3.63Å; W62-I66 HydrophobicContact CZ2-CG1 3.56Å; W62-I66 HydrophobicContact CZ3-CD1 4.34Å; W62-I66 WeakPolarHBondContact O-CG1 3.38Å; W62-I66 PolarHBondContact O-N 3.44Å; I66-R68 VanDerWaalsContact C-N 3.35Å; I66-R68 PolarHBondContact O-N 2.95Å; I66-L69 PolarHBondContact O-N 3.1Å; I66-R70 HydrophobicContact CG2-CG 4.41Å; I66-R70 WeakPolarHBondContact O-CG 3.34Å; I66-R70 PolarHBondContact O-N 2.91Å
67	R	91.7	Very high	92.3	Very high	131 Å²	131	48.9 Å²	48.9	49%	0.494	24%	0.238	S	C	.	.	H	α-helix	trans	-57.6	-48.6	177.4	-177.7	178.5	67.8	-119.2	-3	111	N63 D64 R70 Q71	N63-R67 VanDerWaalsContact O-CB 3.27Å; N63-R67 WeakPolarHBondContact O-CB 3.46Å; N63-R67 PolarHBondContact O-N 2.88Å; D64-R67 PolarHBondContact O-N 2.92Å; D64-R67 IonicContact OD1-CZ 3.08Å; D64-R67 IonicContact OD1-NH1 2.7Å; D64-R67 PolarHBondContact OD1-NH1 3.47Å; D64-R67 IonicContact OD1-NH2 2.63Å; D64-R67 PolarHBondContact OD1-NH2 3.29Å; R67-R70 PolarHBondContact O-N 2.76Å; R67-Q71 WeakPolarHBondContact O-CG 3.45Å; R67-Q71 PolarHBondContact O-N 2.62Å
68	R	88.8	Confident	92.1	Very high	50 Å²	50	48.1 Å²	48.1	19%	0.189	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-47	178.1	-174	178.1	74.9	-133.8	9.4	111.8	D64 R65 I66 R70 Q71 G72 D125 N223	D64-R68 WeakPolarHBondContact O-CB 3.34Å; D64-R68 PolarHBondContact O-N 3.22Å; R65-R68 PolarHBondContact O-N 2.97Å; I66-R68 VanDerWaalsContact C-N 3.35Å; I66-R68 PolarHBondContact O-N 2.95Å; R68-R70 VanDerWaalsContact C-N 3.33Å; R68-R70 PolarHBondContact O-N 2.71Å; R68-Q71 PolarHBondContact O-N 2.87Å; R68-G72 PolarHBondContact O-N 2.87Å; R68-D125 IonicContact CZ-OD1 2.73Å; R68-D125 VanDerWaalsContact CZ-OD1 3.32Å; R68-D125 IonicContact NE-OD1 2.7Å; R68-D125 PolarHBondContact NE-OD1 2.92Å; R68-D125 IonicContact NE-OD2 3.12Å; R68-D125 PolarHBondContact NE-OD2 3.37Å; R68-D125 IonicContact NH2-OD1 3.29Å; R68-D125 PolarHBondContact NH2-OD1 3.32Å; R68-N223 PolarHBondContact NH1-O 2.89Å; R68-N223 PolarHBondContact NH2-O 3.14Å
69	L	91.8	Very high	91.5	Very high	18 Å²	18	49.8 Å²	49.8	9%	0.094	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-40.2	178.4	-71	168.8	0	0	0	112.2	F20 R65 I66 G72 M73 D125	F20-L69 HydrophobicContact CE1-CB 4.19Å; F20-L69 HydrophobicContact CZ-CB 4.11Å; F20-L69 HydrophobicContact CZ-CD1 4.35Å; R65-L69 VanDerWaalsContact O-CG 3.27Å; R65-L69 WeakPolarHBondContact O-CG 3.25Å; R65-L69 PolarHBondContact O-N 2.99Å; I66-L69 PolarHBondContact O-N 3.1Å; L69-G72 PolarHBondContact O-N 2.93Å; L69-M73 WeakPolarHBondContact O-CG 3.08Å; L69-M73 PolarHBondContact O-N 3.48Å; L69-D125 HydrophobicContact CD2-CB 4.13Å
70	R	91.9	Very high	90.4	Very high	86 Å²	86	50.5 Å²	50.5	33%	0.325	26%	0.258	S	S	.	.	H	α-helix	trans	-65.3	-39.4	174.8	-73.2	-173.5	-179.7	-76.9	6.2	112.3	F20 E21 I66 R67 R68 G72 M73 D201	F20-R70 HydrophobicContact CE1-CG 4.48Å; E21-R70 IonicContact OE1-CZ 3.97Å; E21-R70 IonicContact OE1-NE 2.7Å; E21-R70 PolarHBondContact OE1-NE 3.3Å; E21-R70 IonicContact OE1-NH2 3.01Å; E21-R70 PolarHBondContact OE1-NH2 2.61Å; I66-R70 HydrophobicContact CG2-CG 4.41Å; I66-R70 WeakPolarHBondContact O-CG 3.34Å; I66-R70 PolarHBondContact O-N 2.91Å; R67-R70 PolarHBondContact O-N 2.76Å; R68-R70 VanDerWaalsContact C-N 3.33Å; R68-R70 PolarHBondContact O-N 2.71Å; R70-G72 VanDerWaalsContact C-N 3.3Å; R70-G72 PolarHBondContact O-N 3.3Å; R70-M73 HydrophobicContact CB-CE 4.49Å; R70-M73 HydrophobicContact CG-CE 3.93Å; R70-M73 HydrophobicContact CG-SD 4.45Å; R70-M73 WeakPolarHBondContact O-CB 3.38Å; R70-M73 PolarHBondContact O-N 2.91Å; R70-D201 IonicContact CZ-OD2 2.88Å; R70-D201 IonicContact NH1-OD2 3.56Å; R70-D201 IonicContact NH2-OD2 3.66Å; R70-D201 PolarHBondContact NH2-OD2 2.81Å; R70-D201 VanDerWaalsContact NH2-OD2 3.14Å
71	Q	88.1	Confident	88.7	Confident	59 Å²	59	45.7 Å²	45.7	28%	0.276	24%	0.243	S	C	.	.	H	α-helix	trans	-66.3	-32.3	175	-72.4	172.7	-20.5	0	0	112.5	R67 R68 M73 H114	R67-Q71 WeakPolarHBondContact O-CG 3.45Å; R67-Q71 PolarHBondContact O-N 2.62Å; R68-Q71 PolarHBondContact O-N 2.87Å; Q71-M73 VanDerWaalsContact C-N 3.28Å; Q71-M73 PolarHBondContact O-N 2.96Å; Q71-H114 HydrophobicContact CB-CB 4.38Å; Q71-H114 HydrophobicContact CG-CB 4.38Å; Q71-H114 PolarHBondContact NE2-ND1 2.88Å
72	G	89.7	Confident	87	Confident	32 Å²	32	44.1 Å²	44.1	33%	0.33	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.1	176.6	0	0	0	0	0	114.9	R68 L69 R70	R68-G72 PolarHBondContact O-N 2.87Å; L69-G72 PolarHBondContact O-N 2.93Å; R70-G72 VanDerWaalsContact C-N 3.3Å; R70-G72 PolarHBondContact O-N 3.3Å
73	M	93.9	Very high	85.1	Confident	5 Å²	5	47.1 Å²	47.1	3%	0.025	27%	0.268	C	S	.	.			trans	-67.6	136.1	-179.3	-65.4	-179.5	178.3	0	0	111.3	F20 L69 R70 Q71 I116 G117 C140 N142 V203	F20-M73 HydrophobicContact CD1-CE 3.63Å; F20-M73 HydrophobicContact CD2-CE 4.08Å; F20-M73 HydrophobicContact CE1-CE 3.46Å; F20-M73 VanDerWaalsContact CE1-CE 3.46Å; F20-M73 HydrophobicContact CE2-CE 3.93Å; F20-M73 HydrophobicContact CG-CE 3.93Å; F20-M73 HydrophobicContact CZ-CE 3.62Å; L69-M73 WeakPolarHBondContact O-CG 3.08Å; L69-M73 PolarHBondContact O-N 3.48Å; R70-M73 HydrophobicContact CB-CE 4.49Å; R70-M73 HydrophobicContact CG-CE 3.93Å; R70-M73 HydrophobicContact CG-SD 4.45Å; R70-M73 WeakPolarHBondContact O-CB 3.38Å; R70-M73 PolarHBondContact O-N 2.91Å; Q71-M73 VanDerWaalsContact C-N 3.28Å; Q71-M73 PolarHBondContact O-N 2.96Å; M73-I116 WeakPolarHBondContact O-CG2 3.1Å; M73-G117 PolarHBondContact O-N 2.93Å; M73-C140 CarbonylContact C-O 3.59Å; M73-C140 VanDerWaalsContact CA-O 3.31Å; M73-C140 WeakPolarHBondContact CA-O 3.29Å; M73-C140 HydrophobicContact CE-CB 4.13Å; M73-C140 HydrophobicContact CG-CB 3.76Å; M73-C140 HydrophobicContact SD-CB 4.41Å; M73-N142 HydrophobicContact CB-CB 4.25Å; M73-N142 HydrophobicContact SD-CB 4.38Å; M73-V203 HydrophobicContact CE-CB 4.37Å; M73-V203 HydrophobicContact CE-CG1 3.55Å; M73-V203 HydrophobicContact CE-CG2 3.87Å; M73-V203 HydrophobicContact SD-CG1 3.84Å; M73-V203 HydrophobicContact SD-CG2 3.88Å
74	F	93.9	Very high	83.1	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	143.6	170.1	-69.8	-71.9	0	0	0	111.2	G117 Y122 V139 C140 F141 N142 R181 I183	F74-G117 WeakPolarHBondContact CD1-O 3.35Å; F74-G117 WeakPolarHBondContact CE1-O 3.44Å; F74-Y122 HydrophobicContact CE2-CD2 4.32Å; F74-Y122 HydrophobicContact CE2-CG 4.14Å; F74-Y122 HydrophobicContact CZ-CD1 4.04Å; F74-Y122 HydrophobicContact CZ-CD2 4.13Å; F74-Y122 AromaticContact CZ-CG 3.6Å; F74-Y122 HydrophobicContact CZ-CG 3.6Å; F74-V139 HydrophobicContact CD2-CB 4.36Å; F74-V139 HydrophobicContact CE2-CB 4.05Å; F74-V139 HydrophobicContact CE2-CG1 4.06Å; F74-C140 PolarHBondContact N-O 3.29Å; F74-F141 HydrophobicContact CB-CB 4.45Å; F74-F141 HydrophobicContact CB-CD1 3.33Å; F74-F141 HydrophobicContact CB-CE1 3.62Å; F74-F141 HydrophobicContact CB-CG 3.98Å; F74-F141 HydrophobicContact CB-CZ 4.49Å; F74-F141 HydrophobicContact CD2-CD1 4.31Å; F74-F141 AromaticContact CD2-CE1 3.94Å; F74-F141 HydrophobicContact CD2-CE1 3.94Å; F74-F141 HydrophobicContact CD2-CE2 4.48Å; F74-F141 HydrophobicContact CD2-CZ 4.02Å; F74-F141 HydrophobicContact CG-CD1 4.12Å; F74-F141 AromaticContact CG-CE1 3.91Å; F74-F141 HydrophobicContact CG-CE1 3.91Å; F74-F141 HydrophobicContact CG-CZ 4.46Å; F74-F141 CarbonylContact O-C 3.55Å; F74-F141 VanDerWaalsContact O-CA 3.24Å; F74-F141 WeakPolarHBondContact O-CA 3.49Å; F74-N142 PolarHBondContact O-N 3.46Å; F74-R181 HydrophobicContact CB-CG 4.19Å; F74-R181 HydrophobicContact CD1-CG 4.14Å; F74-R181 HydrophobicContact CG-CG 4.33Å; F74-I183 HydrophobicContact CD1-CG2 4.14Å; F74-I183 HydrophobicContact CD2-CG2 4.26Å; F74-I183 HydrophobicContact CE1-CG2 3.63Å; F74-I183 HydrophobicContact CE2-CD1 4.09Å; F74-I183 HydrophobicContact CE2-CG2 3.78Å; F74-I183 HydrophobicContact CG-CG2 4.42Å; F74-I183 HydrophobicContact CZ-CB 4.37Å; F74-I183 HydrophobicContact CZ-CD1 4.49Å; F74-I183 HydrophobicContact CZ-CG2 3.42Å; F74-I183 VanDerWaalsContact CZ-CG2 3.42Å
75	V	91.9	Very high	81	Confident	46 Å²	46	47.9 Å²	47.9	28%	0.279	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	150.7	166.1	-65.3	0	0	0	0	109.6	L77 I116	V75-L77 HydrophobicContact CG2-CD2 4.35Å; V75-I116 HydrophobicContact CG1-CG2 3.84Å; V75-I116 HydrophobicContact CG2-CG2 4.44Å
76	L	92.4	Very high	79.1	Confident	16 Å²	16	50.3 Å²	50.3	8%	0.084	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-82.2	135.5	172.2	-52.1	-173.5	0	0	0	110.2	F141 L143 F146 V162 A164 F179 R181	L76-F141 HydrophobicContact CD2-CD1 4.16Å; L76-L143 HydrophobicContact CD1-CD2 3.5Å; L76-L143 VanDerWaalsContact CD1-CD2 3.5Å; L76-L143 HydrophobicContact CD2-CD2 3.9Å; L76-L143 HydrophobicContact CG-CD2 3.4Å; L76-L143 VanDerWaalsContact CG-CD2 3.4Å; L76-F146 HydrophobicContact CD1-CE2 4.47Å; L76-V162 HydrophobicContact CD1-CG1 4.4Å; L76-V162 HydrophobicContact CD2-CB 4.03Å; L76-V162 HydrophobicContact CD2-CG1 3.84Å; L76-A164 HydrophobicContact CD1-CB 3.49Å; L76-A164 VanDerWaalsContact CD1-CB 3.49Å; L76-F179 HydrophobicContact CB-CB 3.52Å; L76-F179 HydrophobicContact CD1-CB 4.12Å; L76-R181 HydrophobicContact CD2-CB 3.57Å
77	L	89.6	Confident	77.4	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	142.6	179.7	-62.2	178.2	0	0	0	110.8	V75 L79 Y82 M97 M101 F179 C180	V75-L77 HydrophobicContact CG2-CD2 4.35Å; L77-L79 PolarHBondContact O-N 3.24Å; L77-Y82 WeakPolarHBondContact CB-OH 3.43Å; L77-Y82 WeakPolarHBondContact CD1-OH 3.47Å; L77-M97 HydrophobicContact CD1-CB 3.83Å; L77-M97 HydrophobicContact CD1-CG 3.93Å; L77-M101 HydrophobicContact CD1-CG 4.03Å; L77-F179 CarbonylContact O-C 3.57Å; L77-F179 VanDerWaalsContact O-CA 3.27Å; L77-F179 WeakPolarHBondContact O-CA 3.06Å; L77-C180 PolarHBondContact N-O 2.67Å; L77-C180 PolarHBondContact O-N 3.32Å
78	P	87.9	Confident	76.1	Confident	21 Å²	21	52.1 Å²	52.1	14%	0.136	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	126.3	-177.6	-14.2	25.4	0	0	0	111.8	S80 T81 Y82 F179	P78-S80 VanDerWaalsContact C-N 3.33Å; P78-S80 PolarHBondContact O-N 2.85Å; P78-T81 WeakPolarHBondContact O-CB 3.25Å; P78-T81 PolarHBondContact O-N 3.48Å; P78-T81 PolarHBondContact O-OG1 3.35Å; P78-Y82 VanDerWaalsContact O-CE2 3.26Å; P78-Y82 WeakPolarHBondContact O-CE2 3.39Å; P78-F179 HydrophobicContact CB-CD1 4.19Å; P78-F179 HydrophobicContact CB-CE1 4.12Å; P78-F179 HydrophobicContact CG-CD1 4.06Å; P78-F179 HydrophobicContact CG-CE1 3.85Å
79	L	82.4	Confident	75.8	Confident	35 Å²	35	53.1 Å²	53.1	18%	0.183	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-68.2	-30.3	-179.9	-78.6	-178.6	0	0	0	113.2	L77 T81 Y82 E178 C180	L77-L79 PolarHBondContact O-N 3.24Å; L79-T81 PolarHBondContact O-N 2.72Å; L79-T81 VanDerWaalsContact O-N 3.14Å; L79-Y82 HydrophobicContact CB-CD2 4.42Å; L79-Y82 HydrophobicContact CD2-CD2 3.72Å; L79-Y82 HydrophobicContact CD2-CE2 3.85Å; L79-Y82 WeakPolarHBondContact O-CB 3.44Å; L79-Y82 VanDerWaalsContact O-CD2 3.28Å; L79-Y82 WeakPolarHBondContact O-CD2 3.16Å; L79-Y82 PolarHBondContact O-N 2.54Å; L79-E178 HydrophobicContact CB-CB 4.25Å; L79-E178 HydrophobicContact CD1-CB 3.92Å; L79-E178 HydrophobicContact CG-CB 4.44Å; L79-E178 PolarHBondContact N-O 3.03Å; L79-C180 HydrophobicContact CD1-CB 3.99Å; L79-C180 HydrophobicContact CD2-CB 3.44Å; L79-C180 VanDerWaalsContact CD2-CB 3.44Å; L79-C180 HydrophobicContact CG-CB 3.67Å
80	S	71.1	Confident	75.4	Confident	94 Å²	94	54.1 Å²	54.1	66%	0.657	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-63.5	-17.2	178.3	61	0	0	0	0	113.9	P78	P78-S80 VanDerWaalsContact C-N 3.33Å; P78-S80 PolarHBondContact O-N 2.85Å
81	T	60	Low	75	Confident	77 Å²	77	52.5 Å²	52.5	47%	0.472	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-69.7	-26.9	174.8	-40.4	0	0	0	0	111.2	P78 L79	P78-T81 WeakPolarHBondContact O-CB 3.25Å; P78-T81 PolarHBondContact O-N 3.48Å; P78-T81 PolarHBondContact O-OG1 3.35Å; L79-T81 PolarHBondContact O-N 2.72Å; L79-T81 VanDerWaalsContact O-N 3.14Å
82	Y	55.9	Low	74.8	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.016	35%	0.351	C	S	.	.	S	Bend	trans	-87.7	123.5	179.5	-44	-58.2	0	0	0	107.5	L77 P78 L79 L84 L93 Q96 M97 Q100	L77-Y82 WeakPolarHBondContact CB-OH 3.43Å; L77-Y82 WeakPolarHBondContact CD1-OH 3.47Å; P78-Y82 VanDerWaalsContact O-CE2 3.26Å; P78-Y82 WeakPolarHBondContact O-CE2 3.39Å; L79-Y82 HydrophobicContact CB-CD2 4.42Å; L79-Y82 HydrophobicContact CD2-CD2 3.72Å; L79-Y82 HydrophobicContact CD2-CE2 3.85Å; L79-Y82 WeakPolarHBondContact O-CB 3.44Å; L79-Y82 VanDerWaalsContact O-CD2 3.28Å; L79-Y82 WeakPolarHBondContact O-CD2 3.16Å; L79-Y82 PolarHBondContact O-N 2.54Å; Y82-L84 PolarHBondContact O-N 2.9Å; Y82-L93 HydrophobicContact CD2-CD1 4.35Å; Y82-L93 HydrophobicContact CE2-CD1 4.46Å; Y82-Q96 HydrophobicContact CD1-CG 3.69Å; Y82-Q96 HydrophobicContact CE1-CG 3.88Å; Y82-M97 HydrophobicContact CE2-CE 4.35Å; Y82-M97 WeakPolarHBondContact OH-CG 3.37Å; Y82-Q100 PolarHBondContact OH-OE1 2.99Å
83	G	54.1	Low	74.5	Confident	82 Å²	82	51.5 Å²	51.5	85%	0.845	34%	0.338	S	S	*	.	S	Bend	trans	-63.3	22.5	165.2	0	0	0	0	0	113.6
84	L	53	Low	74.2	Confident	70 Å²	70	51.3 Å²	51.3	37%	0.366	34%	0.337	S	S	.	.			trans	-124.6	60.9	-170.8	-58.2	173.7	0	0	0	109.7	Y82 G86 T87	Y82-L84 PolarHBondContact O-N 2.9Å; L84-G86 PolarHBondContact O-N 2.91Å; L84-T87 HydrophobicContact CB-CG2 4.02Å; L84-T87 HydrophobicContact CD1-CG2 3.84Å; L84-T87 WeakPolarHBondContact CD1-OG1 3.46Å; L84-T87 HydrophobicContact CD2-CG2 3.33Å; L84-T87 HydrophobicContact CG-CG2 3.9Å
85	V	48.8	Very low	73.8	Confident	152 Å²	152	51.6 Å²	51.6	92%	0.921	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	19.6	162	-176.8	0	0	0	0	111.3
86	G	50.6	Low	73.4	Confident	63 Å²	63	51.9 Å²	51.9	65%	0.649	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-164.8	2.4	-173.9	0	0	0	0	0	119	L84 C88	L84-G86 PolarHBondContact O-N 2.91Å; G86-C88 PolarHBondContact O-N 3.33Å
87	T	57.5	Low	73.1	Confident	47 Å²	47	51.1 Å²	51.1	29%	0.288	33%	0.333	S	S	.	.			trans	-77.7	111.2	170.5	59.5	0	0	0	0	109.4	L84 D89	L84-T87 HydrophobicContact CB-CG2 4.02Å; L84-T87 HydrophobicContact CD1-CG2 3.84Å; L84-T87 WeakPolarHBondContact CD1-OG1 3.46Å; L84-T87 HydrophobicContact CD2-CG2 3.33Å; L84-T87 HydrophobicContact CG-CG2 3.9Å; T87-D89 PolarHBondContact O-N 3.47Å
88	C	64.7	Low	72.9	Confident	129 Å²	129	52 Å²	52	87%	0.872	34%	0.337	S	S	*	.			trans	-77.6	-3.8	172.3	-67.5	0	0	0	0	113.2	G86 P90	G86-C88 PolarHBondContact O-N 3.33Å; C88-P90 VanDerWaalsContact O-CD 3.27Å; C88-P90 WeakPolarHBondContact O-CD 3.41Å
89	D	82.1	Confident	72.7	Confident	71 Å²	71	56.9 Å²	56.9	38%	0.38	35%	0.353	S	S	.	.			trans	-77.1	115.6	-177.7	-168.1	-48.8	0	0	0	111.4	T87 I91 L92 L93	T87-D89 PolarHBondContact O-N 3.47Å; D89-I91 VanDerWaalsContact C-N 3.34Å; D89-I91 PolarHBondContact O-N 3.29Å; D89-I91 WeakPolarHBondContact OD1-CA 3.26Å; D89-I91 WeakPolarHBondContact OD1-CB 3.08Å; D89-I91 PolarHBondContact OD1-N 2.89Å; D89-L92 HydrophobicContact CB-CB 4.2Å; D89-L92 HydrophobicContact CB-CD1 3.92Å; D89-L92 HydrophobicContact CB-CG 3.97Å; D89-L92 PolarHBondContact OD1-N 3.02Å; D89-L93 PolarHBondContact O-N 3.37Å
90	P	82.9	Confident	72.7	Confident	39 Å²	39	56.5 Å²	56.5	25%	0.253	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-34.2	179.6	-22.2	35.4	0	0	0	113.8	C88 L93 M94 Y159 V182	C88-P90 VanDerWaalsContact O-CD 3.27Å; C88-P90 WeakPolarHBondContact O-CD 3.41Å; P90-L93 PolarHBondContact O-N 3.42Å; P90-M94 WeakPolarHBondContact O-CE 3.4Å; P90-M94 VanDerWaalsContact O-CG 3.28Å; P90-M94 WeakPolarHBondContact O-CG 3.3Å; P90-M94 PolarHBondContact O-N 2.87Å; P90-Y159 HydrophobicContact CB-CD1 4.28Å; P90-Y159 HydrophobicContact CB-CD2 3.51Å; P90-Y159 HydrophobicContact CB-CE2 3.83Å; P90-Y159 HydrophobicContact CB-CG 3.77Å; P90-Y159 HydrophobicContact CG-CD2 3.7Å; P90-Y159 HydrophobicContact CG-CE2 4.08Å; P90-Y159 HydrophobicContact CG-CG 4.35Å; P90-V182 HydrophobicContact CB-CG1 4.25Å
91	I	84	Confident	73.2	Confident	53 Å²	53	52.6 Å²	52.6	27%	0.272	32%	0.322	S	S	.	.	H	α-helix	trans	-67.9	-49.7	-176.3	-60	176.6	0	0	0	109.6	D89 L93 M94 D95 Y159 H339	D89-I91 VanDerWaalsContact C-N 3.34Å; D89-I91 PolarHBondContact O-N 3.29Å; D89-I91 WeakPolarHBondContact OD1-CA 3.26Å; D89-I91 WeakPolarHBondContact OD1-CB 3.08Å; D89-I91 PolarHBondContact OD1-N 2.89Å; I91-L93 VanDerWaalsContact C-N 3.26Å; I91-L93 PolarHBondContact O-N 3.06Å; I91-M94 HydrophobicContact CG1-CE 4.44Å; I91-M94 PolarHBondContact O-N 3.41Å; I91-D95 PolarHBondContact O-N 3.42Å; I91-Y159 VanDerWaalsContact CG1-OH 3.31Å; I91-Y159 WeakPolarHBondContact CG1-OH 3.43Å; I91-H339 HydrophobicContact CG2-CB 4.35Å
92	L	83.6	Confident	74.3	Confident	56 Å²	56	52.8 Å²	52.8	29%	0.293	32%	0.317	S	S	.	.	H	α-helix	trans	-59.2	-40	177	-63.1	-176.4	0	0	0	111.9	D89 Q96 L341	D89-L92 HydrophobicContact CB-CB 4.2Å; D89-L92 HydrophobicContact CB-CD1 3.92Å; D89-L92 HydrophobicContact CB-CG 3.97Å; D89-L92 PolarHBondContact OD1-N 3.02Å; L92-Q96 PolarHBondContact O-N 3.47Å; L92-Q96 VanDerWaalsContact O-N 3.13Å; L92-L341 HydrophobicContact CD2-CD1 3.37Å; L92-L341 HydrophobicContact CD2-CD2 3.88Å; L92-L341 HydrophobicContact CD2-CG 3.75Å
93	L	84.8	Confident	75.6	Confident	14 Å²	14	56.6 Å²	56.6	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-66.6	-43.8	179.2	-175.9	57	0	0	0	111.6	Y82 D89 P90 I91 Q96 M97 V182	Y82-L93 HydrophobicContact CD2-CD1 4.35Å; Y82-L93 HydrophobicContact CE2-CD1 4.46Å; D89-L93 PolarHBondContact O-N 3.37Å; P90-L93 PolarHBondContact O-N 3.42Å; I91-L93 VanDerWaalsContact C-N 3.26Å; I91-L93 PolarHBondContact O-N 3.06Å; L93-Q96 PolarHBondContact O-N 3.27Å; L93-M97 HydrophobicContact CD1-CE 3.84Å; L93-M97 HydrophobicContact CD2-CE 4.14Å; L93-M97 HydrophobicContact CG-CE 3.82Å; L93-M97 HydrophobicContact CG-SD 4.33Å; L93-M97 WeakPolarHBondContact O-CB 3.27Å; L93-M97 WeakPolarHBondContact O-CG 3.42Å; L93-M97 PolarHBondContact O-N 2.77Å; L93-V182 HydrophobicContact CD2-CG2 3.67Å; L93-V182 HydrophobicContact CG-CG2 4.29Å
94	M	86.9	Confident	76.9	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-43.4	177	-71.4	-177.7	-60	0	0	112.4	P90 I91 Q96 M97 E98 Y159 V182 H339	P90-M94 WeakPolarHBondContact O-CE 3.4Å; P90-M94 VanDerWaalsContact O-CG 3.28Å; P90-M94 WeakPolarHBondContact O-CG 3.3Å; P90-M94 PolarHBondContact O-N 2.87Å; I91-M94 HydrophobicContact CG1-CE 4.44Å; I91-M94 PolarHBondContact O-N 3.41Å; M94-Q96 VanDerWaalsContact C-N 3.3Å; M94-Q96 PolarHBondContact O-N 2.87Å; M94-M97 WeakPolarHBondContact O-CB 3.45Å; M94-M97 PolarHBondContact O-N 3Å; M94-E98 PolarHBondContact O-N 3.34Å; M94-Y159 HydrophobicContact CE-CD1 3.57Å; M94-Y159 HydrophobicContact CE-CE1 3.22Å; M94-Y159 HydrophobicContact SD-CD1 3.88Å; M94-Y159 HydrophobicContact SD-CE1 4.08Å; M94-V182 HydrophobicContact CG-CB 3.73Å; M94-V182 HydrophobicContact CG-CG1 3.8Å; M94-V182 HydrophobicContact SD-CB 4.36Å; M94-V182 HydrophobicContact SD-CG1 3.87Å; M94-H339 HydrophobicContact CB-CB 4.37Å; M94-H339 WeakPolarHBondContact CE-CE1 3.08Å; M94-H339 WeakPolarHBondContact CE-ND1 3.38Å; M94-H339 WeakPolarHBondContact CE-NE2 3.41Å
95	D	84.8	Confident	78.1	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.032	31%	0.307	C	S	.	.	H	α-helix	trans	-56.3	-45.7	175.9	-168.8	23.5	0	0	0	111.6	I91 E98 R99 H339 L341	I91-D95 PolarHBondContact O-N 3.42Å; D95-E98 PolarHBondContact O-N 3.07Å; D95-R99 VanDerWaalsContact CG-CZ 3.45Å; D95-R99 VanDerWaalsContact CG-NH1 3.25Å; D95-R99 VanDerWaalsContact CG-NH2 3.29Å; D95-R99 WeakPolarHBondContact O-CG 3.48Å; D95-R99 PolarHBondContact O-N 2.84Å; D95-R99 IonicContact OD1-CZ 3.62Å; D95-R99 IonicContact OD1-NH1 2.6Å; D95-R99 PolarHBondContact OD1-NH1 2.98Å; D95-R99 IonicContact OD1-NH2 3.75Å; D95-R99 IonicContact OD2-CZ 2.77Å; D95-R99 IonicContact OD2-NH1 3.72Å; D95-R99 PolarHBondContact OD2-NH1 2.93Å; D95-R99 IonicContact OD2-NH2 2.71Å; D95-R99 PolarHBondContact OD2-NH2 3.36Å; D95-H339 WeakPolarHBondContact CB-O 3.36Å; D95-H339 VanDerWaalsContact CG-O 3.22Å; D95-L341 PolarHBondContact OD2-N 3.11Å
96	Q	83.9	Confident	79.6	Confident	52 Å²	52	53.7 Å²	53.7	24%	0.243	29%	0.293	C	S	.	.	H	α-helix	trans	-68.2	-40.3	177.9	-168.7	173.3	11.5	0	0	112.6	Y82 L92 L93 M94 E98 R99 Q100	Y82-Q96 HydrophobicContact CD1-CG 3.69Å; Y82-Q96 HydrophobicContact CE1-CG 3.88Å; L92-Q96 PolarHBondContact O-N 3.47Å; L92-Q96 VanDerWaalsContact O-N 3.13Å; L93-Q96 PolarHBondContact O-N 3.27Å; M94-Q96 VanDerWaalsContact C-N 3.3Å; M94-Q96 PolarHBondContact O-N 2.87Å; Q96-E98 VanDerWaalsContact C-N 3.33Å; Q96-E98 PolarHBondContact O-N 2.95Å; Q96-R99 PolarHBondContact O-N 2.89Å; Q96-Q100 WeakPolarHBondContact O-CB 3.31Å; Q96-Q100 PolarHBondContact O-N 2.93Å
97	M	85.6	Confident	81	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-42.5	174.3	-75.7	-177.8	173.4	0	0	111.7	L77 Y82 L93 M94 Q100 M101 C180	L77-M97 HydrophobicContact CD1-CB 3.83Å; L77-M97 HydrophobicContact CD1-CG 3.93Å; Y82-M97 HydrophobicContact CE2-CE 4.35Å; Y82-M97 WeakPolarHBondContact OH-CG 3.37Å; L93-M97 HydrophobicContact CD1-CE 3.84Å; L93-M97 HydrophobicContact CD2-CE 4.14Å; L93-M97 HydrophobicContact CG-CE 3.82Å; L93-M97 HydrophobicContact CG-SD 4.33Å; L93-M97 WeakPolarHBondContact O-CB 3.27Å; L93-M97 WeakPolarHBondContact O-CG 3.42Å; L93-M97 PolarHBondContact O-N 2.77Å; M94-M97 WeakPolarHBondContact O-CB 3.45Å; M94-M97 PolarHBondContact O-N 3Å; M97-Q100 PolarHBondContact O-N 3.42Å; M97-M101 WeakPolarHBondContact O-CG 3.4Å; M97-M101 PolarHBondContact O-N 2.82Å; M97-C180 HydrophobicContact CE-CB 3.74Å; M97-C180 WeakPolarHBondContact CE-O 3.41Å
