A0A3Q0KJX6_SCHMA Loading...

Polyketide_cyc domain-containing protein

Required for the function of coenzyme Q in the respiratory chain. May serve as a chaperone or may be involved in the transport of Q6 from its site of synthesis to the catalytic sites of the respiratory complexes.

AlphaFold DB , UniProt , Accession A0A3Q0KJX6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 202 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	30.2	Very low	31	Very low	242 Å²	242	148.5 Å²	148.5	100%	1.192	80%	0.797	S	S	*	*				0	100.1	0	-77.9	163.3	73.5	0	0	106.1
2	I	30	Very low	31.6	Very low	171 Å²	171	152.5 Å²	152.5	88%	0.877	80%	0.802	S	S	*	*			cis	-127.9	147.2	35	-74.2	157.6	0	0	0	110.4
3	C	25.3	Very low	32	Very low	100 Å²	100	149.7 Å²	149.7	68%	0.676	80%	0.803	S	S	*	*			trans	-81.6	131.2	-175	-155.4	0	0	0	0	111.1
4	L	31.8	Very low	32.3	Very low	143 Å²	143	147.4 Å²	147.4	75%	0.749	80%	0.8	S	S	*	*			trans	-150.6	85.9	147.5	-119.7	114.8	0	0	0	108.8	F6	L4-F6 HydrophobicContact CD2-CD2 3.62Å; L4-F6 HydrophobicContact CD2-CE2 3.81Å; L4-F6 HydrophobicContact CG-CD2 4.25Å; L4-F6 HydrophobicContact CG-CE2 4.28Å
5	K	26.4	Very low	32.2	Very low	182 Å²	182	145.5 Å²	145.5	79%	0.791	80%	0.801	S	S	*	*			trans	-70.3	124.5	153.8	-77.2	178.4	171.8	-177.6	0	107.5
6	F	34.6	Very low	32	Very low	169 Å²	169	146.3 Å²	146.3	74%	0.741	80%	0.802	S	S	*	*			trans	-151.2	135.8	150.3	-83.3	-90	0	0	0	107.6	L4	L4-F6 HydrophobicContact CD2-CD2 3.62Å; L4-F6 HydrophobicContact CD2-CE2 3.81Å; L4-F6 HydrophobicContact CG-CD2 4.25Å; L4-F6 HydrophobicContact CG-CE2 4.28Å
7	L	32.3	Very low	32.3	Very low	123 Å²	123	147.1 Å²	147.1	64%	0.644	80%	0.803	S	S	*	*			cis	-167	137.2	-22	-108.7	-179.5	0	0	0	102.1
8	N	33.3	Very low	32.2	Very low	131 Å²	131	145.8 Å²	145.8	70%	0.701	80%	0.801	S	S	*	*			trans	60.3	101.1	146.8	-62.8	-10.5	0	0	0	120.5
9	T	32.9	Very low	32.5	Very low	132 Å²	132	144.3 Å²	144.3	81%	0.81	80%	0.802	S	S	*	*				-20.8	131.9	123.9	48.7	0	0	0	0	115.1
10	C	30.2	Very low	32.7	Very low	128 Å²	128	145.1 Å²	145.1	87%	0.865	81%	0.805	S	S	*	*			trans	-148.6	122	156.9	-132.1	0	0	0	0	109.9
11	P	33.6	Very low	33	Very low	112 Å²	112	144.1 Å²	144.1	73%	0.727	80%	0.802	S	S	*	*			trans	-99.9	137.4	168.5	34.1	-25	0	0	0	112.3
12	K	38.1	Very low	33.2	Very low	197 Å²	197	138.2 Å²	138.2	86%	0.857	78%	0.782	S	S	*	*			trans	50.8	113.6	143.2	-59.8	-174.7	179.9	178.5	0	121.1
13	S	37.6	Very low	33.7	Very low	116 Å²	116	136.8 Å²	136.8	81%	0.811	78%	0.775	S	S	*	*				93	151.1	129.3	-64.5	0	0	0	0	121.1
14	P	35.6	Very low	34.4	Very low	117 Å²	117	138.7 Å²	138.7	76%	0.76	78%	0.783	S	S	*	*			trans	-115.4	164.1	-146.6	40.4	-28.2	0	0	0	114.7
15	C	31	Very low	34.8	Very low	120 Å²	120	138.6 Å²	138.6	81%	0.811	78%	0.782	S	S	*	*			trans	-175.2	128.3	143	-106.2	0	0	0	0	113.4
16	L	29	Very low	35.1	Very low	157 Å²	157	140.4 Å²	140.4	82%	0.822	78%	0.784	S	S	*	*			trans	10.6	134.8	147.5	-58.3	155.7	0	0	0	120.1
17	I	36.8	Very low	35.2	Very low	161 Å²	161	143.4 Å²	143.4	83%	0.826	79%	0.79	S	S	*	*				165.9	146.3	112.7	-78.2	158.4	0	0	0	110.1
18	T	31.1	Very low	35.5	Very low	123 Å²	123	144.3 Å²	144.3	76%	0.755	80%	0.796	S	S	*	*			trans	-60.3	149.4	-171.6	61.1	0	0	0	0	117.4
19	S	37.2	Very low	35.8	Very low	117 Å²	117	144.1 Å²	144.1	82%	0.818	80%	0.799	S	S	*	*				170	147.4	115	60.7	0	0	0	0	112.5
20	N	36.4	Very low	36.2	Very low	161 Å²	161	144.6 Å²	144.6	86%	0.861	80%	0.796	S	S	*	*			trans	-77.4	136.7	-175	-70.5	-41.4	0	0	0	113.3
21	V	39.3	Very low	36.5	Very low	124 Å²	124	144 Å²	144	75%	0.752	79%	0.793	S	S	*	*			trans	-145.1	127.6	146.3	-175.9	0	0	0	0	108.1
22	P	33.9	Very low	36.9	Very low	119 Å²	119	146.6 Å²	146.6	77%	0.773	79%	0.793	S	S	*	*			trans	-84.1	117.3	173.9	32.1	-26.9	0	0	0	109.4
23	I	41.1	Very low	36.9	Very low	140 Å²	140	139.2 Å²	139.2	72%	0.718	77%	0.773	S	S	*	*			trans	-96.7	111.3	167.8	-58.2	178	0	0	0	107.8	I25	I23-I25 HydrophobicContact CG2-CD1 4.14Å; I23-I25 HydrophobicContact CG2-CG1 3.66Å; I23-I25 PolarHBondContact O-N 3.33Å
24	V	40.2	Very low	37	Very low	140 Å²	140	140.2 Å²	140.2	85%	0.848	78%	0.777	S	S	*	*			trans	-72.3	108.3	167.2	176.4	0	0	0	0	107.7
25	I	39.5	Very low	37.5	Very low	142 Å²	142	139.9 Å²	139.9	73%	0.728	77%	0.773	S	S	*	*			trans	-108	120.9	168.7	-56	-175.2	0	0	0	108.3	I23	I23-I25 HydrophobicContact CG2-CD1 4.14Å; I23-I25 HydrophobicContact CG2-CG1 3.66Å; I23-I25 PolarHBondContact O-N 3.33Å
26	R	34.1	Very low	38.3	Very low	220 Å²	220	143.7 Å²	143.7	83%	0.83	78%	0.776	S	S	*	*			trans	-47	132.6	175.6	-97.2	179.4	168.9	-175.6	-3.2	111.5	D28	R26-D28 PolarHBondContact O-N 3.32Å
27	R	35.2	Very low	39.6	Very low	232 Å²	232	140.1 Å²	140.1	88%	0.875	76%	0.757	S	S	*	*			trans	-76.4	102.7	165.4	-77.1	177.7	171.4	155.5	-2.6	109	T29	R27-T29 PolarHBondContact O-N 3.31Å
28	D	39.9	Very low	40.6	Very low	142 Å²	142	137.1 Å²	137.1	76%	0.759	74%	0.738	S	S	*	*			trans	-79.9	99	155.6	-71.8	-29	0	0	0	107.3	R26 L30	R26-D28 PolarHBondContact O-N 3.32Å; D28-L30 VanDerWaalsContact C-N 3.33Å; D28-L30 PolarHBondContact O-N 2.98Å
29	T	39.3	Very low	42.7	Very low	126 Å²	126	137.6 Å²	137.6	77%	0.773	73%	0.729	S	S	*	*			trans	-70.4	91.8	170.1	46.3	0	0	0	0	108.6	R27 S31	R27-T29 PolarHBondContact O-N 3.31Å; T29-S31 VanDerWaalsContact C-N 3.34Å; T29-S31 PolarHBondContact O-N 3Å
30	L	41.9	Very low	44.9	Very low	143 Å²	143	133.5 Å²	133.5	75%	0.749	70%	0.701	S	S	*	*			trans	-66.1	97	162.1	-85.8	158	0	0	0	108.3	D28 F32	D28-L30 VanDerWaalsContact C-N 3.33Å; D28-L30 PolarHBondContact O-N 2.98Å; L30-F32 VanDerWaalsContact C-N 3.32Å; L30-F32 HydrophobicContact CB-CD2 4.23Å; L30-F32 HydrophobicContact CB-CE2 4.18Å; L30-F32 PolarHBondContact O-N 3.31Å
31	S	35.5	Very low	47.3	Very low	114 Å²	114	126 Å²	126	80%	0.797	66%	0.661	S	S	*	*			trans	-62.5	92	163.8	169.6	0	0	0	0	108.6	T29 G33	T29-S31 VanDerWaalsContact C-N 3.34Å; T29-S31 PolarHBondContact O-N 3Å; S31-G33 PolarHBondContact O-N 2.97Å
32	F	43.3	Very low	49.7	Very low	167 Å²	167	121.4 Å²	121.4	73%	0.732	63%	0.634	S	S	*	*			trans	-78.2	101.3	160.3	-85.7	-89.3	0	0	0	106.8	L30	L30-F32 VanDerWaalsContact C-N 3.32Å; L30-F32 HydrophobicContact CB-CD2 4.23Å; L30-F32 HydrophobicContact CB-CE2 4.18Å; L30-F32 PolarHBondContact O-N 3.31Å
33	G	37.2	Very low	52.4	Low	43 Å²	43	116.3 Å²	116.3	44%	0.443	60%	0.599	S	S	.	*			trans	-52.4	157	166.1	0	0	0	0	0	110.4	S31 T35	S31-G33 PolarHBondContact O-N 2.97Å; G33-T35 VanDerWaalsContact C-N 3.28Å; G33-T35 PolarHBondContact O-N 2.74Å
34	P	40.1	Very low	55	Low	136 Å²	136	112 Å²	112	88%	0.883	58%	0.575	S	S	*	*			trans	-67.9	90.1	-177.3	29.4	-32.7	0	0	0	108.6	F36	P34-F36 PolarHBondContact O-N 2.76Å; P34-F36 VanDerWaalsContact O-N 3.12Å
35	T	45	Very low	57.6	Low	111 Å²	111	105.7 Å²	105.7	68%	0.681	54%	0.537	S	S	*	.			trans	-61.3	117.5	163	-35.3	0	0	0	0	105.2	G33 I37	G33-T35 VanDerWaalsContact C-N 3.28Å; G33-T35 PolarHBondContact O-N 2.74Å; T35-I37 PolarHBondContact O-N 3.12Å
36	F	48.2	Very low	60.2	Low	200 Å²	200	103.6 Å²	103.6	88%	0.877	52%	0.52	S	S	*	.			trans	-63.8	87.8	174.5	-164.4	-95	0	0	0	107.6	P34 K38	P34-F36 PolarHBondContact O-N 2.76Å; P34-F36 VanDerWaalsContact O-N 3.12Å; F36-K38 PolarHBondContact O-N 3.34Å
37	I	55.9	Low	63.1	Low	81 Å²	81	94.8 Å²	94.8	42%	0.415	49%	0.487	S	S	.	.			trans	-68.9	107	176.5	-61	176.1	0	0	0	105.5	T35 K39	T35-I37 PolarHBondContact O-N 3.12Å; I37-K39 PolarHBondContact O-N 3.04Å
38	K	58.9	Low	66.1	Low	99 Å²	99	84.7 Å²	84.7	43%	0.43	45%	0.45	S	S	.	.			trans	-57.1	113.1	170.8	-169.8	178	175.1	-175.3	0	107	F36	F36-K38 PolarHBondContact O-N 3.34Å
39	K	74.5	Confident	68.8	Low	132 Å²	132	78.2 Å²	78.2	57%	0.574	42%	0.415	S	S	*	.			trans	-75	-34.4	-167.7	-64.5	-170.8	177.1	-178.4	0	112.8	I37 E152	I37-K39 PolarHBondContact O-N 3.04Å; K39-E152 HydrophobicContact CB-CG 3.83Å; K39-E152 WeakPolarHBondContact CB-OE1 3.33Å; K39-E152 WeakPolarHBondContact CD-OE1 3.42Å; K39-E152 WeakPolarHBondContact O-CG 3.4Å
40	S	83.9	Confident	71.5	Confident	32 Å²	32	72.4 Å²	72.4	22%	0.224	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.3	-178.4	166.8	0	0	0	0	111.5	D150 F151	S40-D150 PolarHBondContact OG-OD1 3.19Å; S40-F151 WeakPolarHBondContact CA-O 3.37Å
41	Q	86.3	Confident	74.2	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.019	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.1	177.6	-69.4	-179.9	-2	0	0	109.1	F151 N201 K202	Q41-F151 HydrophobicContact CB-CD1 4.27Å; Q41-F151 HydrophobicContact CB-CE1 3.67Å; Q41-F151 HydrophobicContact CB-CE2 4.02Å; Q41-F151 HydrophobicContact CB-CZ 3.55Å; Q41-F151 HydrophobicContact CG-CE2 4.5Å; Q41-F151 HydrophobicContact CG-CZ 4.26Å; Q41-F151 PolarHBondContact N-O 3.39Å; Q41-F151 WeakPolarHBondContact O-CD1 3.5Å; Q41-F151 PolarHBondContact O-N 3.32Å; Q41-N201 VanDerWaalsContact CA-O 3.28Å; Q41-N201 WeakPolarHBondContact CA-O 3.48Å; Q41-K202 VanDerWaalsContact CG-OXT 3.31Å; Q41-K202 WeakPolarHBondContact CG-OXT 3.38Å; Q41-K202 PolarHBondContact NE2-OXT 3.07Å
42	S	90.2	Very high	77.2	Confident	26 Å²	26	61 Å²	61	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.3	-179.1	-31.8	0	0	0	0	110.5	V149 D150 N201	S42-V149 CarbonylContact C-O 3.54Å; S42-V149 WeakPolarHBondContact CA-O 3.46Å; S42-D150 WeakPolarHBondContact CB-OD1 3.4Å; S42-D150 PolarHBondContact OG-OD1 2.8Å; S42-N201 PolarHBondContact N-O 3Å; S42-N201 PolarHBondContact O-N 2.76Å
43	Y	91	Very high	79.8	Confident	12 Å²	12	53.7 Å²	53.7	5%	0.047	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	136.9	178.8	176.8	-107.5	0	0	0	109.9	E45 F147 S148 V149 F166 V170 I197 I199 Y200	Y43-E45 HydrophobicContact CE1-CB 4.05Å; Y43-E45 HydrophobicContact CE1-CG 3.76Å; Y43-E45 PolarHBondContact OH-OE2 3.03Å; Y43-F147 HydrophobicContact CD1-CD1 4.38Å; Y43-F147 HydrophobicContact CD1-CE1 4.41Å; Y43-F147 HydrophobicContact CE1-CD1 4.41Å; Y43-S148 CarbonylContact O-C 3.55Å; Y43-S148 WeakPolarHBondContact O-CA 3.29Å; Y43-S148 WeakPolarHBondContact O-CB 3.48Å; Y43-V149 HydrophobicContact CD1-CG1 4.3Å; Y43-V149 PolarHBondContact N-O 3.05Å; Y43-V149 PolarHBondContact O-N 3.12Å; Y43-F166 AromaticContact CD2-CE1 3.98Å; Y43-F166 HydrophobicContact CD2-CE1 3.98Å; Y43-F166 HydrophobicContact CD2-CZ 4.45Å; Y43-F166 HydrophobicContact CG-CE1 4.05Å; Y43-F166 HydrophobicContact CG-CZ 4.06Å; Y43-V170 HydrophobicContact CD1-CG1 4.38Å; Y43-V170 HydrophobicContact CD1-CG2 4.32Å; Y43-V170 HydrophobicContact CE1-CG1 3.59Å; Y43-V170 HydrophobicContact CE1-CG2 4.31Å; Y43-V170 HydrophobicContact CE2-CG1 4.41Å; Y43-V170 WeakPolarHBondContact OH-CG1 3.46Å; Y43-I197 HydrophobicContact CE2-CD1 3.84Å; Y43-I197 HydrophobicContact CE2-CG2 4.19Å; Y43-I197 WeakPolarHBondContact OH-CD1 3.43Å; Y43-I199 CarbonylContact C-O 3.58Å; Y43-I199 WeakPolarHBondContact CA-O 3.31Å; Y43-Y200 AromaticContact CD2-CD2 3.71Å; Y43-Y200 HydrophobicContact CD2-CD2 3.71Å; Y43-Y200 HydrophobicContact CD2-CE2 4.44Å; Y43-Y200 AromaticContact CE2-CD2 3.93Å; Y43-Y200 HydrophobicContact CE2-CD2 3.93Å; Y43-Y200 HydrophobicContact CE2-CE2 4.49Å
44	K	94.3	Very high	82.7	Confident	49 Å²	49	55.9 Å²	55.9	21%	0.213	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	127.8	171.2	-172.9	173.3	-178	176.3	0	109.5	E146 F147 L198 I199	K44-E146 VanDerWaalsContact CE-OE2 3.26Å; K44-E146 WeakPolarHBondContact CE-OE2 3.25Å; K44-E146 IonicContact NZ-OE2 2.88Å; K44-E146 PolarHBondContact NZ-OE2 3.25Å; K44-F147 CarbonylContact C-O 3.55Å; K44-F147 VanDerWaalsContact CA-O 3.28Å; K44-F147 WeakPolarHBondContact CA-O 3.27Å; K44-L198 HydrophobicContact CB-CB 4.19Å; K44-L198 HydrophobicContact CD-CB 4.25Å; K44-L198 HydrophobicContact CD-CD1 4.05Å; K44-L198 HydrophobicContact CG-CB 4.02Å; K44-L198 HydrophobicContact CG-CD1 4.06Å; K44-L198 PolarHBondContact O-N 2.94Å; K44-I199 HydrophobicContact CB-CB 3.75Å; K44-I199 HydrophobicContact CB-CD1 4.13Å; K44-I199 HydrophobicContact CB-CG1 3.98Å; K44-I199 HydrophobicContact CD-CD1 4.36Å; K44-I199 PolarHBondContact N-O 3.11Å; K44-I199 PolarHBondContact O-N 3.15Å; K44-I199 VanDerWaalsContact O-N 3.09Å
45	E	94.6	Very high	85.4	Confident	9 Å²	9	50.9 Å²	50.9	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	154.9	170	68	163.9	-143.8	0	0	111.5	Y43 R47 E146 F147 P195 N196 I197	Y43-E45 HydrophobicContact CE1-CB 4.05Å; Y43-E45 HydrophobicContact CE1-CG 3.76Å; Y43-E45 PolarHBondContact OH-OE2 3.03Å; E45-R47 IonicContact OE1-CZ 3.56Å; E45-R47 IonicContact OE1-NE 3.6Å; E45-R47 PolarHBondContact OE1-NE 3.15Å; E45-R47 IonicContact OE1-NH2 3.4Å; E45-R47 PolarHBondContact OE1-NH2 3.38Å; E45-R47 IonicContact OE2-CZ 3.5Å; E45-R47 IonicContact OE2-NH2 3.82Å; E45-R47 PolarHBondContact OE2-NH2 3.23Å; E45-E146 CarbonylContact O-C 3.51Å; E45-E146 WeakPolarHBondContact O-CA 3.36Å; E45-F147 HydrophobicContact CG-CB 4.49Å; E45-F147 PolarHBondContact N-O 3Å; E45-F147 PolarHBondContact O-N 3.36Å; E45-P195 HydrophobicContact CB-CB 4.06Å; E45-P195 HydrophobicContact CG-CB 4.41Å; E45-P195 WeakPolarHBondContact OE2-CB 3.49Å; E45-P195 WeakPolarHBondContact OE2-CG 3.45Å; E45-N196 CarbonylContact C-O 3.59Å; E45-N196 WeakPolarHBondContact CA-O 3.33Å; E45-I197 HydrophobicContact CB-CD1 3.85Å
46	R	95.6	Very high	87.9	Confident	98 Å²	98	46 Å²	46	37%	0.37	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.1	164.9	179.3	-173.9	-75.4	-160.4	-2.6	108.9	Y144 V145 E146 N196 L198	R46-Y144 HydrophobicContact CG-CD1 4.1Å; R46-V145 CarbonylContact C-O 3.53Å; R46-V145 VanDerWaalsContact CA-O 3.3Å; R46-V145 WeakPolarHBondContact CA-O 3.4Å; R46-E146 HydrophobicContact CB-CG 4.2Å; R46-E146 HydrophobicContact CG-CG 4.07Å; R46-E146 IonicContact CZ-OE1 3.41Å; R46-E146 IonicContact NE-OE1 2.89Å; R46-E146 PolarHBondContact NE-OE1 3.09Å; R46-E146 IonicContact NH2-OE1 3.48Å; R46-E146 PolarHBondContact NH2-OE1 3.03Å; R46-N196 PolarHBondContact N-O 2.73Å; R46-N196 PolarHBondContact O-N 3.47Å; R46-L198 HydrophobicContact CB-CD1 4.04Å
47	R	95.1	Very high	90.3	Very high	35 Å²	35	36.4 Å²	36.4	13%	0.132	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	137.2	179.9	-162.8	178.2	-60.6	-157.6	0.9	112.1	E45 L49 Y144 V145 Q193 P195	E45-R47 IonicContact OE1-CZ 3.56Å; E45-R47 IonicContact OE1-NE 3.6Å; E45-R47 PolarHBondContact OE1-NE 3.15Å; E45-R47 IonicContact OE1-NH2 3.4Å; E45-R47 PolarHBondContact OE1-NH2 3.38Å; E45-R47 IonicContact OE2-CZ 3.5Å; E45-R47 IonicContact OE2-NH2 3.82Å; E45-R47 PolarHBondContact OE2-NH2 3.23Å; R47-L49 HydrophobicContact CB-CD2 4.36Å; R47-L49 HydrophobicContact CG-CD2 3.85Å; R47-Y144 WeakPolarHBondContact O-CA 3.39Å; R47-V145 PolarHBondContact N-O 2.82Å; R47-V145 PolarHBondContact O-N 3.31Å; R47-Q193 WeakPolarHBondContact CD-O 3.31Å; R47-Q193 VanDerWaalsContact CG-O 3.29Å; R47-Q193 WeakPolarHBondContact CG-O 3.42Å; R47-P195 VanDerWaalsContact NH2-CG 3.28Å
48	L	96.7	Very high	92.3	Very high	20 Å²	20	35.6 Å²	35.6	11%	0.105	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.3	170	-179.9	61.9	0	0	0	109.8	L136 Y144 I190 Q193	L48-L136 HydrophobicContact CD2-CD2 4.03Å; L48-L136 HydrophobicContact CD2-CG 4.26Å; L48-Y144 HydrophobicContact CB-CD1 3.95Å; L48-Y144 HydrophobicContact CB-CE1 3.68Å; L48-Y144 HydrophobicContact CD1-CD1 4.25Å; L48-Y144 HydrophobicContact CD1-CD2 4.28Å; L48-Y144 HydrophobicContact CD1-CE1 4.07Å; L48-Y144 HydrophobicContact CD1-CE2 4.07Å; L48-Y144 HydrophobicContact CD1-CG 4.36Å; L48-Y144 HydrophobicContact CG-CE1 4.29Å; L48-I190 HydrophobicContact CD1-CD1 4.16Å; L48-I190 HydrophobicContact CD2-CD1 3.75Å; L48-I190 HydrophobicContact CG-CD1 3.64Å; L48-Q193 HydrophobicContact CB-CB 4.26Å; L48-Q193 HydrophobicContact CB-CG 3.97Å; L48-Q193 HydrophobicContact CD2-CG 4.15Å; L48-Q193 HydrophobicContact CG-CG 4.36Å; L48-Q193 PolarHBondContact O-N 3.07Å
49	L	96.8	Very high	94.2	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.031	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	150.4	-178.4	-55.9	-174.6	0	0	0	110.9	R47 Y51 M56 S142 C143 V145 M178	R47-L49 HydrophobicContact CB-CD2 4.36Å; R47-L49 HydrophobicContact CG-CD2 3.85Å; L49-Y51 PolarHBondContact O-N 3.43Å; L49-M56 HydrophobicContact CD1-CE 3.66Å; L49-M56 HydrophobicContact CD1-CG 4.06Å; L49-M56 HydrophobicContact CD1-SD 3.91Å; L49-S142 VanDerWaalsContact O-CA 3.22Å; L49-S142 WeakPolarHBondContact O-CA 3.26Å; L49-S142 WeakPolarHBondContact O-CB 3.38Å; L49-C143 PolarHBondContact N-O 3.13Å; L49-C143 PolarHBondContact O-N 3.48Å; L49-V145 HydrophobicContact CD1-CB 4.26Å; L49-V145 HydrophobicContact CD1-CG2 3.56Å; L49-V145 HydrophobicContact CG-CG2 4.27Å; L49-M178 HydrophobicContact CD1-SD 3.74Å; L49-M178 HydrophobicContact CD2-CE 3.73Å; L49-M178 HydrophobicContact CD2-SD 3.44Å; L49-M178 WeakPolarHBondContact CD2-SD 3.44Å; L49-M178 HydrophobicContact CG-SD 4.2Å
50	G	97.4	Very high	95.2	Very high	3 Å²	3	24.9 Å²	24.9	3%	0.031	12%	0.123	C	C	.	.	S	Bend	trans	-89.2	43.4	175.9	0	0	0	0	0	114	N141 P188 S189 I190	G50-N141 CarbonylContact C-O 3.56Å; G50-N141 WeakPolarHBondContact CA-O 3.5Å; G50-P188 CarbonylContact O-C 3.46Å; G50-P188 VanDerWaalsContact O-CA 3.29Å; G50-P188 WeakPolarHBondContact O-CA 3.42Å; G50-S189 WeakPolarHBondContact CA-OG 3.02Å; G50-S189 PolarHBondContact O-N 2.77Å; G50-S189 PolarHBondContact O-OG 2.64Å; G50-I190 VanDerWaalsContact CA-CG1 3.43Å
51	Y	97.6	Very high	95.9	Very high	6 Å²	6	24.4 Å²	24.4	2%	0.024	12%	0.118	C	C	.	.	S	Bend	trans	-135.3	156.8	172.9	-62.1	-73.3	0	0	0	108.9	L49 M56 N141 S142 C143 M178 A181 K182 H185 G186 P188	L49-Y51 PolarHBondContact O-N 3.43Å; Y51-M56 HydrophobicContact CD2-SD 3.83Å; Y51-M56 HydrophobicContact CG-SD 4.07Å; Y51-N141 VanDerWaalsContact C-C 3.49Å; Y51-N141 CarbonylContact C-O 3.58Å; Y51-N141 WeakPolarHBondContact CA-O 3.25Å; Y51-N141 PolarHBondContact N-O 3.3Å; Y51-N141 CarbonylContact O-C 3.51Å; Y51-S142 CarbonylContact O-C 3.11Å; Y51-S142 WeakPolarHBondContact O-CA 3.3Å; Y51-S142 PolarHBondContact O-N 2.77Å; Y51-C143 WeakPolarHBondContact O-CB 3.33Å; Y51-C143 PolarHBondContact O-N 3.21Å; Y51-C143 PolarHBondContact O-SG 3.17Å; Y51-M178 HydrophobicContact CE2-CE 4.15Å; Y51-A181 HydrophobicContact CD1-CB 4.49Å; Y51-A181 HydrophobicContact CD2-CB 3.76Å; Y51-A181 HydrophobicContact CE1-CB 4.25Å; Y51-A181 HydrophobicContact CE2-CB 3.46Å; Y51-A181 VanDerWaalsContact CE2-CB 3.46Å; Y51-A181 HydrophobicContact CG-CB 4.27Å; Y51-K182 WeakPolarHBondContact OH-CA 2.83Å; Y51-K182 VanDerWaalsContact OH-CG 3.27Å; Y51-K182 WeakPolarHBondContact OH-CG 3.29Å; Y51-K182 PolarHBondContact OH-N 3.45Å; Y51-H185 HydrophobicContact CD1-CB 3.92Å; Y51-H185 HydrophobicContact CE1-CB 3.83Å; Y51-G186 PolarHBondContact OH-O 2.95Å; Y51-P188 HydrophobicContact CE1-CB 4.45Å; Y51-P188 HydrophobicContact CE2-CB 3.86Å; Y51-P188 WeakPolarHBondContact OH-CD 3.32Å
52	S	97.7	Very high	96.4	Very high	12 Å²	12	27 Å²	27	8%	0.084	13%	0.132	C	C	.	.			trans	-70.9	162.4	177.6	91	0	0	0	0	111.3	E54 N55 M56 P140	S52-E54 VanDerWaalsContact CB-OE2 3.31Å; S52-E54 WeakPolarHBondContact CB-OE2 3.31Å; S52-E54 PolarHBondContact O-N 2.88Å; S52-E54 PolarHBondContact OG-N 3.4Å; S52-E54 PolarHBondContact OG-OE2 3.1Å; S52-N55 WeakPolarHBondContact CB-OD1 3.41Å; S52-N55 PolarHBondContact N-OD1 2.84Å; S52-N55 VanDerWaalsContact N-OD1 3.11Å; S52-N55 PolarHBondContact O-N 3.14Å; S52-N55 PolarHBondContact OG-N 2.93Å; S52-N55 PolarHBondContact OG-OD1 3.48Å; S52-N55 VanDerWaalsContact OG-OD1 3.07Å; S52-M56 PolarHBondContact O-N 2.99Å; S52-P140 WeakPolarHBondContact CB-O 3.49Å
53	P	98	Very high	96.7	Very high	13 Å²	13	26.1 Å²	26.1	8%	0.084	13%	0.125	C	C	.	.	H	α-helix	trans	-53.5	-39.5	171.3	-26.7	36.1	0	0	0	112.8	M56 F57 F132 C143	P53-M56 PolarHBondContact O-N 2.47Å; P53-F57 VanDerWaalsContact O-CB 3.22Å; P53-F57 WeakPolarHBondContact O-CB 3.21Å; P53-F57 PolarHBondContact O-N 3.3Å; P53-F132 HydrophobicContact CB-CB 4.05Å; P53-C143 HydrophobicContact CB-CB 4.4Å; P53-C143 HydrophobicContact CG-CB 3.8Å
54	E	98.1	Very high	97	Very high	89 Å²	89	26.9 Å²	26.9	42%	0.416	14%	0.137	S	C	.	.	H	α-helix	trans	-63.5	-46.9	178.8	-61.1	69.8	-153	0	0	111.5	S52 M56 F57 D58 P110	S52-E54 VanDerWaalsContact CB-OE2 3.31Å; S52-E54 WeakPolarHBondContact CB-OE2 3.31Å; S52-E54 PolarHBondContact O-N 2.88Å; S52-E54 PolarHBondContact OG-N 3.4Å; S52-E54 PolarHBondContact OG-OE2 3.1Å; E54-M56 VanDerWaalsContact C-N 3.32Å; E54-M56 PolarHBondContact O-N 2.97Å; E54-F57 PolarHBondContact O-N 2.96Å; E54-D58 WeakPolarHBondContact O-CB 3.19Å; E54-D58 PolarHBondContact O-N 2.98Å; E54-P110 HydrophobicContact CG-CB 4.15Å; E54-P110 HydrophobicContact CG-CG 4.22Å
55	N	97.8	Very high	97.2	Very high	31 Å²	31	30.1 Å²	30.1	17%	0.166	15%	0.148	C	C	.	.	H	α-helix	trans	-56.2	-48.5	177.4	-69.1	123.4	0	0	0	111.5	S52 D58 I59 H185	S52-N55 WeakPolarHBondContact CB-OD1 3.41Å; S52-N55 PolarHBondContact N-OD1 2.84Å; S52-N55 VanDerWaalsContact N-OD1 3.11Å; S52-N55 PolarHBondContact O-N 3.14Å; S52-N55 PolarHBondContact OG-N 2.93Å; S52-N55 PolarHBondContact OG-OD1 3.48Å; S52-N55 VanDerWaalsContact OG-OD1 3.07Å; N55-D58 PolarHBondContact O-N 2.78Å; N55-I59 WeakPolarHBondContact O-CD1 3.22Å; N55-I59 WeakPolarHBondContact O-CG1 3.37Å; N55-I59 PolarHBondContact O-N 2.77Å; N55-H185 PolarHBondContact ND2-CD2 3.12Å; N55-H185 PolarHBondContact ND2-CE1 2.86Å; N55-H185 PolarHBondContact ND2-ND1 3.45Å; N55-H185 PolarHBondContact ND2-NE2 2.69Å