98	E	85.6	Confident	81.6	Confident	26 Å²	26	58.9 Å²	58.9	12%	0.121	30%	0.299	C	S	.	.	H	α-helix	trans	-68.2	-42.9	177.5	-171.2	61.9	-137.9	0	0	111.7	M94 D95 Q96 Q100 M101 Q102 R105 S118 I119	M94-E98 PolarHBondContact O-N 3.34Å; D95-E98 PolarHBondContact O-N 3.07Å; Q96-E98 VanDerWaalsContact C-N 3.33Å; Q96-E98 PolarHBondContact O-N 2.95Å; E98-Q100 VanDerWaalsContact C-N 3.31Å; E98-Q100 PolarHBondContact O-N 2.71Å; E98-M101 HydrophobicContact CB-CE 4.37Å; E98-M101 VanDerWaalsContact CD-CE 3.47Å; E98-M101 HydrophobicContact CG-CE 4.49Å; E98-M101 PolarHBondContact O-N 2.87Å; E98-M101 WeakPolarHBondContact OE2-CE 3.41Å; E98-Q102 WeakPolarHBondContact O-CB 3.39Å; E98-Q102 PolarHBondContact O-N 3.37Å; E98-R105 IonicContact OE1-CZ 2.93Å; E98-R105 IonicContact OE1-NH1 2.61Å; E98-R105 PolarHBondContact OE1-NH1 3.31Å; E98-R105 IonicContact OE1-NH2 3.32Å; E98-R105 PolarHBondContact OE1-NH2 2.91Å; E98-R105 IonicContact OE2-NH2 2.81Å; E98-S118 PolarHBondContact OE1-OG 2.78Å; E98-I119 HydrophobicContact CB-CD1 3.89Å; E98-I119 HydrophobicContact CG-CD1 3.83Å; E98-I119 HydrophobicContact CG-CG1 4.15Å; E98-I119 VanDerWaalsContact OE2-CG1 3.3Å; E98-I119 WeakPolarHBondContact OE2-CG1 3.49Å; E98-I119 PolarHBondContact OE2-N 3.35Å
99	R	84.4	Confident	81.3	Confident	123 Å²	123	64.3 Å²	64.3	46%	0.464	30%	0.301	S	S	.	.	H	α-helix	trans	-56.9	-43.5	173.3	-79.5	-168.4	-76.8	-102.6	-4.7	112.5	D95 Q96 Q102 D103	D95-R99 VanDerWaalsContact CG-CZ 3.45Å; D95-R99 VanDerWaalsContact CG-NH1 3.25Å; D95-R99 VanDerWaalsContact CG-NH2 3.29Å; D95-R99 WeakPolarHBondContact O-CG 3.48Å; D95-R99 PolarHBondContact O-N 2.84Å; D95-R99 IonicContact OD1-CZ 3.62Å; D95-R99 IonicContact OD1-NH1 2.6Å; D95-R99 PolarHBondContact OD1-NH1 2.98Å; D95-R99 IonicContact OD1-NH2 3.75Å; D95-R99 IonicContact OD2-CZ 2.77Å; D95-R99 IonicContact OD2-NH1 3.72Å; D95-R99 PolarHBondContact OD2-NH1 2.93Å; D95-R99 IonicContact OD2-NH2 2.71Å; D95-R99 PolarHBondContact OD2-NH2 3.36Å; Q96-R99 PolarHBondContact O-N 2.89Å; R99-Q102 PolarHBondContact O-N 3.42Å; R99-D103 PolarHBondContact O-N 3.13Å
100	Q	81.4	Confident	80	Confident	27 Å²	27	64.9 Å²	64.9	13%	0.126	30%	0.304	C	S	.	.	H	α-helix	trans	-67	-42	178.8	-178.3	178	-24.3	0	0	111.9	Y82 Q96 M97 E98 Q102 D103 M104	Y82-Q100 PolarHBondContact OH-OE1 2.99Å; Q96-Q100 WeakPolarHBondContact O-CB 3.31Å; Q96-Q100 PolarHBondContact O-N 2.93Å; M97-Q100 PolarHBondContact O-N 3.42Å; E98-Q100 VanDerWaalsContact C-N 3.31Å; E98-Q100 PolarHBondContact O-N 2.71Å; Q100-Q102 VanDerWaalsContact C-N 3.27Å; Q100-Q102 PolarHBondContact O-N 2.6Å; Q100-D103 PolarHBondContact O-N 2.83Å; Q100-M104 HydrophobicContact CG-CE 4.06Å; Q100-M104 VanDerWaalsContact NE2-CE 3.28Å; Q100-M104 WeakPolarHBondContact O-CG 3.4Å; Q100-M104 PolarHBondContact O-N 3.18Å
101	M	83.3	Confident	78.5	Confident	11 Å²	11	71.1 Å²	71.1	5%	0.054	34%	0.335	C	S	.	.	H	α-helix	trans	-63.4	-37.9	173.9	-73.2	-170.9	-59.6	0	0	111.7	L77 M97 E98 M104 R105 R181	L77-M101 HydrophobicContact CD1-CG 4.03Å; M97-M101 WeakPolarHBondContact O-CG 3.4Å; M97-M101 PolarHBondContact O-N 2.82Å; E98-M101 HydrophobicContact CB-CE 4.37Å; E98-M101 VanDerWaalsContact CD-CE 3.47Å; E98-M101 HydrophobicContact CG-CE 4.49Å; E98-M101 PolarHBondContact O-N 2.87Å; E98-M101 WeakPolarHBondContact OE2-CE 3.41Å; M101-M104 PolarHBondContact O-N 2.95Å; M101-R105 VanDerWaalsContact O-CG 3.26Å; M101-R105 WeakPolarHBondContact O-CG 3.25Å; M101-R105 PolarHBondContact O-N 3.32Å; M101-R181 VanDerWaalsContact CE-NH1 3.31Å; M101-R181 VanDerWaalsContact SD-CZ 3.53Å; M101-R181 PolarHBondContact SD-NH1 3.04Å; M101-R181 PolarHBondContact SD-NH2 3.37Å
102	Q	83.4	Confident	76.8	Confident	82 Å²	82	75.7 Å²	75.7	38%	0.383	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-45.2	176.2	-172.4	58.3	38.1	0	0	111.2	E98 R99 Q100 M104 R105 D106	E98-Q102 WeakPolarHBondContact O-CB 3.39Å; E98-Q102 PolarHBondContact O-N 3.37Å; R99-Q102 PolarHBondContact O-N 3.42Å; Q100-Q102 VanDerWaalsContact C-N 3.27Å; Q100-Q102 PolarHBondContact O-N 2.6Å; Q102-M104 VanDerWaalsContact C-N 3.33Å; Q102-M104 PolarHBondContact O-N 3Å; Q102-R105 WeakPolarHBondContact O-CB 3.43Å; Q102-R105 PolarHBondContact O-N 3.49Å; Q102-R105 VanDerWaalsContact O-N 3.11Å; Q102-D106 PolarHBondContact NE2-OD1 3.37Å; Q102-D106 PolarHBondContact O-N 2.99Å
103	D	83.1	Confident	75.3	Confident	83 Å²	83	75.8 Å²	75.8	44%	0.444	36%	0.358	S	S	.	.	H	α-helix	trans	-59.6	-42.3	173.7	177.9	53.6	0	0	0	111.8	R99 Q100 R105 D106 Q107	R99-D103 PolarHBondContact O-N 3.13Å; Q100-D103 PolarHBondContact O-N 2.83Å; D103-R105 VanDerWaalsContact C-N 3.33Å; D103-R105 PolarHBondContact O-N 2.75Å; D103-D106 PolarHBondContact O-N 3.43Å; D103-Q107 WeakPolarHBondContact O-CB 3.38Å; D103-Q107 VanDerWaalsContact O-CG 3.26Å; D103-Q107 WeakPolarHBondContact O-CG 3.35Å; D103-Q107 PolarHBondContact O-N 3.41Å; D103-Q107 PolarHBondContact OD1-NE2 2.87Å; D103-Q107 PolarHBondContact OD2-NE2 3.29Å
104	M	80	Confident	73.8	Confident	80 Å²	80	80.1 Å²	80.1	39%	0.394	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-40.4	173.6	-72.8	177.5	175.3	0	0	112.4	Q100 M101 Q102 Q107 I108	Q100-M104 HydrophobicContact CG-CE 4.06Å; Q100-M104 VanDerWaalsContact NE2-CE 3.28Å; Q100-M104 WeakPolarHBondContact O-CG 3.4Å; Q100-M104 PolarHBondContact O-N 3.18Å; M101-M104 PolarHBondContact O-N 2.95Å; Q102-M104 VanDerWaalsContact C-N 3.33Å; Q102-M104 PolarHBondContact O-N 3Å; M104-Q107 PolarHBondContact O-N 3.34Å; M104-I108 VanDerWaalsContact O-CG1 3.28Å; M104-I108 WeakPolarHBondContact O-CG1 3.47Å; M104-I108 PolarHBondContact O-N 3.48Å
105	R	78.1	Confident	72.5	Confident	48 Å²	48	81.7 Å²	81.7	18%	0.181	39%	0.389	C	S	.	.	H	α-helix	trans	-63.8	-44.8	175.4	-69.9	170.7	-156.4	135	3	110.9	E98 M101 Q102 D103 Q107 I108 S115	E98-R105 IonicContact OE1-CZ 2.93Å; E98-R105 IonicContact OE1-NH1 2.61Å; E98-R105 PolarHBondContact OE1-NH1 3.31Å; E98-R105 IonicContact OE1-NH2 3.32Å; E98-R105 PolarHBondContact OE1-NH2 2.91Å; E98-R105 IonicContact OE2-NH2 2.81Å; M101-R105 VanDerWaalsContact O-CG 3.26Å; M101-R105 WeakPolarHBondContact O-CG 3.25Å; M101-R105 PolarHBondContact O-N 3.32Å; Q102-R105 WeakPolarHBondContact O-CB 3.43Å; Q102-R105 PolarHBondContact O-N 3.49Å; Q102-R105 VanDerWaalsContact O-N 3.11Å; D103-R105 VanDerWaalsContact C-N 3.33Å; D103-R105 PolarHBondContact O-N 2.75Å; R105-Q107 VanDerWaalsContact C-N 3.29Å; R105-Q107 PolarHBondContact O-N 3.4Å; R105-I108 PolarHBondContact O-N 3.15Å; R105-I108 VanDerWaalsContact O-O 3.13Å; R105-S115 PolarHBondContact NE-OG 3.21Å; R105-S115 PolarHBondContact NH2-OG 3.02Å
106	D	81.2	Confident	71.4	Confident	115 Å²	115	85 Å²	85	62%	0.615	41%	0.406	S	S	*	.	H	α-helix	trans	-66.5	-32.7	-179.1	-64.2	-19.3	0	0	0	111.7	Q102 D103	Q102-D106 PolarHBondContact NE2-OD1 3.37Å; Q102-D106 PolarHBondContact O-N 2.99Å; D103-D106 PolarHBondContact O-N 3.43Å
107	Q	79	Confident	70.7	Confident	135 Å²	135	82.7 Å²	82.7	63%	0.631	40%	0.396	S	S	*	.	H	α-helix	trans	-75.6	-35.6	176.9	-73.2	177	21.6	0	0	113.3	D103 M104 R105 R109	D103-Q107 WeakPolarHBondContact O-CB 3.38Å; D103-Q107 VanDerWaalsContact O-CG 3.26Å; D103-Q107 WeakPolarHBondContact O-CG 3.35Å; D103-Q107 PolarHBondContact O-N 3.41Å; D103-Q107 PolarHBondContact OD1-NE2 2.87Å; D103-Q107 PolarHBondContact OD2-NE2 3.29Å; M104-Q107 PolarHBondContact O-N 3.34Å; R105-Q107 VanDerWaalsContact C-N 3.29Å; R105-Q107 PolarHBondContact O-N 3.4Å; Q107-R109 PolarHBondContact O-N 2.63Å; Q107-R109 VanDerWaalsContact O-N 3.09Å
108	I	71.6	Confident	70.3	Confident	84 Å²	84	82.8 Å²	82.8	43%	0.431	40%	0.397	S	S	.	.			trans	-79.8	94.8	176.4	-60.6	165	0	0	0	107.9	M104 R105 D110 V113	M104-I108 VanDerWaalsContact O-CG1 3.28Å; M104-I108 WeakPolarHBondContact O-CG1 3.47Å; M104-I108 PolarHBondContact O-N 3.48Å; R105-I108 PolarHBondContact O-N 3.15Å; R105-I108 VanDerWaalsContact O-O 3.13Å; I108-D110 HydrophobicContact CG2-CB 3.77Å; I108-D110 PolarHBondContact O-N 2.6Å; I108-V113 HydrophobicContact CD1-CG2 4.43Å; I108-V113 HydrophobicContact CG2-CG2 3.71Å
109	R	58.4	Low	69.9	Low	244 Å²	244	83 Å²	83	92%	0.921	40%	0.398	S	S	*	.			trans	-71.5	55.2	171.6	-162.9	-174.4	70.8	-172.7	0.9	111.4	Q107	Q107-R109 PolarHBondContact O-N 2.63Å; Q107-R109 VanDerWaalsContact O-N 3.09Å
110	D	53.8	Low	69.5	Low	82 Å²	82	78.4 Å²	78.4	44%	0.439	39%	0.385	S	S	.	.			trans	-135.3	109.7	174.2	-165.4	-3.5	0	0	0	109	I108 Q112 V113	I108-D110 HydrophobicContact CG2-CB 3.77Å; I108-D110 PolarHBondContact O-N 2.6Å; D110-Q112 PolarHBondContact O-N 2.83Å; D110-Q112 PolarHBondContact OD1-N 2.95Å; D110-V113 PolarHBondContact O-N 3.19Å
111	N	52.8	Low	69.6	Low	171 Å²	171	78.6 Å²	78.6	91%	0.914	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-1.1	177.8	-77.4	16.2	0	0	0	113.2
112	Q	46.9	Very low	69.8	Low	148 Å²	148	79 Å²	79	69%	0.692	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-11.9	-178.9	-61.1	-163.1	-22.8	0	0	115	D110 H114	D110-Q112 PolarHBondContact O-N 2.83Å; D110-Q112 PolarHBondContact OD1-N 2.95Å; Q112-H114 VanDerWaalsContact C-N 3.27Å; Q112-H114 PolarHBondContact O-N 2.83Å; Q112-H114 PolarHBondContact O-ND1 3.13Å
113	V	51.7	Low	70.2	Confident	59 Å²	59	75.1 Å²	75.1	36%	0.358	37%	0.37	S	S	.	.			trans	-75.3	87.6	172.4	-172.9	0	0	0	0	108.3	I108 D110 S115 I116	I108-V113 HydrophobicContact CD1-CG2 4.43Å; I108-V113 HydrophobicContact CG2-CG2 3.71Å; D110-V113 PolarHBondContact O-N 3.19Å; V113-S115 PolarHBondContact O-N 2.88Å; V113-I116 HydrophobicContact CG1-CD1 4.26Å; V113-I116 HydrophobicContact CG1-CG1 4.26Å
114	H	54.4	Low	70.4	Confident	104 Å²	104	73.4 Å²	73.4	48%	0.481	36%	0.359	S	S	.	.			trans	-53.5	139.9	166.1	-65.2	62.5	0	0	0	107.5	Q71 Q112 I116	Q71-H114 HydrophobicContact CB-CB 4.38Å; Q71-H114 HydrophobicContact CG-CB 4.38Å; Q71-H114 PolarHBondContact NE2-ND1 2.88Å; Q112-H114 VanDerWaalsContact C-N 3.27Å; Q112-H114 PolarHBondContact O-N 2.83Å; Q112-H114 PolarHBondContact O-ND1 3.13Å; H114-I116 VanDerWaalsContact C-N 3.34Å; H114-I116 VanDerWaalsContact O-CG1 3.28Å; H114-I116 WeakPolarHBondContact O-CG1 3.26Å; H114-I116 PolarHBondContact O-N 3.24Å
115	S	59.6	Low	70.9	Confident	34 Å²	34	70.7 Å²	70.7	24%	0.238	35%	0.346	C	S	.	.			trans	-53.2	92.1	-174.9	-147.5	0	0	0	0	111.1	R105 V113 G117 S118 D121	R105-S115 PolarHBondContact NE-OG 3.21Å; R105-S115 PolarHBondContact NH2-OG 3.02Å; V113-S115 PolarHBondContact O-N 2.88Å; S115-G117 PolarHBondContact O-N 2.92Å; S115-S118 VanDerWaalsContact OG-CB 3.29Å; S115-S118 WeakPolarHBondContact OG-CB 3.41Å; S115-D121 VanDerWaalsContact CB-OD2 3.31Å; S115-D121 WeakPolarHBondContact CB-OD2 3.23Å
116	I	62.2	Low	71.6	Confident	77 Å²	77	68.5 Å²	68.5	40%	0.395	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	109.7	-172.4	-61.6	-177.4	0	0	0	107.7	M73 V75 V113 H114 S118	M73-I116 WeakPolarHBondContact O-CG2 3.1Å; V75-I116 HydrophobicContact CG1-CG2 3.84Å; V75-I116 HydrophobicContact CG2-CG2 4.44Å; V113-I116 HydrophobicContact CG1-CD1 4.26Å; V113-I116 HydrophobicContact CG1-CG1 4.26Å; H114-I116 VanDerWaalsContact C-N 3.34Å; H114-I116 VanDerWaalsContact O-CG1 3.28Å; H114-I116 WeakPolarHBondContact O-CG1 3.26Å; H114-I116 PolarHBondContact O-N 3.24Å; I116-S118 VanDerWaalsContact C-N 3.33Å; I116-S118 PolarHBondContact O-N 3.2Å
117	G	67.7	Low	72.2	Confident	2 Å²	2	63.5 Å²	63.5	2%	0.021	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	42.7	178.5	0	0	0	0	0	114.7	M73 F74 S115 R181	M73-G117 PolarHBondContact O-N 2.93Å; F74-G117 WeakPolarHBondContact CD1-O 3.35Å; F74-G117 WeakPolarHBondContact CE1-O 3.44Å; S115-G117 PolarHBondContact O-N 2.92Å; G117-R181 PolarHBondContact O-NH2 3.45Å
118	S	78	Confident	72.8	Confident	4 Å²	4	57.4 Å²	57.4	3%	0.028	28%	0.282	C	S	.	.			trans	-60.7	144.4	172.5	178.2	0	0	0	0	111.7	E98 S115 I116 S120 D121 Y122	E98-S118 PolarHBondContact OE1-OG 2.78Å; S115-S118 VanDerWaalsContact OG-CB 3.29Å; S115-S118 WeakPolarHBondContact OG-CB 3.41Å; I116-S118 VanDerWaalsContact C-N 3.33Å; I116-S118 PolarHBondContact O-N 3.2Å; S118-S120 PolarHBondContact O-N 3.32Å; S118-S120 PolarHBondContact OG-N 2.88Å; S118-D121 PolarHBondContact O-N 2.96Å; S118-Y122 PolarHBondContact O-N 3.38Å
119	I	77.7	Confident	73.8	Confident	29 Å²	29	53.4 Å²	53.4	15%	0.149	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22	175.2	69.9	-178.4	0	0	0	112.6	E98 D121 Y122	E98-I119 HydrophobicContact CB-CD1 3.89Å; E98-I119 HydrophobicContact CG-CD1 3.83Å; E98-I119 HydrophobicContact CG-CG1 4.15Å; E98-I119 VanDerWaalsContact OE2-CG1 3.3Å; E98-I119 WeakPolarHBondContact OE2-CG1 3.49Å; E98-I119 PolarHBondContact OE2-N 3.35Å; I119-D121 VanDerWaalsContact C-N 3.32Å; I119-Y122 WeakPolarHBondContact O-CD1 3.47Å; I119-Y122 WeakPolarHBondContact O-CE1 3.29Å
120	S	76.3	Confident	75.4	Confident	27 Å²	27	42.1 Å²	42.1	19%	0.189	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-15.1	176.1	-74.8	0	0	0	0	113.3	S118 N284	S118-S120 PolarHBondContact O-N 3.32Å; S118-S120 PolarHBondContact OG-N 2.88Å; S120-N284 VanDerWaalsContact CB-OD1 3.25Å; S120-N284 WeakPolarHBondContact CB-OD1 3.35Å; S120-N284 PolarHBondContact OG-ND2 3.03Å; S120-N284 VanDerWaalsContact OG-ND2 3.07Å; S120-N284 PolarHBondContact OG-OD1 2.81Å
121	D	83.4	Confident	77.1	Confident	31 Å²	31	42.4 Å²	42.4	17%	0.166	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-23.6	-165.5	-68.5	0.7	0	0	0	113	S115 S118 I119 L123 K124 S283	S115-D121 VanDerWaalsContact CB-OD2 3.31Å; S115-D121 WeakPolarHBondContact CB-OD2 3.23Å; S118-D121 PolarHBondContact O-N 2.96Å; I119-D121 VanDerWaalsContact C-N 3.32Å; D121-L123 VanDerWaalsContact C-N 3.3Å; D121-L123 PolarHBondContact O-N 3.01Å; D121-K124 WeakPolarHBondContact O-CD 3Å; D121-K124 WeakPolarHBondContact O-CG 3.28Å; D121-K124 PolarHBondContact O-N 2.97Å; D121-S283 WeakPolarHBondContact OD1-CB 3.21Å; D121-S283 PolarHBondContact OD1-OG 2.72Å; D121-S283 PolarHBondContact OD2-OG 3.32Å
122	Y	87.1	Confident	78.7	Confident	19 Å²	19	37.2 Å²	37.2	8%	0.075	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.5	-33.1	-167.7	77.5	-78.2	0	0	0	113.6	F74 S118 I119 K124 D125 A126 F137 V139 I183 E184	F74-Y122 HydrophobicContact CE2-CD2 4.32Å; F74-Y122 HydrophobicContact CE2-CG 4.14Å; F74-Y122 HydrophobicContact CZ-CD1 4.04Å; F74-Y122 HydrophobicContact CZ-CD2 4.13Å; F74-Y122 AromaticContact CZ-CG 3.6Å; F74-Y122 HydrophobicContact CZ-CG 3.6Å; S118-Y122 PolarHBondContact O-N 3.38Å; I119-Y122 WeakPolarHBondContact O-CD1 3.47Å; I119-Y122 WeakPolarHBondContact O-CE1 3.29Å; Y122-K124 VanDerWaalsContact C-N 3.29Å; Y122-K124 PolarHBondContact O-N 3.18Å; Y122-D125 PolarHBondContact O-N 3.41Å; Y122-A126 WeakPolarHBondContact O-CB 3.45Å; Y122-A126 PolarHBondContact O-N 2.89Å; Y122-F137 HydrophobicContact CE2-CE2 4.3Å; Y122-F137 HydrophobicContact CE2-CZ 4.34Å; Y122-V139 HydrophobicContact CD2-CG1 3.7Å; Y122-V139 HydrophobicContact CE2-CG1 4.35Å; Y122-I183 HydrophobicContact CE2-CD1 4.37Å; Y122-E184 PolarHBondContact OH-O 2.85Å
123	L	90.4	Very high	80.6	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-67.8	-23.8	-174.5	-69.6	176.8	0	0	0	114.2	D121 D125 A126 F137 P186 T314 L315 P317 M336	D121-L123 VanDerWaalsContact C-N 3.3Å; D121-L123 PolarHBondContact O-N 3.01Å; L123-D125 VanDerWaalsContact C-N 3.27Å; L123-D125 PolarHBondContact O-N 2.94Å; L123-A126 HydrophobicContact CD2-CB 4.25Å; L123-A126 PolarHBondContact O-N 3.48Å; L123-F137 HydrophobicContact CD2-CE2 4.31Å; L123-P186 HydrophobicContact CD2-CG 3.66Å; L123-T314 HydrophobicContact CD1-CG2 4.01Å; L123-L315 WeakPolarHBondContact CD1-O 3.42Å; L123-P317 WeakPolarHBondContact O-CG 3.27Å; L123-M336 HydrophobicContact CD1-CE 4.44Å; L123-M336 HydrophobicContact CD1-CG 3.96Å; L123-M336 HydrophobicContact CD1-SD 4.4Å
124	K	88.9	Confident	82.3	Confident	48 Å²	48	30.7 Å²	30.7	21%	0.209	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-66.4	-28.8	-178.7	77.7	-167.6	170	-175.8	0	113.9	D121 Y122 Q225 V281 D282 S283	D121-K124 WeakPolarHBondContact O-CD 3Å; D121-K124 WeakPolarHBondContact O-CG 3.28Å; D121-K124 PolarHBondContact O-N 2.97Å; Y122-K124 VanDerWaalsContact C-N 3.29Å; Y122-K124 PolarHBondContact O-N 3.18Å; K124-Q225 WeakPolarHBondContact O-CG 3.22Å; K124-Q225 PolarHBondContact O-NE2 3.49Å; K124-V281 WeakPolarHBondContact CB-O 3.31Å; K124-D282 WeakPolarHBondContact CD-OD1 3.28Å; K124-D282 IonicContact NZ-OD1 2.67Å; K124-D282 PolarHBondContact NZ-OD1 3.45Å; K124-S283 PolarHBondContact NZ-OG 3.32Å
125	D	90.6	Very high	84.1	Confident	23 Å²	23	25.8 Å²	25.8	12%	0.123	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-117.3	13.1	178.6	-71.9	-62.9	0	0	0	111.2	R68 L69 Y122 L123 Y127 H138 Q225	R68-D125 IonicContact CZ-OD1 2.73Å; R68-D125 VanDerWaalsContact CZ-OD1 3.32Å; R68-D125 IonicContact NE-OD1 2.7Å; R68-D125 PolarHBondContact NE-OD1 2.92Å; R68-D125 IonicContact NE-OD2 3.12Å; R68-D125 PolarHBondContact NE-OD2 3.37Å; R68-D125 IonicContact NH2-OD1 3.29Å; R68-D125 PolarHBondContact NH2-OD1 3.32Å; L69-D125 HydrophobicContact CD2-CB 4.13Å; Y122-D125 PolarHBondContact O-N 3.41Å; L123-D125 VanDerWaalsContact C-N 3.27Å; L123-D125 PolarHBondContact O-N 2.94Å; D125-Y127 VanDerWaalsContact C-N 3.29Å; D125-Y127 PolarHBondContact O-N 3.04Å; D125-H138 PolarHBondContact O-CE1 3.43Å; D125-Q225 VanDerWaalsContact CG-NE2 3.29Å; D125-Q225 WeakPolarHBondContact OD1-CG 3.5Å; D125-Q225 PolarHBondContact OD1-NE2 2.79Å; D125-Q225 PolarHBondContact OD2-NE2 3.09Å
126	A	93	Very high	85.8	Confident	1 Å²	1	26 Å²	26	1%	0.008	13%	0.13	C	C	.	.	S	Bend	trans	-81	-5.2	-175.8	0	0	0	0	0	114.2	Y122 L123 F137 H138	Y122-A126 WeakPolarHBondContact O-CB 3.45Å; Y122-A126 PolarHBondContact O-N 2.89Å; L123-A126 HydrophobicContact CD2-CB 4.25Å; L123-A126 PolarHBondContact O-N 3.48Å; A126-F137 HydrophobicContact CB-CD2 3.86Å; A126-F137 HydrophobicContact CB-CE2 3.68Å; A126-F137 CarbonylContact O-C 3.56Å; A126-F137 VanDerWaalsContact O-CA 3.26Å; A126-F137 WeakPolarHBondContact O-CA 3.46Å; A126-H138 VanDerWaalsContact CA-O 3.28Å; A126-H138 WeakPolarHBondContact CA-O 3.21Å; A126-H138 PolarHBondContact O-N 3.45Å
127	Y	93.8	Very high	87.4	Confident	10 Å²	10	22.3 Å²	22.3	4%	0.039	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.1	-177.7	-60.7	-75.8	0	0	0	111.9	D125 V135 H136 F137 P186 S188 V210 D316 P317 L318	D125-Y127 VanDerWaalsContact C-N 3.29Å; D125-Y127 PolarHBondContact O-N 3.04Å; Y127-V135 HydrophobicContact CD1-CG1 4.05Å; Y127-V135 HydrophobicContact CG-CG1 4.43Å; Y127-H136 WeakPolarHBondContact CA-O 3.49Å; Y127-F137 HydrophobicContact CD1-CB 4.14Å; Y127-F137 HydrophobicContact CD1-CD2 4.45Å; Y127-F137 HydrophobicContact CE1-CB 3.82Å; Y127-F137 AromaticContact CE1-CD2 3.88Å; Y127-F137 HydrophobicContact CE1-CD2 3.88Å; Y127-F137 HydrophobicContact CE1-CG 4.35Å; Y127-P186 WeakPolarHBondContact OH-CB 3.26Å; Y127-P186 WeakPolarHBondContact OH-CG 3.4Å; Y127-S188 PolarHBondContact OH-OG 3.24Å; Y127-V210 HydrophobicContact CD1-CG2 3.92Å; Y127-V210 HydrophobicContact CE1-CG2 3.78Å; Y127-D316 WeakPolarHBondContact CE2-OD1 3.28Å; Y127-D316 PolarHBondContact OH-OD1 3.32Å; Y127-D316 PolarHBondContact OH-OD2 3.46Å; Y127-P317 HydrophobicContact CD2-CB 4.46Å; Y127-P317 HydrophobicContact CD2-CG 4.03Å; Y127-P317 HydrophobicContact CE2-CB 4.48Å; Y127-P317 HydrophobicContact CE2-CG 3.96Å; Y127-L318 HydrophobicContact CD1-CD1 3.63Å; Y127-L318 HydrophobicContact CD1-CG 4.4Å; Y127-L318 HydrophobicContact CD2-CD1 4.43Å; Y127-L318 HydrophobicContact CD2-CG 4.35Å; Y127-L318 HydrophobicContact CE1-CD1 3.51Å; Y127-L318 HydrophobicContact CE1-CG 4.27Å; Y127-L318 HydrophobicContact CE2-CD1 4.31Å; Y127-L318 HydrophobicContact CE2-CG 4.2Å; Y127-L318 HydrophobicContact CG-CD1 4.09Å; Y127-L318 HydrophobicContact CG-CG 4.42Å
128	E	91.7	Very high	88.8	Confident	8 Å²	8	22.8 Å²	22.8	4%	0.037	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	169	173.1	78.8	-168.4	166.6	0	0	110.9	R24 L27 W54 G130 H136 H138 K205	R24-E128 IonicContact CZ-OE2 3.61Å; R24-E128 IonicContact NH1-OE2 3.95Å; R24-E128 PolarHBondContact NH1-OE2 3.07Å; R24-E128 IonicContact NH2-OE2 3.43Å; L27-E128 HydrophobicContact CD2-CG 4.4Å; W54-E128 HydrophobicContact CZ2-CB 4.28Å; E128-G130 PolarHBondContact O-N 2.96Å; E128-H136 PolarHBondContact N-O 3.3Å; E128-H136 VanDerWaalsContact N-O 3.11Å; E128-H136 PolarHBondContact O-N 3.33Å; E128-H138 WeakPolarHBondContact CB-NE2 3.25Å; E128-H138 WeakPolarHBondContact CG-CD2 3.42Å; E128-H138 VanDerWaalsContact CG-NE2 3.32Å; E128-H138 WeakPolarHBondContact CG-NE2 3.42Å; E128-H138 IonicContact OE1-CD2 3.86Å; E128-H138 PolarHBondContact OE1-CD2 3.3Å; E128-H138 IonicContact OE1-CG 2.72Å; E128-H138 IonicContact OE1-NE2 3.84Å; E128-H138 IonicContact OE2-NE2 3.08Å; E128-H138 PolarHBondContact OE2-NE2 3Å; E128-K205 IonicContact OE1-NZ 3.17Å; E128-K205 PolarHBondContact OE1-NZ 3.43Å
129	I	91.8	Very high	89.6	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	121.3	172.4	-52.8	-50.4	0	0	0	108.5	L31 W47 L51 W54 K134 V135 F220 I226	L31-I129 HydrophobicContact CD1-CB 4.19Å; L31-I129 HydrophobicContact CD1-CG2 4.13Å; L31-I129 HydrophobicContact CD2-CG2 3.97Å; W47-I129 HydrophobicContact CH2-CD1 4.06Å; W47-I129 HydrophobicContact CZ2-CD1 3.71Å; W47-I129 HydrophobicContact CZ2-CG1 4.41Å; L51-I129 HydrophobicContact CD1-CB 4.25Å; L51-I129 HydrophobicContact CD1-CG1 4.08Å; L51-I129 HydrophobicContact CD1-CG2 4.04Å; W54-I129 HydrophobicContact CH2-CB 4.45Å; W54-I129 HydrophobicContact CZ3-CB 4.43Å; I129-K134 CarbonylContact C-O 3.44Å; I129-K134 WeakPolarHBondContact CA-O 3.42Å; I129-V135 HydrophobicContact CD1-CG2 3.93Å; I129-F220 HydrophobicContact CD1-CE1 4.38Å; I129-F220 HydrophobicContact CD1-CZ 4.07Å; I129-F220 HydrophobicContact CG1-CE1 4.27Å; I129-F220 HydrophobicContact CG1-CZ 3.93Å; I129-I226 HydrophobicContact CD1-CD1 4.32Å