56	M	97.8	Very high	97.3	Very high	8 Å²	8	30.7 Å²	30.7	4%	0.039	15%	0.15	C	C	.	.	H	α-helix	trans	-73.2	-35.3	-176.6	-64.6	-53	-50.5	0	0	112	L49 Y51 S52 P53 E54 I59 A60 F132 C143 V145 A181	L49-M56 HydrophobicContact CD1-CE 3.66Å; L49-M56 HydrophobicContact CD1-CG 4.06Å; L49-M56 HydrophobicContact CD1-SD 3.91Å; Y51-M56 HydrophobicContact CD2-SD 3.83Å; Y51-M56 HydrophobicContact CG-SD 4.07Å; S52-M56 PolarHBondContact O-N 2.99Å; P53-M56 PolarHBondContact O-N 2.47Å; E54-M56 VanDerWaalsContact C-N 3.32Å; E54-M56 PolarHBondContact O-N 2.97Å; M56-I59 HydrophobicContact CE-CD1 4.37Å; M56-I59 PolarHBondContact O-N 2.74Å; M56-I59 HydrophobicContact SD-CD1 4.2Å; M56-A60 WeakPolarHBondContact O-CB 3.35Å; M56-A60 PolarHBondContact O-N 3.33Å; M56-A60 VanDerWaalsContact O-N 3.12Å; M56-F132 HydrophobicContact CB-CD1 3.75Å; M56-F132 HydrophobicContact CB-CE1 3.73Å; M56-C143 VanDerWaalsContact CG-SG 3.59Å; M56-V145 HydrophobicContact CB-CG2 4.19Å; M56-V145 HydrophobicContact CG-CG2 4.25Å; M56-A181 HydrophobicContact SD-CB 3.99Å
57	F	98.3	Very high	97.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-44.9	172.8	-177.3	-82	0	0	0	111.3	P53 E54 I59 A60 I61 F107 R109 P110 L113 F132	P53-F57 VanDerWaalsContact O-CB 3.22Å; P53-F57 WeakPolarHBondContact O-CB 3.21Å; P53-F57 PolarHBondContact O-N 3.3Å; E54-F57 PolarHBondContact O-N 2.96Å; F57-I59 VanDerWaalsContact C-N 3.28Å; F57-I59 PolarHBondContact O-N 2.94Å; F57-A60 PolarHBondContact O-N 3.42Å; F57-A60 VanDerWaalsContact O-N 3.09Å; F57-I61 HydrophobicContact CD1-CB 4.29Å; F57-I61 HydrophobicContact CD1-CG2 3.97Å; F57-I61 HydrophobicContact CE1-CB 3.86Å; F57-I61 HydrophobicContact CE1-CG1 4.17Å; F57-I61 HydrophobicContact CE1-CG2 3.78Å; F57-I61 HydrophobicContact CZ-CB 4.33Å; F57-I61 HydrophobicContact CZ-CG1 4.41Å; F57-I61 WeakPolarHBondContact O-CG2 3.28Å; F57-I61 PolarHBondContact O-N 3.36Å; F57-F107 HydrophobicContact CE2-CB 4.26Å; F57-F107 HydrophobicContact CZ-CB 3.94Å; F57-F107 AromaticContact CZ-CD2 3.97Å; F57-F107 HydrophobicContact CZ-CD2 3.97Å; F57-F107 HydrophobicContact CZ-CG 4.21Å; F57-R109 HydrophobicContact CD1-CG 4.22Å; F57-R109 HydrophobicContact CE1-CB 3.88Å; F57-R109 HydrophobicContact CE1-CG 3.96Å; F57-R109 VanDerWaalsContact CE1-CZ 3.48Å; F57-R109 HydrophobicContact CE2-CB 4.48Å; F57-R109 HydrophobicContact CZ-CB 3.84Å; F57-R109 HydrophobicContact CZ-CG 4.37Å; F57-P110 HydrophobicContact CB-CB 4.05Å; F57-P110 VanDerWaalsContact CD2-C 3.43Å; F57-P110 HydrophobicContact CD2-CB 4.42Å; F57-P110 VanDerWaalsContact CD2-O 3.28Å; F57-P110 WeakPolarHBondContact CD2-O 3.43Å; F57-P110 HydrophobicContact CG-CB 4.15Å; F57-L113 HydrophobicContact CE2-CB 4.42Å; F57-F132 HydrophobicContact CB-CD2 4.2Å; F57-F132 HydrophobicContact CB-CE2 4.2Å; F57-F132 HydrophobicContact CB-CG 4.43Å; F57-F132 HydrophobicContact CB-CZ 4.42Å; F57-F132 AromaticContact CD2-CD2 3.77Å; F57-F132 HydrophobicContact CD2-CD2 3.77Å; F57-F132 AromaticContact CD2-CE2 3.66Å; F57-F132 HydrophobicContact CD2-CE2 3.66Å; F57-F132 HydrophobicContact CG-CD2 4.49Å; F57-F132 HydrophobicContact CG-CE2 4.35Å
58	D	98	Very high	97.3	Very high	64 Å²	64	32.2 Å²	32.2	34%	0.342	17%	0.168	S	C	.	.	H	α-helix	trans	-58.8	-39.8	179.8	-79.1	-22.5	0	0	0	112.2	E54 N55 D62 R109	E54-D58 WeakPolarHBondContact O-CB 3.19Å; E54-D58 PolarHBondContact O-N 2.98Å; N55-D58 PolarHBondContact O-N 2.78Å; D58-D62 WeakPolarHBondContact O-CB 3.31Å; D58-D62 PolarHBondContact O-N 3.33Å; D58-R109 IonicContact OD1-CZ 2.64Å; D58-R109 IonicContact OD1-NH1 3.87Å; D58-R109 PolarHBondContact OD1-NH1 2.93Å; D58-R109 IonicContact OD1-NH2 3.75Å; D58-R109 PolarHBondContact OD1-NH2 3.17Å
59	I	97.8	Very high	97.3	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-68	-41.7	175.6	-59.7	162.2	0	0	0	111	N55 M56 F57 F69 F177 R180 A181 L184	N55-I59 WeakPolarHBondContact O-CD1 3.22Å; N55-I59 WeakPolarHBondContact O-CG1 3.37Å; N55-I59 PolarHBondContact O-N 2.77Å; M56-I59 HydrophobicContact CE-CD1 4.37Å; M56-I59 PolarHBondContact O-N 2.74Å; M56-I59 HydrophobicContact SD-CD1 4.2Å; F57-I59 VanDerWaalsContact C-N 3.28Å; F57-I59 PolarHBondContact O-N 2.94Å; I59-F69 HydrophobicContact CG2-CZ 4.23Å; I59-F177 HydrophobicContact CG2-CD1 3.7Å; I59-F177 HydrophobicContact CG2-CE1 4.17Å; I59-R180 HydrophobicContact CG1-CG 4.47Å; I59-R180 HydrophobicContact CG2-CB 4.1Å; I59-R180 HydrophobicContact CG2-CG 3.75Å; I59-A181 VanDerWaalsContact CD1-CA 3.43Å; I59-A181 HydrophobicContact CD1-CB 3.51Å; I59-L184 HydrophobicContact CG1-CD1 4.14Å
60	A	97.2	Very high	97.2	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-74.3	-26.7	-176.9	0	0	0	0	0	113.8	M56 F57 Y66 L113 W130 F132	M56-A60 WeakPolarHBondContact O-CB 3.35Å; M56-A60 PolarHBondContact O-N 3.33Å; M56-A60 VanDerWaalsContact O-N 3.12Å; F57-A60 PolarHBondContact O-N 3.42Å; F57-A60 VanDerWaalsContact O-N 3.09Å; A60-Y66 WeakPolarHBondContact CA-OH 3.39Å; A60-Y66 PolarHBondContact O-OH 2.95Å; A60-L113 HydrophobicContact CB-CD1 4.22Å; A60-L113 VanDerWaalsContact O-CD1 3.28Å; A60-L113 WeakPolarHBondContact O-CD1 3.29Å; A60-W130 HydrophobicContact CB-CD2 4.49Å; A60-F132 HydrophobicContact CB-CE1 4.46Å; A60-F132 HydrophobicContact CB-CZ 3.71Å
61	I	97.7	Very high	96.8	Very high	23 Å²	23	35 Å²	35	12%	0.118	18%	0.182	C	C	.	.	H	α-helix	trans	-88.4	-18.5	177.9	-163.5	58.7	0	0	0	112.8	F57 V63 M86 I105 F107 L113	F57-I61 HydrophobicContact CD1-CB 4.29Å; F57-I61 HydrophobicContact CD1-CG2 3.97Å; F57-I61 HydrophobicContact CE1-CB 3.86Å; F57-I61 HydrophobicContact CE1-CG1 4.17Å; F57-I61 HydrophobicContact CE1-CG2 3.78Å; F57-I61 HydrophobicContact CZ-CB 4.33Å; F57-I61 HydrophobicContact CZ-CG1 4.41Å; F57-I61 WeakPolarHBondContact O-CG2 3.28Å; F57-I61 PolarHBondContact O-N 3.36Å; I61-V63 PolarHBondContact O-N 3.08Å; I61-M86 HydrophobicContact CD1-CE 4Å; I61-I105 HydrophobicContact CD1-CG2 4.05Å; I61-F107 HydrophobicContact CD1-CB 4.17Å; I61-F107 HydrophobicContact CD1-CD1 3.38Å; I61-F107 HydrophobicContact CD1-CD2 4.49Å; I61-F107 HydrophobicContact CD1-CE1 3.81Å; I61-F107 HydrophobicContact CD1-CG 3.76Å; I61-F107 HydrophobicContact CG1-CD1 4.34Å; I61-F107 HydrophobicContact CG1-CE1 4.48Å; I61-F107 HydrophobicContact CG1-CG 4.5Å; I61-L113 HydrophobicContact CB-CD1 3.9Å; I61-L113 HydrophobicContact CD1-CD1 3.53Å; I61-L113 HydrophobicContact CD1-CG 4.3Å; I61-L113 HydrophobicContact CG1-CD1 4.28Å
62	D	97.2	Very high	96.3	Very high	59 Å²	59	38.1 Å²	38.1	32%	0.316	19%	0.194	S	C	.	.			trans	-77.5	55.4	178.2	-167.7	13.4	0	0	0	112.3	D58 G64 R65 Y66	D58-D62 WeakPolarHBondContact O-CB 3.31Å; D58-D62 PolarHBondContact O-N 3.33Å; D62-G64 PolarHBondContact O-N 3.44Å; D62-G64 VanDerWaalsContact O-N 3.16Å; D62-R65 PolarHBondContact O-N 2.93Å; D62-R65 WeakPolarHBondContact OD2-CD 3.3Å; D62-R65 WeakPolarHBondContact OD2-CG 3.38Å; D62-R65 IonicContact OD2-NE 2.81Å; D62-R65 PolarHBondContact OD2-NE 2.99Å; D62-Y66 WeakPolarHBondContact O-CD1 3.36Å
63	V	96.7	Very high	96	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.036	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-58.1	-31	-177	179.5	0	0	0	0	111.1	I61 R65 Y66 S76 M86 A88 L90	I61-V63 PolarHBondContact O-N 3.08Å; V63-R65 PolarHBondContact O-N 2.94Å; V63-R65 VanDerWaalsContact O-N 3.12Å; V63-Y66 HydrophobicContact CG1-CD2 4.18Å; V63-Y66 HydrophobicContact CG1-CE2 4.39Å; V63-Y66 HydrophobicContact CG2-CE2 4.14Å; V63-Y66 WeakPolarHBondContact O-CB 3.28Å; V63-Y66 PolarHBondContact O-N 3.35Å; V63-Y66 VanDerWaalsContact O-N 3.16Å; V63-S76 VanDerWaalsContact O-CB 3.25Å; V63-S76 WeakPolarHBondContact O-CB 3.41Å; V63-M86 HydrophobicContact CB-CE 3.78Å; V63-M86 HydrophobicContact CG2-CE 3.5Å; V63-M86 VanDerWaalsContact CG2-CE 3.5Å; V63-A88 HydrophobicContact CG1-CB 3.69Å; V63-L90 HydrophobicContact CG1-CD1 4.35Å; V63-L90 HydrophobicContact CG1-CD2 3.8Å; V63-L90 HydrophobicContact CG1-CG 4.32Å
64	G	97.2	Very high	95.7	Very high	29 Å²	29	41.6 Å²	41.6	30%	0.299	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-58.6	-24	177.3	0	0	0	0	0	114.1	D62 S76	D62-G64 PolarHBondContact O-N 3.44Å; D62-G64 VanDerWaalsContact O-N 3.16Å; G64-S76 VanDerWaalsContact O-O 3.08Å; G64-S76 PolarHBondContact O-OG 2.77Å
65	R	97.2	Very high	95.5	Very high	117 Å²	117	41 Å²	41	44%	0.442	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-101	6.4	-179.2	-63.4	-160.9	-171.4	-162.5	-1.6	114.6	D62 V63 S67 E68 F69	D62-R65 PolarHBondContact O-N 2.93Å; D62-R65 WeakPolarHBondContact OD2-CD 3.3Å; D62-R65 WeakPolarHBondContact OD2-CG 3.38Å; D62-R65 IonicContact OD2-NE 2.81Å; D62-R65 PolarHBondContact OD2-NE 2.99Å; V63-R65 PolarHBondContact O-N 2.94Å; V63-R65 VanDerWaalsContact O-N 3.12Å; R65-S67 VanDerWaalsContact C-N 3.27Å; R65-S67 PolarHBondContact O-N 3.3Å; R65-E68 HydrophobicContact CB-CG 4.33Å; R65-E68 WeakPolarHBondContact CD-OE1 3.43Å; R65-E68 WeakPolarHBondContact CG-OE1 3.45Å; R65-E68 VanDerWaalsContact O-CB 3.26Å; R65-E68 WeakPolarHBondContact O-CB 3.34Å; R65-E68 WeakPolarHBondContact O-CG 3.35Å; R65-E68 PolarHBondContact O-N 2.79Å; R65-F69 VanDerWaalsContact O-CD1 3.28Å; R65-F69 WeakPolarHBondContact O-CD1 3.44Å
66	Y	97	Very high	95.5	Very high	21 Å²	21	40 Å²	40	8%	0.082	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-35.8	-175.8	-81.5	13.9	0	0	0	113.1	A60 D62 V63 E68 F69 L70 S76 L90 F177	A60-Y66 WeakPolarHBondContact CA-OH 3.39Å; A60-Y66 PolarHBondContact O-OH 2.95Å; D62-Y66 WeakPolarHBondContact O-CD1 3.36Å; V63-Y66 HydrophobicContact CG1-CD2 4.18Å; V63-Y66 HydrophobicContact CG1-CE2 4.39Å; V63-Y66 HydrophobicContact CG2-CE2 4.14Å; V63-Y66 WeakPolarHBondContact O-CB 3.28Å; V63-Y66 PolarHBondContact O-N 3.35Å; V63-Y66 VanDerWaalsContact O-N 3.16Å; Y66-E68 PolarHBondContact O-N 2.94Å; Y66-F69 AromaticContact CD1-CE1 3.74Å; Y66-F69 HydrophobicContact CD1-CE1 3.74Å; Y66-F69 AromaticContact CD1-CZ 3.83Å; Y66-F69 HydrophobicContact CD1-CZ 3.83Å; Y66-F69 HydrophobicContact CE1-CE1 4.26Å; Y66-F69 AromaticContact CE1-CZ 3.97Å; Y66-F69 HydrophobicContact CE1-CZ 3.97Å; Y66-F69 PolarHBondContact O-N 3.46Å; Y66-L70 HydrophobicContact CD1-CD1 4.2Å; Y66-L70 HydrophobicContact CD2-CD1 3.44Å; Y66-L70 VanDerWaalsContact CD2-CD1 3.44Å; Y66-L70 HydrophobicContact CE2-CD1 3.95Å; Y66-L70 HydrophobicContact CG-CD1 3.55Å; Y66-L70 HydrophobicContact CG-CG 4.27Å; Y66-L70 VanDerWaalsContact O-CB 3.3Å; Y66-L70 WeakPolarHBondContact O-CB 3.49Å; Y66-L70 PolarHBondContact O-N 2.93Å; Y66-S76 PolarHBondContact N-OG 2.94Å; Y66-L90 HydrophobicContact CD2-CD2 4.33Å; Y66-F177 HydrophobicContact CE1-CE1 4.08Å; Y66-F177 HydrophobicContact CE1-CZ 4.23Å; Y66-F177 HydrophobicContact CE2-CZ 4.28Å; Y66-F177 AromaticContact CZ-CE1 3.96Å; Y66-F177 AromaticContact CZ-CZ 3.79Å
67	S	95.6	Very high	95.4	Very high	53 Å²	53	42.5 Å²	42.5	37%	0.371	22%	0.221	S	C	.	.	H	α-helix	trans	-64.9	-16.2	175.8	57.9	0	0	0	0	114.2	R65 C73 S76	R65-S67 VanDerWaalsContact C-N 3.27Å; R65-S67 PolarHBondContact O-N 3.3Å; S67-C73 WeakPolarHBondContact CA-O 3.12Å; S67-S76 VanDerWaalsContact CB-OG 3.31Å; S67-S76 WeakPolarHBondContact CB-OG 3.28Å; S67-S76 PolarHBondContact N-OG 3.01Å; S67-S76 PolarHBondContact OG-OG 3.41Å
68	E	96.5	Very high	95.4	Very high	112 Å²	112	45.2 Å²	45.2	52%	0.523	24%	0.237	S	C	.	.	H	α-helix	trans	-75.9	-30.1	177.2	-60	175.1	-170.3	0	0	112.9	R65 Y66 R180	R65-E68 HydrophobicContact CB-CG 4.33Å; R65-E68 WeakPolarHBondContact CD-OE1 3.43Å; R65-E68 WeakPolarHBondContact CG-OE1 3.45Å; R65-E68 VanDerWaalsContact O-CB 3.26Å; R65-E68 WeakPolarHBondContact O-CB 3.34Å; R65-E68 WeakPolarHBondContact O-CG 3.35Å; R65-E68 PolarHBondContact O-N 2.79Å; Y66-E68 PolarHBondContact O-N 2.94Å; E68-R180 IonicContact OE2-CZ 3.88Å; E68-R180 IonicContact OE2-NH1 3.45Å; E68-R180 PolarHBondContact OE2-NH1 3.12Å; E68-R180 IonicContact OE2-NH2 3.87Å; E68-R180 PolarHBondContact OE2-NH2 3.47Å
69	F	96	Very high	95.4	Very high	40 Å²	40	46.8 Å²	46.8	18%	0.175	25%	0.245	C	C	.	.	H	α-helix	trans	-138.1	-20	-167.1	76.1	-86.5	0	0	0	115.2	I59 R65 Y66 A176 F177 R180	I59-F69 HydrophobicContact CG2-CZ 4.23Å; R65-F69 VanDerWaalsContact O-CD1 3.28Å; R65-F69 WeakPolarHBondContact O-CD1 3.44Å; Y66-F69 AromaticContact CD1-CE1 3.74Å; Y66-F69 HydrophobicContact CD1-CE1 3.74Å; Y66-F69 AromaticContact CD1-CZ 3.83Å; Y66-F69 HydrophobicContact CD1-CZ 3.83Å; Y66-F69 HydrophobicContact CE1-CE1 4.26Å; Y66-F69 AromaticContact CE1-CZ 3.97Å; Y66-F69 HydrophobicContact CE1-CZ 3.97Å; Y66-F69 PolarHBondContact O-N 3.46Å; F69-A176 HydrophobicContact CD2-CB 4.18Å; F69-A176 WeakPolarHBondContact O-CB 3.26Å; F69-F177 AromaticContact CE2-CD1 3.95Å; F69-F177 HydrophobicContact CE2-CD1 3.95Å; F69-F177 HydrophobicContact CE2-CE1 4.08Å; F69-F177 HydrophobicContact CE2-CG 4.22Å; F69-F177 HydrophobicContact CE2-CZ 4.48Å; F69-F177 HydrophobicContact CZ-CD1 4.15Å; F69-F177 AromaticContact CZ-CE1 3.91Å; F69-F177 HydrophobicContact CZ-CE1 3.91Å; F69-F177 HydrophobicContact CZ-CZ 4.42Å; F69-R180 HydrophobicContact CD1-CG 4.2Å; F69-R180 HydrophobicContact CD2-CB 3.77Å; F69-R180 HydrophobicContact CD2-CG 4.2Å; F69-R180 HydrophobicContact CE1-CG 4.18Å; F69-R180 HydrophobicContact CE2-CB 3.89Å; F69-R180 HydrophobicContact CE2-CG 4.18Å; F69-R180 HydrophobicContact CG-CB 4.17Å; F69-R180 HydrophobicContact CG-CG 4.21Å; F69-R180 HydrophobicContact CZ-CB 4.39Å; F69-R180 HydrophobicContact CZ-CG 4.19Å
70	L	94.4	Very high	95.3	Very high	18 Å²	18	51.2 Å²	51.2	9%	0.094	27%	0.265	C	S	.	.	S	Bend	trans	-81.6	132.3	178.2	-65.8	-172.7	0	0	0	110.8	Y66 W72 C73 M173 A176 F177	Y66-L70 HydrophobicContact CD1-CD1 4.2Å; Y66-L70 HydrophobicContact CD2-CD1 3.44Å; Y66-L70 VanDerWaalsContact CD2-CD1 3.44Å; Y66-L70 HydrophobicContact CE2-CD1 3.95Å; Y66-L70 HydrophobicContact CG-CD1 3.55Å; Y66-L70 HydrophobicContact CG-CG 4.27Å; Y66-L70 VanDerWaalsContact O-CB 3.3Å; Y66-L70 WeakPolarHBondContact O-CB 3.49Å; Y66-L70 PolarHBondContact O-N 2.93Å; L70-W72 PolarHBondContact O-N 3.03Å; L70-C73 HydrophobicContact CB-CB 3.79Å; L70-C73 PolarHBondContact O-N 2.83Å; L70-M173 HydrophobicContact CB-SD 4.32Å; L70-M173 HydrophobicContact CD1-SD 4.48Å; L70-M173 HydrophobicContact CD2-SD 4.08Å; L70-A176 HydrophobicContact CD2-CB 3.88Å; L70-F177 HydrophobicContact CD1-CE2 4.15Å; L70-F177 HydrophobicContact CD1-CZ 4.02Å; L70-F177 HydrophobicContact CD2-CD2 3.84Å; L70-F177 HydrophobicContact CD2-CE2 3.48Å; L70-F177 VanDerWaalsContact CD2-CE2 3.48Å; L70-F177 HydrophobicContact CD2-CG 4.5Å; L70-F177 HydrophobicContact CD2-CZ 3.87Å; L70-F177 HydrophobicContact CG-CE2 4.47Å
71	P	88.2	Confident	95.3	Very high	28 Å²	28	56.8 Å²	56.8	18%	0.182	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	140.7	172.8	34	-42.2	0	0	0	109.1	C73 V172 M173	P71-C73 PolarHBondContact O-N 2.98Å; P71-V172 HydrophobicContact CB-CG1 3.71Å; P71-V172 HydrophobicContact CG-CB 4.3Å; P71-V172 HydrophobicContact CG-CG1 3.56Å; P71-M173 HydrophobicContact CG-CE 4.09Å; P71-M173 HydrophobicContact CG-CG 4.27Å; P71-M173 HydrophobicContact CG-SD 3.68Å; P71-M173 WeakPolarHBondContact O-CE 3.24Å
72	W	87.6	Confident	95.2	Very high	72 Å²	72	57 Å²	57	27%	0.273	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	-7.1	176	-41.3	-62.1	0	0	0	115.9	L70 N74 V92 G93 F94 V169 V172 M173	L70-W72 PolarHBondContact O-N 3.03Å; W72-N74 PolarHBondContact O-N 2.87Å; W72-V92 CarbonylContact O-C 3.37Å; W72-V92 VanDerWaalsContact O-CA 3.3Å; W72-V92 WeakPolarHBondContact O-CA 3.32Å; W72-G93 WeakPolarHBondContact CB-O 3.25Å; W72-G93 PolarHBondContact O-N 2.93Å; W72-F94 HydrophobicContact CB-CE2 4.42Å; W72-F94 AromaticContact CD1-CD1 3.33Å; W72-F94 AromaticContact CD1-CE1 3.19Å; W72-F94 AromaticContact CD1-CG 3.86Å; W72-F94 AromaticContact CD1-CZ 3.52Å; W72-F94 AromaticContact CD2-CE1 3.76Å; W72-F94 HydrophobicContact CD2-CE1 3.76Å; W72-F94 HydrophobicContact CD2-CE2 4.21Å; W72-F94 AromaticContact CD2-CZ 3.48Å; W72-F94 HydrophobicContact CD2-CZ 3.48Å; W72-F94 VanDerWaalsContact CD2-CZ 3.48Å; W72-F94 AromaticContact CE2-CE1 3.19Å; W72-F94 AromaticContact CE2-CZ 3.38Å; W72-F94 HydrophobicContact CE3-CZ 4.19Å; W72-F94 HydrophobicContact CG-CD1 4.18Å; W72-F94 HydrophobicContact CG-CD2 4.39Å; W72-F94 AromaticContact CG-CE1 3.76Å; W72-F94 HydrophobicContact CG-CE1 3.76Å; W72-F94 AromaticContact CG-CE2 3.93Å; W72-F94 HydrophobicContact CG-CE2 3.93Å; W72-F94 HydrophobicContact CG-CG 4.5Å; W72-F94 AromaticContact CG-CZ 3.58Å; W72-F94 HydrophobicContact CG-CZ 3.58Å; W72-F94 AromaticContact CZ2-CE1 3.79Å; W72-F94 HydrophobicContact CZ2-CE1 3.79Å; W72-F94 AromaticContact CZ2-CZ 3.97Å; W72-F94 HydrophobicContact CZ2-CZ 3.97Å; W72-F94 AromaticContact NE1-CD1 3.32Å; W72-F94 VanDerWaalsContact NE1-CD1 3.32Å; W72-F94 AromaticContact NE1-CE1 2.85Å; W72-F94 AromaticContact NE1-CZ 3.45Å; W72-V169 HydrophobicContact CH2-CB 4.45Å; W72-V169 HydrophobicContact CH2-CG2 4.14Å; W72-V169 HydrophobicContact CZ3-CB 4.21Å; W72-V169 HydrophobicContact CZ3-CG1 3.93Å; W72-V169 HydrophobicContact CZ3-CG2 4.13Å; W72-V172 HydrophobicContact CH2-CB 3.84Å; W72-V172 HydrophobicContact CH2-CG1 4.07Å; W72-V172 HydrophobicContact CH2-CG2 4.18Å; W72-V172 HydrophobicContact CZ3-CB 4.31Å; W72-V172 HydrophobicContact CZ3-CG1 4.5Å; W72-M173 HydrophobicContact CE3-CE 3.94Å; W72-M173 HydrophobicContact CZ3-CE 4.38Å; W72-M173 HydrophobicContact CZ3-CG 4.44Å
73	C	92.3	Very high	95.1	Very high	13 Å²	13	62.4 Å²	62.4	9%	0.088	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	104.9	169	-170.8	0	0	0	0	108.6	S67 L70 P71 Q75 G91	S67-C73 WeakPolarHBondContact CA-O 3.12Å; L70-C73 HydrophobicContact CB-CB 3.79Å; L70-C73 PolarHBondContact O-N 2.83Å; P71-C73 PolarHBondContact O-N 2.98Å; C73-Q75 PolarHBondContact SG-O 2.63Å; C73-G91 CarbonylContact C-O 3.5Å; C73-G91 VanDerWaalsContact CA-O 3.3Å; C73-G91 WeakPolarHBondContact CA-O 3.36Å
74	N	91.9	Very high	95.1	Very high	85 Å²	85	65.9 Å²	65.9	46%	0.455	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-9.6	-178.6	61.1	14.7	0	0	0	113.2	W72 G91 S98	W72-N74 PolarHBondContact O-N 2.87Å; N74-G91 PolarHBondContact N-O 3.5Å; N74-G91 VanDerWaalsContact OD1-CA 3.26Å; N74-G91 WeakPolarHBondContact OD1-CA 3.42Å; N74-G91 PolarHBondContact OD1-O 3.1Å; N74-S98 PolarHBondContact ND2-OG 3.37Å
75	Q	94	Very high	95.2	Very high	76 Å²	76	67.2 Å²	67.2	36%	0.355	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	136.4	173.3	-179.7	-178.3	22.4	0	0	109.1	C73 L90 G91 S100	C73-Q75 PolarHBondContact SG-O 2.63Å; Q75-L90 WeakPolarHBondContact O-CA 3.36Å; Q75-G91 PolarHBondContact O-N 3.41Å; Q75-S100 PolarHBondContact OE1-OG 2.85Å
76	S	96.5	Very high	95.2	Very high	11 Å²	11	61.7 Å²	61.7	8%	0.077	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	106.4	173.1	61.1	0	0	0	0	110.7	V63 G64 Y66 S67	V63-S76 VanDerWaalsContact O-CB 3.25Å; V63-S76 WeakPolarHBondContact O-CB 3.41Å; G64-S76 VanDerWaalsContact O-O 3.08Å; G64-S76 PolarHBondContact O-OG 2.77Å; Y66-S76 PolarHBondContact N-OG 2.94Å; S67-S76 VanDerWaalsContact CB-OG 3.31Å; S67-S76 WeakPolarHBondContact CB-OG 3.28Å; S67-S76 PolarHBondContact N-OG 3.01Å; S67-S76 PolarHBondContact OG-OG 3.41Å
77	T	97.2	Very high	95.2	Very high	61 Å²	61	61.6 Å²	61.6	37%	0.374	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	124.2	-173.7	-50.9	0	0	0	0	110.3	L79 A88 C89	T77-L79 HydrophobicContact CG2-CD2 4Å; T77-A88 CarbonylContact O-C 3.52Å; T77-A88 VanDerWaalsContact O-CA 3.23Å; T77-A88 WeakPolarHBondContact O-CA 3.44Å; T77-C89 PolarHBondContact N-O 3.44Å; T77-C89 PolarHBondContact O-N 3Å
78	V	97.7	Very high	95.3	Very high	57 Å²	57	59 Å²	59	35%	0.345	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.2	171.3	179.2	0	0	0	0	108.5	Q81 M86	V78-Q81 HydrophobicContact CG1-CB 4.45Å; V78-M86 HydrophobicContact CB-SD 4.15Å; V78-M86 HydrophobicContact CG1-CG 3.7Å; V78-M86 HydrophobicContact CG1-SD 3.6Å; V78-M86 VanDerWaalsContact CG1-SD 3.6Å; V78-M86 HydrophobicContact CG2-CG 4.47Å; V78-M86 HydrophobicContact CG2-SD 3.45Å; V78-M86 WeakPolarHBondContact CG2-SD 3.48Å
79	L	97.1	Very high	95.3	Very high	97 Å²	97	54.6 Å²	54.6	51%	0.508	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-37.1	179.8	-57	-166.7	0	0	0	112.2	T77 L87 C89 M102	T77-L79 HydrophobicContact CG2-CD2 4Å; L79-L87 HydrophobicContact CB-CD2 4.5Å; L79-L87 PolarHBondContact N-O 3.35Å; L79-C89 HydrophobicContact CD1-CB 4.49Å; L79-M102 HydrophobicContact CD1-CE 3.2Å; L79-M102 HydrophobicContact CD1-SD 3.93Å; L79-M102 HydrophobicContact CG-CE 3.96Å