130	G	91.6	Very high	90.5	Very high	6 Å²	6	22.2 Å²	22.2	6%	0.062	11%	0.111	C	C	.	.			trans	-75.5	170.1	175.4	0	0	0	0	0	112.4	L31 E128 D132 G133 K134	L31-G130 WeakPolarHBondContact CD2-O 3.47Å; E128-G130 PolarHBondContact O-N 2.96Å; G130-D132 PolarHBondContact O-N 3.22Å; G130-D132 VanDerWaalsContact O-N 3.08Å; G130-G133 PolarHBondContact O-N 3.27Å; G130-K134 PolarHBondContact N-O 3.42Å
131	E	89.4	Confident	91.5	Very high	89 Å²	89	20.9 Å²	20.9	42%	0.416	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.6	-178.4	-64.8	-175.6	176	0	0	113.9	L27 T30 K34 G133	L27-E131 HydrophobicContact CD1-CB 4.41Å; L27-E131 HydrophobicContact CD1-CG 3.56Å; T30-E131 HydrophobicContact CG2-CB 4.18Å; T30-E131 HydrophobicContact CG2-CG 4.24Å; K34-E131 VanDerWaalsContact CD-O 3.3Å; K34-E131 WeakPolarHBondContact CD-O 3.32Å; K34-E131 PolarHBondContact NZ-O 3.27Å; E131-G133 VanDerWaalsContact C-N 3.29Å
132	D	87.2	Confident	92.1	Very high	62 Å²	62	22.5 Å²	22.5	33%	0.332	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-2.5	174.5	59.7	-2.8	0	0	0	113.2	G130 K134 H136	G130-D132 PolarHBondContact O-N 3.22Å; G130-D132 VanDerWaalsContact O-N 3.08Å; D132-K134 VanDerWaalsContact C-N 3.26Å; D132-K134 PolarHBondContact O-N 3.33Å; D132-K134 WeakPolarHBondContact OD1-CB 3.43Å; D132-K134 PolarHBondContact OD1-N 2.86Å; D132-H136 VanDerWaalsContact CG-NE2 3.34Å; D132-H136 IonicContact OD1-CD2 3.88Å; D132-H136 IonicContact OD1-NE2 3.76Å; D132-H136 PolarHBondContact OD1-NE2 3.05Å; D132-H136 VanDerWaalsContact OD1-NE2 3.08Å; D132-H136 IonicContact OD2-CD2 3.3Å; D132-H136 IonicContact OD2-CE1 3.98Å; D132-H136 IonicContact OD2-NE2 3.75Å; D132-H136 PolarHBondContact OD2-NE2 2.66Å
133	G	85.4	Confident	92.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	81.4	-0.3	-175.8	0	0	0	0	0	114.3	Y43 G130 E131	Y43-G133 WeakPolarHBondContact CE2-O 3.47Å; G130-G133 PolarHBondContact O-N 3.27Å; E131-G133 VanDerWaalsContact C-N 3.29Å
134	K	88	Confident	92.7	Very high	70 Å²	70	28.6 Å²	28.6	30%	0.304	14%	0.14	S	C	.	.	S	Bend	trans	-87.9	158.2	179.2	-68.4	174.2	-175.4	-180	0	110.8	E41 Y43 I129 G130 D132 H136 Y215	E41-K134 IonicContact OE1-NZ 3.63Å; E41-K134 PolarHBondContact OE1-NZ 2.88Å; E41-K134 WeakPolarHBondContact OE2-CE 2.9Å; E41-K134 IonicContact OE2-NZ 3.22Å; E41-K134 PolarHBondContact OE2-NZ 3.49Å; Y43-K134 VanDerWaalsContact OH-CE 3.26Å; Y43-K134 WeakPolarHBondContact OH-CE 3.39Å; Y43-K134 WeakPolarHBondContact OH-CG 3.38Å; I129-K134 CarbonylContact C-O 3.44Å; I129-K134 WeakPolarHBondContact CA-O 3.42Å; G130-K134 PolarHBondContact N-O 3.42Å; D132-K134 VanDerWaalsContact C-N 3.26Å; D132-K134 PolarHBondContact O-N 3.33Å; D132-K134 WeakPolarHBondContact OD1-CB 3.43Å; D132-K134 PolarHBondContact OD1-N 2.86Å; K134-H136 PolarHBondContact O-CD2 3.3Å; K134-H136 PolarHBondContact O-N 2.87Å; K134-Y215 VanDerWaalsContact CA-OH 3.29Å; K134-Y215 WeakPolarHBondContact CA-OH 3.26Å; K134-Y215 WeakPolarHBondContact CB-OH 3.46Å
135	V	93	Very high	92.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.8	167.5	-175.6	0	0	0	0	109.2	Y127 I129 V210 P213 Y215 L218 I226 L318	Y127-V135 HydrophobicContact CD1-CG1 4.05Å; Y127-V135 HydrophobicContact CG-CG1 4.43Å; I129-V135 HydrophobicContact CD1-CG2 3.93Å; V135-V210 HydrophobicContact CB-CB 4.47Å; V135-V210 HydrophobicContact CB-CG2 4.34Å; V135-V210 HydrophobicContact CG1-CG2 3.93Å; V135-V210 PolarHBondContact O-N 3.13Å; V135-P213 HydrophobicContact CB-CG 4.44Å; V135-P213 HydrophobicContact CG2-CG 4.44Å; V135-Y215 HydrophobicContact CG2-CE1 3.88Å; V135-Y215 PolarHBondContact N-OH 3.07Å; V135-L218 HydrophobicContact CG2-CD1 3.49Å; V135-L218 VanDerWaalsContact CG2-CD1 3.49Å; V135-I226 HydrophobicContact CG2-CD1 4.32Å; V135-L318 HydrophobicContact CG1-CD1 4Å
136	H	95.1	Very high	93.1	Very high	38 Å²	38	29.6 Å²	29.6	18%	0.176	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	140.6	173.3	-80.1	-127.8	0	0	0	109.6	Y127 E128 D132 K134 A208	Y127-H136 WeakPolarHBondContact CA-O 3.49Å; E128-H136 PolarHBondContact N-O 3.3Å; E128-H136 VanDerWaalsContact N-O 3.11Å; E128-H136 PolarHBondContact O-N 3.33Å; D132-H136 VanDerWaalsContact CG-NE2 3.34Å; D132-H136 IonicContact OD1-CD2 3.88Å; D132-H136 IonicContact OD1-NE2 3.76Å; D132-H136 PolarHBondContact OD1-NE2 3.05Å; D132-H136 VanDerWaalsContact OD1-NE2 3.08Å; D132-H136 IonicContact OD2-CD2 3.3Å; D132-H136 IonicContact OD2-CE1 3.98Å; D132-H136 IonicContact OD2-NE2 3.75Å; D132-H136 PolarHBondContact OD2-NE2 2.66Å; K134-H136 PolarHBondContact O-CD2 3.3Å; K134-H136 PolarHBondContact O-N 2.87Å; H136-A208 CarbonylContact C-O 3.3Å; H136-A208 WeakPolarHBondContact CA-O 3.38Å
137	F	96	Very high	93.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	138.5	162.8	172.7	-100.7	0	0	0	109.6	Y122 L123 A126 Y127 V139 L185 P186 I189 G207 A208	Y122-F137 HydrophobicContact CE2-CE2 4.3Å; Y122-F137 HydrophobicContact CE2-CZ 4.34Å; L123-F137 HydrophobicContact CD2-CE2 4.31Å; A126-F137 HydrophobicContact CB-CD2 3.86Å; A126-F137 HydrophobicContact CB-CE2 3.68Å; A126-F137 CarbonylContact O-C 3.56Å; A126-F137 VanDerWaalsContact O-CA 3.26Å; A126-F137 WeakPolarHBondContact O-CA 3.46Å; Y127-F137 HydrophobicContact CD1-CB 4.14Å; Y127-F137 HydrophobicContact CD1-CD2 4.45Å; Y127-F137 HydrophobicContact CE1-CB 3.82Å; Y127-F137 AromaticContact CE1-CD2 3.88Å; Y127-F137 HydrophobicContact CE1-CD2 3.88Å; Y127-F137 HydrophobicContact CE1-CG 4.35Å; F137-V139 HydrophobicContact CE1-CG1 4.18Å; F137-V139 HydrophobicContact CE1-CG2 4.28Å; F137-V139 HydrophobicContact CE2-CG1 4.04Å; F137-V139 HydrophobicContact CZ-CG1 3.53Å; F137-V139 HydrophobicContact CZ-CG2 4.36Å; F137-L185 HydrophobicContact CE1-CD2 4.05Å; F137-L185 HydrophobicContact CZ-CD2 4.45Å; F137-P186 HydrophobicContact CD2-CG 4.03Å; F137-P186 HydrophobicContact CE2-CG 3.74Å; F137-P186 HydrophobicContact CZ-CG 4.42Å; F137-I189 HydrophobicContact CB-CB 4.41Å; F137-I189 HydrophobicContact CB-CG2 3.45Å; F137-I189 VanDerWaalsContact CB-CG2 3.45Å; F137-I189 HydrophobicContact CD1-CD1 4.23Å; F137-I189 HydrophobicContact CD1-CG2 4.12Å; F137-I189 HydrophobicContact CD2-CG2 4.22Å; F137-I189 HydrophobicContact CG-CG2 3.69Å; F137-G207 CarbonylContact O-C 3.58Å; F137-G207 WeakPolarHBondContact O-CA 3.31Å; F137-A208 PolarHBondContact N-O 3.34Å; F137-A208 PolarHBondContact O-N 2.88Å
138	H	95.6	Very high	93.1	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.056	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	146.4	169.1	65.4	79.4	0	0	0	112.5	D125 A126 E128 K205 L206	D125-H138 PolarHBondContact O-CE1 3.43Å; A126-H138 VanDerWaalsContact CA-O 3.28Å; A126-H138 WeakPolarHBondContact CA-O 3.21Å; A126-H138 PolarHBondContact O-N 3.45Å; E128-H138 WeakPolarHBondContact CB-NE2 3.25Å; E128-H138 WeakPolarHBondContact CG-CD2 3.42Å; E128-H138 VanDerWaalsContact CG-NE2 3.32Å; E128-H138 WeakPolarHBondContact CG-NE2 3.42Å; E128-H138 IonicContact OE1-CD2 3.86Å; E128-H138 PolarHBondContact OE1-CD2 3.3Å; E128-H138 IonicContact OE1-CG 2.72Å; E128-H138 IonicContact OE1-NE2 3.84Å; E128-H138 IonicContact OE2-NE2 3.08Å; E128-H138 PolarHBondContact OE2-NE2 3Å; H138-K205 HydrophobicContact CB-CG 4.48Å; H138-L206 CarbonylContact C-O 3.6Å; H138-L206 WeakPolarHBondContact CA-O 3.47Å
139	V	95.6	Very high	93.2	Very high	6 Å²	6	44 Å²	44	4%	0.036	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.1	167.2	-69.3	0	0	0	0	109.2	F74 Y122 F137 F141 I183 L206	F74-V139 HydrophobicContact CD2-CB 4.36Å; F74-V139 HydrophobicContact CE2-CB 4.05Å; F74-V139 HydrophobicContact CE2-CG1 4.06Å; Y122-V139 HydrophobicContact CD2-CG1 3.7Å; Y122-V139 HydrophobicContact CE2-CG1 4.35Å; F137-V139 HydrophobicContact CE1-CG1 4.18Å; F137-V139 HydrophobicContact CE1-CG2 4.28Å; F137-V139 HydrophobicContact CE2-CG1 4.04Å; F137-V139 HydrophobicContact CZ-CG1 3.53Å; F137-V139 HydrophobicContact CZ-CG2 4.36Å; V139-F141 HydrophobicContact CG2-CE2 3.78Å; V139-F141 HydrophobicContact CG2-CZ 4.32Å; V139-I183 HydrophobicContact CB-CD1 4.18Å; V139-I183 HydrophobicContact CG1-CD1 3.93Å; V139-I183 HydrophobicContact CG2-CD1 3.63Å; V139-L206 HydrophobicContact CG2-CB 3.94Å; V139-L206 HydrophobicContact CG2-CD2 3.93Å; V139-L206 HydrophobicContact CG2-CG 4.45Å; V139-L206 PolarHBondContact N-O 2.97Å; V139-L206 PolarHBondContact O-N 3.01Å
140	C	96.5	Very high	93.4	Very high	15 Å²	15	46.6 Å²	46.6	10%	0.101	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.4	-178.4	-69.2	0	0	0	0	110.3	M73 F74 V203 L204	M73-C140 CarbonylContact C-O 3.59Å; M73-C140 VanDerWaalsContact CA-O 3.31Å; M73-C140 WeakPolarHBondContact CA-O 3.29Å; M73-C140 HydrophobicContact CE-CB 4.13Å; M73-C140 HydrophobicContact CG-CB 3.76Å; M73-C140 HydrophobicContact SD-CB 4.41Å; F74-C140 PolarHBondContact N-O 3.29Å; C140-V203 HydrophobicContact CB-CG1 3.89Å; C140-L204 CarbonylContact C-O 3.6Å; C140-L204 VanDerWaalsContact CA-O 3.29Å; C140-L204 WeakPolarHBondContact CA-O 3.44Å
141	F	96.9	Very high	93.7	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.7	172.1	-55.5	-106.7	0	0	0	108.7	F74 L76 V139 L143 V162 R181 I183 V203 L204 L206	F74-F141 HydrophobicContact CB-CB 4.45Å; F74-F141 HydrophobicContact CB-CD1 3.33Å; F74-F141 HydrophobicContact CB-CE1 3.62Å; F74-F141 HydrophobicContact CB-CG 3.98Å; F74-F141 HydrophobicContact CB-CZ 4.49Å; F74-F141 HydrophobicContact CD2-CD1 4.31Å; F74-F141 AromaticContact CD2-CE1 3.94Å; F74-F141 HydrophobicContact CD2-CE1 3.94Å; F74-F141 HydrophobicContact CD2-CE2 4.48Å; F74-F141 HydrophobicContact CD2-CZ 4.02Å; F74-F141 HydrophobicContact CG-CD1 4.12Å; F74-F141 AromaticContact CG-CE1 3.91Å; F74-F141 HydrophobicContact CG-CE1 3.91Å; F74-F141 HydrophobicContact CG-CZ 4.46Å; F74-F141 CarbonylContact O-C 3.55Å; F74-F141 VanDerWaalsContact O-CA 3.24Å; F74-F141 WeakPolarHBondContact O-CA 3.49Å; L76-F141 HydrophobicContact CD2-CD1 4.16Å; V139-F141 HydrophobicContact CG2-CE2 3.78Å; V139-F141 HydrophobicContact CG2-CZ 4.32Å; F141-L143 HydrophobicContact CB-CD2 3.86Å; F141-L143 HydrophobicContact CB-CG 4.03Å; F141-L143 PolarHBondContact O-N 3.3Å; F141-V162 HydrophobicContact CD1-CB 4.18Å; F141-V162 HydrophobicContact CD1-CG1 4.47Å; F141-V162 HydrophobicContact CD1-CG2 4.04Å; F141-V162 HydrophobicContact CD2-CG2 4.06Å; F141-V162 HydrophobicContact CE1-CB 4.07Å; F141-V162 HydrophobicContact CE1-CG2 3.68Å; F141-V162 HydrophobicContact CE2-CG2 3.69Å; F141-V162 HydrophobicContact CG-CG2 4.25Å; F141-V162 HydrophobicContact CZ-CB 4.4Å; F141-V162 HydrophobicContact CZ-CG2 3.51Å; F141-R181 HydrophobicContact CD1-CB 4.21Å; F141-R181 HydrophobicContact CD1-CG 4.32Å; F141-R181 HydrophobicContact CE1-CB 3.9Å; F141-R181 HydrophobicContact CE1-CG 3.81Å; F141-I183 HydrophobicContact CZ-CD1 4.34Å; F141-V203 WeakPolarHBondContact O-CA 3.44Å; F141-L204 HydrophobicContact CB-CB 4.16Å; F141-L204 HydrophobicContact CD2-CD2 4.16Å; F141-L204 PolarHBondContact N-O 3.43Å; F141-L204 PolarHBondContact O-N 2.92Å; F141-L206 HydrophobicContact CE2-CB 4.46Å
142	N	95.8	Very high	94	Very high	65 Å²	65	48.1 Å²	48.1	35%	0.348	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	104.1	169.7	-177.4	2.6	0	0	0	109	M73 F74 E144	M73-N142 HydrophobicContact CB-CB 4.25Å; M73-N142 HydrophobicContact SD-CB 4.38Å; F74-N142 PolarHBondContact O-N 3.46Å; N142-E144 WeakPolarHBondContact OD1-CB 3.4Å; N142-E144 PolarHBondContact OD1-N 3.26Å; N142-E144 VanDerWaalsContact OD1-N 3.11Å
143	L	96.8	Very high	94.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.232	C	C	.	.			trans	-112.6	29.1	179.5	-52.2	-168.9	0	0	0	111.5	L76 F141 G145 F146 I151 V162 G202 L204	L76-L143 HydrophobicContact CD1-CD2 3.5Å; L76-L143 VanDerWaalsContact CD1-CD2 3.5Å; L76-L143 HydrophobicContact CD2-CD2 3.9Å; L76-L143 HydrophobicContact CG-CD2 3.4Å; L76-L143 VanDerWaalsContact CG-CD2 3.4Å; F141-L143 HydrophobicContact CB-CD2 3.86Å; F141-L143 HydrophobicContact CB-CG 4.03Å; F141-L143 PolarHBondContact O-N 3.3Å; L143-G145 PolarHBondContact O-N 3.37Å; L143-F146 HydrophobicContact CB-CD2 4.06Å; L143-F146 WeakPolarHBondContact O-CD2 3.45Å; L143-F146 PolarHBondContact O-N 2.98Å; L143-F146 VanDerWaalsContact O-N 3.11Å; L143-I151 HydrophobicContact CB-CD1 4.3Å; L143-I151 HydrophobicContact CD1-CD1 3.61Å; L143-I151 HydrophobicContact CD1-CG1 4.02Å; L143-I151 HydrophobicContact CD1-CG2 3.96Å; L143-V162 HydrophobicContact CD1-CG1 4.22Å; L143-G202 CarbonylContact C-O 3.59Å; L143-G202 VanDerWaalsContact C-O 3.3Å; L143-G202 VanDerWaalsContact CA-O 3.27Å; L143-G202 WeakPolarHBondContact CA-O 3.38Å; L143-G202 WeakPolarHBondContact CB-O 3.46Å; L143-G202 PolarHBondContact N-O 2.86Å; L143-L204 HydrophobicContact CD1-CB 3.63Å; L143-L204 HydrophobicContact CD1-CD1 4.28Å; L143-L204 HydrophobicContact CD1-CD2 3.81Å; L143-L204 HydrophobicContact CD1-CG 4.11Å; L143-L204 HydrophobicContact CG-CB 4Å
144	E	94.2	Very high	95	Very high	147 Å²	147	46 Å²	46	69%	0.687	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	129	174.4	-172.2	178.9	-175.1	0	0	111.1	N142 G202	N142-E144 WeakPolarHBondContact OD1-CB 3.4Å; N142-E144 PolarHBondContact OD1-N 3.26Å; N142-E144 VanDerWaalsContact OD1-N 3.11Å; E144-G202 PolarHBondContact N-O 3.02Å
145	G	92	Very high	95.3	Very high	55 Å²	55	43 Å²	43	57%	0.567	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	12.8	179.7	0	0	0	0	0	115.7	L143 K166	L143-G145 PolarHBondContact O-N 3.37Å; G145-K166 PolarHBondContact O-NZ 3.46Å
146	F	94.9	Very high	95.2	Very high	38 Å²	38	44.5 Å²	44.5	17%	0.167	23%	0.233	C	C	.	.			trans	-104.4	141	163.2	-64.7	-79.8	0	0	0	110.7	L76 L143 I151 A164 K166 F179	L76-F146 HydrophobicContact CD1-CE2 4.47Å; L143-F146 HydrophobicContact CB-CD2 4.06Å; L143-F146 WeakPolarHBondContact O-CD2 3.45Å; L143-F146 PolarHBondContact O-N 2.98Å; L143-F146 VanDerWaalsContact O-N 3.11Å; F146-I151 HydrophobicContact CB-CD1 4.09Å; F146-I151 HydrophobicContact CB-CG1 4.14Å; F146-A164 HydrophobicContact CB-CB 4.46Å; F146-A164 HydrophobicContact CD1-CB 3.44Å; F146-A164 VanDerWaalsContact CD1-CB 3.44Å; F146-A164 HydrophobicContact CD2-CB 4.43Å; F146-A164 HydrophobicContact CE1-CB 3.64Å; F146-A164 HydrophobicContact CG-CB 3.87Å; F146-A164 HydrophobicContact CZ-CB 4.22Å; F146-K166 HydrophobicContact CD1-CB 4.48Å; F146-K166 HydrophobicContact CE1-CB 4.08Å; F146-K166 HydrophobicContact CE1-CD 4.37Å; F146-F179 AromaticContact CE1-CD2 3.66Å; F146-F179 HydrophobicContact CE1-CD2 3.66Å; F146-F179 HydrophobicContact CE1-CE2 4.02Å; F146-F179 HydrophobicContact CE1-CG 4.24Å; F146-F179 HydrophobicContact CZ-CB 4.27Å; F146-F179 HydrophobicContact CZ-CD1 4.36Å; F146-F179 AromaticContact CZ-CD2 3.73Å; F146-F179 HydrophobicContact CZ-CD2 3.73Å; F146-F179 HydrophobicContact CZ-CE2 4.12Å; F146-F179 AromaticContact CZ-CG 3.88Å; F146-F179 HydrophobicContact CZ-CG 3.88Å
147	E	93.1	Very high	94.7	Very high	101 Å²	101	46.4 Å²	46.4	47%	0.472	25%	0.245	S	C	.	.			trans	-82.8	147.1	173.2	-65.5	-166.3	178.2	0	0	110.9	K149 D150	E147-K149 HydrophobicContact CB-CG 4.26Å; E147-K149 PolarHBondContact O-N 2.88Å; E147-K149 VanDerWaalsContact O-N 3.14Å; E147-K149 WeakPolarHBondContact OE2-CE 3.27Å; E147-K149 IonicContact OE2-NZ 2.65Å; E147-K149 PolarHBondContact OE2-NZ 2.96Å; E147-D150 PolarHBondContact O-N 3.41Å
148	P	94	Very high	94.4	Very high	60 Å²	60	47.9 Å²	47.9	39%	0.39	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-53.5	-38	-179.5	-24	29.3	0	0	0	114.4	C15 D150 I151 L198	C15-P148 WeakPolarHBondContact SG-CB 3.42Å; C15-P148 VanDerWaalsContact SG-CG 3.51Å; P148-D150 PolarHBondContact O-N 3.5Å; P148-I151 PolarHBondContact O-N 3.22Å; P148-L198 HydrophobicContact CB-CD2 4.01Å; P148-L198 HydrophobicContact CG-CD2 3.83Å
149	K	94.2	Very high	94.2	Very high	159 Å²	159	48.2 Å²	48.2	69%	0.691	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-66.9	-21.5	-179.9	74.8	-169.1	-168.4	-150.1	0	113.5	E147	E147-K149 HydrophobicContact CB-CG 4.26Å; E147-K149 PolarHBondContact O-N 2.88Å; E147-K149 VanDerWaalsContact O-N 3.14Å; E147-K149 WeakPolarHBondContact OE2-CE 3.27Å; E147-K149 IonicContact OE2-NZ 2.65Å; E147-K149 PolarHBondContact OE2-NZ 2.96Å
150	D	95.6	Very high	94.1	Very high	56 Å²	56	47.9 Å²	47.9	30%	0.299	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-94.3	-3.2	-178.1	-61.1	-37.5	0	0	0	112	E147 P148 A164 K165	E147-D150 PolarHBondContact O-N 3.41Å; P148-D150 PolarHBondContact O-N 3.5Å; D150-A164 VanDerWaalsContact O-CA 3.24Å; D150-A164 WeakPolarHBondContact O-CA 3.45Å; D150-K165 VanDerWaalsContact CB-O 3.3Å; D150-K165 WeakPolarHBondContact CB-O 3.34Å; D150-K165 PolarHBondContact O-N 3.41Å
151	I	97.6	Very high	94	Very high	14 Å²	14	50.2 Å²	50.2	7%	0.072	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.7	180	-62.9	162.1	0	0	0	109.5	V13 L143 F146 P148 V153 Q163 A164 L198	V13-I151 HydrophobicContact CG2-CG2 4.1Å; L143-I151 HydrophobicContact CB-CD1 4.3Å; L143-I151 HydrophobicContact CD1-CD1 3.61Å; L143-I151 HydrophobicContact CD1-CG1 4.02Å; L143-I151 HydrophobicContact CD1-CG2 3.96Å; F146-I151 HydrophobicContact CB-CD1 4.09Å; F146-I151 HydrophobicContact CB-CG1 4.14Å; P148-I151 PolarHBondContact O-N 3.22Å; I151-V153 HydrophobicContact CG2-CG2 4.35Å; I151-Q163 CarbonylContact C-O 3.58Å; I151-Q163 WeakPolarHBondContact CA-O 3.47Å; I151-A164 HydrophobicContact CG1-CB 4.18Å; I151-L198 HydrophobicContact CD1-CD2 3.69Å
152	K	96.9	Very high	94	Very high	113 Å²	113	50.2 Å²	50.2	49%	0.491	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.8	175.1	-173.6	-179.1	-177.1	-175.5	0	109.9	T154 Q163	K152-T154 HydrophobicContact CD-CG2 4.35Å; K152-T154 HydrophobicContact CG-CG2 4.24Å; K152-Q163 HydrophobicContact CB-CB 4.48Å; K152-Q163 PolarHBondContact N-O 3.38Å; K152-Q163 PolarHBondContact O-N 3.43Å
153	V	97.4	Very high	93.9	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.4	175	-174.8	0	0	0	0	108.7	I11 V13 I151 V160 K161 V162 L204 L206	I11-V153 HydrophobicContact CB-CB 4.22Å; I11-V153 HydrophobicContact CB-CG1 4.02Å; I11-V153 HydrophobicContact CD1-CG1 4.13Å; I11-V153 HydrophobicContact CG1-CG1 4.49Å; I11-V153 PolarHBondContact N-O 3.46Å; V13-V153 HydrophobicContact CG2-CG2 3.86Å; I151-V153 HydrophobicContact CG2-CG2 4.35Å; V153-V160 HydrophobicContact CG1-CG2 3.76Å; V153-K161 WeakPolarHBondContact CA-O 3.28Å; V153-V162 HydrophobicContact CG1-CG2 4.43Å; V153-V162 HydrophobicContact CG2-CG1 4.45Å; V153-V162 HydrophobicContact CG2-CG2 4.34Å; V153-L204 HydrophobicContact CG2-CD2 3.87Å; V153-L206 HydrophobicContact CG1-CD1 4.23Å
154	T	95.4	Very high	93.9	Very high	15 Å²	15	49.1 Å²	49.1	9%	0.092	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.4	177.8	48.7	0	0	0	0	110.2	V8 V9 K152 K161	V8-T154 HydrophobicContact CG1-CG2 4.11Å; V9-T154 CarbonylContact O-C 3.57Å; V9-T154 VanDerWaalsContact O-CA 3.28Å; V9-T154 WeakPolarHBondContact O-CA 3.37Å; K152-T154 HydrophobicContact CD-CG2 4.35Å; K152-T154 HydrophobicContact CG-CG2 4.24Å; T154-K161 PolarHBondContact N-O 3.5Å; T154-K161 PolarHBondContact O-N 3.27Å; T154-K161 PolarHBondContact OG1-O 3.46Å
155	S	93.8	Very high	93.9	Very high	8 Å²	8	45.6 Å²	45.6	6%	0.056	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.7	176.7	-161.4	0	0	0	0	110.5	V8 V9 Y159 L185	V8-S155 CarbonylContact C-O 3.54Å; V8-S155 WeakPolarHBondContact CA-O 3.48Å; V9-S155 PolarHBondContact N-O 2.76Å; V9-S155 PolarHBondContact O-N 3.39Å; S155-Y159 CarbonylContact C-O 3.56Å; S155-Y159 WeakPolarHBondContact CA-O 3.27Å; S155-Y159 PolarHBondContact OG-O 3.09Å; S155-L185 WeakPolarHBondContact OG-CD1 3.27Å
156	T	90.8	Very high	93.9	Very high	30 Å²	30	47 Å²	47	18%	0.184	23%	0.226	C	C	.	.			trans	-103.6	-168.5	155.6	59.2	0	0	0	0	108.4	H6 V8 Y159	H6-T156 HydrophobicContact CB-CG2 4.24Å; V8-T156 HydrophobicContact CG2-CG2 3.89Å; T156-Y159 PolarHBondContact N-O 2.7Å; T156-Y159 PolarHBondContact OG1-N 3.42Å; T156-Y159 PolarHBondContact OG1-O 2.66Å
157	D	85.9	Confident	93.6	Very high	78 Å²	78	50.4 Å²	50.4	42%	0.417	24%	0.243	S	C	.	.	S	Bend	trans	-58.6	-57	168.6	-61.1	-42.1	0	0	0	110.2	H6 R191	H6-D157 IonicContact CE1-OD2 3.79Å; H6-D157 IonicContact CG-OD2 3.92Å; H6-D157 IonicContact ND1-OD2 2.9Å; H6-D157 PolarHBondContact ND1-OD2 3.29Å; D157-R191 WeakPolarHBondContact O-CD 3.24Å; D157-R191 PolarHBondContact O-NH1 2.71Å
158	D	88.6	Confident	93.2	Very high	32 Å²	32	48.7 Å²	48.7	17%	0.171	24%	0.239	C	C	.	.	S	Bend	trans	-88.8	-18.2	-168.1	-70.6	-16.9	0	0	0	114.3	E184 L185 R191 K337	D158-E184 WeakPolarHBondContact O-CA 3.3Å; D158-L185 PolarHBondContact O-N 3.07Å; D158-R191 IonicContact OD1-NH1 3.59Å; D158-K337 IonicContact OD2-NZ 3.27Å
159	Y	91.8	Very high	92.9	Very high	18 Å²	18	53.7 Å²	53.7	7%	0.071	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.3	-169.3	-50.8	-74.4	0	0	0	113.1	P90 I91 M94 S155 T156 V182 I183 E184	P90-Y159 HydrophobicContact CB-CD1 4.28Å; P90-Y159 HydrophobicContact CB-CD2 3.51Å; P90-Y159 HydrophobicContact CB-CE2 3.83Å; P90-Y159 HydrophobicContact CB-CG 3.77Å; P90-Y159 HydrophobicContact CG-CD2 3.7Å; P90-Y159 HydrophobicContact CG-CE2 4.08Å; P90-Y159 HydrophobicContact CG-CG 4.35Å; I91-Y159 VanDerWaalsContact CG1-OH 3.31Å; I91-Y159 WeakPolarHBondContact CG1-OH 3.43Å; M94-Y159 HydrophobicContact CE-CD1 3.57Å; M94-Y159 HydrophobicContact CE-CE1 3.22Å; M94-Y159 HydrophobicContact SD-CD1 3.88Å; M94-Y159 HydrophobicContact SD-CE1 4.08Å; S155-Y159 CarbonylContact C-O 3.56Å; S155-Y159 WeakPolarHBondContact CA-O 3.27Å; S155-Y159 PolarHBondContact OG-O 3.09Å; T156-Y159 PolarHBondContact N-O 2.7Å; T156-Y159 PolarHBondContact OG1-N 3.42Å; T156-Y159 PolarHBondContact OG1-O 2.66Å; Y159-V182 HydrophobicContact CD1-CG1 4.46Å; Y159-V182 HydrophobicContact CG-CG1 4.43Å; Y159-I183 VanDerWaalsContact CA-O 3.31Å; Y159-I183 WeakPolarHBondContact CA-O 3.41Å; Y159-E184 HydrophobicContact CD1-CB 4.04Å; Y159-E184 HydrophobicContact CD1-CG 4.25Å; Y159-E184 HydrophobicContact CE1-CB 3.92Å; Y159-E184 HydrophobicContact CE1-CG 3.85Å
160	V	94.4	Very high	92.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.7	162.9	65.2	0	0	0	0	109.8	V153 V182 I183 L185 L206	V153-V160 HydrophobicContact CG1-CG2 3.76Å; V160-V182 WeakPolarHBondContact O-CA 2.83Å; V160-I183 HydrophobicContact CG1-CD1 3.78Å; V160-I183 HydrophobicContact CG1-CG1 3.29Å; V160-I183 PolarHBondContact N-O 3.11Å; V160-I183 PolarHBondContact O-N 3.31Å; V160-L185 HydrophobicContact CB-CD1 4.31Å; V160-L185 HydrophobicContact CB-CD2 4.16Å; V160-L185 HydrophobicContact CB-CG 4.34Å; V160-L185 HydrophobicContact CG1-CD2 3.81Å; V160-L185 HydrophobicContact CG1-CG 4.32Å; V160-L206 HydrophobicContact CB-CD2 3.99Å; V160-L206 HydrophobicContact CG1-CD2 3.52Å; V160-L206 HydrophobicContact CG2-CD1 4.42Å; V160-L206 HydrophobicContact CG2-CD2 3.71Å
161	K	93.9	Very high	92.1	Very high	64 Å²	64	57.1 Å²	57.1	28%	0.278	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.4	178.2	179.5	-177.8	-166	-164.6	0	109.1	V153 T154 Q163 C180 R181 V182	V153-K161 WeakPolarHBondContact CA-O 3.28Å; T154-K161 PolarHBondContact N-O 3.5Å; T154-K161 PolarHBondContact O-N 3.27Å; T154-K161 PolarHBondContact OG1-O 3.46Å; K161-Q163 HydrophobicContact CD-CG 4.01Å; K161-Q163 HydrophobicContact CG-CG 3.83Å; K161-Q163 VanDerWaalsContact NZ-CD 3.35Å; K161-C180 WeakPolarHBondContact CE-SG 3.5Å; K161-R181 WeakPolarHBondContact CA-O 3.35Å; K161-V182 HydrophobicContact CB-CG2 4.02Å; K161-V182 HydrophobicContact CD-CG2 4.39Å; K161-V182 HydrophobicContact CG-CG2 3.83Å
162	V	96.3	Very high	91.8	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122	172	-177	0	0	0	0	108	L76 F141 L143 V153 C180 R181 L204	L76-V162 HydrophobicContact CD1-CG1 4.4Å; L76-V162 HydrophobicContact CD2-CB 4.03Å; L76-V162 HydrophobicContact CD2-CG1 3.84Å; F141-V162 HydrophobicContact CD1-CB 4.18Å; F141-V162 HydrophobicContact CD1-CG1 4.47Å; F141-V162 HydrophobicContact CD1-CG2 4.04Å; F141-V162 HydrophobicContact CD2-CG2 4.06Å; F141-V162 HydrophobicContact CE1-CB 4.07Å; F141-V162 HydrophobicContact CE1-CG2 3.68Å; F141-V162 HydrophobicContact CE2-CG2 3.69Å; F141-V162 HydrophobicContact CG-CG2 4.25Å; F141-V162 HydrophobicContact CZ-CB 4.4Å; F141-V162 HydrophobicContact CZ-CG2 3.51Å; L143-V162 HydrophobicContact CD1-CG1 4.22Å; V153-V162 HydrophobicContact CG1-CG2 4.43Å; V153-V162 HydrophobicContact CG2-CG1 4.45Å; V153-V162 HydrophobicContact CG2-CG2 4.34Å; V162-C180 CarbonylContact O-C 3.52Å; V162-C180 VanDerWaalsContact O-CA 3.28Å; V162-C180 WeakPolarHBondContact O-CA 3.12Å; V162-R181 PolarHBondContact N-O 3.35Å; V162-R181 PolarHBondContact O-N 3.5Å; V162-L204 HydrophobicContact CG1-CD2 3.78Å; V162-L204 HydrophobicContact CG2-CD2 4.13Å
163	Q	95.2	Very high	91.4	Very high	37 Å²	37	62.3 Å²	62.3	17%	0.173	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	147.9	177.1	-55.8	-171.1	-104	0	0	110.1	I151 K152 K161 F179 C180	I151-Q163 CarbonylContact C-O 3.58Å; I151-Q163 WeakPolarHBondContact CA-O 3.47Å; K152-Q163 HydrophobicContact CB-CB 4.48Å; K152-Q163 PolarHBondContact N-O 3.38Å; K152-Q163 PolarHBondContact O-N 3.43Å; K161-Q163 HydrophobicContact CD-CG 4.01Å; K161-Q163 HydrophobicContact CG-CG 3.83Å; K161-Q163 VanDerWaalsContact NZ-CD 3.35Å; Q163-F179 CarbonylContact C-O 3.49Å; Q163-F179 VanDerWaalsContact CA-O 3.28Å; Q163-F179 WeakPolarHBondContact CA-O 3.18Å; Q163-C180 HydrophobicContact CG-CB 4.49Å
164	A	95.7	Very high	90.9	Very high	4 Å²	4	66.8 Å²	66.8	3%	0.033	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	145.6	168.4	0	0	0	0	0	111.2	L76 F146 D150 I151 E178 F179	L76-A164 HydrophobicContact CD1-CB 3.49Å; L76-A164 VanDerWaalsContact CD1-CB 3.49Å; F146-A164 HydrophobicContact CB-CB 4.46Å; F146-A164 HydrophobicContact CD1-CB 3.44Å; F146-A164 VanDerWaalsContact CD1-CB 3.44Å; F146-A164 HydrophobicContact CD2-CB 4.43Å; F146-A164 HydrophobicContact CE1-CB 3.64Å; F146-A164 HydrophobicContact CG-CB 3.87Å; F146-A164 HydrophobicContact CZ-CB 4.22Å; D150-A164 VanDerWaalsContact O-CA 3.24Å; D150-A164 WeakPolarHBondContact O-CA 3.45Å; I151-A164 HydrophobicContact CG1-CB 4.18Å; A164-E178 WeakPolarHBondContact O-CA 3.27Å; A164-F179 PolarHBondContact N-O 3.14Å; A164-F179 PolarHBondContact O-N 2.97Å
165	K	94.1	Very high	90.5	Very high	73 Å²	73	69 Å²	69	32%	0.317	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	142.5	173.1	-166.8	-175.5	-177	-161.8	0	109.9	D150 E167 S176 R177 E178	D150-K165 VanDerWaalsContact CB-O 3.3Å; D150-K165 WeakPolarHBondContact CB-O 3.34Å; D150-K165 PolarHBondContact O-N 3.41Å; K165-E167 WeakPolarHBondContact CE-OE1 3.34Å; K165-E167 IonicContact NZ-OE1 2.71Å; K165-E167 PolarHBondContact NZ-OE1 3.48Å; K165-S176 WeakPolarHBondContact CE-OG 3.33Å; K165-R177 CarbonylContact C-O 3.53Å; K165-R177 WeakPolarHBondContact CA-O 3.01Å; K165-E178 HydrophobicContact CG-CG 4.28Å
166	K	91.8	Very high	90.3	Very high	84 Å²	84	71.7 Å²	71.7	37%	0.365	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	118	173.8	-168	164	-173.8	154.5	0	109.9	G145 F146 S176 R177 F179	G145-K166 PolarHBondContact O-NZ 3.46Å; F146-K166 HydrophobicContact CD1-CB 4.48Å; F146-K166 HydrophobicContact CE1-CB 4.08Å; F146-K166 HydrophobicContact CE1-CD 4.37Å; K166-S176 WeakPolarHBondContact O-CA 3.34Å; K166-R177 PolarHBondContact N-O 3.27Å; K166-R177 PolarHBondContact O-N 3.41Å; K166-F179 HydrophobicContact CB-CE2 3.95Å
167	E	89.2	Confident	90.3	Very high	110 Å²	110	75.8 Å²	75.8	51%	0.514	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.7	173.3	-65.6	-173.9	-176.4	0	0	109.7	K165 C175	K165-E167 WeakPolarHBondContact CE-OE1 3.34Å; K165-E167 IonicContact NZ-OE1 2.71Å; K165-E167 PolarHBondContact NZ-OE1 3.48Å; E167-C175 CarbonylContact C-O 3.58Å; E167-C175 WeakPolarHBondContact CA-O 3.17Å
168	T	85	Confident	90.6	Very high	65 Å²	65	76.8 Å²	76.8	40%	0.399	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.5	171.7	54.7	0	0	0	0	108.6	S174 C175	T168-S174 WeakPolarHBondContact O-CA 3.26Å; T168-C175 PolarHBondContact N-O 3.41Å; T168-C175 PolarHBondContact O-N 3.13Å; T168-C175 WeakPolarHBondContact OG1-CB 3.47Å; T168-C175 PolarHBondContact OG1-O 3.38Å
169	K	86.9	Confident	90.8	Very high	166 Å²	166	76.4 Å²	76.4	72%	0.722	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	126.3	173.9	-65	-179.8	-176.9	175.1	0	109.1
170	T	86.6	Confident	90.8	Very high	89 Å²	89	75.5 Å²	75.5	55%	0.546	39%	0.39	S	S	.	.			trans	-112.5	168.8	168	60.1	0	0	0	0	108.1	D172 S173	T170-D172 PolarHBondContact O-N 2.84Å; T170-S173 PolarHBondContact N-O 3.39Å; T170-S173 PolarHBondContact O-N 3.19Å; T170-S173 PolarHBondContact OG1-N 2.93Å; T170-S173 PolarHBondContact OG1-O 3.41Å; T170-S173 PolarHBondContact OG1-OG 3.43Å
171	E	87.9	Confident	90.8	Very high	198 Å²	198	75.6 Å²	75.6	93%	0.925	39%	0.39	S	S	*	.	S	Bend	trans	-54.6	-37.7	-177.7	-64.6	-175.8	172.6	0	0	112.9
172	D	90.8	Very high	90.7	Very high	165 Å²	165	72.7 Å²	72.7	88%	0.882	38%	0.378	S	S	*	.	S	Bend	trans	-104.2	-10.4	-175.2	-61.5	-43.3	0	0	0	114.5	T170	T170-D172 PolarHBondContact O-N 2.84Å
173	S	88.3	Confident	90.5	Very high	71 Å²	71	72.8 Å²	72.8	50%	0.497	38%	0.378	S	S	.	.			trans	-154.7	148.3	-173.6	72.1	0	0	0	0	114.3	T170	T170-S173 PolarHBondContact N-O 3.39Å; T170-S173 PolarHBondContact O-N 3.19Å; T170-S173 PolarHBondContact OG1-N 2.93Å; T170-S173 PolarHBondContact OG1-O 3.41Å; T170-S173 PolarHBondContact OG1-OG 3.43Å
174	S	87.7	Confident	90.3	Very high	96 Å²	96	71.7 Å²	71.7	67%	0.671	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.5	165.7	60.1	0	0	0	0	109.6	T168	T168-S174 WeakPolarHBondContact O-CA 3.26Å
175	C	85.9	Confident	90.1	Very high	61 Å²	61	71.6 Å²	71.6	41%	0.412	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.1	173.6	-177.7	0	0	0	0	108.8	E167 T168	E167-C175 CarbonylContact C-O 3.58Å; E167-C175 WeakPolarHBondContact CA-O 3.17Å; T168-C175 PolarHBondContact N-O 3.41Å; T168-C175 PolarHBondContact O-N 3.13Å; T168-C175 WeakPolarHBondContact OG1-CB 3.47Å; T168-C175 PolarHBondContact OG1-O 3.38Å
176	S	89.3	Confident	90	Very high	64 Å²	64	68.2 Å²	68.2	45%	0.448	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	123.7	173.9	171.2	0	0	0	0	108.5	K165 K166	K165-S176 WeakPolarHBondContact CE-OG 3.33Å; K166-S176 WeakPolarHBondContact O-CA 3.34Å
177	R	90.8	Very high	89.9	Confident	117 Å²	117	71.4 Å²	71.4	44%	0.442	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.1	178.5	-65.9	175.1	65.6	-179.2	1	109.8	K165 K166 F179	K165-R177 CarbonylContact C-O 3.53Å; K165-R177 WeakPolarHBondContact CA-O 3.01Å; K166-R177 PolarHBondContact N-O 3.27Å; K166-R177 PolarHBondContact O-N 3.41Å; R177-F179 HydrophobicContact CB-CE2 3.64Å; R177-F179 HydrophobicContact CB-CZ 4.05Å
178	E	92.2	Very high	89.9	Confident	99 Å²	99	67.3 Å²	67.3	46%	0.463	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	143.7	173.9	-63.8	-174.8	-180	0	0	110	L79 A164 K165	L79-E178 HydrophobicContact CB-CB 4.25Å; L79-E178 HydrophobicContact CD1-CB 3.92Å; L79-E178 HydrophobicContact CG-CB 4.44Å; L79-E178 PolarHBondContact N-O 3.03Å; A164-E178 WeakPolarHBondContact O-CA 3.27Å; K165-E178 HydrophobicContact CG-CG 4.28Å
179	F	92.9	Very high	90.2	Very high	23 Å²	23	64.3 Å²	64.3	10%	0.101	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.3	-179.2	-57.7	-104.1	0	0	0	109	L76 L77 P78 F146 Q163 A164 K166 R177	L76-F179 HydrophobicContact CB-CB 3.52Å; L76-F179 HydrophobicContact CD1-CB 4.12Å; L77-F179 CarbonylContact O-C 3.57Å; L77-F179 VanDerWaalsContact O-CA 3.27Å; L77-F179 WeakPolarHBondContact O-CA 3.06Å; P78-F179 HydrophobicContact CB-CD1 4.19Å; P78-F179 HydrophobicContact CB-CE1 4.12Å; P78-F179 HydrophobicContact CG-CD1 4.06Å; P78-F179 HydrophobicContact CG-CE1 3.85Å; F146-F179 AromaticContact CE1-CD2 3.66Å; F146-F179 HydrophobicContact CE1-CD2 3.66Å; F146-F179 HydrophobicContact CE1-CE2 4.02Å; F146-F179 HydrophobicContact CE1-CG 4.24Å; F146-F179 HydrophobicContact CZ-CB 4.27Å; F146-F179 HydrophobicContact CZ-CD1 4.36Å; F146-F179 AromaticContact CZ-CD2 3.73Å; F146-F179 HydrophobicContact CZ-CD2 3.73Å; F146-F179 HydrophobicContact CZ-CE2 4.12Å; F146-F179 AromaticContact CZ-CG 3.88Å; F146-F179 HydrophobicContact CZ-CG 3.88Å; Q163-F179 CarbonylContact C-O 3.49Å; Q163-F179 VanDerWaalsContact CA-O 3.28Å; Q163-F179 WeakPolarHBondContact CA-O 3.18Å; A164-F179 PolarHBondContact N-O 3.14Å; A164-F179 PolarHBondContact O-N 2.97Å; K166-F179 HydrophobicContact CB-CE2 3.95Å; R177-F179 HydrophobicContact CB-CE2 3.64Å; R177-F179 HydrophobicContact CB-CZ 4.05Å
180	C	92.6	Very high	90.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	151	-176.9	-171	0	0	0	0	111.7	L77 L79 M97 K161 V162 Q163	L77-C180 PolarHBondContact N-O 2.67Å; L77-C180 PolarHBondContact O-N 3.32Å; L79-C180 HydrophobicContact CD1-CB 3.99Å; L79-C180 HydrophobicContact CD2-CB 3.44Å; L79-C180 VanDerWaalsContact CD2-CB 3.44Å; L79-C180 HydrophobicContact CG-CB 3.67Å; M97-C180 HydrophobicContact CE-CB 3.74Å; M97-C180 WeakPolarHBondContact CE-O 3.41Å; K161-C180 WeakPolarHBondContact CE-SG 3.5Å; V162-C180 CarbonylContact O-C 3.52Å; V162-C180 VanDerWaalsContact O-CA 3.28Å; V162-C180 WeakPolarHBondContact O-CA 3.12Å; Q163-C180 HydrophobicContact CG-CB 4.49Å
181	R	93.3	Very high	90.7	Very high	1 Å²	1	57.2 Å²	57.2	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	139.2	161.3	-170.3	65	171.1	-161.2	-5.7	109.6	F74 L76 M101 G117 F141 K161 V162 I183	F74-R181 HydrophobicContact CB-CG 4.19Å; F74-R181 HydrophobicContact CD1-CG 4.14Å; F74-R181 HydrophobicContact CG-CG 4.33Å; L76-R181 HydrophobicContact CD2-CB 3.57Å; M101-R181 VanDerWaalsContact CE-NH1 3.31Å; M101-R181 VanDerWaalsContact SD-CZ 3.53Å; M101-R181 PolarHBondContact SD-NH1 3.04Å; M101-R181 PolarHBondContact SD-NH2 3.37Å; G117-R181 PolarHBondContact O-NH2 3.45Å; F141-R181 HydrophobicContact CD1-CB 4.21Å; F141-R181 HydrophobicContact CD1-CG 4.32Å; F141-R181 HydrophobicContact CE1-CB 3.9Å; F141-R181 HydrophobicContact CE1-CG 3.81Å; K161-R181 WeakPolarHBondContact CA-O 3.35Å; V162-R181 PolarHBondContact N-O 3.35Å; V162-R181 PolarHBondContact O-N 3.5Å; R181-I183 HydrophobicContact CG-CG2 4.39Å
182	V	92.2	Very high	90.9	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.4	173	-175.4	0	0	0	0	108.2	P90 L93 M94 Y159 V160 K161	P90-V182 HydrophobicContact CB-CG1 4.25Å; L93-V182 HydrophobicContact CD2-CG2 3.67Å; L93-V182 HydrophobicContact CG-CG2 4.29Å; M94-V182 HydrophobicContact CG-CB 3.73Å; M94-V182 HydrophobicContact CG-CG1 3.8Å; M94-V182 HydrophobicContact SD-CB 4.36Å; M94-V182 HydrophobicContact SD-CG1 3.87Å; Y159-V182 HydrophobicContact CD1-CG1 4.46Å; Y159-V182 HydrophobicContact CG-CG1 4.43Å; V160-V182 WeakPolarHBondContact O-CA 2.83Å; K161-V182 HydrophobicContact CB-CG2 4.02Å; K161-V182 HydrophobicContact CD-CG2 4.39Å; K161-V182 HydrophobicContact CG-CG2 3.83Å
183	I	91.9	Very high	91	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	152.2	172.7	70.7	169.5	0	0	0	109.8	F74 Y122 V139 F141 Y159 V160 R181	F74-I183 HydrophobicContact CD1-CG2 4.14Å; F74-I183 HydrophobicContact CD2-CG2 4.26Å; F74-I183 HydrophobicContact CE1-CG2 3.63Å; F74-I183 HydrophobicContact CE2-CD1 4.09Å; F74-I183 HydrophobicContact CE2-CG2 3.78Å; F74-I183 HydrophobicContact CG-CG2 4.42Å; F74-I183 HydrophobicContact CZ-CB 4.37Å; F74-I183 HydrophobicContact CZ-CD1 4.49Å; F74-I183 HydrophobicContact CZ-CG2 3.42Å; F74-I183 VanDerWaalsContact CZ-CG2 3.42Å; Y122-I183 HydrophobicContact CE2-CD1 4.37Å; V139-I183 HydrophobicContact CB-CD1 4.18Å; V139-I183 HydrophobicContact CG1-CD1 3.93Å; V139-I183 HydrophobicContact CG2-CD1 3.63Å; F141-I183 HydrophobicContact CZ-CD1 4.34Å; Y159-I183 VanDerWaalsContact CA-O 3.31Å; Y159-I183 WeakPolarHBondContact CA-O 3.41Å; V160-I183 HydrophobicContact CG1-CD1 3.78Å; V160-I183 HydrophobicContact CG1-CG1 3.29Å; V160-I183 PolarHBondContact N-O 3.11Å; V160-I183 PolarHBondContact O-N 3.31Å; R181-I183 HydrophobicContact CG-CG2 4.39Å
184	E	91.3	Very high	91.4	Very high	13 Å²	13	50.1 Å²	50.1	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.1	170.1	-167.5	174.3	-165.9	0	0	110.7	Y122 D158 Y159 M336 H339	Y122-E184 PolarHBondContact OH-O 2.85Å; D158-E184 WeakPolarHBondContact O-CA 3.3Å; Y159-E184 HydrophobicContact CD1-CB 4.04Å; Y159-E184 HydrophobicContact CD1-CG 4.25Å; Y159-E184 HydrophobicContact CE1-CB 3.92Å; Y159-E184 HydrophobicContact CE1-CG 3.85Å; E184-M336 HydrophobicContact CB-CE 4.1Å; E184-M336 HydrophobicContact CG-CE 3.71Å; E184-M336 WeakPolarHBondContact OE2-CE 2.91Å; E184-H339 IonicContact OE2-CE1 2.66Å; E184-H339 PolarHBondContact OE2-CE1 2.79Å; E184-H339 IonicContact OE2-NE2 3.91Å
185	L	91.6	Very high	91.8	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-91.6	129.7	175.8	-68.4	175.9	0	0	0	109.8	F137 S155 D158 V160 I189 L194	F137-L185 HydrophobicContact CE1-CD2 4.05Å; F137-L185 HydrophobicContact CZ-CD2 4.45Å; S155-L185 WeakPolarHBondContact OG-CD1 3.27Å; D158-L185 PolarHBondContact O-N 3.07Å; V160-L185 HydrophobicContact CB-CD1 4.31Å; V160-L185 HydrophobicContact CB-CD2 4.16Å; V160-L185 HydrophobicContact CB-CG 4.34Å; V160-L185 HydrophobicContact CG1-CD2 3.81Å; V160-L185 HydrophobicContact CG1-CG 4.32Å; L185-I189 HydrophobicContact CB-CD1 3.95Å; L185-I189 HydrophobicContact CD1-CD1 4.28Å; L185-I189 HydrophobicContact CD2-CD1 3.85Å; L185-I189 HydrophobicContact CG-CD1 4.25Å; L185-L194 HydrophobicContact CD1-CD1 3.85Å
186	P	91.8	Very high	92.3	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-60.2	141.8	172.9	-22.5	33.7	0	0	0	111.4	L123 Y127 F137 S188 I189 D316	L123-P186 HydrophobicContact CD2-CG 3.66Å; Y127-P186 WeakPolarHBondContact OH-CB 3.26Å; Y127-P186 WeakPolarHBondContact OH-CG 3.4Å; F137-P186 HydrophobicContact CD2-CG 4.03Å; F137-P186 HydrophobicContact CE2-CG 3.74Å; F137-P186 HydrophobicContact CZ-CG 4.42Å; P186-S188 PolarHBondContact O-N 3.3Å; P186-I189 HydrophobicContact CB-CG2 4.21Å; P186-I189 HydrophobicContact CG-CG2 4.47Å; P186-I189 WeakPolarHBondContact O-CG1 3.45Å; P186-I189 PolarHBondContact O-N 2.74Å; P186-D316 HydrophobicContact CB-CB 4.48Å
187	K	89.1	Confident	92.6	Very high	151 Å²	151	43.9 Å²	43.9	66%	0.657	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.4	178.7	-66.1	-177.1	179.3	177.1	0	113.2	I189	K187-I189 VanDerWaalsContact C-N 3.28Å; K187-I189 PolarHBondContact O-N 3.17Å
188	S	89.2	Confident	93	Very high	25 Å²	25	38.8 Å²	38.8	18%	0.175	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.3	-179.3	56	0	0	0	0	113.5	Y127 P186 V210 N211 D316	Y127-S188 PolarHBondContact OH-OG 3.24Å; P186-S188 PolarHBondContact O-N 3.3Å; S188-V210 WeakPolarHBondContact O-CG1 3.33Å; S188-N211 WeakPolarHBondContact O-CB 3.39Å; S188-N211 PolarHBondContact O-N 2.94Å; S188-N211 PolarHBondContact O-ND2 2.87Å; S188-D316 WeakPolarHBondContact CB-OD2 3.46Å; S188-D316 PolarHBondContact OG-OD2 2.83Å
189	I	93	Very high	93.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-85.3	147.3	-174.5	79.9	-176.2	0	0	0	113.5	F137 L185 P186 K187 R191 L194 A208 N211	F137-I189 HydrophobicContact CB-CB 4.41Å; F137-I189 HydrophobicContact CB-CG2 3.45Å; F137-I189 VanDerWaalsContact CB-CG2 3.45Å; F137-I189 HydrophobicContact CD1-CD1 4.23Å; F137-I189 HydrophobicContact CD1-CG2 4.12Å; F137-I189 HydrophobicContact CD2-CG2 4.22Å; F137-I189 HydrophobicContact CG-CG2 3.69Å; L185-I189 HydrophobicContact CB-CD1 3.95Å; L185-I189 HydrophobicContact CD1-CD1 4.28Å; L185-I189 HydrophobicContact CD2-CD1 3.85Å; L185-I189 HydrophobicContact CG-CD1 4.25Å; P186-I189 HydrophobicContact CB-CG2 4.21Å; P186-I189 HydrophobicContact CG-CG2 4.47Å; P186-I189 WeakPolarHBondContact O-CG1 3.45Å; P186-I189 PolarHBondContact O-N 2.74Å; K187-I189 VanDerWaalsContact C-N 3.28Å; K187-I189 PolarHBondContact O-N 3.17Å; I189-R191 HydrophobicContact CD1-CG 4.15Å; I189-R191 HydrophobicContact CG1-CG 3.71Å; I189-R191 PolarHBondContact O-N 3.22Å; I189-R191 VanDerWaalsContact O-N 3.12Å; I189-L194 HydrophobicContact CD1-CD1 4.45Å; I189-L194 HydrophobicContact CD1-CD2 4.08Å; I189-L194 HydrophobicContact CD1-CG 4.46Å; I189-A208 HydrophobicContact CB-CB 4.47Å; I189-N211 PolarHBondContact O-ND2 2.6Å
190	D	93.1	Very high	93.5	Very high	32 Å²	32	36.7 Å²	36.7	17%	0.171	19%	0.188	C	C	.	.			trans	-77.4	90.7	167.5	-173.4	-5.9	0	0	0	110.2	N192 Q193 A208 P209 N211	D190-N192 PolarHBondContact O-N 2.66Å; D190-N192 PolarHBondContact OD1-N 3.17Å; D190-Q193 HydrophobicContact CB-CB 4.47Å; D190-Q193 PolarHBondContact O-N 3.33Å; D190-Q193 WeakPolarHBondContact OD2-CG 3.46Å; D190-Q193 PolarHBondContact OD2-NE2 2.94Å; D190-A208 WeakPolarHBondContact O-CB 3.26Å; D190-P209 PolarHBondContact N-O 3.29Å; D190-N211 WeakPolarHBondContact CB-OD1 3.36Å
191	R	89.6	Confident	93.7	Very high	75 Å²	75	38.8 Å²	38.8	28%	0.283	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-62.3	-26.9	-175.4	-63.3	174.7	-130.3	-164.1	6.2	113.3	D157 D158 I189 Q193 L194	D157-R191 WeakPolarHBondContact O-CD 3.24Å; D157-R191 PolarHBondContact O-NH1 2.71Å; D158-R191 IonicContact OD1-NH1 3.59Å; I189-R191 HydrophobicContact CD1-CG 4.15Å; I189-R191 HydrophobicContact CG1-CG 3.71Å; I189-R191 PolarHBondContact O-N 3.22Å; I189-R191 VanDerWaalsContact O-N 3.12Å; R191-Q193 PolarHBondContact O-N 3.22Å; R191-L194 HydrophobicContact CB-CD1 4.12Å; R191-L194 HydrophobicContact CG-CD1 4.37Å; R191-L194 WeakPolarHBondContact O-CB 3.47Å; R191-L194 PolarHBondContact O-N 3.39Å
192	N	91.6	Very high	93.9	Very high	157 Å²	157	39.3 Å²	39.3	84%	0.84	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-68.9	-17.6	178	-63.1	-38.3	0	0	0	112.2	D190	D190-N192 PolarHBondContact O-N 2.66Å; D190-N192 PolarHBondContact OD1-N 3.17Å
193	Q	94	Very high	94.2	Very high	105 Å²	105	39.1 Å²	39.1	49%	0.491	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-106.6	12.6	178.6	-65.9	-164.4	59.2	0	0	113.1	D190 R191 N195 P209	D190-Q193 HydrophobicContact CB-CB 4.47Å; D190-Q193 PolarHBondContact O-N 3.33Å; D190-Q193 WeakPolarHBondContact OD2-CG 3.46Å; D190-Q193 PolarHBondContact OD2-NE2 2.94Å; R191-Q193 PolarHBondContact O-N 3.22Å; Q193-N195 PolarHBondContact O-N 2.98Å; Q193-N195 PolarHBondContact O-ND2 3.25Å; Q193-P209 HydrophobicContact CB-CG 4.19Å
194	L	95.7	Very high	94.5	Very high	23 Å²	23	39 Å²	39	12%	0.12	20%	0.204	C	C	.	.			trans	-57.5	122.6	171	-82.4	166.4	0	0	0	110.5	I11 L185 I189 R191 L206 G207 A208	I11-L194 HydrophobicContact CD1-CB 3.91Å; I11-L194 HydrophobicContact CD1-CD1 4.43Å; L185-L194 HydrophobicContact CD1-CD1 3.85Å; I189-L194 HydrophobicContact CD1-CD1 4.45Å; I189-L194 HydrophobicContact CD1-CD2 4.08Å; I189-L194 HydrophobicContact CD1-CG 4.46Å; R191-L194 HydrophobicContact CB-CD1 4.12Å; R191-L194 HydrophobicContact CG-CD1 4.37Å; R191-L194 WeakPolarHBondContact O-CB 3.47Å; R191-L194 PolarHBondContact O-N 3.39Å; L194-L206 HydrophobicContact CD2-CD1 4.36Å; L194-L206 HydrophobicContact CD2-CG 4.29Å; L194-G207 WeakPolarHBondContact CA-O 3.28Å; L194-A208 HydrophobicContact CD2-CB 3.85Å; L194-A208 HydrophobicContact CG-CB 4.07Å
195	N	96.3	Very high	94.8	Very high	78 Å²	78	40.6 Å²	40.6	42%	0.417	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	158.9	178.4	65.4	63.3	0	0	0	110.7	Q193 L206 G207	Q193-N195 PolarHBondContact O-N 2.98Å; Q193-N195 PolarHBondContact O-ND2 3.25Å; N195-L206 WeakPolarHBondContact O-CA 3.23Å; N195-G207 PolarHBondContact N-O 3.27Å; N195-G207 PolarHBondContact O-N 2.94Å
196	C	96.3	Very high	95.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	133.2	-177.8	-171.5	0	0	0	0	110.4	I11 N14 L204 K205 L206	I11-C196 HydrophobicContact CG2-CB 3.75Å; N14-C196 WeakPolarHBondContact CB-O 3.46Å; N14-C196 PolarHBondContact N-O 3.46Å; N14-C196 PolarHBondContact ND2-O 3.18Å; C196-L204 WeakPolarHBondContact SG-CD1 3.35Å; C196-L204 WeakPolarHBondContact SG-CG 3.45Å; C196-K205 CarbonylContact C-O 3.58Å; C196-K205 WeakPolarHBondContact CA-O 3.37Å; C196-L206 HydrophobicContact CB-CD1 4.31Å