80	E	97.1	Very high	95.2	Very high	97 Å²	97	53.3 Å²	53.3	45%	0.453	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	138.7	179.3	-61	169.8	-162.8	0	0	109.3	M86 L87 R104	E80-M86 CarbonylContact O-C 3.55Å; E80-M86 VanDerWaalsContact O-CA 3.26Å; E80-M86 WeakPolarHBondContact O-CA 3.31Å; E80-M86 WeakPolarHBondContact O-CG 3.35Å; E80-L87 HydrophobicContact CB-CB 3.9Å; E80-L87 HydrophobicContact CG-CB 4.19Å; E80-L87 HydrophobicContact CG-CD2 4.35Å; E80-L87 PolarHBondContact N-O 3.02Å; E80-L87 PolarHBondContact O-N 3.07Å; E80-R104 IonicContact OE1-NH2 3.29Å; E80-R104 IonicContact OE2-CZ 3.03Å; E80-R104 IonicContact OE2-NH1 2.88Å; E80-R104 IonicContact OE2-NH2 3.02Å; E80-R104 PolarHBondContact OE2-NH2 3.31Å
81	Q	96.4	Very high	95	Very high	117 Å²	117	52.4 Å²	52.4	55%	0.547	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	116.2	174.8	-177.5	66.7	51.1	0	0	109.2	V78 M86	V78-Q81 HydrophobicContact CG1-CB 4.45Å; Q81-M86 PolarHBondContact OE1-SD 2.94Å; Q81-M86 VanDerWaalsContact OE1-SD 3.32Å
82	G	95.7	Very high	95	Very high	29 Å²	29	52.7 Å²	52.7	30%	0.299	28%	0.276	S	S	.	.			trans	-105.3	-171.6	169.4	0	0	0	0	0	111.7	N85	G82-N85 WeakPolarHBondContact CA-O 3.48Å; G82-N85 PolarHBondContact N-O 2.94Å
83	E	95.4	Very high	94.7	Very high	171 Å²	171	49.8 Å²	49.8	80%	0.799	27%	0.269	S	S	*	.	S	Bend	trans	-63.2	-49.1	-179.2	-170.5	-174.6	170.7	0	0	112.5	F107	E83-F107 WeakPolarHBondContact O-CE2 3.29Å; E83-F107 WeakPolarHBondContact O-CZ 3.4Å
84	N	97	Very high	93.6	Very high	79 Å²	79	54.5 Å²	54.5	42%	0.422	29%	0.288	S	S	.	.	S	Bend	trans	-130.4	19.5	-177.5	-67.5	-55.7	0	0	0	112.8	T106 F107	N84-T106 WeakPolarHBondContact O-CA 3.41Å; N84-F107 WeakPolarHBondContact CB-O 3.37Å; N84-F107 PolarHBondContact O-N 2.84Å
85	N	97.5	Very high	92.2	Very high	57 Å²	57	56.6 Å²	56.6	31%	0.305	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.7	179	73.5	93	0	0	0	111.7	G82 R104 I105 T106	G82-N85 WeakPolarHBondContact CA-O 3.48Å; G82-N85 PolarHBondContact N-O 2.94Å; N85-R104 PolarHBondContact OD1-NH1 3.07Å; N85-R104 VanDerWaalsContact OD1-NH1 3.14Å; N85-I105 CarbonylContact C-O 3.58Å; N85-I105 WeakPolarHBondContact CA-O 3.41Å; N85-T106 HydrophobicContact CB-CG2 4.36Å
86	M	97.5	Very high	91.3	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	149.8	-179.3	169.9	173	59.5	0	0	109.8	I61 V63 V78 E80 Q81 R104 I105	I61-M86 HydrophobicContact CD1-CE 4Å; V63-M86 HydrophobicContact CB-CE 3.78Å; V63-M86 HydrophobicContact CG2-CE 3.5Å; V63-M86 VanDerWaalsContact CG2-CE 3.5Å; V78-M86 HydrophobicContact CB-SD 4.15Å; V78-M86 HydrophobicContact CG1-CG 3.7Å; V78-M86 HydrophobicContact CG1-SD 3.6Å; V78-M86 VanDerWaalsContact CG1-SD 3.6Å; V78-M86 HydrophobicContact CG2-CG 4.47Å; V78-M86 HydrophobicContact CG2-SD 3.45Å; V78-M86 WeakPolarHBondContact CG2-SD 3.48Å; E80-M86 CarbonylContact O-C 3.55Å; E80-M86 VanDerWaalsContact O-CA 3.26Å; E80-M86 WeakPolarHBondContact O-CA 3.31Å; E80-M86 WeakPolarHBondContact O-CG 3.35Å; Q81-M86 PolarHBondContact OE1-SD 2.94Å; Q81-M86 VanDerWaalsContact OE1-SD 3.32Å; M86-R104 WeakPolarHBondContact O-CA 3.32Å; M86-I105 HydrophobicContact CB-CB 4.29Å; M86-I105 HydrophobicContact CE-CB 4.18Å; M86-I105 HydrophobicContact CE-CD1 3.95Å; M86-I105 HydrophobicContact CE-CG1 4.17Å; M86-I105 HydrophobicContact CE-CG2 4.33Å; M86-I105 HydrophobicContact CG-CD1 4.28Å; M86-I105 PolarHBondContact N-O 2.86Å; M86-I105 PolarHBondContact O-N 3.15Å
87	L	97.6	Very high	90.4	Very high	18 Å²	18	63 Å²	63	9%	0.094	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.5	167.1	-173.3	66.4	0	0	0	108.6	L79 E80 M102 R104	L79-L87 HydrophobicContact CB-CD2 4.5Å; L79-L87 PolarHBondContact N-O 3.35Å; E80-L87 HydrophobicContact CB-CB 3.9Å; E80-L87 HydrophobicContact CG-CB 4.19Å; E80-L87 HydrophobicContact CG-CD2 4.35Å; E80-L87 PolarHBondContact N-O 3.02Å; E80-L87 PolarHBondContact O-N 3.07Å; L87-M102 HydrophobicContact CD1-CE 3.89Å; L87-M102 HydrophobicContact CD2-CE 3.85Å; L87-M102 HydrophobicContact CG-CE 3.55Å; L87-R104 HydrophobicContact CD1-CB 4.32Å
88	A	97.4	Very high	89.7	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.4	178	0	0	0	0	0	111.6	V63 T77 M102 S103 I105	V63-A88 HydrophobicContact CG1-CB 3.69Å; T77-A88 CarbonylContact O-C 3.52Å; T77-A88 VanDerWaalsContact O-CA 3.23Å; T77-A88 WeakPolarHBondContact O-CA 3.44Å; A88-M102 CarbonylContact O-C 3.56Å; A88-M102 WeakPolarHBondContact O-CA 3.26Å; A88-M102 WeakPolarHBondContact O-CE 3.31Å; A88-S103 PolarHBondContact N-O 3.18Å; A88-S103 PolarHBondContact O-N 3.25Å; A88-I105 HydrophobicContact CB-CD1 3.87Å
89	C	95.6	Very high	89.2	Confident	18 Å²	18	64.3 Å²	64.3	12%	0.122	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125.4	167	-173.7	0	0	0	0	108.7	T77 L79 M102	T77-C89 PolarHBondContact N-O 3.44Å; T77-C89 PolarHBondContact O-N 3Å; L79-C89 HydrophobicContact CD1-CB 4.49Å; C89-M102 HydrophobicContact CB-CE 4.11Å; C89-M102 HydrophobicContact CB-SD 3.56Å; C89-M102 VanDerWaalsContact CB-SD 3.56Å
90	L	94.6	Very high	88.9	Confident	13 Å²	13	62.4 Å²	62.4	7%	0.068	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.6	177.8	-69.2	173.3	0	0	0	109.5	V63 Y66 Q75 S100 Y101	V63-L90 HydrophobicContact CG1-CD1 4.35Å; V63-L90 HydrophobicContact CG1-CD2 3.8Å; V63-L90 HydrophobicContact CG1-CG 4.32Å; Y66-L90 HydrophobicContact CD2-CD2 4.33Å; Q75-L90 WeakPolarHBondContact O-CA 3.36Å; L90-S100 CarbonylContact O-C 3.59Å; L90-S100 VanDerWaalsContact O-CA 3.28Å; L90-S100 WeakPolarHBondContact O-CA 3.3Å; L90-Y101 HydrophobicContact CB-CD1 4.35Å; L90-Y101 HydrophobicContact CB-CE1 3.86Å; L90-Y101 HydrophobicContact CB-CE2 4.25Å; L90-Y101 HydrophobicContact CD1-CE2 4.13Å; L90-Y101 WeakPolarHBondContact CD1-OH 3.41Å; L90-Y101 PolarHBondContact N-O 2.86Å; L90-Y101 WeakPolarHBondContact O-CD1 3.26Å; L90-Y101 PolarHBondContact O-N 3.26Å
91	G	91.5	Very high	88.7	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127	169.7	0	0	0	0	0	109.9	C73 N74 Q75 E99	C73-G91 CarbonylContact C-O 3.5Å; C73-G91 VanDerWaalsContact CA-O 3.3Å; C73-G91 WeakPolarHBondContact CA-O 3.36Å; N74-G91 PolarHBondContact N-O 3.5Å; N74-G91 VanDerWaalsContact OD1-CA 3.26Å; N74-G91 WeakPolarHBondContact OD1-CA 3.42Å; N74-G91 PolarHBondContact OD1-O 3.1Å; Q75-G91 PolarHBondContact O-N 3.41Å; G91-E99 CarbonylContact C-O 3.53Å; G91-E99 WeakPolarHBondContact CA-O 3.3Å
92	V	87.5	Confident	88.6	Confident	33 Å²	33	55.4 Å²	55.4	20%	0.2	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.6	176.5	-68.9	0	0	0	0	110	W72 E99 Y101 M122	W72-V92 CarbonylContact O-C 3.37Å; W72-V92 VanDerWaalsContact O-CA 3.3Å; W72-V92 WeakPolarHBondContact O-CA 3.32Å; V92-E99 PolarHBondContact N-O 3.05Å; V92-E99 PolarHBondContact O-N 3.16Å; V92-E99 VanDerWaalsContact O-O 3.09Å; V92-Y101 HydrophobicContact CG1-CE1 3.84Å; V92-Y101 HydrophobicContact CG2-CD1 4.07Å; V92-Y101 HydrophobicContact CG2-CE1 3.88Å; V92-M122 HydrophobicContact CG2-CE 3.68Å; V92-M122 HydrophobicContact CG2-SD 3.63Å
93	G	80.6	Confident	88.7	Confident	12 Å²	12	54.1 Å²	54.1	12%	0.124	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	150.1	-176.1	0	0	0	0	0	115.1	W72 L97	W72-G93 WeakPolarHBondContact CB-O 3.25Å; W72-G93 PolarHBondContact O-N 2.93Å; G93-L97 CarbonylContact C-O 3.58Å; G93-L97 WeakPolarHBondContact CA-O 3.14Å
94	F	70.6	Confident	88.8	Confident	112 Å²	112	49 Å²	49	49%	0.491	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	115.7	163.1	-63.8	-103.7	0	0	0	105.6	W72 L97	W72-F94 HydrophobicContact CB-CE2 4.42Å; W72-F94 AromaticContact CD1-CD1 3.33Å; W72-F94 AromaticContact CD1-CE1 3.19Å; W72-F94 AromaticContact CD1-CG 3.86Å; W72-F94 AromaticContact CD1-CZ 3.52Å; W72-F94 AromaticContact CD2-CE1 3.76Å; W72-F94 HydrophobicContact CD2-CE1 3.76Å; W72-F94 HydrophobicContact CD2-CE2 4.21Å; W72-F94 AromaticContact CD2-CZ 3.48Å; W72-F94 HydrophobicContact CD2-CZ 3.48Å; W72-F94 VanDerWaalsContact CD2-CZ 3.48Å; W72-F94 AromaticContact CE2-CE1 3.19Å; W72-F94 AromaticContact CE2-CZ 3.38Å; W72-F94 HydrophobicContact CE3-CZ 4.19Å; W72-F94 HydrophobicContact CG-CD1 4.18Å; W72-F94 HydrophobicContact CG-CD2 4.39Å; W72-F94 AromaticContact CG-CE1 3.76Å; W72-F94 HydrophobicContact CG-CE1 3.76Å; W72-F94 AromaticContact CG-CE2 3.93Å; W72-F94 HydrophobicContact CG-CE2 3.93Å; W72-F94 HydrophobicContact CG-CG 4.5Å; W72-F94 AromaticContact CG-CZ 3.58Å; W72-F94 HydrophobicContact CG-CZ 3.58Å; W72-F94 AromaticContact CZ2-CE1 3.79Å; W72-F94 HydrophobicContact CZ2-CE1 3.79Å; W72-F94 AromaticContact CZ2-CZ 3.97Å; W72-F94 HydrophobicContact CZ2-CZ 3.97Å; W72-F94 AromaticContact NE1-CD1 3.32Å; W72-F94 VanDerWaalsContact NE1-CD1 3.32Å; W72-F94 AromaticContact NE1-CE1 2.85Å; W72-F94 AromaticContact NE1-CZ 3.45Å; F94-L97 CarbonylContact C-O 3.52Å; F94-L97 PolarHBondContact N-O 3.36Å; F94-L97 CarbonylContact O-C 3.58Å; F94-L97 WeakPolarHBondContact O-CA 3.37Å; F94-L97 PolarHBondContact O-N 3.37Å
95	P	61.9	Low	88.8	Confident	129 Å²	129	45.4 Å²	45.4	84%	0.838	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	130.7	179.1	-29.5	35.3	0	0	0	111.7
96	P	75.1	Confident	88.9	Confident	132 Å²	132	45.8 Å²	45.8	86%	0.857	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	cis	-90.1	-2.4	8.4	36.7	-36.6	0	0	0	115.5
97	L	76.9	Confident	88.9	Confident	88 Å²	88	46.8 Å²	46.8	46%	0.461	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	123.7	-177.8	-59.1	176.9	0	0	0	110.1	G93 F94 Y158	G93-L97 CarbonylContact C-O 3.58Å; G93-L97 WeakPolarHBondContact CA-O 3.14Å; F94-L97 CarbonylContact C-O 3.52Å; F94-L97 PolarHBondContact N-O 3.36Å; F94-L97 CarbonylContact O-C 3.58Å; F94-L97 WeakPolarHBondContact O-CA 3.37Å; F94-L97 PolarHBondContact O-N 3.37Å; L97-Y158 HydrophobicContact CD1-CE1 4.05Å
98	S	83.1	Confident	88.9	Confident	64 Å²	64	51.2 Å²	51.2	45%	0.448	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	125.6	175	179.3	0	0	0	0	109	N74	N74-S98 PolarHBondContact ND2-OG 3.37Å
99	E	87.5	Confident	88.9	Confident	83 Å²	83	57 Å²	57	39%	0.388	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.8	178.8	-67	-72.1	-177.8	0	0	108.7	G91 V92 M122	G91-E99 CarbonylContact C-O 3.53Å; G91-E99 WeakPolarHBondContact CA-O 3.3Å; V92-E99 PolarHBondContact N-O 3.05Å; V92-E99 PolarHBondContact O-N 3.16Å; V92-E99 VanDerWaalsContact O-O 3.09Å; E99-M122 HydrophobicContact CB-CE 4.32Å; E99-M122 HydrophobicContact CB-CG 4.49Å; E99-M122 HydrophobicContact CB-SD 3.64Å; E99-M122 HydrophobicContact CG-SD 4.26Å