197	S	97.1	Very high	95.3	Very high	11 Å²	11	40.7 Å²	40.7	8%	0.077	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.3	173.3	58.6	0	0	0	0	110.9	N14 E16 Q23 L204 K205	N14-S197 CarbonylContact O-C 3.58Å; N14-S197 WeakPolarHBondContact O-CA 3.15Å; E16-S197 WeakPolarHBondContact OE1-CB 3.44Å; Q23-S197 PolarHBondContact NE2-OG 2.92Å; S197-L204 CarbonylContact O-C 3.57Å; S197-L204 WeakPolarHBondContact O-CA 3.39Å; S197-K205 PolarHBondContact N-O 3.42Å; S197-K205 PolarHBondContact O-N 3.19Å
198	L	98.3	Very high	95.6	Very high	10 Å²	10	33.5 Å²	33.5	5%	0.052	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	114.5	176.5	-178.2	62.2	0	0	0	109.1	V13 N14 E16 P148 I151 L204	V13-L198 HydrophobicContact CG1-CB 3.83Å; V13-L198 HydrophobicContact CG1-CD2 4.35Å; N14-L198 PolarHBondContact O-N 3.13Å; E16-L198 PolarHBondContact N-O 2.99Å; P148-L198 HydrophobicContact CB-CD2 4.01Å; P148-L198 HydrophobicContact CG-CD2 3.83Å; I151-L198 HydrophobicContact CD1-CD2 3.69Å; L198-L204 HydrophobicContact CB-CD1 3.97Å; L198-L204 HydrophobicContact CD1-CB 4.14Å; L198-L204 HydrophobicContact CD1-CD1 4.1Å
199	T	98.2	Very high	95.9	Very high	5 Å²	5	33 Å²	33	3%	0.031	18%	0.177	C	C	.	.			trans	-71.6	161.6	177.8	55.2	0	0	0	0	111.8	R18 F20 D201 G202 V203	R18-T199 WeakPolarHBondContact O-CA 3.39Å; R18-T199 WeakPolarHBondContact O-CB 3.33Å; F20-T199 HydrophobicContact CB-CG2 4.37Å; T199-D201 WeakPolarHBondContact CB-OD1 3.49Å; T199-D201 PolarHBondContact O-N 2.86Å; T199-D201 PolarHBondContact OG1-OD1 3.34Å; T199-D201 VanDerWaalsContact OG1-OD1 3.09Å; T199-G202 PolarHBondContact O-N 3.08Å; T199-V203 PolarHBondContact N-O 3.4Å; T199-V203 VanDerWaalsContact OG1-CA 3.32Å; T199-V203 WeakPolarHBondContact OG1-CA 3.32Å; T199-V203 VanDerWaalsContact OG1-CB 3.24Å; T199-V203 WeakPolarHBondContact OG1-CB 3.35Å; T199-V203 PolarHBondContact OG1-N 3.29Å; T199-V203 PolarHBondContact OG1-O 3.44Å
200	S	97.5	Very high	96	Very high	73 Å²	73	33.7 Å²	33.7	51%	0.51	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.4	-178.8	65.6	0	0	0	0	113.9	E16 R18 T19	E16-S200 PolarHBondContact O-N 3.28Å; R18-S200 VanDerWaalsContact C-OG 3.3Å; R18-S200 PolarHBondContact O-N 3.33Å; R18-S200 PolarHBondContact O-OG 3.3Å; T19-S200 PolarHBondContact N-OG 2.65Å
201	D	97.1	Very high	95.8	Very high	44 Å²	44	35.8 Å²	35.8	24%	0.235	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	17.8	173.9	63.9	-36.6	0	0	0	113	T19 F20 R70 T199 V203	T19-D201 WeakPolarHBondContact CA-OD1 3.23Å; T19-D201 HydrophobicContact CG2-CB 4.36Å; F20-D201 PolarHBondContact N-OD1 3.43Å; R70-D201 IonicContact CZ-OD2 2.88Å; R70-D201 IonicContact NH1-OD2 3.56Å; R70-D201 IonicContact NH2-OD2 3.66Å; R70-D201 PolarHBondContact NH2-OD2 2.81Å; R70-D201 VanDerWaalsContact NH2-OD2 3.14Å; T199-D201 WeakPolarHBondContact CB-OD1 3.49Å; T199-D201 PolarHBondContact O-N 2.86Å; T199-D201 PolarHBondContact OG1-OD1 3.34Å; T199-D201 VanDerWaalsContact OG1-OD1 3.09Å; D201-V203 PolarHBondContact O-N 3.07Å
202	G	97.3	Very high	94.9	Very high	12 Å²	12	38.9 Å²	38.9	12%	0.124	22%	0.219	C	C	.	.	S	Bend	trans	80.5	14.4	169.6	0	0	0	0	0	115	L143 E144 T199	L143-G202 CarbonylContact C-O 3.59Å; L143-G202 VanDerWaalsContact C-O 3.3Å; L143-G202 VanDerWaalsContact CA-O 3.27Å; L143-G202 WeakPolarHBondContact CA-O 3.38Å; L143-G202 WeakPolarHBondContact CB-O 3.46Å; L143-G202 PolarHBondContact N-O 2.86Å; E144-G202 PolarHBondContact N-O 3.02Å; T199-G202 PolarHBondContact O-N 3.08Å
203	V	97.9	Very high	94.1	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	118	173.4	-175.4	0	0	0	0	109.7	F20 M73 C140 F141 T199 D201	F20-V203 HydrophobicContact CB-CB 4.05Å; F20-V203 HydrophobicContact CB-CG1 4.47Å; F20-V203 HydrophobicContact CB-CG2 3.83Å; F20-V203 HydrophobicContact CD2-CB 4.28Å; F20-V203 HydrophobicContact CD2-CG1 3.81Å; F20-V203 HydrophobicContact CE2-CG1 4.34Å; F20-V203 HydrophobicContact CG-CB 4.34Å; F20-V203 HydrophobicContact CG-CG1 4.23Å; F20-V203 HydrophobicContact CG-CG2 4.21Å; M73-V203 HydrophobicContact CE-CB 4.37Å; M73-V203 HydrophobicContact CE-CG1 3.55Å; M73-V203 HydrophobicContact CE-CG2 3.87Å; M73-V203 HydrophobicContact SD-CG1 3.84Å; M73-V203 HydrophobicContact SD-CG2 3.88Å; C140-V203 HydrophobicContact CB-CG1 3.89Å; F141-V203 WeakPolarHBondContact O-CA 3.44Å; T199-V203 PolarHBondContact N-O 3.4Å; T199-V203 VanDerWaalsContact OG1-CA 3.32Å; T199-V203 WeakPolarHBondContact OG1-CA 3.32Å; T199-V203 VanDerWaalsContact OG1-CB 3.24Å; T199-V203 WeakPolarHBondContact OG1-CB 3.35Å; T199-V203 PolarHBondContact OG1-N 3.29Å; T199-V203 PolarHBondContact OG1-O 3.44Å; D201-V203 PolarHBondContact O-N 3.07Å
204	L	98.4	Very high	93.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	112.9	172	-169.1	82.3	0	0	0	109.1	V13 C140 F141 L143 V153 V162 C196 S197 L198	V13-L204 HydrophobicContact CG1-CD1 3.72Å; V13-L204 HydrophobicContact CG2-CD1 4.49Å; C140-L204 CarbonylContact C-O 3.6Å; C140-L204 VanDerWaalsContact CA-O 3.29Å; C140-L204 WeakPolarHBondContact CA-O 3.44Å; F141-L204 HydrophobicContact CB-CB 4.16Å; F141-L204 HydrophobicContact CD2-CD2 4.16Å; F141-L204 PolarHBondContact N-O 3.43Å; F141-L204 PolarHBondContact O-N 2.92Å; L143-L204 HydrophobicContact CD1-CB 3.63Å; L143-L204 HydrophobicContact CD1-CD1 4.28Å; L143-L204 HydrophobicContact CD1-CD2 3.81Å; L143-L204 HydrophobicContact CD1-CG 4.11Å; L143-L204 HydrophobicContact CG-CB 4Å; V153-L204 HydrophobicContact CG2-CD2 3.87Å; V162-L204 HydrophobicContact CG1-CD2 3.78Å; V162-L204 HydrophobicContact CG2-CD2 4.13Å; C196-L204 WeakPolarHBondContact SG-CD1 3.35Å; C196-L204 WeakPolarHBondContact SG-CG 3.45Å; S197-L204 CarbonylContact O-C 3.57Å; S197-L204 WeakPolarHBondContact O-CA 3.39Å; L198-L204 HydrophobicContact CB-CD1 3.97Å; L198-L204 HydrophobicContact CD1-CB 4.14Å; L198-L204 HydrophobicContact CD1-CD1 4.1Å
205	K	97.4	Very high	93.1	Very high	45 Å²	45	31 Å²	31	20%	0.196	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	119.3	171.2	-174.8	179.6	-173.7	175.5	0	109	E128 H138 C196 S197	E128-K205 IonicContact OE1-NZ 3.17Å; E128-K205 PolarHBondContact OE1-NZ 3.43Å; H138-K205 HydrophobicContact CB-CG 4.48Å; C196-K205 CarbonylContact C-O 3.58Å; C196-K205 WeakPolarHBondContact CA-O 3.37Å; S197-K205 PolarHBondContact N-O 3.42Å; S197-K205 PolarHBondContact O-N 3.19Å
206	L	97.4	Very high	92.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.3	167.5	178	82.7	0	0	0	107.9	I11 H138 V139 F141 V153 V160 L194 N195 C196	I11-L206 HydrophobicContact CD1-CD1 3.99Å; H138-L206 CarbonylContact C-O 3.6Å; H138-L206 WeakPolarHBondContact CA-O 3.47Å; V139-L206 HydrophobicContact CG2-CB 3.94Å; V139-L206 HydrophobicContact CG2-CD2 3.93Å; V139-L206 HydrophobicContact CG2-CG 4.45Å; V139-L206 PolarHBondContact N-O 2.97Å; V139-L206 PolarHBondContact O-N 3.01Å; F141-L206 HydrophobicContact CE2-CB 4.46Å; V153-L206 HydrophobicContact CG1-CD1 4.23Å; V160-L206 HydrophobicContact CB-CD2 3.99Å; V160-L206 HydrophobicContact CG1-CD2 3.52Å; V160-L206 HydrophobicContact CG2-CD1 4.42Å; V160-L206 HydrophobicContact CG2-CD2 3.71Å; L194-L206 HydrophobicContact CD2-CD1 4.36Å; L194-L206 HydrophobicContact CD2-CG 4.29Å; N195-L206 WeakPolarHBondContact O-CA 3.23Å; C196-L206 HydrophobicContact CB-CD1 4.31Å
207	G	96	Very high	92.4	Very high	6 Å²	6	33.8 Å²	33.8	6%	0.062	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	167.8	176.5	0	0	0	0	0	114.8	F137 L194 N195	F137-G207 CarbonylContact O-C 3.58Å; F137-G207 WeakPolarHBondContact O-CA 3.31Å; L194-G207 WeakPolarHBondContact CA-O 3.28Å; N195-G207 PolarHBondContact N-O 3.27Å; N195-G207 PolarHBondContact O-N 2.94Å
208	A	96.3	Very high	92.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	153.8	176.8	0	0	0	0	0	110.5	H136 F137 I189 D190 L194	H136-A208 CarbonylContact C-O 3.3Å; H136-A208 WeakPolarHBondContact CA-O 3.38Å; F137-A208 PolarHBondContact N-O 3.34Å; F137-A208 PolarHBondContact O-N 2.88Å; I189-A208 HydrophobicContact CB-CB 4.47Å; D190-A208 WeakPolarHBondContact O-CB 3.26Å; L194-A208 HydrophobicContact CD2-CB 3.85Å; L194-A208 HydrophobicContact CG-CB 4.07Å
209	P	94.9	Very high	91.8	Very high	16 Å²	16	33.7 Å²	33.7	10%	0.104	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	154.1	165.8	-17.2	28.7	0	0	0	112.1	D190 Q193	D190-P209 PolarHBondContact N-O 3.29Å; Q193-P209 HydrophobicContact CB-CG 4.19Å
210	V	94.7	Very high	91.5	Very high	14 Å²	14	34.9 Å²	34.9	9%	0.085	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-90.4	138.6	171.8	177.9	0	0	0	0	110.7	Y127 V135 S188 V212 P213 L318	Y127-V210 HydrophobicContact CD1-CG2 3.92Å; Y127-V210 HydrophobicContact CE1-CG2 3.78Å; V135-V210 HydrophobicContact CB-CB 4.47Å; V135-V210 HydrophobicContact CB-CG2 4.34Å; V135-V210 HydrophobicContact CG1-CG2 3.93Å; V135-V210 PolarHBondContact O-N 3.13Å; S188-V210 WeakPolarHBondContact O-CG1 3.33Å; V210-V212 PolarHBondContact O-N 3.42Å; V210-P213 HydrophobicContact CG1-CB 4.24Å; V210-P213 HydrophobicContact CG1-CG 4.36Å; V210-L318 HydrophobicContact CB-CD1 4.29Å; V210-L318 HydrophobicContact CG1-CD1 3.7Å; V210-L318 HydrophobicContact CG2-CD1 3.79Å
211	N	89.8	Confident	91.2	Very high	76 Å²	76	32.4 Å²	32.4	41%	0.406	18%	0.177	S	C	.	.	S	Bend	trans	-69.1	115.8	171.6	-62.5	-45.7	0	0	0	110.4	S188 I189 D190	S188-N211 WeakPolarHBondContact O-CB 3.39Å; S188-N211 PolarHBondContact O-N 2.94Å; S188-N211 PolarHBondContact O-ND2 2.87Å; I189-N211 PolarHBondContact O-ND2 2.6Å; D190-N211 WeakPolarHBondContact CB-OD1 3.36Å
212	V	71.6	Confident	90.7	Very high	140 Å²	140	36.1 Å²	36.1	85%	0.848	20%	0.196	S	C	*	.	S	Bend	trans	43.2	57.5	162.6	-158.7	0	0	0	0	114.2	V210	V210-V212 PolarHBondContact O-N 3.42Å
213	P	73.7	Confident	90.2	Very high	19 Å²	19	39.7 Å²	39.7	12%	0.123	21%	0.213	C	C	.	.			trans	-68.7	148.5	176	30.7	-33.3	0	0	0	110.1	V135 V210 Y215 L218	V135-P213 HydrophobicContact CB-CG 4.44Å; V135-P213 HydrophobicContact CG2-CG 4.44Å; V210-P213 HydrophobicContact CG1-CB 4.24Å; V210-P213 HydrophobicContact CG1-CG 4.36Å; P213-Y215 HydrophobicContact CG-CD2 3.89Å; P213-Y215 HydrophobicContact CG-CE1 4.12Å; P213-Y215 HydrophobicContact CG-CE2 3.34Å; P213-Y215 HydrophobicContact CG-CG 4.49Å; P213-Y215 VanDerWaalsContact CG-CZ 3.42Å; P213-Y215 VanDerWaalsContact O-CD2 3.23Å; P213-Y215 WeakPolarHBondContact O-CD2 3.36Å; P213-Y215 PolarHBondContact O-N 3.25Å; P213-L218 HydrophobicContact CB-CD1 4.18Å; P213-L218 HydrophobicContact CG-CD1 4.49Å
214	D	84.2	Confident	89.7	Confident	76 Å²	76	39.8 Å²	39.8	41%	0.406	21%	0.214	S	C	.	.			trans	-76	78.3	174.7	178.6	19.7	0	0	0	110.2	Q216 S217 L218 K231	D214-Q216 PolarHBondContact O-N 3.46Å; D214-S217 PolarHBondContact O-N 3.2Å; D214-S217 WeakPolarHBondContact OD2-CB 3.45Å; D214-S217 PolarHBondContact OD2-OG 2.95Å; D214-L218 PolarHBondContact O-N 3.41Å; D214-K231 IonicContact OD1-NZ 3.32Å; D214-K231 PolarHBondContact OD1-NZ 3.42Å; D214-K231 WeakPolarHBondContact OD2-CE 3.28Å; D214-K231 IonicContact OD2-NZ 2.87Å; D214-K231 PolarHBondContact OD2-NZ 2.97Å
215	Y	85.1	Confident	89.3	Confident	26 Å²	26	40.3 Å²	40.3	10%	0.102	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-20.5	-176.9	-75	-82.9	0	0	0	114.4	Y43 W47 K134 V135 P213 S217 L218	Y43-Y215 HydrophobicContact CD1-CD1 4.19Å; Y43-Y215 AromaticContact CD1-CD2 3.46Å; Y43-Y215 HydrophobicContact CD1-CD2 3.46Å; Y43-Y215 VanDerWaalsContact CD1-CD2 3.46Å; Y43-Y215 HydrophobicContact CD1-CE1 4.38Å; Y43-Y215 AromaticContact CD1-CE2 3.63Å; Y43-Y215 HydrophobicContact CD1-CE2 3.63Å; Y43-Y215 AromaticContact CD1-CG 3.77Å; Y43-Y215 HydrophobicContact CD1-CG 3.77Å; Y43-Y215 AromaticContact CD2-CD1 3.3Å; Y43-Y215 HydrophobicContact CD2-CD1 3.3Å; Y43-Y215 HydrophobicContact CD2-CD2 4.14Å; Y43-Y215 AromaticContact CD2-CE1 3.45Å; Y43-Y215 HydrophobicContact CD2-CE1 3.45Å; Y43-Y215 VanDerWaalsContact CD2-CE1 3.45Å; Y43-Y215 HydrophobicContact CD2-CE2 4.21Å; Y43-Y215 AromaticContact CD2-CG 3.71Å; Y43-Y215 HydrophobicContact CD2-CG 3.71Å; Y43-Y215 AromaticContact CD2-CZ 3.93Å; Y43-Y215 AromaticContact CE1-CD2 3.96Å; Y43-Y215 HydrophobicContact CE1-CD2 3.96Å; Y43-Y215 HydrophobicContact CE1-CE1 4.43Å; Y43-Y215 AromaticContact CE1-CE2 3.61Å; Y43-Y215 HydrophobicContact CE1-CE2 3.61Å; Y43-Y215 HydrophobicContact CE1-CG 4.49Å; Y43-Y215 AromaticContact CE1-CZ 3.92Å; Y43-Y215 AromaticContact CE2-CD1 3.88Å; Y43-Y215 HydrophobicContact CE2-CD1 3.88Å; Y43-Y215 AromaticContact CE2-CE1 3.48Å; Y43-Y215 HydrophobicContact CE2-CE1 3.48Å; Y43-Y215 VanDerWaalsContact CE2-CE1 3.48Å; Y43-Y215 HydrophobicContact CE2-CE2 4.17Å; Y43-Y215 HydrophobicContact CE2-CG 4.43Å; Y43-Y215 AromaticContact CE2-CZ 3.66Å; Y43-Y215 AromaticContact CG-CD1 3.51Å; Y43-Y215 HydrophobicContact CG-CD1 3.51Å; Y43-Y215 AromaticContact CG-CD2 3.6Å; Y43-Y215 HydrophobicContact CG-CD2 3.6Å; Y43-Y215 AromaticContact CG-CE1 3.95Å; Y43-Y215 HydrophobicContact CG-CE1 3.95Å; Y43-Y215 AromaticContact CG-CE2 3.98Å; Y43-Y215 HydrophobicContact CG-CE2 3.98Å; Y43-Y215 AromaticContact CG-CG 3.36Å; Y43-Y215 HydrophobicContact CG-CG 3.36Å; Y43-Y215 AromaticContact CZ-CE2 3.91Å; Y43-Y215 AromaticContact CZ-CZ 3.7Å; W47-Y215 HydrophobicContact CH2-CD1 4.36Å; W47-Y215 HydrophobicContact CZ2-CD1 4.24Å; W47-Y215 HydrophobicContact CZ2-CE1 4.35Å; K134-Y215 VanDerWaalsContact CA-OH 3.29Å; K134-Y215 WeakPolarHBondContact CA-OH 3.26Å; K134-Y215 WeakPolarHBondContact CB-OH 3.46Å; V135-Y215 HydrophobicContact CG2-CE1 3.88Å; V135-Y215 PolarHBondContact N-OH 3.07Å; P213-Y215 HydrophobicContact CG-CD2 3.89Å; P213-Y215 HydrophobicContact CG-CE1 4.12Å; P213-Y215 HydrophobicContact CG-CE2 3.34Å; P213-Y215 HydrophobicContact CG-CG 4.49Å; P213-Y215 VanDerWaalsContact CG-CZ 3.42Å; P213-Y215 VanDerWaalsContact O-CD2 3.23Å; P213-Y215 WeakPolarHBondContact O-CD2 3.36Å; P213-Y215 PolarHBondContact O-N 3.25Å; Y215-S217 VanDerWaalsContact C-N 3.28Å; Y215-L218 HydrophobicContact CD1-CD1 3.6Å; Y215-L218 HydrophobicContact CE1-CD1 3.96Å; Y215-L218 HydrophobicContact CG-CD1 4.16Å; Y215-L218 PolarHBondContact O-N 3.04Å
216	Q	86.7	Confident	89.1	Confident	126 Å²	126	38.5 Å²	38.5	59%	0.589	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-30.7	173.9	-64.7	-180	-6	0	0	112.4	T44 D214	T44-Q216 HydrophobicContact CG2-CB 4.46Å; T44-Q216 HydrophobicContact CG2-CG 3.99Å; D214-Q216 PolarHBondContact O-N 3.46Å
217	S	90.8	Very high	89	Confident	10 Å²	10	38.6 Å²	38.6	7%	0.07	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-10.1	176.4	-56.2	0	0	0	0	112.1	D214 Y215 I228 R229 K231	D214-S217 PolarHBondContact O-N 3.2Å; D214-S217 WeakPolarHBondContact OD2-CB 3.45Å; D214-S217 PolarHBondContact OD2-OG 2.95Å; Y215-S217 VanDerWaalsContact C-N 3.28Å; S217-I228 CarbonylContact O-C 3.5Å; S217-I228 WeakPolarHBondContact O-CA 3.37Å; S217-R229 PolarHBondContact O-N 2.79Å; S217-K231 WeakPolarHBondContact OG-CE 3.31Å
218	L	91.2	Very high	89	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	137.5	-178.6	-67.6	-175.8	0	0	0	112.5	W47 V135 P213 D214 Y215 I226 I228 L318	W47-L218 HydrophobicContact CH2-CB 4.29Å; W47-L218 HydrophobicContact CZ3-CB 4.05Å; V135-L218 HydrophobicContact CG2-CD1 3.49Å; V135-L218 VanDerWaalsContact CG2-CD1 3.49Å; P213-L218 HydrophobicContact CB-CD1 4.18Å; P213-L218 HydrophobicContact CG-CD1 4.49Å; D214-L218 PolarHBondContact O-N 3.41Å; Y215-L218 HydrophobicContact CD1-CD1 3.6Å; Y215-L218 HydrophobicContact CE1-CD1 3.96Å; Y215-L218 HydrophobicContact CG-CD1 4.16Å; Y215-L218 PolarHBondContact O-N 3.04Å; L218-I226 HydrophobicContact CD2-CG2 4.14Å; L218-I228 HydrophobicContact CD2-CD1 3.85Å; L218-L318 HydrophobicContact CD2-CD2 3.6Å
219	T	91.2	Very high	88.9	Confident	15 Å²	15	40.5 Å²	40.5	9%	0.092	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	-174.4	172.7	-165.6	0	0	0	0	109.6	A227 R229 C278	T219-A227 HydrophobicContact CG2-CB 3.82Å; T219-A227 PolarHBondContact N-O 2.87Å; T219-A227 PolarHBondContact O-N 3.35Å; T219-A227 VanDerWaalsContact O-O 3.1Å; T219-R229 HydrophobicContact CG2-CB 4.18Å; T219-R229 PolarHBondContact OG1-NH2 3.43Å; T219-C278 HydrophobicContact CG2-CB 4.36Å
220	F	91.7	Very high	89	Confident	31 Å²	31	39.9 Å²	39.9	14%	0.136	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.5	174.4	-54.2	-81	0	0	0	110.4	W47 W54 I129 Q225 I226	W47-F220 HydrophobicContact CH2-CE2 4.22Å; W47-F220 AromaticContact CH2-CZ 3.99Å; W47-F220 HydrophobicContact CH2-CZ 3.99Å; W47-F220 HydrophobicContact CZ3-CE2 4.39Å; W54-F220 HydrophobicContact CB-CD2 3.95Å; W54-F220 HydrophobicContact CB-CE1 4.48Å; W54-F220 HydrophobicContact CB-CE2 3.87Å; W54-F220 HydrophobicContact CB-CG 4.31Å; W54-F220 HydrophobicContact CB-CZ 4.14Å; W54-F220 AromaticContact CD1-CD1 3.26Å; W54-F220 AromaticContact CD1-CE1 3.45Å; W54-F220 VanDerWaalsContact CD1-CE1 3.45Å; W54-F220 AromaticContact CD1-CG 3.59Å; W54-F220 AromaticContact CD1-CZ 3.96Å; W54-F220 HydrophobicContact CD2-CE1 4.42Å; W54-F220 HydrophobicContact CG-CD1 4.05Å; W54-F220 HydrophobicContact CG-CD2 4.28Å; W54-F220 AromaticContact CG-CE1 3.9Å; W54-F220 HydrophobicContact CG-CE1 3.9Å; W54-F220 HydrophobicContact CG-CE2 4.17Å; W54-F220 HydrophobicContact CG-CG 4.23Å; W54-F220 AromaticContact CG-CZ 3.97Å; W54-F220 HydrophobicContact CG-CZ 3.97Å; W54-F220 AromaticContact NE1-CD1 3.68Å; W54-F220 AromaticContact NE1-CE1 3.67Å; I129-F220 HydrophobicContact CD1-CE1 4.38Å; I129-F220 HydrophobicContact CD1-CZ 4.07Å; I129-F220 HydrophobicContact CG1-CE1 4.27Å; I129-F220 HydrophobicContact CG1-CZ 3.93Å; F220-Q225 VanDerWaalsContact CA-O 3.25Å; F220-Q225 WeakPolarHBondContact CA-O 3.46Å; F220-I226 HydrophobicContact CD1-CD1 4.1Å; F220-I226 HydrophobicContact CE1-CD1 3.53Å; F220-I226 HydrophobicContact CE1-CG1 4.48Å; F220-I226 HydrophobicContact CZ-CD1 4.31Å
221	N	91.7	Very high	89	Confident	21 Å²	21	41.3 Å²	41.3	11%	0.112	22%	0.216	C	C	.	.			trans	-82	177.1	168.3	71.6	7.8	0	0	0	111.1	N223 G224 Q225 A227 S280	N221-N223 PolarHBondContact O-N 3.38Å; N221-N223 WeakPolarHBondContact OD1-CA 3.42Å; N221-N223 WeakPolarHBondContact OD1-CB 3.49Å; N221-N223 PolarHBondContact OD1-N 3.44Å; N221-G224 PolarHBondContact O-N 3.05Å; N221-G224 PolarHBondContact OD1-N 3.48Å; N221-Q225 PolarHBondContact N-O 2.98Å; N221-Q225 VanDerWaalsContact N-O 3.1Å; N221-Q225 PolarHBondContact ND2-OE1 3.29Å; N221-Q225 WeakPolarHBondContact OD1-CB 3.42Å; N221-Q225 PolarHBondContact OD1-N 2.89Å; N221-A227 HydrophobicContact CB-CB 4.36Å; N221-S280 PolarHBondContact ND2-OG 3.19Å
222	D	86.3	Confident	89.2	Confident	121 Å²	121	39.4 Å²	39.4	65%	0.647	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-22	-180	-55.9	-45	0	0	0	113.6	G224 K304	D222-G224 VanDerWaalsContact C-N 3.31Å; D222-K304 IonicContact OD1-NZ 2.6Å; D222-K304 PolarHBondContact OD1-NZ 2.82Å; D222-K304 IonicContact OD2-NZ 3.16Å; D222-K304 PolarHBondContact OD2-NZ 3.5Å
223	N	86.7	Confident	90.2	Very high	88 Å²	88	34.6 Å²	34.6	47%	0.471	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	2.2	179.4	-66.9	-31.1	0	0	0	113.2	R68 N221 Q225	R68-N223 PolarHBondContact NH1-O 2.89Å; R68-N223 PolarHBondContact NH2-O 3.14Å; N221-N223 PolarHBondContact O-N 3.38Å; N221-N223 WeakPolarHBondContact OD1-CA 3.42Å; N221-N223 WeakPolarHBondContact OD1-CB 3.49Å; N221-N223 PolarHBondContact OD1-N 3.44Å; N223-Q225 VanDerWaalsContact C-N 3.27Å; N223-Q225 HydrophobicContact CB-CG 4.3Å; N223-Q225 PolarHBondContact O-N 3.39Å
224	G	87.2	Confident	91	Very high	2 Å²	2	40.4 Å²	40.4	2%	0.021	21%	0.207	C	C	.	.	S	Bend	trans	67.6	24	-176.4	0	0	0	0	0	113.6	W54 R65 N221 D222	W54-G224 PolarHBondContact NE1-O 3.37Å; R65-G224 PolarHBondContact NH2-O 3.43Å; N221-G224 PolarHBondContact O-N 3.05Å; N221-G224 PolarHBondContact OD1-N 3.48Å; D222-G224 VanDerWaalsContact C-N 3.31Å
225	Q	91.5	Very high	91.2	Very high	11 Å²	11	44 Å²	44	5%	0.051	22%	0.221	C	C	.	.			trans	-88.8	154.8	171.9	-62.9	163.1	-44.9	0	0	109.4	K124 D125 F220 N221 N223 A227	K124-Q225 WeakPolarHBondContact O-CG 3.22Å; K124-Q225 PolarHBondContact O-NE2 3.49Å; D125-Q225 VanDerWaalsContact CG-NE2 3.29Å; D125-Q225 WeakPolarHBondContact OD1-CG 3.5Å; D125-Q225 PolarHBondContact OD1-NE2 2.79Å; D125-Q225 PolarHBondContact OD2-NE2 3.09Å; F220-Q225 VanDerWaalsContact CA-O 3.25Å; F220-Q225 WeakPolarHBondContact CA-O 3.46Å; N221-Q225 PolarHBondContact N-O 2.98Å; N221-Q225 VanDerWaalsContact N-O 3.1Å; N221-Q225 PolarHBondContact ND2-OE1 3.29Å; N221-Q225 WeakPolarHBondContact OD1-CB 3.42Å; N221-Q225 PolarHBondContact OD1-N 2.89Å; N223-Q225 VanDerWaalsContact C-N 3.27Å; N223-Q225 HydrophobicContact CB-CG 4.3Å; N223-Q225 PolarHBondContact O-N 3.39Å; Q225-A227 PolarHBondContact O-N 2.74Å
226	I	92.4	Very high	91.3	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.041	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	136.5	173.9	-70	-70.8	0	0	0	109.8	I129 V135 L218 F220 L318	I129-I226 HydrophobicContact CD1-CD1 4.32Å; V135-I226 HydrophobicContact CG2-CD1 4.32Å; L218-I226 HydrophobicContact CD2-CG2 4.14Å; F220-I226 HydrophobicContact CD1-CD1 4.1Å; F220-I226 HydrophobicContact CE1-CD1 3.53Å; F220-I226 HydrophobicContact CE1-CG1 4.48Å; F220-I226 HydrophobicContact CZ-CD1 4.31Å; I226-L318 HydrophobicContact CG2-CD2 3.64Å
227	A	94.9	Very high	91.4	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	165.1	178.5	0	0	0	0	0	110.1	T219 N221 Q225 C278 I279	T219-A227 HydrophobicContact CG2-CB 3.82Å; T219-A227 PolarHBondContact N-O 2.87Å; T219-A227 PolarHBondContact O-N 3.35Å; T219-A227 VanDerWaalsContact O-O 3.1Å; N221-A227 HydrophobicContact CB-CB 4.36Å; Q225-A227 PolarHBondContact O-N 2.74Å; A227-C278 WeakPolarHBondContact CB-SG 3.16Å; A227-I279 CarbonylContact C-O 3.53Å; A227-I279 VanDerWaalsContact CA-O 3.23Å; A227-I279 WeakPolarHBondContact CA-O 3.45Å; A227-I279 VanDerWaalsContact CB-O 3.26Å; A227-I279 WeakPolarHBondContact CB-O 3.46Å
228	I	95.5	Very high	91.1	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.056	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.9	-179.5	-56.2	-53.8	0	0	0	109.6	S217 L218 I279 P317 V320 A322	S217-I228 CarbonylContact O-C 3.5Å; S217-I228 WeakPolarHBondContact O-CA 3.37Å; L218-I228 HydrophobicContact CD2-CD1 3.85Å; I228-I279 HydrophobicContact CB-CB 4.4Å; I228-I279 PolarHBondContact N-O 3.05Å; I228-I279 PolarHBondContact O-N 3.44Å; I228-P317 WeakPolarHBondContact CG1-O 3.39Å; I228-V320 HydrophobicContact CG1-CB 4.08Å; I228-V320 HydrophobicContact CG1-CG1 4.49Å; I228-A322 HydrophobicContact CG2-CB 4.29Å
229	R	95.3	Very high	90.9	Very high	35 Å²	35	54.6 Å²	54.6	13%	0.132	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-84.9	121.9	163.7	-177	-175	-71.5	103.7	13.8	107.9	R50 S217 T219 P274	R50-R229 VanDerWaalsContact CZ-NH1 3.26Å; R50-R229 VanDerWaalsContact NE-NH2 3.2Å; R50-R229 VanDerWaalsContact NH2-CZ 3.33Å; S217-R229 PolarHBondContact O-N 2.79Å; T219-R229 HydrophobicContact CG2-CB 4.18Å; T219-R229 PolarHBondContact OG1-NH2 3.43Å; R229-P274 VanDerWaalsContact CG-O 3.29Å; R229-P274 WeakPolarHBondContact CG-O 3.37Å
230	P	96.7	Very high	90.7	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.019	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-58.2	146.7	172.5	-22.1	32.8	0	0	0	112.1	P274 L277 I279 A322 V324 L329	P230-P274 WeakPolarHBondContact O-CB 3.01Å; P230-L277 HydrophobicContact CG-CB 3.94Å; P230-L277 HydrophobicContact CG-CD1 4.07Å; P230-I279 HydrophobicContact CG-CD1 3.75Å; P230-I279 HydrophobicContact CG-CG1 4.36Å; P230-A322 WeakPolarHBondContact CA-O 3.49Å; P230-A322 HydrophobicContact CB-CB 4.01Å; P230-A322 HydrophobicContact CG-CB 4.07Å; P230-V324 HydrophobicContact CB-CG2 4.08Å; P230-L329 HydrophobicContact CB-CD1 3.8Å; P230-L329 HydrophobicContact CG-CD1 3.5Å; P230-L329 VanDerWaalsContact CG-CD1 3.5Å
231	K	94.8	Very high	90.8	Very high	44 Å²	44	62 Å²	62	19%	0.191	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	153.7	170	-74.7	176	165.7	166.9	0	111	D214 S217 H233 V236 A322 Q323 V324	D214-K231 IonicContact OD1-NZ 3.32Å; D214-K231 PolarHBondContact OD1-NZ 3.42Å; D214-K231 WeakPolarHBondContact OD2-CE 3.28Å; D214-K231 IonicContact OD2-NZ 2.87Å; D214-K231 PolarHBondContact OD2-NZ 2.97Å; S217-K231 WeakPolarHBondContact OG-CE 3.31Å; K231-H233 PolarHBondContact O-N 2.8Å; K231-V236 HydrophobicContact CB-CG2 3.65Å; K231-V236 HydrophobicContact CD-CG2 4.15Å; K231-A322 PolarHBondContact N-O 3.49Å; K231-Q323 VanDerWaalsContact O-CA 3.25Å; K231-Q323 WeakPolarHBondContact O-CA 3.43Å; K231-V324 PolarHBondContact O-N 3.44Å
232	S	94.4	Very high	91	Very high	36 Å²	36	61.6 Å²	61.6	25%	0.252	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	133.8	165	-179.6	0	0	0	0	109.1	N234 Q235	S232-N234 PolarHBondContact O-N 3.08Å; S232-Q235 WeakPolarHBondContact O-CB 3.34Å; S232-Q235 PolarHBondContact O-N 3.08Å
233	H	92.8	Very high	91.3	Very high	40 Å²	40	58.9 Å²	58.9	19%	0.185	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-52.6	-32	-179.8	-173.7	70.8	0	0	0	113.8	K231 Q235 V236 L242 Q323 V324 I325	K231-H233 PolarHBondContact O-N 2.8Å; H233-Q235 VanDerWaalsContact C-N 3.31Å; H233-Q235 PolarHBondContact O-N 2.88Å; H233-V236 PolarHBondContact O-N 3.17Å; H233-L242 PolarHBondContact CE1-O 2.89Å; H233-Q323 PolarHBondContact ND1-OE1 3.3Å; H233-V324 WeakPolarHBondContact CB-O 3.38Å; H233-V324 PolarHBondContact N-O 2.89Å; H233-I325 HydrophobicContact CB-CB 4.47Å; H233-I325 HydrophobicContact CB-CG1 3.92Å
234	N	90.6	Very high	91.7	Very high	141 Å²	141	58 Å²	58	75%	0.754	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-74.5	-18.7	179.1	-67.4	-33.9	0	0	0	113.8	S232	S232-N234 PolarHBondContact O-N 3.08Å
235	Q	87.4	Confident	92.1	Very high	151 Å²	151	62.9 Å²	62.9	71%	0.706	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-90.4	-5.3	178	-67.2	173.4	-21.3	0	0	112.6	S232 H233	S232-Q235 WeakPolarHBondContact O-CB 3.34Å; S232-Q235 PolarHBondContact O-N 3.08Å; H233-Q235 VanDerWaalsContact C-N 3.31Å; H233-Q235 PolarHBondContact O-N 2.88Å
236	V	88.4	Confident	92.1	Very high	18 Å²	18	65.1 Å²	65.1	11%	0.109	36%	0.36	C	S	.	.	S	Bend	trans	-95.4	133.5	-177.5	-174.8	0	0	0	0	110.9	K231 H233 H240 K241 Q323	K231-V236 HydrophobicContact CB-CG2 3.65Å; K231-V236 HydrophobicContact CD-CG2 4.15Å; H233-V236 PolarHBondContact O-N 3.17Å; V236-H240 HydrophobicContact CG1-CB 3.52Å; V236-K241 HydrophobicContact CB-CG 4.44Å; V236-K241 HydrophobicContact CG1-CG 4.46Å; V236-K241 WeakPolarHBondContact O-CE 3.46Å; V236-Q323 HydrophobicContact CG2-CG 3.9Å
237	Q	87.2	Confident	92.1	Very high	145 Å²	145	68.3 Å²	68.3	68%	0.678	38%	0.38	S	S	*	.			trans	-60	145.8	173.8	-62.4	-178.5	6.5	0	0	110.5	A239 H240 K241	Q237-A239 PolarHBondContact O-N 3.5Å; Q237-H240 PolarHBondContact O-N 3.01Å; Q237-K241 PolarHBondContact O-N 3.48Å
238	N	84.7	Confident	92	Very high	133 Å²	133	74.8 Å²	74.8	71%	0.711	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-54	-32.6	-174.2	-73.2	-25.3	0	0	0	114.2	H240 K241	N238-H240 PolarHBondContact O-N 3.11Å; N238-K241 PolarHBondContact O-N 3.31Å; N238-K241 WeakPolarHBondContact OD1-CE 3.46Å; N238-K241 PolarHBondContact OD1-NZ 2.8Å
239	A	86.6	Confident	91.9	Very high	91 Å²	91	75.1 Å²	75.1	75%	0.752	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-66.7	-19.6	178.1	0	0	0	0	0	114.3	Q237	Q237-A239 PolarHBondContact O-N 3.5Å
240	H	88.5	Confident	91.9	Very high	120 Å²	120	78.3 Å²	78.3	56%	0.556	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-113.4	6.2	-177	-61.6	-59.5	0	0	0	112.9	V236 Q237 N238 L242 Q323	V236-H240 HydrophobicContact CG1-CB 3.52Å; Q237-H240 PolarHBondContact O-N 3.01Å; N238-H240 PolarHBondContact O-N 3.11Å; H240-L242 PolarHBondContact O-N 2.81Å; H240-Q323 PolarHBondContact O-NE2 3.03Å
241	K	93.3	Very high	91.8	Very high	81 Å²	81	79.7 Å²	79.7	35%	0.352	44%	0.438	S	S	.	.			trans	-68.5	128.3	-179.1	-82.3	-175.4	171.9	178.8	0	111.1	V236 Q237 N238	V236-K241 HydrophobicContact CB-CG 4.44Å; V236-K241 HydrophobicContact CG1-CG 4.46Å; V236-K241 WeakPolarHBondContact O-CE 3.46Å; Q237-K241 PolarHBondContact O-N 3.48Å; N238-K241 PolarHBondContact O-N 3.31Å; N238-K241 WeakPolarHBondContact OD1-CE 3.46Å; N238-K241 PolarHBondContact OD1-NZ 2.8Å
242	L	94.8	Very high	91.8	Very high	14 Å²	14	80.3 Å²	80.3	7%	0.073	44%	0.443	C	S	.	.			trans	-83.2	160.1	169.9	-58	-177.6	0	0	0	109.7	H233 H240 Q323 I325 V330 E332	H233-L242 PolarHBondContact CE1-O 2.89Å; H240-L242 PolarHBondContact O-N 2.81Å; L242-Q323 HydrophobicContact CD1-CB 4.36Å; L242-Q323 HydrophobicContact CD1-CG 4.36Å; L242-Q323 HydrophobicContact CG-CG 4.39Å; L242-Q323 VanDerWaalsContact N-OE1 3.14Å; L242-I325 HydrophobicContact CB-CD1 4.47Å; L242-I325 WeakPolarHBondContact O-CD1 3.4Å; L242-V330 HydrophobicContact CB-CB 4.37Å; L242-V330 HydrophobicContact CB-CG1 3.9Å; L242-V330 HydrophobicContact CD1-CB 4.43Å; L242-V330 HydrophobicContact CD1-CG1 4.11Å; L242-V330 WeakPolarHBondContact CD1-O 3.24Å; L242-E332 HydrophobicContact CD1-CG 4.46Å; L242-E332 HydrophobicContact CD2-CB 4.06Å; L242-E332 HydrophobicContact CD2-CG 3.99Å; L242-E332 WeakPolarHBondContact CD2-OE2 3.28Å
243	A	93.8	Very high	91.7	Very high	63 Å²	63	81.5 Å²	81.5	52%	0.521	45%	0.449	S	S	.	.			trans	-126.4	142.9	178.5	0	0	0	0	0	110.8	K245 H263	A243-K245 PolarHBondContact O-N 2.86Å; A243-H263 PolarHBondContact O-CE1 3.18Å
244	V	95.3	Very high	91.5	Very high	71 Å²	71	87.7 Å²	87.7	43%	0.43	48%	0.478	S	S	.	.			trans	-76.6	116.9	171.1	-176.8	0	0	0	0	108.3	E265 I325 V330	V244-E265 WeakPolarHBondContact CA-OE1 3.26Å; V244-E265 WeakPolarHBondContact CG1-OE1 2.91Å; V244-I325 HydrophobicContact CG2-CB 4.07Å; V244-I325 HydrophobicContact CG2-CD1 4.05Å; V244-I325 HydrophobicContact CG2-CG2 4.17Å; V244-V330 HydrophobicContact CG2-CG2 3.76Å
245	K	94.3	Very high	91.3	Very high	104 Å²	104	82.8 Å²	82.8	45%	0.452	45%	0.452	S	S	.	.			trans	-84	-18.5	171.6	-61	177.9	-170.9	158.6	0	112.2	A243 H263 E265 E332	A243-K245 PolarHBondContact O-N 2.86Å; K245-H263 PolarHBondContact NZ-ND1 3.05Å; K245-H263 VanDerWaalsContact NZ-ND1 3.14Å; K245-E265 WeakPolarHBondContact CA-OE1 3.02Å; K245-E265 PolarHBondContact N-OE1 2.79Å; K245-E332 IonicContact NZ-OE1 3.5Å; K245-E332 PolarHBondContact NZ-OE1 2.81Å
246	G	92.8	Very high	91	Very high	57 Å²	57	85.2 Å²	85.2	59%	0.588	46%	0.463	S	S	*	.	S	Bend	trans	83.3	27.6	175.9	0	0	0	0	0	113.7	E265	G246-E265 VanDerWaalsContact CA-OE2 3.25Å; G246-E265 WeakPolarHBondContact CA-OE2 3.24Å; G246-E265 PolarHBondContact N-OE1 3.44Å; G246-E265 PolarHBondContact N-OE2 3.42Å
247	V	91.9	Very high	90.6	Very high	75 Å²	75	91.6 Å²	91.6	46%	0.455	50%	0.497	S	S	.	.			trans	-117.1	98.2	179.5	-177.8	0	0	0	0	108.4	E265	V247-E265 PolarHBondContact N-OE2 2.75Å
248	H	92.1	Very high	90.3	Very high	138 Å²	138	88.2 Å²	88.2	64%	0.639	50%	0.501	S	S	*	.	S	Bend	trans	-62.5	138.2	176.8	-68.8	-62.7	0	0	0	112.1	S267	H248-S267 PolarHBondContact CE1-OG 2.8Å
249	G	94.3	Very high	90.4	Very high	18 Å²	18	83.3 Å²	83.3	19%	0.186	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.3	-148.6	-173	0	0	0	0	0	110.6	V264 E265	G249-V264 CarbonylContact O-C 3.44Å; G249-V264 VanDerWaalsContact O-CA 3.28Å; G249-V264 WeakPolarHBondContact O-CA 3.21Å; G249-V264 VanDerWaalsContact O-CG1 3.31Å; G249-V264 WeakPolarHBondContact O-CG1 3.43Å; G249-E265 PolarHBondContact N-O 3.33Å; G249-E265 PolarHBondContact O-N 2.98Å
250	Y	94.9	Very high	90.6	Very high	102 Å²	102	83.2 Å²	83.2	40%	0.4	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	153.3	179.6	79.9	-87.2	0	0	0	112.5	I252 L262 H263 Y309 E310 I311	Y250-I252 HydrophobicContact CD2-CD1 4.24Å; Y250-I252 HydrophobicContact CE2-CD1 4.44Å; Y250-I252 HydrophobicContact CE2-CG1 4.46Å; Y250-L262 HydrophobicContact CD2-CD1 3.76Å; Y250-L262 HydrophobicContact CG-CD1 4.14Å; Y250-H263 CarbonylContact C-O 3.48Å; Y250-H263 VanDerWaalsContact CA-O 3.25Å; Y250-H263 WeakPolarHBondContact CA-O 3.06Å; Y250-Y309 AromaticContact CD1-CD1 3.92Å; Y250-Y309 HydrophobicContact CD1-CD1 3.92Å; Y250-Y309 HydrophobicContact CD1-CG 4.28Å; Y250-E310 VanDerWaalsContact CE1-O 3.29Å; Y250-E310 WeakPolarHBondContact CE1-O 3.4Å; Y250-E310 VanDerWaalsContact CZ-O 3.23Å; Y250-E310 PolarHBondContact OH-O 3.37Å; Y250-I311 HydrophobicContact CD2-CG2 4.5Å
251	S	95.1	Very high	90.9	Very high	31 Å²	31	79.9 Å²	79.9	22%	0.217	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153.6	171.3	59.6	0	0	0	0	109.7	H263	S251-H263 PolarHBondContact N-O 2.87Å; S251-H263 PolarHBondContact O-N 3.03Å
252	I	93.8	Very high	91	Very high	58 Å²	58	76.1 Å²	76.1	30%	0.297	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129	174.1	-56.7	-53.3	0	0	0	108	Y250 R260 D261 L262 P312 L335	Y250-I252 HydrophobicContact CD2-CD1 4.24Å; Y250-I252 HydrophobicContact CE2-CD1 4.44Å; Y250-I252 HydrophobicContact CE2-CG1 4.46Å; I252-R260 HydrophobicContact CG2-CB 3.73Å; I252-R260 HydrophobicContact CG2-CG 4.16Å; I252-D261 WeakPolarHBondContact CA-O 3.38Å; I252-L262 HydrophobicContact CD1-CB 4.29Å; I252-L262 HydrophobicContact CD1-CD1 3.66Å; I252-P312 HydrophobicContact CD1-CG 4.24Å; I252-P312 HydrophobicContact CG1-CG 4.16Å; I252-L335 HydrophobicContact CD1-CD1 3.88Å; I252-L335 HydrophobicContact CG2-CD1 4.24Å
253	V	92.1	Very high	91.1	Very high	61 Å²	61	75.5 Å²	75.5	37%	0.37	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.9	-178.3	-173.7	0	0	0	0	109	R260 D261	V253-R260 CarbonylContact O-C 3.52Å; V253-R260 WeakPolarHBondContact O-CA 3.33Å; V253-D261 PolarHBondContact N-O 3.43Å; V253-D261 PolarHBondContact O-N 2.95Å
254	E	90.5	Very high	91.2	Very high	170 Å²	170	72.6 Å²	72.6	79%	0.794	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	131.8	172.2	-67.1	-179.6	179.7	0	0	110.1	G259	E254-G259 WeakPolarHBondContact CA-O 3.44Å
255	N	84.7	Confident	91.3	Very high	38 Å²	38	69.3 Å²	69.3	20%	0.203	38%	0.384	C	S	.	.			trans	-95.4	162.9	179.6	71.9	35.3	0	0	0	111.8	N257 G258 G259 D261	N255-N257 PolarHBondContact O-N 2.99Å; N255-N257 WeakPolarHBondContact OD1-CA 3.41Å; N255-N257 WeakPolarHBondContact OD1-CB 3.35Å; N255-N257 PolarHBondContact OD1-N 2.84Å; N255-N257 VanDerWaalsContact OD1-N 3.09Å; N255-G258 PolarHBondContact O-N 2.8Å; N255-G258 PolarHBondContact OD1-N 3.32Å; N255-G259 VanDerWaalsContact CG-C 3.44Å; N255-G259 PolarHBondContact N-O 3.36Å; N255-G259 VanDerWaalsContact OD1-CA 3.27Å; N255-G259 WeakPolarHBondContact OD1-CA 3.48Å; N255-G259 PolarHBondContact OD1-N 2.75Å; N255-G259 PolarHBondContact OD1-O 3.37Å; N255-D261 WeakPolarHBondContact CB-OD2 3.35Å; N255-D261 PolarHBondContact ND2-OD1 2.87Å
256	E	81.4	Confident	91.5	Very high	202 Å²	202	65.1 Å²	65.1	94%	0.944	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.2	-177	-61.3	-176.8	167.9	0	0	113.4	G258	E256-G258 VanDerWaalsContact C-N 3.28Å; E256-G258 PolarHBondContact O-N 3.12Å
257	N	79.9	Confident	91.6	Very high	152 Å²	152	66 Å²	66	81%	0.813	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	6.5	178.9	-62.2	-31.5	0	0	0	113	N255 G259	N255-N257 PolarHBondContact O-N 2.99Å; N255-N257 WeakPolarHBondContact OD1-CA 3.41Å; N255-N257 WeakPolarHBondContact OD1-CB 3.35Å; N255-N257 PolarHBondContact OD1-N 2.84Å; N255-N257 VanDerWaalsContact OD1-N 3.09Å; N257-G259 PolarHBondContact O-N 2.93Å
258	G	81	Confident	91.9	Very high	74 Å²	74	63.1 Å²	63.1	76%	0.763	35%	0.345	S	S	*	.	S	Bend	trans	74.4	9.9	-176	0	0	0	0	0	114.5	N255 E256	N255-G258 PolarHBondContact O-N 2.8Å; N255-G258 PolarHBondContact OD1-N 3.32Å; E256-G258 VanDerWaalsContact C-N 3.28Å; E256-G258 PolarHBondContact O-N 3.12Å
259	G	86.6	Confident	92	Very high	29 Å²	29	60.7 Å²	60.7	30%	0.299	34%	0.337	S	S	.	.			trans	-89.6	-173.4	169.9	0	0	0	0	0	112.1	E254 N255 N257	E254-G259 WeakPolarHBondContact CA-O 3.44Å; N255-G259 VanDerWaalsContact CG-C 3.44Å; N255-G259 PolarHBondContact N-O 3.36Å; N255-G259 VanDerWaalsContact OD1-CA 3.27Å; N255-G259 WeakPolarHBondContact OD1-CA 3.48Å; N255-G259 PolarHBondContact OD1-N 2.75Å; N255-G259 PolarHBondContact OD1-O 3.37Å; N257-G259 PolarHBondContact O-N 2.93Å
260	R	92.3	Very high	92	Very high	89 Å²	89	64.3 Å²	64.3	34%	0.336	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.9	179	-63.6	-168	-54.9	-146.6	5.3	110.8	I252 V253 E313 L335	I252-R260 HydrophobicContact CG2-CB 3.73Å; I252-R260 HydrophobicContact CG2-CG 4.16Å; V253-R260 CarbonylContact O-C 3.52Å; V253-R260 WeakPolarHBondContact O-CA 3.33Å; R260-E313 IonicContact CZ-OE1 3.51Å; R260-E313 IonicContact CZ-OE2 3.62Å; R260-E313 IonicContact NE-OE2 3.81Å; R260-E313 IonicContact NH2-OE1 2.79Å; R260-E313 PolarHBondContact NH2-OE1 2.79Å; R260-E313 IonicContact NH2-OE2 3.19Å; R260-E313 PolarHBondContact NH2-OE2 2.8Å; R260-L335 HydrophobicContact CB-CD1 3.99Å; R260-L335 WeakPolarHBondContact O-CB 3.43Å; R260-L335 PolarHBondContact O-N 3.26Å
261	D	93.8	Very high	92	Very high	51 Å²	51	62.7 Å²	62.7	27%	0.273	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.4	178.8	-64.9	-8.4	0	0	0	109.7	I252 V253 N255 A333 P334	I252-D261 WeakPolarHBondContact CA-O 3.38Å; V253-D261 PolarHBondContact N-O 3.43Å; V253-D261 PolarHBondContact O-N 2.95Å; N255-D261 WeakPolarHBondContact CB-OD2 3.35Å; N255-D261 PolarHBondContact ND2-OD1 2.87Å; D261-A333 WeakPolarHBondContact CA-O 3.47Å; D261-P334 WeakPolarHBondContact OD1-CA 3.5Å
262	L	95.4	Very high	92	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	131.6	168.8	177.3	68.1	0	0	0	108.8	Y250 I252 V264 I286 I311 L315 L331 E332 A333 L335	Y250-L262 HydrophobicContact CD2-CD1 3.76Å; Y250-L262 HydrophobicContact CG-CD1 4.14Å; I252-L262 HydrophobicContact CD1-CB 4.29Å; I252-L262 HydrophobicContact CD1-CD1 3.66Å; L262-V264 HydrophobicContact CD1-CG2 4.03Å; L262-V264 HydrophobicContact CD2-CG2 4.07Å; L262-V264 HydrophobicContact CG-CG2 3.9Å; L262-I286 HydrophobicContact CD2-CG1 3.78Å; L262-I311 HydrophobicContact CD1-CG2 3.8Å; L262-I311 HydrophobicContact CD2-CD1 4.3Å; L262-I311 HydrophobicContact CD2-CG2 3.97Å; L262-L315 HydrophobicContact CB-CD2 4.43Å; L262-L315 HydrophobicContact CD2-CD2 3.57Å; L262-L331 HydrophobicContact CD2-CD1 4.19Å; L262-L331 HydrophobicContact CG-CD1 4.48Å; L262-E332 VanDerWaalsContact O-CA 3.25Å; L262-E332 WeakPolarHBondContact O-CA 3.43Å; L262-A333 PolarHBondContact N-O 2.91Å; L262-A333 PolarHBondContact O-N 2.86Å; L262-L335 HydrophobicContact CB-CD2 4.15Å
263	H	96.4	Very high	92.1	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.009	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	128.3	168.8	178.8	91.5	0	0	0	109.2	A243 K245 Y250 S251 E265 L331 E332	A243-H263 PolarHBondContact O-CE1 3.18Å; K245-H263 PolarHBondContact NZ-ND1 3.05Å; K245-H263 VanDerWaalsContact NZ-ND1 3.14Å; Y250-H263 CarbonylContact C-O 3.48Å; Y250-H263 VanDerWaalsContact CA-O 3.25Å; Y250-H263 WeakPolarHBondContact CA-O 3.06Å; S251-H263 PolarHBondContact N-O 2.87Å; S251-H263 PolarHBondContact O-N 3.03Å; H263-E265 WeakPolarHBondContact NE2-CG 3.29Å; H263-E265 IonicContact NE2-OE1 3.75Å; H263-E265 PolarHBondContact NE2-OE1 3.35Å; H263-E265 VanDerWaalsContact NE2-OE1 3.16Å; H263-L331 WeakPolarHBondContact CA-O 3.48Å; H263-E332 HydrophobicContact CB-CG 4.37Å; H263-E332 IonicContact CE1-OE1 3.81Å; H263-E332 IonicContact CG-OE1 3.6Å; H263-E332 WeakPolarHBondContact ND1-CG 3.49Å; H263-E332 IonicContact ND1-OE1 3.55Å; H263-E332 PolarHBondContact ND1-OE1 2.83Å
264	V	97.4	Very high	92.2	Very high	1 Å²	1	63 Å²	63	1%	0.006	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.1	178.3	-168.9	0	0	0	0	110.7	G249 L262 Y309 V330 L331	G249-V264 CarbonylContact O-C 3.44Å; G249-V264 VanDerWaalsContact O-CA 3.28Å; G249-V264 WeakPolarHBondContact O-CA 3.21Å; G249-V264 VanDerWaalsContact O-CG1 3.31Å; G249-V264 WeakPolarHBondContact O-CG1 3.43Å; L262-V264 HydrophobicContact CD1-CG2 4.03Å; L262-V264 HydrophobicContact CD2-CG2 4.07Å; L262-V264 HydrophobicContact CG-CG2 3.9Å; V264-Y309 HydrophobicContact CG1-CD2 3.76Å; V264-Y309 HydrophobicContact CG1-CE1 4.39Å; V264-Y309 HydrophobicContact CG1-CE2 3.33Å; V264-Y309 HydrophobicContact CG1-CG 4.43Å; V264-V330 WeakPolarHBondContact O-CA 3.44Å; V264-L331 HydrophobicContact CB-CD1 3.87Å; V264-L331 HydrophobicContact CB-CD2 3.75Å; V264-L331 HydrophobicContact CB-CG 3.59Å; V264-L331 HydrophobicContact CG1-CD2 4.32Å; V264-L331 HydrophobicContact CG2-CD1 3.44Å; V264-L331 VanDerWaalsContact CG2-CD1 3.44Å; V264-L331 HydrophobicContact CG2-CD2 3.98Å; V264-L331 HydrophobicContact CG2-CG 3.78Å; V264-L331 PolarHBondContact N-O 2.85Å; V264-L331 PolarHBondContact O-N 2.64Å
265	E	97.6	Very high	92.3	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.009	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.9	170.3	-57.8	-175.2	171.5	0	0	111.1	V244 K245 G246 V247 G249 H263 T328 L329 V330	V244-E265 WeakPolarHBondContact CA-OE1 3.26Å; V244-E265 WeakPolarHBondContact CG1-OE1 2.91Å; K245-E265 WeakPolarHBondContact CA-OE1 3.02Å; K245-E265 PolarHBondContact N-OE1 2.79Å; G246-E265 VanDerWaalsContact CA-OE2 3.25Å; G246-E265 WeakPolarHBondContact CA-OE2 3.24Å; G246-E265 PolarHBondContact N-OE1 3.44Å; G246-E265 PolarHBondContact N-OE2 3.42Å; V247-E265 PolarHBondContact N-OE2 2.75Å; G249-E265 PolarHBondContact N-O 3.33Å; G249-E265 PolarHBondContact O-N 2.98Å; H263-E265 WeakPolarHBondContact NE2-CG 3.29Å; H263-E265 IonicContact NE2-OE1 3.75Å; H263-E265 PolarHBondContact NE2-OE1 3.35Å; H263-E265 VanDerWaalsContact NE2-OE1 3.16Å; E265-T328 HydrophobicContact CB-CG2 4.16Å; E265-L329 CarbonylContact C-O 3.56Å; E265-L329 VanDerWaalsContact CA-O 3.32Å; E265-L329 WeakPolarHBondContact CA-O 3.45Å; E265-V330 HydrophobicContact CG-CG2 4.49Å
266	M	96.9	Very high	92.8	Very high	17 Å²	17	60.1 Å²	60.1	8%	0.084	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	121.7	177.3	178.4	-176.1	-64.4	0	0	110.3	L268 V288 F305 H307 Y309 T328 L329	M266-L268 HydrophobicContact CG-CD2 4.49Å; M266-L268 PolarHBondContact O-N 3.45Å; M266-L268 HydrophobicContact SD-CD2 4.35Å; M266-V288 HydrophobicContact CE-CB 3.87Å; M266-V288 HydrophobicContact CE-CG1 4.18Å; M266-V288 HydrophobicContact CE-CG2 3.98Å; M266-V288 HydrophobicContact SD-CB 4.23Å; M266-V288 HydrophobicContact SD-CG1 3.88Å; M266-F305 HydrophobicContact SD-CE2 3.98Å; M266-F305 HydrophobicContact SD-CZ 4.49Å; M266-H307 HydrophobicContact CE-CB 3.63Å; M266-H307 VanDerWaalsContact CE-CD2 3.45Å; M266-H307 WeakPolarHBondContact CE-CD2 3.44Å; M266-H307 HydrophobicContact SD-CB 4.49Å; M266-Y309 HydrophobicContact CE-CE2 3.52Å; M266-Y309 WeakPolarHBondContact CE-OH 3.39Å; M266-T328 CarbonylContact O-C 3.51Å; M266-T328 WeakPolarHBondContact O-CA 3.32Å; M266-L329 HydrophobicContact CB-CB 4.33Å; M266-L329 PolarHBondContact N-O 3.02Å; M266-L329 PolarHBondContact O-N 3.14Å
267	S	96.6	Very high	93.5	Very high	74 Å²	74	50.7 Å²	50.7	52%	0.517	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	130	169.1	-59.6	0	0	0	0	110.1	H248	H248-S267 PolarHBondContact CE1-OG 2.8Å
268	L	96.2	Very high	94.3	Very high	15 Å²	15	44.1 Å²	44.1	8%	0.079	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-101.8	146.3	179.7	-60.8	173	0	0	0	110.1	M266 L277 F305 V324 Q327 L329	M266-L268 HydrophobicContact CG-CD2 4.49Å; M266-L268 PolarHBondContact O-N 3.45Å; M266-L268 HydrophobicContact SD-CD2 4.35Å; L268-L277 HydrophobicContact CD1-CD1 3.58Å; L268-L277 HydrophobicContact CD2-CD1 4.35Å; L268-L277 HydrophobicContact CD2-CD2 4.12Å; L268-F305 HydrophobicContact CD2-CZ 4.01Å; L268-V324 HydrophobicContact CD1-CG1 4.06Å; L268-V324 HydrophobicContact CD1-CG2 4.01Å; L268-Q327 WeakPolarHBondContact CB-O 3.35Å; L268-Q327 PolarHBondContact N-O 3.46Å; L268-L329 HydrophobicContact CD1-CB 4.04Å; L268-L329 HydrophobicContact CD2-CB 4.25Å; L268-L329 HydrophobicContact CG-CB 4.16Å