100	S	90.8	Very high	89	Confident	57 Å²	57	57.4 Å²	57.4	40%	0.399	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	147.5	173.3	-62.2	0	0	0	0	110.8	Q75 L90	Q75-S100 PolarHBondContact OE1-OG 2.85Å; L90-S100 CarbonylContact O-C 3.59Å; L90-S100 VanDerWaalsContact O-CA 3.28Å; L90-S100 WeakPolarHBondContact O-CA 3.3Å
101	Y	92.6	Very high	89.2	Confident	25 Å²	25	62.7 Å²	62.7	10%	0.098	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.8	176.2	69.1	-86.8	0	0	0	111.7	L90 V92 A117 T120 F123 L126	L90-Y101 HydrophobicContact CB-CD1 4.35Å; L90-Y101 HydrophobicContact CB-CE1 3.86Å; L90-Y101 HydrophobicContact CB-CE2 4.25Å; L90-Y101 HydrophobicContact CD1-CE2 4.13Å; L90-Y101 WeakPolarHBondContact CD1-OH 3.41Å; L90-Y101 PolarHBondContact N-O 2.86Å; L90-Y101 WeakPolarHBondContact O-CD1 3.26Å; L90-Y101 PolarHBondContact O-N 3.26Å; V92-Y101 HydrophobicContact CG1-CE1 3.84Å; V92-Y101 HydrophobicContact CG2-CD1 4.07Å; V92-Y101 HydrophobicContact CG2-CE1 3.88Å; Y101-A117 HydrophobicContact CD2-CB 3.97Å; Y101-A117 HydrophobicContact CE2-CB 4.29Å; Y101-T120 HydrophobicContact CD2-CG2 4.36Å; Y101-T120 HydrophobicContact CG-CG2 4.34Å; Y101-F123 AromaticContact CD1-CE2 3.8Å; Y101-F123 HydrophobicContact CD1-CE2 3.8Å; Y101-F123 HydrophobicContact CE1-CE2 4.07Å; Y101-F123 HydrophobicContact CG-CD2 4.47Å; Y101-F123 HydrophobicContact CG-CE2 4.06Å; Y101-L126 HydrophobicContact CD2-CD2 4.46Å; Y101-L126 HydrophobicContact CE1-CD2 4.41Å; Y101-L126 HydrophobicContact CE2-CD2 3.72Å
102	M	95.1	Very high	89.5	Confident	42 Å²	42	64.4 Å²	64.4	21%	0.207	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	141.9	172.5	-63.4	-52.6	-53.8	0	0	109.4	L79 L87 A88 C89 A117 Q118	L79-M102 HydrophobicContact CD1-CE 3.2Å; L79-M102 HydrophobicContact CD1-SD 3.93Å; L79-M102 HydrophobicContact CG-CE 3.96Å; L87-M102 HydrophobicContact CD1-CE 3.89Å; L87-M102 HydrophobicContact CD2-CE 3.85Å; L87-M102 HydrophobicContact CG-CE 3.55Å; A88-M102 CarbonylContact O-C 3.56Å; A88-M102 WeakPolarHBondContact O-CA 3.26Å; A88-M102 WeakPolarHBondContact O-CE 3.31Å; C89-M102 HydrophobicContact CB-CE 4.11Å; C89-M102 HydrophobicContact CB-SD 3.56Å; C89-M102 VanDerWaalsContact CB-SD 3.56Å; M102-A117 CarbonylContact O-C 3.54Å; M102-A117 WeakPolarHBondContact O-CA 3.42Å; M102-Q118 HydrophobicContact CB-CB 4.44Å; M102-Q118 PolarHBondContact O-N 2.82Å
103	S	96.3	Very high	90	Very high	2 Å²	2	63 Å²	63	1%	0.014	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	128	175.3	179.2	0	0	0	0	109.4	A88 I105 S115 V116	A88-S103 PolarHBondContact N-O 3.18Å; A88-S103 PolarHBondContact O-N 3.25Å; S103-I105 VanDerWaalsContact O-CD1 3.24Å; S103-I105 WeakPolarHBondContact O-CD1 3.28Å; S103-S115 WeakPolarHBondContact OG-CB 3.2Å; S103-V116 WeakPolarHBondContact CA-O 3.12Å
104	R	97.8	Very high	90.8	Very high	64 Å²	64	65.7 Å²	65.7	24%	0.242	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125.1	169.7	-176.1	146.5	-69.5	-98.8	5.6	109	E80 N85 M86 L87 S115 V116 Q118	E80-R104 IonicContact OE1-NH2 3.29Å; E80-R104 IonicContact OE2-CZ 3.03Å; E80-R104 IonicContact OE2-NH1 2.88Å; E80-R104 IonicContact OE2-NH2 3.02Å; E80-R104 PolarHBondContact OE2-NH2 3.31Å; N85-R104 PolarHBondContact OD1-NH1 3.07Å; N85-R104 VanDerWaalsContact OD1-NH1 3.14Å; M86-R104 WeakPolarHBondContact O-CA 3.32Å; L87-R104 HydrophobicContact CD1-CB 4.32Å; R104-S115 WeakPolarHBondContact O-CA 3.34Å; R104-V116 PolarHBondContact N-O 3.42Å; R104-V116 PolarHBondContact O-N 2.85Å; R104-Q118 HydrophobicContact CB-CG 4.11Å
105	I	98.3	Very high	92.1	Very high	3 Å²	3	61 Å²	61	2%	0.015	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.7	-178.7	-56.2	92.8	0	0	0	108.2	I61 N85 M86 A88 S103 F107 L113 K114	I61-I105 HydrophobicContact CD1-CG2 4.05Å; N85-I105 CarbonylContact C-O 3.58Å; N85-I105 WeakPolarHBondContact CA-O 3.41Å; M86-I105 HydrophobicContact CB-CB 4.29Å; M86-I105 HydrophobicContact CE-CB 4.18Å; M86-I105 HydrophobicContact CE-CD1 3.95Å; M86-I105 HydrophobicContact CE-CG1 4.17Å; M86-I105 HydrophobicContact CE-CG2 4.33Å; M86-I105 HydrophobicContact CG-CD1 4.28Å; M86-I105 PolarHBondContact N-O 2.86Å; M86-I105 PolarHBondContact O-N 3.15Å; A88-I105 HydrophobicContact CB-CD1 3.87Å; S103-I105 VanDerWaalsContact O-CD1 3.24Å; S103-I105 WeakPolarHBondContact O-CD1 3.28Å; I105-F107 HydrophobicContact CG2-CD1 4.32Å; I105-L113 HydrophobicContact CG2-CD1 4.37Å; I105-L113 HydrophobicContact CG2-CD2 4Å; I105-L113 HydrophobicContact CG2-CG 3.91Å; I105-K114 CarbonylContact C-O 3.55Å; I105-K114 VanDerWaalsContact CA-O 3.28Å; I105-K114 WeakPolarHBondContact CA-O 3.35Å
106	T	98.4	Very high	93.8	Very high	64 Å²	64	57.6 Å²	57.6	39%	0.393	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.6	170.8	54.5	0	0	0	0	108.4	N84 N85 K114	N84-T106 WeakPolarHBondContact O-CA 3.41Å; N85-T106 HydrophobicContact CB-CG2 4.36Å; T106-K114 PolarHBondContact N-O 3.28Å; T106-K114 PolarHBondContact O-N 2.95Å
107	F	98.4	Very high	94.7	Very high	24 Å²	24	52.1 Å²	52.1	11%	0.105	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	154.4	-173.6	56.5	-92.8	0	0	0	112.7	F57 I61 E83 N84 I105 H112 L113	F57-F107 HydrophobicContact CE2-CB 4.26Å; F57-F107 HydrophobicContact CZ-CB 3.94Å; F57-F107 AromaticContact CZ-CD2 3.97Å; F57-F107 HydrophobicContact CZ-CD2 3.97Å; F57-F107 HydrophobicContact CZ-CG 4.21Å; I61-F107 HydrophobicContact CD1-CB 4.17Å; I61-F107 HydrophobicContact CD1-CD1 3.38Å; I61-F107 HydrophobicContact CD1-CD2 4.49Å; I61-F107 HydrophobicContact CD1-CE1 3.81Å; I61-F107 HydrophobicContact CD1-CG 3.76Å; I61-F107 HydrophobicContact CG1-CD1 4.34Å; I61-F107 HydrophobicContact CG1-CE1 4.48Å; I61-F107 HydrophobicContact CG1-CG 4.5Å; E83-F107 WeakPolarHBondContact O-CE2 3.29Å; E83-F107 WeakPolarHBondContact O-CZ 3.4Å; N84-F107 WeakPolarHBondContact CB-O 3.37Å; N84-F107 PolarHBondContact O-N 2.84Å; I105-F107 HydrophobicContact CG2-CD1 4.32Å; F107-H112 CarbonylContact C-O 3.55Å; F107-H112 VanDerWaalsContact CA-O 3.29Å; F107-H112 WeakPolarHBondContact CA-O 2.94Å; F107-H112 WeakPolarHBondContact CB-O 3.45Å; F107-L113 HydrophobicContact CB-CB 4.38Å; F107-L113 HydrophobicContact CB-CG 4.45Å
108	Q	98	Very high	95.3	Very high	110 Å²	110	51.3 Å²	51.3	51%	0.514	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	104.1	167.4	-178	-175.8	37.2	0	0	107.4	P110 K111 H112	Q108-P110 CarbonylContact O-C 3.51Å; Q108-K111 PolarHBondContact O-N 2.88Å; Q108-H112 PolarHBondContact N-O 2.75Å; Q108-H112 PolarHBondContact O-N 3Å
109	R	97.4	Very high	94.6	Very high	122 Å²	122	55.9 Å²	55.9	46%	0.46	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	138.6	-178.3	176.4	176.1	-79.3	-79.3	3.9	111.8	F57 D58	F57-R109 HydrophobicContact CD1-CG 4.22Å; F57-R109 HydrophobicContact CE1-CB 3.88Å; F57-R109 HydrophobicContact CE1-CG 3.96Å; F57-R109 VanDerWaalsContact CE1-CZ 3.48Å; F57-R109 HydrophobicContact CE2-CB 4.48Å; F57-R109 HydrophobicContact CZ-CB 3.84Å; F57-R109 HydrophobicContact CZ-CG 4.37Å; D58-R109 IonicContact OD1-CZ 2.64Å; D58-R109 IonicContact OD1-NH1 3.87Å; D58-R109 PolarHBondContact OD1-NH1 2.93Å; D58-R109 IonicContact OD1-NH2 3.75Å; D58-R109 PolarHBondContact OD1-NH2 3.17Å
110	P	96.8	Very high	93.7	Very high	27 Å²	27	52.4 Å²	52.4	18%	0.175	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	cis	-92.2	15.2	-15.3	37.9	-34.6	0	0	0	112.6	E54 F57 Q108 F132	E54-P110 HydrophobicContact CG-CB 4.15Å; E54-P110 HydrophobicContact CG-CG 4.22Å; F57-P110 HydrophobicContact CB-CB 4.05Å; F57-P110 VanDerWaalsContact CD2-C 3.43Å; F57-P110 HydrophobicContact CD2-CB 4.42Å; F57-P110 VanDerWaalsContact CD2-O 3.28Å; F57-P110 WeakPolarHBondContact CD2-O 3.43Å; F57-P110 HydrophobicContact CG-CB 4.15Å; Q108-P110 CarbonylContact O-C 3.51Å; P110-F132 VanDerWaalsContact O-CB 3.29Å; P110-F132 WeakPolarHBondContact O-CB 3.28Å; P110-F132 VanDerWaalsContact O-CD2 3.26Å; P110-F132 WeakPolarHBondContact O-CD2 3.34Å
111	K	98	Very high	93.1	Very high	123 Å²	123	52.6 Å²	52.6	54%	0.535	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-37.6	-163.2	-61.6	-179.1	-178.7	177.7	0	114.6	Q108 Y131 F132	Q108-K111 PolarHBondContact O-N 2.88Å; K111-Y131 WeakPolarHBondContact O-CA 3.46Å; K111-F132 PolarHBondContact O-N 3.13Å
112	H	98.3	Very high	92.5	Very high	36 Å²	36	52.5 Å²	52.5	17%	0.167	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	140.6	-165.5	174.7	-112.8	0	0	0	112.7	F107 Q108 E129 W130 Y131	F107-H112 CarbonylContact C-O 3.55Å; F107-H112 VanDerWaalsContact CA-O 3.29Å; F107-H112 WeakPolarHBondContact CA-O 2.94Å; F107-H112 WeakPolarHBondContact CB-O 3.45Å; Q108-H112 PolarHBondContact N-O 2.75Å; Q108-H112 PolarHBondContact O-N 3Å; H112-E129 IonicContact CD2-OE1 2.77Å; H112-E129 IonicContact CE1-OE1 3.16Å; H112-E129 PolarHBondContact CE1-OE1 3.29Å; H112-E129 VanDerWaalsContact NE2-CG 3.3Å; H112-E129 WeakPolarHBondContact NE2-CG 3.34Å; H112-E129 IonicContact NE2-OE1 3.99Å; H112-E129 PolarHBondContact NE2-OE1 2.88Å; H112-W130 VanDerWaalsContact CA-O 3.3Å; H112-W130 WeakPolarHBondContact CA-O 3.5Å; H112-W130 PolarHBondContact CD2-O 2.86Å; H112-W130 VanDerWaalsContact CD2-O 3.23Å; H112-Y131 HydrophobicContact CB-CD1 4.2Å; H112-Y131 HydrophobicContact CB-CE1 4.26Å; H112-Y131 AromaticContact CD2-CD1 3.63Å; H112-Y131 AromaticContact CD2-CE1 3.24Å; H112-Y131 WeakPolarHBondContact CD2-CE1 3.4Å; H112-Y131 AromaticContact CD2-CE2 3.85Å; H112-Y131 AromaticContact CD2-CZ 3.36Å; H112-Y131 AromaticContact CG-CE1 3.91Å; H112-Y131 AromaticContact NE2-CE1 3.9Å; H112-Y131 AromaticContact NE2-CZ 3.6Å
113	L	97.8	Very high	91.9	Very high	4 Å²	4	51 Å²	51	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	129.6	173.3	-178.7	160.6	0	0	0	108.7	F57 A60 I61 I105 F107 E129 W130 F132	F57-L113 HydrophobicContact CE2-CB 4.42Å; A60-L113 HydrophobicContact CB-CD1 4.22Å; A60-L113 VanDerWaalsContact O-CD1 3.28Å; A60-L113 WeakPolarHBondContact O-CD1 3.29Å; I61-L113 HydrophobicContact CB-CD1 3.9Å; I61-L113 HydrophobicContact CD1-CD1 3.53Å; I61-L113 HydrophobicContact CD1-CG 4.3Å; I61-L113 HydrophobicContact CG1-CD1 4.28Å; I105-L113 HydrophobicContact CG2-CD1 4.37Å; I105-L113 HydrophobicContact CG2-CD2 4Å; I105-L113 HydrophobicContact CG2-CG 3.91Å; F107-L113 HydrophobicContact CB-CB 4.38Å; F107-L113 HydrophobicContact CB-CG 4.45Å; L113-E129 CarbonylContact O-C 2.89Å; L113-E129 WeakPolarHBondContact O-CA 3.45Å; L113-W130 HydrophobicContact CB-CB 4.25Å; L113-W130 PolarHBondContact N-O 2.79Å; L113-W130 PolarHBondContact O-N 2.89Å; L113-F132 HydrophobicContact CB-CE2 4.47Å