269	D	95.6	Very high	95.1	Very high	87 Å²	87	40.7 Å²	40.7	47%	0.465	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-64	133.4	162.6	-172.6	-51	0	0	0	108.7	I271 Y272	D269-I271 HydrophobicContact CB-CG1 4.17Å; D269-I271 PolarHBondContact O-N 3.01Å; D269-I271 WeakPolarHBondContact OD1-CG1 3.24Å; D269-I271 WeakPolarHBondContact OD1-CG2 3.29Å; D269-I271 PolarHBondContact OD1-N 3.18Å; D269-Y272 HydrophobicContact CB-CD2 3.89Å; D269-Y272 HydrophobicContact CB-CE2 4.06Å; D269-Y272 PolarHBondContact O-N 2.93Å
270	P	94.6	Very high	95.5	Very high	94 Å²	94	39.8 Å²	39.8	61%	0.61	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-18.4	-179.6	-28.2	34.7	0	0	0	116.1	Y272	P270-Y272 VanDerWaalsContact C-N 3.26Å; P270-Y272 PolarHBondContact O-N 2.72Å
271	I	94.1	Very high	95.5	Very high	68 Å²	68	35.8 Å²	35.8	35%	0.349	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-26.6	174.7	69.2	-176.3	0	0	0	113	D269 H292 T303	D269-I271 HydrophobicContact CB-CG1 4.17Å; D269-I271 PolarHBondContact O-N 3.01Å; D269-I271 WeakPolarHBondContact OD1-CG1 3.24Å; D269-I271 WeakPolarHBondContact OD1-CG2 3.29Å; D269-I271 PolarHBondContact OD1-N 3.18Å; I271-H292 PolarHBondContact O-ND1 3.02Å; I271-T303 HydrophobicContact CD1-CG2 4.45Å; I271-T303 WeakPolarHBondContact CD1-OG1 3.43Å
272	Y	96.1	Very high	95.3	Very high	25 Å²	25	35.9 Å²	35.9	10%	0.098	19%	0.194	C	C	.	.			trans	-90	119.4	-176.8	-63.3	-74.9	0	0	0	111.5	D269 P270 D276 H292 T303 F305	D269-Y272 HydrophobicContact CB-CD2 3.89Å; D269-Y272 HydrophobicContact CB-CE2 4.06Å; D269-Y272 PolarHBondContact O-N 2.93Å; P270-Y272 VanDerWaalsContact C-N 3.26Å; P270-Y272 PolarHBondContact O-N 2.72Å; Y272-D276 HydrophobicContact CD1-CB 4.18Å; Y272-H292 HydrophobicContact CD1-CB 3.93Å; Y272-H292 HydrophobicContact CE1-CB 3.86Å; Y272-T303 WeakPolarHBondContact OH-CB 3.27Å; Y272-T303 PolarHBondContact OH-OG1 2.96Å; Y272-F305 HydrophobicContact CD1-CD1 4.33Å; Y272-F305 HydrophobicContact CD1-CE1 4.01Å; Y272-F305 HydrophobicContact CD2-CD1 4.05Å; Y272-F305 AromaticContact CD2-CE1 3.74Å; Y272-F305 HydrophobicContact CD2-CE1 3.74Å; Y272-F305 AromaticContact CE1-CD1 3.89Å; Y272-F305 HydrophobicContact CE1-CD1 3.89Å; Y272-F305 HydrophobicContact CE1-CE1 4.05Å; Y272-F305 AromaticContact CE2-CD1 3.59Å; Y272-F305 HydrophobicContact CE2-CD1 3.59Å; Y272-F305 AromaticContact CE2-CE1 3.79Å; Y272-F305 HydrophobicContact CE2-CE1 3.79Å; Y272-F305 HydrophobicContact CG-CD1 4.41Å; Y272-F305 AromaticContact CG-CE1 3.87Å; Y272-F305 HydrophobicContact CG-CE1 3.87Å; Y272-F305 AromaticContact CZ-CD1 3.51Å; Y272-F305 AromaticContact CZ-CE1 3.96Å
273	K	94.5	Very high	94.7	Very high	108 Å²	108	37.2 Å²	37.2	47%	0.47	20%	0.204	S	C	.	.			trans	-94.5	166.2	173.2	-65.1	176.9	-176.1	175.3	0	111.2	E275 D276 L277	K273-E275 HydrophobicContact CB-CG 3.97Å; K273-E275 HydrophobicContact CD-CG 4.48Å; K273-E275 WeakPolarHBondContact CD-OE1 3.34Å; K273-E275 IonicContact NZ-OE1 3.57Å; K273-E275 PolarHBondContact O-N 3.22Å; K273-E275 VanDerWaalsContact O-N 3.17Å; K273-D276 PolarHBondContact N-OD2 2.92Å; K273-D276 WeakPolarHBondContact O-CB 3.45Å; K273-D276 PolarHBondContact O-N 3.32Å; K273-L277 WeakPolarHBondContact O-CG 3.19Å
274	P	95.3	Very high	94.2	Very high	25 Å²	25	39.5 Å²	39.5	16%	0.162	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-52.6	-37.2	174.5	-24.9	33.4	0	0	0	113.6	R229 P230 D276 L277 V324	R229-P274 VanDerWaalsContact CG-O 3.29Å; R229-P274 WeakPolarHBondContact CG-O 3.37Å; P230-P274 WeakPolarHBondContact O-CB 3.01Å; P274-D276 VanDerWaalsContact C-N 3.25Å; P274-D276 PolarHBondContact O-N 3.35Å; P274-L277 PolarHBondContact O-N 3.29Å; P274-V324 HydrophobicContact CB-CG2 4.29Å; P274-V324 HydrophobicContact CG-CB 4.01Å; P274-V324 HydrophobicContact CG-CG2 3.91Å
275	E	92.6	Very high	94	Very high	116 Å²	116	43.9 Å²	43.9	54%	0.542	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-63.5	-26.6	176.3	61	-119.6	-155.1	0	0	114.6	K273 L277	K273-E275 HydrophobicContact CB-CG 3.97Å; K273-E275 HydrophobicContact CD-CG 4.48Å; K273-E275 WeakPolarHBondContact CD-OE1 3.34Å; K273-E275 IonicContact NZ-OE1 3.57Å; K273-E275 PolarHBondContact O-N 3.22Å; K273-E275 VanDerWaalsContact O-N 3.17Å; E275-L277 VanDerWaalsContact C-N 3.33Å
276	D	94.7	Very high	93.9	Very high	31 Å²	31	43.8 Å²	43.8	17%	0.166	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-82.8	-11.5	-179.4	-59.1	-41.4	0	0	0	112.3	Y272 K273 P274 G290 C291 H292	Y272-D276 HydrophobicContact CD1-CB 4.18Å; K273-D276 PolarHBondContact N-OD2 2.92Å; K273-D276 WeakPolarHBondContact O-CB 3.45Å; K273-D276 PolarHBondContact O-N 3.32Å; P274-D276 VanDerWaalsContact C-N 3.25Å; P274-D276 PolarHBondContact O-N 3.35Å; D276-G290 CarbonylContact O-C 3.57Å; D276-G290 VanDerWaalsContact O-CA 3.24Å; D276-G290 WeakPolarHBondContact O-CA 3.44Å; D276-C291 WeakPolarHBondContact CB-O 3.26Å; D276-C291 PolarHBondContact O-N 3.21Å; D276-H292 IonicContact OD1-ND1 3.58Å; D276-H292 IonicContact OD2-CE1 3.97Å; D276-H292 IonicContact OD2-CG 3.84Å; D276-H292 IonicContact OD2-ND1 2.99Å; D276-H292 PolarHBondContact OD2-ND1 3.23Å
277	L	96.7	Very high	93.8	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	148.5	-171.5	-61	173.8	0	0	0	113	P230 L268 K273 P274 E275 S289 F305 V324 L329	P230-L277 HydrophobicContact CG-CB 3.94Å; P230-L277 HydrophobicContact CG-CD1 4.07Å; L268-L277 HydrophobicContact CD1-CD1 3.58Å; L268-L277 HydrophobicContact CD2-CD1 4.35Å; L268-L277 HydrophobicContact CD2-CD2 4.12Å; K273-L277 WeakPolarHBondContact O-CG 3.19Å; P274-L277 PolarHBondContact O-N 3.29Å; E275-L277 VanDerWaalsContact C-N 3.33Å; L277-S289 CarbonylContact C-O 3.56Å; L277-S289 WeakPolarHBondContact CA-O 3.45Å; L277-F305 HydrophobicContact CD2-CE1 4.03Å; L277-F305 HydrophobicContact CD2-CZ 3.83Å; L277-V324 HydrophobicContact CD1-CG2 3.77Å; L277-L329 HydrophobicContact CD1-CD1 4.48Å
278	C	95.9	Very high	93.8	Very high	14 Å²	14	41.4 Å²	41.4	10%	0.095	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	119.4	178.9	176.1	0	0	0	0	110	T219 A227 S289	T219-C278 HydrophobicContact CG2-CB 4.36Å; A227-C278 WeakPolarHBondContact CB-SG 3.16Å; C278-S289 WeakPolarHBondContact CB-OG 3.41Å; C278-S289 PolarHBondContact N-O 3Å; C278-S289 PolarHBondContact O-N 3.26Å; C278-S289 PolarHBondContact O-OG 2.91Å
279	I	97.2	Very high	93.9	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.9	178.2	-58.8	165	0	0	0	108.7	A227 I228 P230 I286 M287 V288 V320 A322 L329 L331	A227-I279 CarbonylContact C-O 3.53Å; A227-I279 VanDerWaalsContact CA-O 3.23Å; A227-I279 WeakPolarHBondContact CA-O 3.45Å; A227-I279 VanDerWaalsContact CB-O 3.26Å; A227-I279 WeakPolarHBondContact CB-O 3.46Å; I228-I279 HydrophobicContact CB-CB 4.4Å; I228-I279 PolarHBondContact N-O 3.05Å; I228-I279 PolarHBondContact O-N 3.44Å; P230-I279 HydrophobicContact CG-CD1 3.75Å; P230-I279 HydrophobicContact CG-CG1 4.36Å; I279-I286 HydrophobicContact CG2-CD1 4.31Å; I279-I286 HydrophobicContact CG2-CG2 4.3Å; I279-M287 CarbonylContact C-O 3.6Å; I279-M287 VanDerWaalsContact CA-O 3.29Å; I279-M287 WeakPolarHBondContact CA-O 3.31Å; I279-V288 HydrophobicContact CG1-CG2 4.43Å; I279-V320 HydrophobicContact CG2-CG1 4.28Å; I279-A322 HydrophobicContact CD1-CB 3.27Å; I279-L329 HydrophobicContact CD1-CD1 4.16Å; I279-L329 HydrophobicContact CD1-CD2 4.17Å; I279-L329 HydrophobicContact CG1-CD2 4.41Å; I279-L331 HydrophobicContact CD1-CD2 4.29Å
280	S	95.1	Very high	93.9	Very high	10 Å²	10	37.5 Å²	37.5	7%	0.07	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151.4	175.1	61.9	0	0	0	0	111.2	N221 M287	N221-S280 PolarHBondContact ND2-OG 3.19Å; S280-M287 PolarHBondContact N-O 3.34Å; S280-M287 WeakPolarHBondContact O-CB 3.45Å; S280-M287 PolarHBondContact O-N 3.38Å
281	V	92.7	Very high	93.9	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.03	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	135.8	171.1	-177.4	0	0	0	0	108.7	K124 I286 L315 P317 V320	K124-V281 WeakPolarHBondContact CB-O 3.31Å; V281-I286 HydrophobicContact CG2-CD1 3.7Å; V281-L315 HydrophobicContact CG2-CD1 3.4Å; V281-L315 HydrophobicContact CG2-CG 4.14Å; V281-P317 HydrophobicContact CB-CB 4.38Å; V281-P317 HydrophobicContact CB-CG 4.01Å; V281-P317 HydrophobicContact CG2-CB 4Å; V281-P317 HydrophobicContact CG2-CG 4.05Å; V281-V320 HydrophobicContact CG2-CG2 4.46Å
282	D	88.7	Confident	93.8	Very high	54 Å²	54	33.4 Å²	33.4	29%	0.289	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	177.4	165.8	-170.1	19.7	0	0	0	108.7	K124 N284 R285 M287	K124-D282 WeakPolarHBondContact CD-OD1 3.28Å; K124-D282 IonicContact NZ-OD1 2.67Å; K124-D282 PolarHBondContact NZ-OD1 3.45Å; D282-N284 PolarHBondContact O-N 2.92Å; D282-R285 HydrophobicContact CB-CB 4.34Å; D282-R285 PolarHBondContact N-O 3.11Å; D282-R285 PolarHBondContact O-N 2.93Å; D282-R285 VanDerWaalsContact O-O 3.05Å; D282-M287 HydrophobicContact CB-CG 4.15Å
283	S	83.2	Confident	93.5	Very high	29 Å²	29	39 Å²	39	20%	0.203	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-40.6	98.2	175.7	-68.3	0	0	0	0	114	D121 K124 R285	D121-S283 WeakPolarHBondContact OD1-CB 3.21Å; D121-S283 PolarHBondContact OD1-OG 2.72Å; D121-S283 PolarHBondContact OD2-OG 3.32Å; K124-S283 PolarHBondContact NZ-OG 3.32Å; S283-R285 PolarHBondContact O-N 2.78Å; S283-R285 VanDerWaalsContact O-N 3.11Å
284	N	87.5	Confident	92.9	Very high	49 Å²	49	38 Å²	38	26%	0.262	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	34.2	-174.3	-64.2	-21.9	0	0	0	113.5	S120 D282 I311 T314	S120-N284 VanDerWaalsContact CB-OD1 3.25Å; S120-N284 WeakPolarHBondContact CB-OD1 3.35Å; S120-N284 PolarHBondContact OG-ND2 3.03Å; S120-N284 VanDerWaalsContact OG-ND2 3.07Å; S120-N284 PolarHBondContact OG-OD1 2.81Å; D282-N284 PolarHBondContact O-N 2.92Å; N284-I311 VanDerWaalsContact O-CG1 3.26Å; N284-I311 WeakPolarHBondContact O-CG1 3.08Å; N284-I311 PolarHBondContact O-N 3.3Å; N284-T314 PolarHBondContact OD1-N 2.94Å
285	R	92.5	Very high	92.1	Very high	93 Å²	93	45.1 Å²	45.1	35%	0.351	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	140.9	-178.8	-72	177.5	179.9	-159.6	1.6	111.7	D282 S283 M287 Y309 E310	D282-R285 HydrophobicContact CB-CB 4.34Å; D282-R285 PolarHBondContact N-O 3.11Å; D282-R285 PolarHBondContact O-N 2.93Å; D282-R285 VanDerWaalsContact O-O 3.05Å; S283-R285 PolarHBondContact O-N 2.78Å; S283-R285 VanDerWaalsContact O-N 3.11Å; R285-M287 HydrophobicContact CB-SD 4.48Å; R285-Y309 CarbonylContact C-O 3.59Å; R285-Y309 WeakPolarHBondContact CA-O 3.47Å; R285-E310 HydrophobicContact CG-CG 4.12Å; R285-E310 IonicContact CZ-OE1 2.64Å; R285-E310 IonicContact NE-OE1 3.41Å; R285-E310 IonicContact NH2-OE1 3.19Å; R285-E310 PolarHBondContact NH2-OE1 2.88Å
286	I	94.8	Very high	90.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.1	162.4	-81.6	-74.2	0	0	0	108.6	L262 I279 V281 V288 S308 Y309 I311 L315 V320 L331	L262-I286 HydrophobicContact CD2-CG1 3.78Å; I279-I286 HydrophobicContact CG2-CD1 4.31Å; I279-I286 HydrophobicContact CG2-CG2 4.3Å; V281-I286 HydrophobicContact CG2-CD1 3.7Å; I286-V288 HydrophobicContact CG2-CG2 4.18Å; I286-S308 CarbonylContact O-C 3.52Å; I286-S308 VanDerWaalsContact O-CA 3.3Å; I286-S308 WeakPolarHBondContact O-CA 3.35Å; I286-Y309 HydrophobicContact CG2-CD2 4.42Å; I286-Y309 PolarHBondContact N-O 3.39Å; I286-Y309 PolarHBondContact O-N 2.84Å; I286-I311 HydrophobicContact CG1-CD1 4.21Å; I286-L315 HydrophobicContact CD1-CD1 4.3Å; I286-L315 HydrophobicContact CD1-CD2 4.13Å; I286-L315 HydrophobicContact CG1-CD2 4.1Å; I286-V320 HydrophobicContact CD1-CG2 4.41Å; I286-L331 HydrophobicContact CG2-CD2 4.16Å
287	M	95.7	Very high	89.3	Confident	41 Å²	41	47.7 Å²	47.7	20%	0.202	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.8	176.4	-56.6	-61.6	-62.5	0	0	108.8	I279 S280 D282 R285 T306 H307 S308	I279-M287 CarbonylContact C-O 3.6Å; I279-M287 VanDerWaalsContact CA-O 3.29Å; I279-M287 WeakPolarHBondContact CA-O 3.31Å; S280-M287 PolarHBondContact N-O 3.34Å; S280-M287 WeakPolarHBondContact O-CB 3.45Å; S280-M287 PolarHBondContact O-N 3.38Å; D282-M287 HydrophobicContact CB-CG 4.15Å; R285-M287 HydrophobicContact CB-SD 4.48Å; M287-T306 HydrophobicContact CE-CG2 3.52Å; M287-H307 CarbonylContact C-O 3.55Å; M287-H307 WeakPolarHBondContact CA-O 3.43Å; M287-S308 WeakPolarHBondContact SD-CB 3.17Å
288	V	97.1	Very high	87.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.2	170.4	-177	0	0	0	0	107.7	M266 I279 I286 F305 T306 H307 L329 L331	M266-V288 HydrophobicContact CE-CB 3.87Å; M266-V288 HydrophobicContact CE-CG1 4.18Å; M266-V288 HydrophobicContact CE-CG2 3.98Å; M266-V288 HydrophobicContact SD-CB 4.23Å; M266-V288 HydrophobicContact SD-CG1 3.88Å; I279-V288 HydrophobicContact CG1-CG2 4.43Å; I286-V288 HydrophobicContact CG2-CG2 4.18Å; V288-F305 HydrophobicContact CG1-CE2 4.13Å; V288-F305 HydrophobicContact CG1-CZ 4.38Å; V288-T306 CarbonylContact O-C 3.58Å; V288-T306 WeakPolarHBondContact O-CA 3.37Å; V288-H307 PolarHBondContact N-O 2.83Å; V288-H307 PolarHBondContact O-N 3.11Å; V288-L329 HydrophobicContact CB-CD2 4.44Å; V288-L329 HydrophobicContact CG1-CD2 3.46Å; V288-L329 VanDerWaalsContact CG1-CD2 3.46Å; V288-L329 HydrophobicContact CG2-CD2 4.08Å; V288-L331 HydrophobicContact CG2-CD2 4.44Å
289	S	96.8	Very high	86.1	Confident	19 Å²	19	60 Å²	60	13%	0.133	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.5	176	61.8	0	0	0	0	110.4	L277 C278 F305	L277-S289 CarbonylContact C-O 3.56Å; L277-S289 WeakPolarHBondContact CA-O 3.45Å; C278-S289 WeakPolarHBondContact CB-OG 3.41Å; C278-S289 PolarHBondContact N-O 3Å; C278-S289 PolarHBondContact O-N 3.26Å; C278-S289 PolarHBondContact O-OG 2.91Å; S289-F305 WeakPolarHBondContact CA-O 3.2Å
290	G	95.9	Very high	85	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	138.3	172.9	0	0	0	0	0	110.4	D276 K304 F305	D276-G290 CarbonylContact O-C 3.57Å; D276-G290 VanDerWaalsContact O-CA 3.24Å; D276-G290 WeakPolarHBondContact O-CA 3.44Å; G290-K304 CarbonylContact O-C 3.53Å; G290-K304 WeakPolarHBondContact O-CA 3.3Å; G290-K304 WeakPolarHBondContact O-CG 3.39Å; G290-F305 VanDerWaalsContact CA-CE1 3.48Å; G290-F305 PolarHBondContact N-O 2.78Å; G290-F305 VanDerWaalsContact N-O 3.15Å; G290-F305 PolarHBondContact O-N 2.92Å
291	C	94.4	Very high	84.7	Confident	33 Å²	33	66.3 Å²	66.3	22%	0.223	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	114.6	178.9	-175.4	0	0	0	0	110.1	D276 T303 K304	D276-C291 WeakPolarHBondContact CB-O 3.26Å; D276-C291 PolarHBondContact O-N 3.21Å; C291-T303 WeakPolarHBondContact CA-O 3.49Å; C291-K304 HydrophobicContact CB-CG 4.43Å
292	H	93.3	Very high	84.6	Confident	43 Å²	43	72.2 Å²	72.2	20%	0.199	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.2	-178.1	-176.2	77.9	0	0	0	110.5	I271 Y272 D276 Y302 T303	I271-H292 PolarHBondContact O-ND1 3.02Å; Y272-H292 HydrophobicContact CD1-CB 3.93Å; Y272-H292 HydrophobicContact CE1-CB 3.86Å; D276-H292 IonicContact OD1-ND1 3.58Å; D276-H292 IonicContact OD2-CE1 3.97Å; D276-H292 IonicContact OD2-CG 3.84Å; D276-H292 IonicContact OD2-ND1 2.99Å; D276-H292 PolarHBondContact OD2-ND1 3.23Å; H292-Y302 CarbonylContact O-C 3.48Å; H292-Y302 WeakPolarHBondContact O-CA 3.28Å; H292-Y302 WeakPolarHBondContact O-CB 3.47Å; H292-T303 PolarHBondContact N-O 3.2Å; H292-T303 PolarHBondContact O-N 2.89Å
293	Y	88.1	Confident	84.9	Confident	143 Å²	143	71.6 Å²	71.6	56%	0.561	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	124.1	177.3	-69.5	-91	0	0	0	110.4	Y302	Y293-Y302 HydrophobicContact CD1-CG 4.44Å; Y293-Y302 HydrophobicContact CE1-CD1 4.23Å; Y293-Y302 HydrophobicContact CE1-CG 4.25Å
294	M	83.8	Confident	85.4	Confident	87 Å²	87	74.3 Å²	74.3	43%	0.429	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.5	174.3	-64	-178.5	-71.6	0	0	109.4	G296 S301 T303	M294-G296 PolarHBondContact O-N 3.21Å; M294-S301 PolarHBondContact N-O 2.83Å; M294-T303 HydrophobicContact CE-CG2 3.99Å; M294-T303 HydrophobicContact SD-CG2 4.48Å
295	N	77.2	Confident	85.8	Confident	175 Å²	175	74.5 Å²	74.5	94%	0.936	39%	0.389	S	S	*	.			trans	-69.1	101.4	173.1	-73.1	-19.5	0	0	0	109.5
296	G	64.4	Low	86	Confident	42 Å²	42	74 Å²	74	43%	0.433	40%	0.396	S	S	.	.			trans	-124.7	142.7	172.2	0	0	0	0	0	111.2	M294 H298	M294-G296 PolarHBondContact O-N 3.21Å; G296-H298 VanDerWaalsContact C-N 3.28Å; G296-H298 PolarHBondContact O-N 2.77Å; G296-H298 VanDerWaalsContact O-N 3.1Å
297	D	65.3	Low	86.1	Confident	158 Å²	158	78 Å²	78	85%	0.845	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.9	-165.4	-81	-31.8	0	0	0	115.5
298	H	59.1	Low	86	Confident	192 Å²	192	78.5 Å²	78.5	89%	0.889	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.1	12	-173.1	-62.7	-46.8	0	0	0	116.2	G296	G296-H298 VanDerWaalsContact C-N 3.28Å; G296-H298 PolarHBondContact O-N 2.77Å; G296-H298 VanDerWaalsContact O-N 3.1Å
299	S	66.3	Low	85.9	Confident	84 Å²	84	79.7 Å²	79.7	59%	0.587	43%	0.427	S	S	*	.	S	Bend	trans	-160.5	126.7	172.1	178.1	0	0	0	0	108.4	S301	S299-S301 PolarHBondContact O-N 3.22Å
300	S	73.8	Confident	85.8	Confident	95 Å²	95	84.6 Å²	84.6	66%	0.664	45%	0.448	S	S	*	.			trans	-70.6	78.9	171	58	0	0	0	0	109.1
301	S	88.2	Confident	85.5	Confident	49 Å²	49	85 Å²	85	34%	0.343	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135	169.4	51.9	0	0	0	0	109	M294 S299	M294-S301 PolarHBondContact N-O 2.83Å; S299-S301 PolarHBondContact O-N 3.22Å
302	Y	90.7	Very high	85.2	Confident	130 Å²	130	86.7 Å²	86.7	51%	0.51	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.5	174.5	67.9	-87.4	0	0	0	109.9	H292 Y293 K304	H292-Y302 CarbonylContact O-C 3.48Å; H292-Y302 WeakPolarHBondContact O-CA 3.28Å; H292-Y302 WeakPolarHBondContact O-CB 3.47Å; Y293-Y302 HydrophobicContact CD1-CG 4.44Å; Y293-Y302 HydrophobicContact CE1-CD1 4.23Å; Y293-Y302 HydrophobicContact CE1-CG 4.25Å; Y302-K304 HydrophobicContact CD2-CB 4.17Å; Y302-K304 HydrophobicContact CE2-CB 4.06Å
303	T	94.2	Very high	84.9	Confident	40 Å²	40	85.7 Å²	85.7	25%	0.245	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.9	169.7	58.1	0	0	0	0	108.9	I271 Y272 C291 H292 M294	I271-T303 HydrophobicContact CD1-CG2 4.45Å; I271-T303 WeakPolarHBondContact CD1-OG1 3.43Å; Y272-T303 WeakPolarHBondContact OH-CB 3.27Å; Y272-T303 PolarHBondContact OH-OG1 2.96Å; C291-T303 WeakPolarHBondContact CA-O 3.49Å; H292-T303 PolarHBondContact N-O 3.2Å; H292-T303 PolarHBondContact O-N 2.89Å; M294-T303 HydrophobicContact CE-CG2 3.99Å; M294-T303 HydrophobicContact SD-CG2 4.48Å
304	K	95	Very high	85	Confident	87 Å²	87	79.5 Å²	79.5	38%	0.378	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	143.1	178.2	-177.3	171.1	-178.6	169.6	0	110.7	D222 G290 C291 Y302	D222-K304 IonicContact OD1-NZ 2.6Å; D222-K304 PolarHBondContact OD1-NZ 2.82Å; D222-K304 IonicContact OD2-NZ 3.16Å; D222-K304 PolarHBondContact OD2-NZ 3.5Å; G290-K304 CarbonylContact O-C 3.53Å; G290-K304 WeakPolarHBondContact O-CA 3.3Å; G290-K304 WeakPolarHBondContact O-CG 3.39Å; C291-K304 HydrophobicContact CB-CG 4.43Å; Y302-K304 HydrophobicContact CD2-CB 4.17Å; Y302-K304 HydrophobicContact CE2-CB 4.06Å
305	F	96.2	Very high	85.3	Confident	53 Å²	53	75.3 Å²	75.3	23%	0.232	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	160.3	166.3	76.6	-88	0	0	0	110.8	M266 L268 Y272 L277 V288 S289 G290	M266-F305 HydrophobicContact SD-CE2 3.98Å; M266-F305 HydrophobicContact SD-CZ 4.49Å; L268-F305 HydrophobicContact CD2-CZ 4.01Å; Y272-F305 HydrophobicContact CD1-CD1 4.33Å; Y272-F305 HydrophobicContact CD1-CE1 4.01Å; Y272-F305 HydrophobicContact CD2-CD1 4.05Å; Y272-F305 AromaticContact CD2-CE1 3.74Å; Y272-F305 HydrophobicContact CD2-CE1 3.74Å; Y272-F305 AromaticContact CE1-CD1 3.89Å; Y272-F305 HydrophobicContact CE1-CD1 3.89Å; Y272-F305 HydrophobicContact CE1-CE1 4.05Å; Y272-F305 AromaticContact CE2-CD1 3.59Å; Y272-F305 HydrophobicContact CE2-CD1 3.59Å; Y272-F305 AromaticContact CE2-CE1 3.79Å; Y272-F305 HydrophobicContact CE2-CE1 3.79Å; Y272-F305 HydrophobicContact CG-CD1 4.41Å; Y272-F305 AromaticContact CG-CE1 3.87Å; Y272-F305 HydrophobicContact CG-CE1 3.87Å; Y272-F305 AromaticContact CZ-CD1 3.51Å; Y272-F305 AromaticContact CZ-CE1 3.96Å; L277-F305 HydrophobicContact CD2-CE1 4.03Å; L277-F305 HydrophobicContact CD2-CZ 3.83Å; V288-F305 HydrophobicContact CG1-CE2 4.13Å; V288-F305 HydrophobicContact CG1-CZ 4.38Å; S289-F305 WeakPolarHBondContact CA-O 3.2Å; G290-F305 VanDerWaalsContact CA-CE1 3.48Å; G290-F305 PolarHBondContact N-O 2.78Å; G290-F305 VanDerWaalsContact N-O 3.15Å; G290-F305 PolarHBondContact O-N 2.92Å
306	T	96.2	Very high	86	Confident	81 Å²	81	67.4 Å²	67.4	50%	0.497	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	131.1	168.9	-58.9	0	0	0	0	107.8	M287 V288	M287-T306 HydrophobicContact CE-CG2 3.52Å; V288-T306 CarbonylContact O-C 3.58Å; V288-T306 WeakPolarHBondContact O-CA 3.37Å
307	H	95.7	Very high	87.4	Confident	85 Å²	85	65.7 Å²	65.7	39%	0.394	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.7	178.4	-163.5	81.7	0	0	0	108.9	M266 M287 V288 Y309	M266-H307 HydrophobicContact CE-CB 3.63Å; M266-H307 VanDerWaalsContact CE-CD2 3.45Å; M266-H307 WeakPolarHBondContact CE-CD2 3.44Å; M266-H307 HydrophobicContact SD-CB 4.49Å; M287-H307 CarbonylContact C-O 3.55Å; M287-H307 WeakPolarHBondContact CA-O 3.43Å; V288-H307 PolarHBondContact N-O 2.83Å; V288-H307 PolarHBondContact O-N 3.11Å; H307-Y309 AromaticContact CD2-CE1 3.77Å; H307-Y309 AromaticContact CD2-CE2 3.64Å; H307-Y309 AromaticContact CD2-CZ 3.39Å; H307-Y309 AromaticContact NE2-CE1 3.54Å; H307-Y309 AromaticContact NE2-CZ 3.6Å