114	K	98.3	Very high	91.5	Very high	69 Å²	69	55.8 Å²	55.8	30%	0.3	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.6	174.7	-177.8	176.8	-172.2	157.6	0	110.2	I105 T106 V116 N128 E129	I105-K114 CarbonylContact C-O 3.55Å; I105-K114 VanDerWaalsContact CA-O 3.28Å; I105-K114 WeakPolarHBondContact CA-O 3.35Å; T106-K114 PolarHBondContact N-O 3.28Å; T106-K114 PolarHBondContact O-N 2.95Å; K114-V116 HydrophobicContact CG-CG2 4.34Å; K114-N128 CarbonylContact C-O 3.59Å; K114-N128 WeakPolarHBondContact CA-O 3.44Å; K114-E129 HydrophobicContact CB-CG 4.37Å
115	S	97.4	Very high	91.2	Very high	13 Å²	13	55.1 Å²	55.1	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.3	172.2	78.8	0	0	0	0	110.6	S103 R104 I127 N128	S103-S115 WeakPolarHBondContact OG-CB 3.2Å; R104-S115 WeakPolarHBondContact O-CA 3.34Å; S115-I127 CarbonylContact O-C 3.54Å; S115-I127 VanDerWaalsContact O-CA 3.31Å; S115-I127 WeakPolarHBondContact O-CA 3.31Å; S115-N128 PolarHBondContact N-O 2.88Å; S115-N128 PolarHBondContact O-N 3.4Å; S115-N128 WeakPolarHBondContact OG-CB 3.31Å; S115-N128 PolarHBondContact OG-ND2 3.02Å; S115-N128 VanDerWaalsContact OG-ND2 3.13Å
116	V	97.1	Very high	90.9	Very high	57 Å²	57	55.6 Å²	55.6	35%	0.345	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.6	177.6	-177.8	0	0	0	0	107.8	S103 R104 K114 I127	S103-V116 WeakPolarHBondContact CA-O 3.12Å; R104-V116 PolarHBondContact N-O 3.42Å; R104-V116 PolarHBondContact O-N 2.85Å; K114-V116 HydrophobicContact CG-CG2 4.34Å; V116-I127 HydrophobicContact CG1-CG1 4.46Å; V116-I127 HydrophobicContact CG2-CG1 4.46Å; V116-I127 HydrophobicContact CG2-CG2 4.44Å
117	A	94.4	Very high	90.7	Very high	18 Å²	18	55.1 Å²	55.1	15%	0.149	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	135	176.7	0	0	0	0	0	110.8	Y101 M102 T120 L126	Y101-A117 HydrophobicContact CD2-CB 3.97Å; Y101-A117 HydrophobicContact CE2-CB 4.29Å; M102-A117 CarbonylContact O-C 3.54Å; M102-A117 WeakPolarHBondContact O-CA 3.42Å; A117-T120 HydrophobicContact CB-CG2 3.74Å; A117-L126 HydrophobicContact CB-CB 3.72Å; A117-L126 HydrophobicContact CB-CD2 4.34Å; A117-L126 HydrophobicContact CB-CG 4.28Å; A117-L126 PolarHBondContact N-O 2.84Å
118	Q	88.7	Confident	90.6	Very high	70 Å²	70	55.1 Å²	55.1	33%	0.327	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.3	-178.1	-64.8	-166.8	-32.1	0	0	110.5	M102 R104 T120	M102-Q118 HydrophobicContact CB-CB 4.44Å; M102-Q118 PolarHBondContact O-N 2.82Å; R104-Q118 HydrophobicContact CB-CG 4.11Å; Q118-T120 WeakPolarHBondContact O-CG2 3.37Å; Q118-T120 PolarHBondContact O-N 2.86Å
119	N	68.4	Low	90.5	Very high	160 Å²	160	51.7 Å²	51.7	86%	0.856	27%	0.269	S	S	*	.	S	Bend	trans	51.9	34.7	168.9	-59	-28.2	0	0	0	114.4
120	T	68.7	Low	90.6	Very high	10 Å²	10	47.2 Å²	47.2	6%	0.061	25%	0.252	C	S	.	.			trans	-92	130.8	-172	75.8	0	0	0	0	111.4	Y101 A117 Q118 F123 R154	Y101-T120 HydrophobicContact CD2-CG2 4.36Å; Y101-T120 HydrophobicContact CG-CG2 4.34Å; A117-T120 HydrophobicContact CB-CG2 3.74Å; Q118-T120 WeakPolarHBondContact O-CG2 3.37Å; Q118-T120 PolarHBondContact O-N 2.86Å; T120-F123 HydrophobicContact CG2-CD2 4.37Å; T120-F123 WeakPolarHBondContact OG1-CA 3.44Å; T120-F123 WeakPolarHBondContact OG1-CB 3.36Å; T120-F123 PolarHBondContact OG1-N 3.09Å; T120-F123 VanDerWaalsContact OG1-N 3.08Å; T120-F123 PolarHBondContact OG1-O 2.79Å; T120-R154 PolarHBondContact O-NE 2.89Å; T120-R154 PolarHBondContact O-NH2 2.85Å
121	G	78.2	Confident	90.6	Very high	62 Å²	62	49.5 Å²	49.5	64%	0.639	26%	0.257	S	S	*	.	S	Bend	trans	-70.1	-23.4	164.1	0	0	0	0	0	112.9	R154	G121-R154 VanDerWaalsContact O-CD 3.29Å; G121-R154 WeakPolarHBondContact O-CD 3.47Å
122	M	80.9	Confident	90.6	Very high	22 Å²	22	44 Å²	44	11%	0.108	23%	0.233	C	C	.	.	S	Bend	trans	-81.3	-40.9	-173.5	-172.7	175.7	-167.7	0	0	113.8	V92 E99 F153 R154	V92-M122 HydrophobicContact CG2-CE 3.68Å; V92-M122 HydrophobicContact CG2-SD 3.63Å; E99-M122 HydrophobicContact CB-CE 4.32Å; E99-M122 HydrophobicContact CB-CG 4.49Å; E99-M122 HydrophobicContact CB-SD 3.64Å; E99-M122 HydrophobicContact CG-SD 4.26Å; M122-F153 HydrophobicContact CE-CD1 4.46Å; M122-F153 HydrophobicContact CE-CE1 3.6Å; M122-F153 HydrophobicContact CE-CZ 4.4Å; M122-F153 HydrophobicContact CG-CD1 4.06Å; M122-F153 HydrophobicContact CG-CE1 3.99Å; M122-F153 HydrophobicContact SD-CE1 4.38Å; M122-R154 PolarHBondContact O-N 2.89Å
123	F	82.9	Confident	90.6	Very high	10 Å²	10	45.3 Å²	45.3	4%	0.044	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.3	-172.8	-53.5	-83.5	0	0	0	112.3	Y101 T120 L126 E152 F153 R154	Y101-F123 AromaticContact CD1-CE2 3.8Å; Y101-F123 HydrophobicContact CD1-CE2 3.8Å; Y101-F123 HydrophobicContact CE1-CE2 4.07Å; Y101-F123 HydrophobicContact CG-CD2 4.47Å; Y101-F123 HydrophobicContact CG-CE2 4.06Å; T120-F123 HydrophobicContact CG2-CD2 4.37Å; T120-F123 WeakPolarHBondContact OG1-CA 3.44Å; T120-F123 WeakPolarHBondContact OG1-CB 3.36Å; T120-F123 PolarHBondContact OG1-N 3.09Å; T120-F123 VanDerWaalsContact OG1-N 3.08Å; T120-F123 PolarHBondContact OG1-O 2.79Å; F123-L126 HydrophobicContact CB-CB 4.28Å; F123-L126 HydrophobicContact CD1-CB 4.06Å; F123-L126 HydrophobicContact CD2-CB 4.26Å; F123-L126 HydrophobicContact CD2-CD2 4.2Å; F123-L126 HydrophobicContact CE1-CB 4.45Å; F123-L126 HydrophobicContact CE1-CD2 4.17Å; F123-L126 HydrophobicContact CE2-CD2 3.84Å; F123-L126 HydrophobicContact CG-CB 3.95Å; F123-L126 HydrophobicContact CZ-CD2 3.83Å; F123-E152 CarbonylContact C-O 3.33Å; F123-E152 WeakPolarHBondContact CA-O 3.21Å; F123-F153 AromaticContact CD1-CD1 3.76Å; F123-F153 HydrophobicContact CD1-CD1 3.76Å; F123-F153 AromaticContact CD1-CE1 3.73Å; F123-F153 HydrophobicContact CD1-CE1 3.73Å; F123-F153 HydrophobicContact CD1-CG 4.45Å; F123-F153 HydrophobicContact CD1-CZ 4.39Å; F123-F153 AromaticContact CE1-CD1 3.63Å; F123-F153 HydrophobicContact CE1-CD1 3.63Å; F123-F153 AromaticContact CE1-CE1 3.08Å; F123-F153 HydrophobicContact CE1-CE1 3.08Å; F123-F153 HydrophobicContact CE1-CE2 4.42Å; F123-F153 HydrophobicContact CE1-CG 4.49Å; F123-F153 AromaticContact CE1-CZ 3.56Å; F123-F153 HydrophobicContact CE1-CZ 3.56Å; F123-F153 HydrophobicContact CZ-CD1 4.44Å; F123-F153 AromaticContact CZ-CE1 3.68Å; F123-F153 HydrophobicContact CZ-CE1 3.68Å; F123-F153 HydrophobicContact CZ-CZ 4.26Å; F123-R154 VanDerWaalsContact C-CG 3.49Å; F123-R154 PolarHBondContact O-NE 2.86Å
124	H	87.6	Confident	90.6	Very high	104 Å²	104	50.2 Å²	50.2	48%	0.481	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-45.2	158.3	-81.9	-63	0	0	0	109.5	E152	H124-E152 HydrophobicContact CB-CB 4.06Å; H124-E152 HydrophobicContact CB-CG 3.87Å; H124-E152 IonicContact CD2-OE1 2.73Å; H124-E152 PolarHBondContact N-O 2.87Å
125	H	90.6	Very high	90.5	Very high	50 Å²	50	47.7 Å²	47.7	23%	0.231	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	153.6	167	62.7	-87.2	0	0	0	109.9	D150 F151 E152	H125-D150 IonicContact CD2-OD2 2.69Å; H125-D150 IonicContact NE2-OD1 2.6Å; H125-D150 IonicContact NE2-OD2 3.02Å; H125-D150 PolarHBondContact NE2-OD2 2.95Å; H125-F151 CarbonylContact O-C 3.59Å; H125-F151 VanDerWaalsContact O-CA 3.24Å; H125-F151 WeakPolarHBondContact O-CA 3.28Å; H125-E152 WeakPolarHBondContact CE1-CB 3.38Å; H125-E152 IonicContact CE1-OE2 4Å; H125-E152 IonicContact ND1-OE2 3.43Å; H125-E152 PolarHBondContact O-N 3.41Å
126	L	92.6	Very high	90.4	Very high	13 Å²	13	50.5 Å²	50.5	7%	0.068	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	116.7	165.6	164.8	64.8	0	0	0	106.6	Y101 A117 F123 V149 D150 F151	Y101-L126 HydrophobicContact CD2-CD2 4.46Å; Y101-L126 HydrophobicContact CE1-CD2 4.41Å; Y101-L126 HydrophobicContact CE2-CD2 3.72Å; A117-L126 HydrophobicContact CB-CB 3.72Å; A117-L126 HydrophobicContact CB-CD2 4.34Å; A117-L126 HydrophobicContact CB-CG 4.28Å; A117-L126 PolarHBondContact N-O 2.84Å; F123-L126 HydrophobicContact CB-CB 4.28Å; F123-L126 HydrophobicContact CD1-CB 4.06Å; F123-L126 HydrophobicContact CD2-CB 4.26Å; F123-L126 HydrophobicContact CD2-CD2 4.2Å; F123-L126 HydrophobicContact CE1-CB 4.45Å; F123-L126 HydrophobicContact CE1-CD2 4.17Å; F123-L126 HydrophobicContact CE2-CD2 3.84Å; F123-L126 HydrophobicContact CG-CB 3.95Å; F123-L126 HydrophobicContact CZ-CD2 3.83Å; L126-V149 HydrophobicContact CD1-CG2 3.84Å; L126-D150 CarbonylContact C-O 3.6Å; L126-D150 WeakPolarHBondContact CA-O 3.28Å; L126-F151 HydrophobicContact CB-CB 4.26Å; L126-F151 HydrophobicContact CD1-CB 3.76Å
127	I	94.8	Very high	90.2	Very high	53 Å²	53	53.9 Å²	53.9	27%	0.272	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.7	-179.7	-56.7	174.4	0	0	0	107	S115 V116 V149 D150	S115-I127 CarbonylContact O-C 3.54Å; S115-I127 VanDerWaalsContact O-CA 3.31Å; S115-I127 WeakPolarHBondContact O-CA 3.31Å; V116-I127 HydrophobicContact CG1-CG1 4.46Å; V116-I127 HydrophobicContact CG2-CG1 4.46Å; V116-I127 HydrophobicContact CG2-CG2 4.44Å; I127-V149 CarbonylContact O-C 3.58Å; I127-V149 WeakPolarHBondContact O-CA 3.4Å; I127-D150 PolarHBondContact N-O 2.88Å; I127-D150 PolarHBondContact O-N 2.95Å
128	N	95	Very high	90.2	Very high	25 Å²	25	60.6 Å²	60.6	13%	0.134	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	142.7	168.4	-52.4	-85.4	0	0	0	109.1	K114 S115 F147 S148 V149	K114-N128 CarbonylContact C-O 3.59Å; K114-N128 WeakPolarHBondContact CA-O 3.44Å; S115-N128 PolarHBondContact N-O 2.88Å; S115-N128 PolarHBondContact O-N 3.4Å; S115-N128 WeakPolarHBondContact OG-CB 3.31Å; S115-N128 PolarHBondContact OG-ND2 3.02Å; S115-N128 VanDerWaalsContact OG-ND2 3.13Å; N128-F147 HydrophobicContact CB-CE2 4.29Å; N128-S148 CarbonylContact C-O 3.57Å; N128-S148 WeakPolarHBondContact CA-O 3.27Å; N128-V149 WeakPolarHBondContact OD1-CB 3.48Å; N128-V149 WeakPolarHBondContact OD1-CG2 3.39Å
129	E	97.4	Very high	90.5	Very high	38 Å²	38	58.8 Å²	58.8	18%	0.178	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	137.4	179.1	-166.7	163.2	-127.7	0	0	110.3	H112 L113 K114 Y131 S148	H112-E129 IonicContact CD2-OE1 2.77Å; H112-E129 IonicContact CE1-OE1 3.16Å; H112-E129 PolarHBondContact CE1-OE1 3.29Å; H112-E129 VanDerWaalsContact NE2-CG 3.3Å; H112-E129 WeakPolarHBondContact NE2-CG 3.34Å; H112-E129 IonicContact NE2-OE1 3.99Å; H112-E129 PolarHBondContact NE2-OE1 2.88Å; L113-E129 CarbonylContact O-C 2.89Å; L113-E129 WeakPolarHBondContact O-CA 3.45Å; K114-E129 HydrophobicContact CB-CG 4.37Å; E129-Y131 HydrophobicContact CG-CD2 4.34Å; E129-Y131 HydrophobicContact CG-CE2 3.69Å; E129-Y131 PolarHBondContact OE1-OH 2.87Å; E129-S148 PolarHBondContact N-O 3.16Å; E129-S148 PolarHBondContact O-N 2.8Å