308	S	95.5	Very high	88.7	Confident	51 Å²	51	59.6 Å²	59.6	36%	0.357	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.1	-175.3	64.3	0	0	0	0	110.8	I286 M287	I286-S308 CarbonylContact O-C 3.52Å; I286-S308 VanDerWaalsContact O-CA 3.3Å; I286-S308 WeakPolarHBondContact O-CA 3.35Å; M287-S308 WeakPolarHBondContact SD-CB 3.17Å
309	Y	94.7	Very high	90.3	Very high	26 Å²	26	52.2 Å²	52.2	10%	0.102	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.2	169.7	-60.3	-76.5	0	0	0	109.3	Y250 V264 M266 R285 I286 H307	Y250-Y309 AromaticContact CD1-CD1 3.92Å; Y250-Y309 HydrophobicContact CD1-CD1 3.92Å; Y250-Y309 HydrophobicContact CD1-CG 4.28Å; V264-Y309 HydrophobicContact CG1-CD2 3.76Å; V264-Y309 HydrophobicContact CG1-CE1 4.39Å; V264-Y309 HydrophobicContact CG1-CE2 3.33Å; V264-Y309 HydrophobicContact CG1-CG 4.43Å; M266-Y309 HydrophobicContact CE-CE2 3.52Å; M266-Y309 WeakPolarHBondContact CE-OH 3.39Å; R285-Y309 CarbonylContact C-O 3.59Å; R285-Y309 WeakPolarHBondContact CA-O 3.47Å; I286-Y309 HydrophobicContact CG2-CD2 4.42Å; I286-Y309 PolarHBondContact N-O 3.39Å; I286-Y309 PolarHBondContact O-N 2.84Å; H307-Y309 AromaticContact CD2-CE1 3.77Å; H307-Y309 AromaticContact CD2-CE2 3.64Å; H307-Y309 AromaticContact CD2-CZ 3.39Å; H307-Y309 AromaticContact NE2-CE1 3.54Å; H307-Y309 AromaticContact NE2-CZ 3.6Å
310	E	93.2	Very high	91.6	Very high	122 Å²	122	48.8 Å²	48.8	57%	0.57	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.4	165.8	-66.9	-173.2	162.4	0	0	108.8	Y250 R285	Y250-E310 VanDerWaalsContact CE1-O 3.29Å; Y250-E310 WeakPolarHBondContact CE1-O 3.4Å; Y250-E310 VanDerWaalsContact CZ-O 3.23Å; Y250-E310 PolarHBondContact OH-O 3.37Å; R285-E310 HydrophobicContact CG-CG 4.12Å; R285-E310 IonicContact CZ-OE1 2.64Å; R285-E310 IonicContact NE-OE1 3.41Å; R285-E310 IonicContact NH2-OE1 3.19Å; R285-E310 PolarHBondContact NH2-OE1 2.88Å
311	I	91.4	Very high	92.6	Very high	9 Å²	9	46.5 Å²	46.5	5%	0.046	25%	0.247	C	C	.	.			trans	-117	151	-178	56.3	171.7	0	0	0	109.6	Y250 L262 N284 I286 E313 L315 L335	Y250-I311 HydrophobicContact CD2-CG2 4.5Å; L262-I311 HydrophobicContact CD1-CG2 3.8Å; L262-I311 HydrophobicContact CD2-CD1 4.3Å; L262-I311 HydrophobicContact CD2-CG2 3.97Å; N284-I311 VanDerWaalsContact O-CG1 3.26Å; N284-I311 WeakPolarHBondContact O-CG1 3.08Å; N284-I311 PolarHBondContact O-N 3.3Å; I286-I311 HydrophobicContact CG1-CD1 4.21Å; I311-E313 VanDerWaalsContact C-N 3.26Å; I311-E313 WeakPolarHBondContact CD1-O 3.21Å; I311-E313 VanDerWaalsContact CG1-O 3.3Å; I311-E313 WeakPolarHBondContact CG1-O 3.27Å; I311-E313 PolarHBondContact O-N 2.9Å; I311-L315 HydrophobicContact CD1-CD2 3.86Å; I311-L315 HydrophobicContact CD1-CG 4.38Å; I311-L335 HydrophobicContact CD1-CD2 4.48Å
312	P	88	Confident	93	Very high	69 Å²	69	44.5 Å²	44.5	45%	0.448	23%	0.234	S	C	.	.	S	Bend	trans	-66.3	-28.8	-173.5	24.7	-34.5	0	0	0	113.4	I252 L335	I252-P312 HydrophobicContact CD1-CG 4.24Å; I252-P312 HydrophobicContact CG1-CG 4.16Å; P312-L335 HydrophobicContact CG-CD1 4.25Å
313	E	86.7	Confident	93.4	Very high	21 Å²	21	38.4 Å²	38.4	10%	0.098	21%	0.21	C	C	.	.	S	Bend	trans	-140.4	152	-176.2	-75.5	163	-176.6	0	0	109.9	R260 I311 L335 C338	R260-E313 IonicContact CZ-OE1 3.51Å; R260-E313 IonicContact CZ-OE2 3.62Å; R260-E313 IonicContact NE-OE2 3.81Å; R260-E313 IonicContact NH2-OE1 2.79Å; R260-E313 PolarHBondContact NH2-OE1 2.79Å; R260-E313 IonicContact NH2-OE2 3.19Å; R260-E313 PolarHBondContact NH2-OE2 2.8Å; I311-E313 VanDerWaalsContact C-N 3.26Å; I311-E313 WeakPolarHBondContact CD1-O 3.21Å; I311-E313 VanDerWaalsContact CG1-O 3.3Å; I311-E313 WeakPolarHBondContact CG1-O 3.27Å; I311-E313 PolarHBondContact O-N 2.9Å; E313-L335 HydrophobicContact CB-CB 4.31Å; E313-L335 HydrophobicContact CB-CD1 4.36Å; E313-L335 HydrophobicContact CB-CD2 4.36Å; E313-C338 WeakPolarHBondContact OE1-CA 3.41Å; E313-C338 WeakPolarHBondContact OE1-CB 3.39Å; E313-C338 PolarHBondContact OE1-SG 3.5Å
314	T	88.6	Confident	93.5	Very high	13 Å²	13	37.4 Å²	37.4	8%	0.08	20%	0.204	C	C	.	.			trans	-68.5	161.6	170.7	-167.2	0	0	0	0	110.7	L123 N284 M336	L123-T314 HydrophobicContact CD1-CG2 4.01Å; N284-T314 PolarHBondContact OD1-N 2.94Å; T314-M336 HydrophobicContact CG2-CB 4.24Å; T314-M336 HydrophobicContact CG2-CG 4.07Å; T314-M336 WeakPolarHBondContact O-CB 3.35Å; T314-M336 PolarHBondContact O-N 3.2Å
315	L	90.7	Very high	93.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-133.5	163	172.7	60.8	88.7	0	0	0	109.5	L123 L262 V281 I286 I311 P317 V320 A333 P334 L335	L123-L315 WeakPolarHBondContact CD1-O 3.42Å; L262-L315 HydrophobicContact CB-CD2 4.43Å; L262-L315 HydrophobicContact CD2-CD2 3.57Å; V281-L315 HydrophobicContact CG2-CD1 3.4Å; V281-L315 HydrophobicContact CG2-CG 4.14Å; I286-L315 HydrophobicContact CD1-CD1 4.3Å; I286-L315 HydrophobicContact CD1-CD2 4.13Å; I286-L315 HydrophobicContact CG1-CD2 4.1Å; I311-L315 HydrophobicContact CD1-CD2 3.86Å; I311-L315 HydrophobicContact CD1-CG 4.38Å; L315-P317 VanDerWaalsContact O-CD 3.26Å; L315-P317 WeakPolarHBondContact O-CD 3.47Å; L315-V320 HydrophobicContact CD1-CG2 3.36Å; L315-A333 HydrophobicContact CD1-CB 4.13Å; L315-A333 HydrophobicContact CD2-CB 3.92Å; L315-P334 WeakPolarHBondContact CB-O 3.28Å; L315-L335 HydrophobicContact CB-CD2 4.36Å; L315-L335 HydrophobicContact CD2-CD2 4.27Å
316	D	92.1	Very high	93.5	Very high	9 Å²	9	38.7 Å²	38.7	5%	0.048	22%	0.217	C	C	.	.			trans	-72	118.1	172.1	178	6.8	0	0	0	110	Y127 P186 S188 L318 S319	Y127-D316 WeakPolarHBondContact CE2-OD1 3.28Å; Y127-D316 PolarHBondContact OH-OD1 3.32Å; Y127-D316 PolarHBondContact OH-OD2 3.46Å; P186-D316 HydrophobicContact CB-CB 4.48Å; S188-D316 WeakPolarHBondContact CB-OD2 3.46Å; S188-D316 PolarHBondContact OG-OD2 2.83Å; D316-L318 PolarHBondContact O-N 2.8Å; D316-L318 PolarHBondContact OD1-N 2.91Å; D316-S319 WeakPolarHBondContact O-CB 3.46Å; D316-S319 PolarHBondContact O-N 2.83Å; D316-S319 PolarHBondContact O-OG 3.04Å
317	P	93.2	Very high	93.4	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.032	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-47.6	-33.1	175.1	-20.5	17.1	0	0	0	114.7	L123 Y127 I228 V281 L315 S319	L123-P317 WeakPolarHBondContact O-CG 3.27Å; Y127-P317 HydrophobicContact CD2-CB 4.46Å; Y127-P317 HydrophobicContact CD2-CG 4.03Å; Y127-P317 HydrophobicContact CE2-CB 4.48Å; Y127-P317 HydrophobicContact CE2-CG 3.96Å; I228-P317 WeakPolarHBondContact CG1-O 3.39Å; V281-P317 HydrophobicContact CB-CB 4.38Å; V281-P317 HydrophobicContact CB-CG 4.01Å; V281-P317 HydrophobicContact CG2-CB 4Å; V281-P317 HydrophobicContact CG2-CG 4.05Å; L315-P317 VanDerWaalsContact O-CD 3.26Å; L315-P317 WeakPolarHBondContact O-CD 3.47Å; P317-S319 VanDerWaalsContact C-N 3.35Å
318	L	93.2	Very high	93.4	Very high	31 Å²	31	37.4 Å²	37.4	16%	0.162	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-83.7	-8.1	-179.2	-63.7	-176.9	0	0	0	113.9	Y127 V135 V210 L218 I226 D316	Y127-L318 HydrophobicContact CD1-CD1 3.63Å; Y127-L318 HydrophobicContact CD1-CG 4.4Å; Y127-L318 HydrophobicContact CD2-CD1 4.43Å; Y127-L318 HydrophobicContact CD2-CG 4.35Å; Y127-L318 HydrophobicContact CE1-CD1 3.51Å; Y127-L318 HydrophobicContact CE1-CG 4.27Å; Y127-L318 HydrophobicContact CE2-CD1 4.31Å; Y127-L318 HydrophobicContact CE2-CG 4.2Å; Y127-L318 HydrophobicContact CG-CD1 4.09Å; Y127-L318 HydrophobicContact CG-CG 4.42Å; V135-L318 HydrophobicContact CG1-CD1 4Å; V210-L318 HydrophobicContact CB-CD1 4.29Å; V210-L318 HydrophobicContact CG1-CD1 3.7Å; V210-L318 HydrophobicContact CG2-CD1 3.79Å; L218-L318 HydrophobicContact CD2-CD2 3.6Å; I226-L318 HydrophobicContact CG2-CD2 3.64Å; D316-L318 PolarHBondContact O-N 2.8Å; D316-L318 PolarHBondContact OD1-N 2.91Å
319	S	92.4	Very high	93.6	Very high	37 Å²	37	35 Å²	35	26%	0.259	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-86.2	-8.3	173.9	77.2	0	0	0	0	113.2	D316 P317 S321	D316-S319 WeakPolarHBondContact O-CB 3.46Å; D316-S319 PolarHBondContact O-N 2.83Å; D316-S319 PolarHBondContact O-OG 3.04Å; P317-S319 VanDerWaalsContact C-N 3.35Å; S319-S321 PolarHBondContact O-N 2.95Å
320	V	94.4	Very high	93.7	Very high	12 Å²	12	33.8 Å²	33.8	7%	0.073	19%	0.186	C	C	.	.			trans	-73	117.3	-178	179.8	0	0	0	0	110.9	I228 I279 V281 I286 L315 L331 A333	I228-V320 HydrophobicContact CG1-CB 4.08Å; I228-V320 HydrophobicContact CG1-CG1 4.49Å; I279-V320 HydrophobicContact CG2-CG1 4.28Å; V281-V320 HydrophobicContact CG2-CG2 4.46Å; I286-V320 HydrophobicContact CD1-CG2 4.41Å; L315-V320 HydrophobicContact CD1-CG2 3.36Å; V320-L331 HydrophobicContact CG1-CB 4.39Å; V320-A333 HydrophobicContact CB-CB 4.39Å; V320-A333 HydrophobicContact CG2-CB 3.91Å
321	S	94.7	Very high	93.9	Very high	46 Å²	46	28 Å²	28	32%	0.322	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.3	164.7	-177	0	0	0	0	109.1	S319 L331 E332	S319-S321 PolarHBondContact O-N 2.95Å; S321-L331 CarbonylContact O-C 3.5Å; S321-L331 WeakPolarHBondContact O-CA 3.48Å; S321-L331 WeakPolarHBondContact O-CB 3.39Å; S321-E332 PolarHBondContact N-O 2.79Å; S321-E332 PolarHBondContact O-N 2.86Å
322	A	97	Very high	94.1	Very high	7 Å²	7	30.3 Å²	30.3	6%	0.058	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	135.8	-178.7	0	0	0	0	0	112.5	I228 P230 K231 I279 L329 V330 L331	I228-A322 HydrophobicContact CG2-CB 4.29Å; P230-A322 WeakPolarHBondContact CA-O 3.49Å; P230-A322 HydrophobicContact CB-CB 4.01Å; P230-A322 HydrophobicContact CG-CB 4.07Å; K231-A322 PolarHBondContact N-O 3.49Å; I279-A322 HydrophobicContact CD1-CB 3.27Å; A322-L329 HydrophobicContact CB-CD1 4.48Å; A322-V330 CarbonylContact C-O 3.54Å; A322-V330 WeakPolarHBondContact CA-O 3.28Å; A322-L331 HydrophobicContact CB-CB 4.08Å
323	Q	97.5	Very high	94.4	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.009	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	146.1	-178.9	-71.5	171.5	38.2	0	0	111.8	K231 H233 V236 H240 L242 I325 V330	K231-Q323 VanDerWaalsContact O-CA 3.25Å; K231-Q323 WeakPolarHBondContact O-CA 3.43Å; H233-Q323 PolarHBondContact ND1-OE1 3.3Å; V236-Q323 HydrophobicContact CG2-CG 3.9Å; H240-Q323 PolarHBondContact O-NE2 3.03Å; L242-Q323 HydrophobicContact CD1-CB 4.36Å; L242-Q323 HydrophobicContact CD1-CG 4.36Å; L242-Q323 HydrophobicContact CG-CG 4.39Å; L242-Q323 VanDerWaalsContact N-OE1 3.14Å; Q323-I325 HydrophobicContact CB-CG1 4.4Å; Q323-V330 PolarHBondContact N-O 2.82Å; Q323-V330 PolarHBondContact O-N 3.26Å
324	V	97.7	Very high	94.7	Very high	20 Å²	20	29 Å²	29	12%	0.121	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.6	166.3	-178.1	0	0	0	0	109.2	P230 K231 H233 L268 P274 L277 T328 L329	P230-V324 HydrophobicContact CB-CG2 4.08Å; K231-V324 PolarHBondContact O-N 3.44Å; H233-V324 WeakPolarHBondContact CB-O 3.38Å; H233-V324 PolarHBondContact N-O 2.89Å; L268-V324 HydrophobicContact CD1-CG1 4.06Å; L268-V324 HydrophobicContact CD1-CG2 4.01Å; P274-V324 HydrophobicContact CB-CG2 4.29Å; P274-V324 HydrophobicContact CG-CB 4.01Å; P274-V324 HydrophobicContact CG-CG2 3.91Å; L277-V324 HydrophobicContact CD1-CG2 3.77Å; V324-T328 WeakPolarHBondContact CA-O 3.4Å; V324-L329 HydrophobicContact CG2-CD1 4.24Å
325	I	96.6	Very high	94.8	Very high	18 Å²	18	29.2 Å²	29.2	9%	0.092	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	111.1	178.6	-46.7	178.4	0	0	0	107.2	H233 L242 V244 Q323 Q327 T328 V330	H233-I325 HydrophobicContact CB-CB 4.47Å; H233-I325 HydrophobicContact CB-CG1 3.92Å; L242-I325 HydrophobicContact CB-CD1 4.47Å; L242-I325 WeakPolarHBondContact O-CD1 3.4Å; V244-I325 HydrophobicContact CG2-CB 4.07Å; V244-I325 HydrophobicContact CG2-CD1 4.05Å; V244-I325 HydrophobicContact CG2-CG2 4.17Å; Q323-I325 HydrophobicContact CB-CG1 4.4Å; I325-Q327 PolarHBondContact O-N 2.91Å; I325-T328 PolarHBondContact N-O 3.4Å; I325-T328 WeakPolarHBondContact O-CA 3.3Å; I325-T328 WeakPolarHBondContact O-CB 3.26Å; I325-T328 PolarHBondContact O-N 3.27Å; I325-V330 HydrophobicContact CD1-CB 4.34Å; I325-V330 HydrophobicContact CD1-CG2 3.9Å; I325-V330 HydrophobicContact CG1-CG2 4.29Å
326	D	93.5	Very high	94.5	Very high	148 Å²	148	30.4 Å²	30.4	79%	0.791	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.4	57.2	175.7	-59.6	-33.5	0	0	0	114.3	T328	D326-T328 PolarHBondContact O-N 2.82Å
327	Q	94.3	Very high	93.7	Very high	116 Å²	116	35 Å²	35	54%	0.542	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	11.9	-177.4	-58.4	148.5	50.8	0	0	115.1	L268 I325	L268-Q327 WeakPolarHBondContact CB-O 3.35Å; L268-Q327 PolarHBondContact N-O 3.46Å; I325-Q327 PolarHBondContact O-N 2.91Å
328	T	97.2	Very high	92.4	Very high	23 Å²	23	37.5 Å²	37.5	14%	0.141	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.9	172.1	-55.6	0	0	0	0	109.2	E265 M266 V324 I325 D326 V330	E265-T328 HydrophobicContact CB-CG2 4.16Å; M266-T328 CarbonylContact O-C 3.51Å; M266-T328 WeakPolarHBondContact O-CA 3.32Å; V324-T328 WeakPolarHBondContact CA-O 3.4Å; I325-T328 PolarHBondContact N-O 3.4Å; I325-T328 WeakPolarHBondContact O-CA 3.3Å; I325-T328 WeakPolarHBondContact O-CB 3.26Å; I325-T328 PolarHBondContact O-N 3.27Å; D326-T328 PolarHBondContact O-N 2.82Å; T328-V330 HydrophobicContact CG2-CG2 4.17Å; T328-V330 PolarHBondContact O-N 2.82Å
329	L	98	Very high	90.9	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	122.8	165.4	176.4	64.4	0	0	0	108.6	P230 E265 M266 L268 L277 I279 V288 A322 V324	P230-L329 HydrophobicContact CB-CD1 3.8Å; P230-L329 HydrophobicContact CG-CD1 3.5Å; P230-L329 VanDerWaalsContact CG-CD1 3.5Å; E265-L329 CarbonylContact C-O 3.56Å; E265-L329 VanDerWaalsContact CA-O 3.32Å; E265-L329 WeakPolarHBondContact CA-O 3.45Å; M266-L329 HydrophobicContact CB-CB 4.33Å; M266-L329 PolarHBondContact N-O 3.02Å; M266-L329 PolarHBondContact O-N 3.14Å; L268-L329 HydrophobicContact CD1-CB 4.04Å; L268-L329 HydrophobicContact CD2-CB 4.25Å; L268-L329 HydrophobicContact CG-CB 4.16Å; L277-L329 HydrophobicContact CD1-CD1 4.48Å; I279-L329 HydrophobicContact CD1-CD1 4.16Å; I279-L329 HydrophobicContact CD1-CD2 4.17Å; I279-L329 HydrophobicContact CG1-CD2 4.41Å; V288-L329 HydrophobicContact CB-CD2 4.44Å; V288-L329 HydrophobicContact CG1-CD2 3.46Å; V288-L329 VanDerWaalsContact CG1-CD2 3.46Å; V288-L329 HydrophobicContact CG2-CD2 4.08Å; A322-L329 HydrophobicContact CB-CD1 4.48Å; V324-L329 HydrophobicContact CG2-CD1 4.24Å
330	V	97.9	Very high	89.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	130.9	171.4	-174.9	0	0	0	0	108.4	L242 V244 V264 E265 A322 Q323 I325 T328	L242-V330 HydrophobicContact CB-CB 4.37Å; L242-V330 HydrophobicContact CB-CG1 3.9Å; L242-V330 HydrophobicContact CD1-CB 4.43Å; L242-V330 HydrophobicContact CD1-CG1 4.11Å; L242-V330 WeakPolarHBondContact CD1-O 3.24Å; V244-V330 HydrophobicContact CG2-CG2 3.76Å; V264-V330 WeakPolarHBondContact O-CA 3.44Å; E265-V330 HydrophobicContact CG-CG2 4.49Å; A322-V330 CarbonylContact C-O 3.54Å; A322-V330 WeakPolarHBondContact CA-O 3.28Å; Q323-V330 PolarHBondContact N-O 2.82Å; Q323-V330 PolarHBondContact O-N 3.26Å; I325-V330 HydrophobicContact CD1-CB 4.34Å; I325-V330 HydrophobicContact CD1-CG2 3.9Å; I325-V330 HydrophobicContact CG1-CG2 4.29Å; T328-V330 HydrophobicContact CG2-CG2 4.17Å; T328-V330 PolarHBondContact O-N 2.82Å
331	L	96.6	Very high	87.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.6	171.4	69.3	93.2	0	0	0	111.2	L262 H263 V264 I279 I286 V288 V320 S321 A322	L262-L331 HydrophobicContact CD2-CD1 4.19Å; L262-L331 HydrophobicContact CG-CD1 4.48Å; H263-L331 WeakPolarHBondContact CA-O 3.48Å; V264-L331 HydrophobicContact CB-CD1 3.87Å; V264-L331 HydrophobicContact CB-CD2 3.75Å; V264-L331 HydrophobicContact CB-CG 3.59Å; V264-L331 HydrophobicContact CG1-CD2 4.32Å; V264-L331 HydrophobicContact CG2-CD1 3.44Å; V264-L331 VanDerWaalsContact CG2-CD1 3.44Å; V264-L331 HydrophobicContact CG2-CD2 3.98Å; V264-L331 HydrophobicContact CG2-CG 3.78Å; V264-L331 PolarHBondContact N-O 2.85Å; V264-L331 PolarHBondContact O-N 2.64Å; I279-L331 HydrophobicContact CD1-CD2 4.29Å; I286-L331 HydrophobicContact CG2-CD2 4.16Å; V288-L331 HydrophobicContact CG2-CD2 4.44Å; V320-L331 HydrophobicContact CG1-CB 4.39Å; S321-L331 CarbonylContact O-C 3.5Å; S321-L331 WeakPolarHBondContact O-CA 3.48Å; S321-L331 WeakPolarHBondContact O-CB 3.39Å; A322-L331 HydrophobicContact CB-CB 4.08Å
332	E	95.8	Very high	85.5	Confident	58 Å²	58	53.7 Å²	53.7	27%	0.271	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.3	174.1	-66.6	-167.6	153.5	0	0	110.4	L242 K245 L262 H263 S321	L242-E332 HydrophobicContact CD1-CG 4.46Å; L242-E332 HydrophobicContact CD2-CB 4.06Å; L242-E332 HydrophobicContact CD2-CG 3.99Å; L242-E332 WeakPolarHBondContact CD2-OE2 3.28Å; K245-E332 IonicContact NZ-OE1 3.5Å; K245-E332 PolarHBondContact NZ-OE1 2.81Å; L262-E332 VanDerWaalsContact O-CA 3.25Å; L262-E332 WeakPolarHBondContact O-CA 3.43Å; H263-E332 HydrophobicContact CB-CG 4.37Å; H263-E332 IonicContact CE1-OE1 3.81Å; H263-E332 IonicContact CG-OE1 3.6Å; H263-E332 WeakPolarHBondContact ND1-CG 3.49Å; H263-E332 IonicContact ND1-OE1 3.55Å; H263-E332 PolarHBondContact ND1-OE1 2.83Å; S321-E332 PolarHBondContact N-O 2.79Å; S321-E332 PolarHBondContact O-N 2.86Å
333	A	94.4	Very high	82.6	Confident	2 Å²	2	65.6 Å²	65.6	2%	0.017	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	137.8	178.7	0	0	0	0	0	111.5	D261 L262 L315 V320	D261-A333 WeakPolarHBondContact CA-O 3.47Å; L262-A333 PolarHBondContact N-O 2.91Å; L262-A333 PolarHBondContact O-N 2.86Å; L315-A333 HydrophobicContact CD1-CB 4.13Å; L315-A333 HydrophobicContact CD2-CB 3.92Å; V320-A333 HydrophobicContact CB-CB 4.39Å; V320-A333 HydrophobicContact CG2-CB 3.91Å
334	P	92.8	Very high	81.9	Confident	60 Å²	60	68.8 Å²	68.8	39%	0.39	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	134.7	171.4	29	-34.3	0	0	0	110.7	D261 L315	D261-P334 WeakPolarHBondContact OD1-CA 3.5Å; L315-P334 WeakPolarHBondContact CB-O 3.28Å
335	L	90.5	Very high	81.1	Confident	19 Å²	19	71.4 Å²	71.4	10%	0.099	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-73	147.1	170.5	-64.1	177.5	0	0	0	110.3	I252 R260 L262 I311 P312 E313 L315	I252-L335 HydrophobicContact CD1-CD1 3.88Å; I252-L335 HydrophobicContact CG2-CD1 4.24Å; R260-L335 HydrophobicContact CB-CD1 3.99Å; R260-L335 WeakPolarHBondContact O-CB 3.43Å; R260-L335 PolarHBondContact O-N 3.26Å; L262-L335 HydrophobicContact CB-CD2 4.15Å; I311-L335 HydrophobicContact CD1-CD2 4.48Å; P312-L335 HydrophobicContact CG-CD1 4.25Å; E313-L335 HydrophobicContact CB-CB 4.31Å; E313-L335 HydrophobicContact CB-CD1 4.36Å; E313-L335 HydrophobicContact CB-CD2 4.36Å; L315-L335 HydrophobicContact CB-CD2 4.36Å; L315-L335 HydrophobicContact CD2-CD2 4.27Å
336	M	85.3	Confident	80.2	Confident	24 Å²	24	74.3 Å²	74.3	12%	0.118	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-65	152	168	-63.6	-63.1	-78	0	0	109.5	L123 E184 T314 C338	L123-M336 HydrophobicContact CD1-CE 4.44Å; L123-M336 HydrophobicContact CD1-CG 3.96Å; L123-M336 HydrophobicContact CD1-SD 4.4Å; E184-M336 HydrophobicContact CB-CE 4.1Å; E184-M336 HydrophobicContact CG-CE 3.71Å; E184-M336 WeakPolarHBondContact OE2-CE 2.91Å; T314-M336 HydrophobicContact CG2-CB 4.24Å; T314-M336 HydrophobicContact CG2-CG 4.07Å; T314-M336 WeakPolarHBondContact O-CB 3.35Å; T314-M336 PolarHBondContact O-N 3.2Å; M336-C338 PolarHBondContact O-N 2.65Å
337	K	74.3	Confident	79.4	Confident	107 Å²	107	70 Å²	70	47%	0.465	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-61.3	135.5	-177.2	-75	178	178.4	170.4	0	110.3	D158 H339	D158-K337 IonicContact OD2-NZ 3.27Å; K337-H339 PolarHBondContact O-CE1 2.92Å; K337-H339 PolarHBondContact O-N 3.14Å; K337-H339 PolarHBondContact O-ND1 3.23Å
338	C	65.3	Low	78.5	Confident	57 Å²	57	67.1 Å²	67.1	39%	0.385	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60	125.1	167.9	-150	0	0	0	0	109.5	E313 M336 K340	E313-C338 WeakPolarHBondContact OE1-CA 3.41Å; E313-C338 WeakPolarHBondContact OE1-CB 3.39Å; E313-C338 PolarHBondContact OE1-SG 3.5Å; M336-C338 PolarHBondContact O-N 2.65Å; C338-K340 VanDerWaalsContact C-N 3.32Å
339	H	62.9	Low	77.2	Confident	18 Å²	18	70.1 Å²	70.1	8%	0.083	34%	0.342	C	S	.	.			trans	-86	-8	168.4	-55.2	-30.6	0	0	0	112.4	I91 M94 D95 E184 K337 L341	I91-H339 HydrophobicContact CG2-CB 4.35Å; M94-H339 HydrophobicContact CB-CB 4.37Å; M94-H339 WeakPolarHBondContact CE-CE1 3.08Å; M94-H339 WeakPolarHBondContact CE-ND1 3.38Å; M94-H339 WeakPolarHBondContact CE-NE2 3.41Å; D95-H339 WeakPolarHBondContact CB-O 3.36Å; D95-H339 VanDerWaalsContact CG-O 3.22Å; E184-H339 IonicContact OE2-CE1 2.66Å; E184-H339 PolarHBondContact OE2-CE1 2.79Å; E184-H339 IonicContact OE2-NE2 3.91Å; K337-H339 PolarHBondContact O-CE1 2.92Å; K337-H339 PolarHBondContact O-N 3.14Å; K337-H339 PolarHBondContact O-ND1 3.23Å; H339-L341 PolarHBondContact O-N 3.2Å
340	K	59.4	Low	75.7	Confident	156 Å²	156	75 Å²	75	68%	0.678	37%	0.366	S	S	*	.	S	Bend	trans	-75.7	124.7	-179.9	-61.7	178.7	-179.7	174.2	0	109.8	C338 E342	C338-K340 VanDerWaalsContact C-N 3.32Å; K340-E342 PolarHBondContact O-N 3.39Å
341	L	54.9	Low	74	Confident	100 Å²	100	80.8 Å²	80.8	52%	0.524	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.3	129.4	162.4	-73.5	174	0	0	0	109.2	L92 D95 H339 Q343	L92-L341 HydrophobicContact CD2-CD1 3.37Å; L92-L341 HydrophobicContact CD2-CD2 3.88Å; L92-L341 HydrophobicContact CD2-CG 3.75Å; D95-L341 PolarHBondContact OD2-N 3.11Å; H339-L341 PolarHBondContact O-N 3.2Å; L341-Q343 PolarHBondContact O-N 2.71Å
342	E	53	Low	72.2	Confident	191 Å²	191	87.5 Å²	87.5	89%	0.893	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-60.6	126.7	162.5	-64.1	-176.3	164.6	0	0	107.9	K340	K340-E342 PolarHBondContact O-N 3.39Å
343	Q	37.4	Very low	70	Confident	258 Å²	258	90.2 Å²	90.2	100%	1.206	44%	0.442	S	S	*	.			trans	-75.2	0	-178.7	-77.6	-175	-4.2	0	0	112.8	L341	L341-Q343 PolarHBondContact O-N 2.71Å

Retrieved 343 of 343 residues in 826.6 ms (Link to these results)

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