130	W	97.9	Very high	91.8	Very high	27 Å²	27	56 Å²	56	10%	0.102	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.5	-176.2	-59.8	75.2	0	0	0	108.7	A60 H112 L113 F132 V145 E146 F147 F177	A60-W130 HydrophobicContact CB-CD2 4.49Å; H112-W130 VanDerWaalsContact CA-O 3.3Å; H112-W130 WeakPolarHBondContact CA-O 3.5Å; H112-W130 PolarHBondContact CD2-O 2.86Å; H112-W130 VanDerWaalsContact CD2-O 3.23Å; L113-W130 HydrophobicContact CB-CB 4.25Å; L113-W130 PolarHBondContact N-O 2.79Å; L113-W130 PolarHBondContact O-N 2.89Å; W130-F132 HydrophobicContact CB-CE2 3.71Å; W130-F132 HydrophobicContact CB-CZ 3.74Å; W130-F132 HydrophobicContact CD2-CZ 4.47Å; W130-F132 HydrophobicContact CE3-CE1 4.42Å; W130-F132 HydrophobicContact CE3-CZ 4.21Å; W130-F132 HydrophobicContact CG-CZ 4.33Å; W130-V145 HydrophobicContact CE3-CG1 3.73Å; W130-V145 HydrophobicContact CZ3-CG1 3.99Å; W130-E146 CarbonylContact C-O 3.55Å; W130-E146 VanDerWaalsContact CA-O 3.29Å; W130-E146 WeakPolarHBondContact CA-O 3.46Å; W130-F147 AromaticContact CD2-CD2 3.52Å; W130-F147 HydrophobicContact CD2-CD2 3.52Å; W130-F147 HydrophobicContact CD2-CE2 4.19Å; W130-F147 HydrophobicContact CD2-CG 4.4Å; W130-F147 AromaticContact CE2-CD2 3.22Å; W130-F147 AromaticContact CE2-CE2 3.41Å; W130-F147 VanDerWaalsContact CE2-CE2 3.41Å; W130-F147 HydrophobicContact CE3-CB 4.11Å; W130-F147 AromaticContact CE3-CD2 3.88Å; W130-F147 HydrophobicContact CE3-CD2 3.88Å; W130-F147 HydrophobicContact CE3-CG 4.32Å; W130-F147 HydrophobicContact CG-CD2 4.14Å; W130-F147 AromaticContact CH2-CD2 3.71Å; W130-F147 HydrophobicContact CH2-CD2 3.71Å; W130-F147 HydrophobicContact CH2-CE2 4.06Å; W130-F147 HydrophobicContact CH2-CG 4.09Å; W130-F147 AromaticContact CZ2-CD2 3.33Å; W130-F147 HydrophobicContact CZ2-CD2 3.33Å; W130-F147 AromaticContact CZ2-CE2 3.34Å; W130-F147 HydrophobicContact CZ2-CE2 3.34Å; W130-F147 HydrophobicContact CZ2-CG 4.16Å; W130-F147 HydrophobicContact CZ2-CZ 4.18Å; W130-F147 HydrophobicContact CZ3-CB 4.12Å; W130-F147 AromaticContact CZ3-CD2 3.96Å; W130-F147 HydrophobicContact CZ3-CD2 3.96Å; W130-F147 HydrophobicContact CZ3-CG 4.17Å; W130-F147 AromaticContact NE1-CD2 3.65Å; W130-F147 AromaticContact NE1-CE2 3.57Å; W130-F177 HydrophobicContact CH2-CD2 4.15Å; W130-F177 HydrophobicContact CH2-CE1 4.44Å; W130-F177 HydrophobicContact CH2-CE2 4.04Å; W130-F177 HydrophobicContact CH2-CG 4.41Å; W130-F177 HydrophobicContact CH2-CZ 4.2Å; W130-F177 HydrophobicContact CZ2-CE2 4.18Å; W130-F177 HydrophobicContact CZ2-CZ 4.13Å
131	Y	98.3	Very high	93.1	Very high	76 Å²	76	59.7 Å²	59.7	30%	0.298	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.1	166.9	-65.7	-91.6	0	0	0	109.7	K111 H112 E129 H133 V145 E146	K111-Y131 WeakPolarHBondContact O-CA 3.46Å; H112-Y131 HydrophobicContact CB-CD1 4.2Å; H112-Y131 HydrophobicContact CB-CE1 4.26Å; H112-Y131 AromaticContact CD2-CD1 3.63Å; H112-Y131 AromaticContact CD2-CE1 3.24Å; H112-Y131 WeakPolarHBondContact CD2-CE1 3.4Å; H112-Y131 AromaticContact CD2-CE2 3.85Å; H112-Y131 AromaticContact CD2-CZ 3.36Å; H112-Y131 AromaticContact CG-CE1 3.91Å; H112-Y131 AromaticContact NE2-CE1 3.9Å; H112-Y131 AromaticContact NE2-CZ 3.6Å; E129-Y131 HydrophobicContact CG-CD2 4.34Å; E129-Y131 HydrophobicContact CG-CE2 3.69Å; E129-Y131 PolarHBondContact OE1-OH 2.87Å; Y131-H133 WeakPolarHBondContact CB-NE2 3.39Å; Y131-V145 CarbonylContact O-C 3.57Å; Y131-V145 WeakPolarHBondContact O-CA 3.38Å; Y131-E146 HydrophobicContact CD2-CB 4.49Å; Y131-E146 PolarHBondContact N-O 2.89Å; Y131-E146 PolarHBondContact O-N 2.82Å
132	F	98.2	Very high	94	Very high	7 Å²	7	56.9 Å²	56.9	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	115.3	177.9	-50.7	-89.9	0	0	0	108.2	P53 M56 F57 A60 P110 K111 L113 W130 V145	P53-F132 HydrophobicContact CB-CB 4.05Å; M56-F132 HydrophobicContact CB-CD1 3.75Å; M56-F132 HydrophobicContact CB-CE1 3.73Å; F57-F132 HydrophobicContact CB-CD2 4.2Å; F57-F132 HydrophobicContact CB-CE2 4.2Å; F57-F132 HydrophobicContact CB-CG 4.43Å; F57-F132 HydrophobicContact CB-CZ 4.42Å; F57-F132 AromaticContact CD2-CD2 3.77Å; F57-F132 HydrophobicContact CD2-CD2 3.77Å; F57-F132 AromaticContact CD2-CE2 3.66Å; F57-F132 HydrophobicContact CD2-CE2 3.66Å; F57-F132 HydrophobicContact CG-CD2 4.49Å; F57-F132 HydrophobicContact CG-CE2 4.35Å; A60-F132 HydrophobicContact CB-CE1 4.46Å; A60-F132 HydrophobicContact CB-CZ 3.71Å; P110-F132 VanDerWaalsContact O-CB 3.29Å; P110-F132 WeakPolarHBondContact O-CB 3.28Å; P110-F132 VanDerWaalsContact O-CD2 3.26Å; P110-F132 WeakPolarHBondContact O-CD2 3.34Å; K111-F132 PolarHBondContact O-N 3.13Å; L113-F132 HydrophobicContact CB-CE2 4.47Å; W130-F132 HydrophobicContact CB-CE2 3.71Å; W130-F132 HydrophobicContact CB-CZ 3.74Å; W130-F132 HydrophobicContact CD2-CZ 4.47Å; W130-F132 HydrophobicContact CE3-CE1 4.42Å; W130-F132 HydrophobicContact CE3-CZ 4.21Å; W130-F132 HydrophobicContact CG-CZ 4.33Å; F132-V145 HydrophobicContact CD1-CG2 3.93Å; F132-V145 HydrophobicContact CE1-CG1 4.28Å; F132-V145 HydrophobicContact CE1-CG2 4.21Å
133	H	97.6	Very high	94.8	Very high	63 Å²	63	55.8 Å²	55.8	29%	0.292	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	148.8	179.1	-51.5	-77.2	0	0	0	110.2	Y131 G135 C143 Y144	Y131-H133 WeakPolarHBondContact CB-NE2 3.39Å; H133-G135 PolarHBondContact O-N 2.91Å; H133-C143 CarbonylContact O-C 3.55Å; H133-C143 WeakPolarHBondContact O-CA 3.29Å; H133-C143 VanDerWaalsContact O-CB 3.28Å; H133-C143 WeakPolarHBondContact O-CB 3.3Å; H133-Y144 PolarHBondContact N-O 2.89Å; H133-Y144 PolarHBondContact O-N 3.44Å
134	P	97.2	Very high	95.5	Very high	108 Å²	108	59.1 Å²	59.1	70%	0.701	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-50.3	139.8	167.7	-25.6	34.8	0	0	0	111.4
135	G	96.2	Very high	95.9	Very high	16 Å²	16	54.7 Å²	54.7	17%	0.165	30%	0.296	C	S	.	.			trans	-86.9	-121.1	-177.3	0	0	0	0	0	113	H133 S142	H133-G135 PolarHBondContact O-N 2.91Å; G135-S142 VanDerWaalsContact CA-O 3.31Å; G135-S142 WeakPolarHBondContact CA-O 3.4Å; G135-S142 PolarHBondContact N-O 2.88Å
136	L	96.5	Very high	96.2	Very high	71 Å²	71	53.1 Å²	53.1	37%	0.372	29%	0.289	S	S	.	.	S	Bend	trans	-72	136.8	178.4	-57.5	172.7	0	0	0	110.1	L48 D138 N139 S142 I190	L48-L136 HydrophobicContact CD2-CD2 4.03Å; L48-L136 HydrophobicContact CD2-CG 4.26Å; L136-D138 VanDerWaalsContact C-N 3.26Å; L136-D138 PolarHBondContact O-N 3.4Å; L136-D138 VanDerWaalsContact O-N 3.14Å; L136-N139 HydrophobicContact CB-CB 4.14Å; L136-N139 PolarHBondContact O-N 3.19Å; L136-N139 VanDerWaalsContact O-N 3.07Å; L136-S142 PolarHBondContact N-OG 3.28Å; L136-I190 HydrophobicContact CD1-CD1 4.17Å; L136-I190 HydrophobicContact CD1-CG2 4.15Å
137	P	93.3	Very high	96.3	Very high	128 Å²	128	54 Å²	54	83%	0.831	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-37.1	-175.4	-29.8	35.8	0	0	0	115.3
138	D	93.1	Very high	96.3	Very high	160 Å²	160	52.6 Å²	52.6	86%	0.856	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	14.5	-176.3	-54.5	-55	0	0	0	113.6	L136	L136-D138 VanDerWaalsContact C-N 3.26Å; L136-D138 PolarHBondContact O-N 3.4Å; L136-D138 VanDerWaalsContact O-N 3.14Å
139	N	95.6	Very high	96.1	Very high	31 Å²	31	52.3 Å²	52.3	17%	0.166	29%	0.286	C	S	.	.			trans	-135.2	93.8	178.8	-175.3	-4.1	0	0	0	110.9	L136 N141 S142 S189	L136-N139 HydrophobicContact CB-CB 4.14Å; L136-N139 PolarHBondContact O-N 3.19Å; L136-N139 VanDerWaalsContact O-N 3.07Å; N139-N141 PolarHBondContact O-N 2.96Å; N139-N141 VanDerWaalsContact O-N 3.15Å; N139-N141 WeakPolarHBondContact OD1-CA 3.47Å; N139-N141 WeakPolarHBondContact OD1-CB 3.23Å; N139-N141 PolarHBondContact OD1-N 2.95Å; N139-S142 PolarHBondContact O-N 3.49Å; N139-S142 VanDerWaalsContact O-N 3.11Å; N139-S142 PolarHBondContact O-OG 2.98Å; N139-S189 PolarHBondContact ND2-OG 3.21Å
140	P	94.5	Very high	95.8	Very high	102 Å²	102	52.8 Å²	52.8	66%	0.662	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.6	179.3	26.7	-34.8	0	0	0	112.8	S52 S142	S52-P140 WeakPolarHBondContact CB-O 3.49Å; P140-S142 PolarHBondContact O-N 2.9Å
141	N	96.7	Very high	95.5	Very high	88 Å²	88	52.3 Å²	52.3	47%	0.471	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	37.4	174.2	-64.2	-45.4	0	0	0	111.3	G50 Y51 N139 S189	G50-N141 CarbonylContact C-O 3.56Å; G50-N141 WeakPolarHBondContact CA-O 3.5Å; Y51-N141 VanDerWaalsContact C-C 3.49Å; Y51-N141 CarbonylContact C-O 3.58Å; Y51-N141 WeakPolarHBondContact CA-O 3.25Å; Y51-N141 PolarHBondContact N-O 3.3Å; Y51-N141 CarbonylContact O-C 3.51Å; N139-N141 PolarHBondContact O-N 2.96Å; N139-N141 VanDerWaalsContact O-N 3.15Å; N139-N141 WeakPolarHBondContact OD1-CA 3.47Å; N139-N141 WeakPolarHBondContact OD1-CB 3.23Å; N139-N141 PolarHBondContact OD1-N 2.95Å; N141-S189 WeakPolarHBondContact O-CB 3.34Å; N141-S189 PolarHBondContact O-OG 3.14Å
142	S	97.3	Very high	95	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.014	28%	0.283	C	S	.	.			trans	-139.5	144.4	172.4	69.7	0	0	0	0	111.2	L49 Y51 G135 L136 N139 P140	L49-S142 VanDerWaalsContact O-CA 3.22Å; L49-S142 WeakPolarHBondContact O-CA 3.26Å; L49-S142 WeakPolarHBondContact O-CB 3.38Å; Y51-S142 CarbonylContact O-C 3.11Å; Y51-S142 WeakPolarHBondContact O-CA 3.3Å; Y51-S142 PolarHBondContact O-N 2.77Å; G135-S142 VanDerWaalsContact CA-O 3.31Å; G135-S142 WeakPolarHBondContact CA-O 3.4Å; G135-S142 PolarHBondContact N-O 2.88Å; L136-S142 PolarHBondContact N-OG 3.28Å; N139-S142 PolarHBondContact O-N 3.49Å; N139-S142 VanDerWaalsContact O-N 3.11Å; N139-S142 PolarHBondContact O-OG 2.98Å; P140-S142 PolarHBondContact O-N 2.9Å
143	C	97.5	Very high	94.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	149.5	-179.2	73.3	0	0	0	0	111.8	L49 Y51 P53 M56 H133	L49-C143 PolarHBondContact N-O 3.13Å; L49-C143 PolarHBondContact O-N 3.48Å; Y51-C143 WeakPolarHBondContact O-CB 3.33Å; Y51-C143 PolarHBondContact O-N 3.21Å; Y51-C143 PolarHBondContact O-SG 3.17Å; P53-C143 HydrophobicContact CB-CB 4.4Å; P53-C143 HydrophobicContact CG-CB 3.8Å; M56-C143 VanDerWaalsContact CG-SG 3.59Å; H133-C143 CarbonylContact O-C 3.55Å; H133-C143 WeakPolarHBondContact O-CA 3.29Å; H133-C143 VanDerWaalsContact O-CB 3.28Å; H133-C143 WeakPolarHBondContact O-CB 3.3Å
144	Y	97.1	Very high	93.9	Very high	80 Å²	80	54.7 Å²	54.7	31%	0.314	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.5	160.2	-69.5	-82.9	0	0	0	109.2	R46 R47 L48 H133	R46-Y144 HydrophobicContact CG-CD1 4.1Å; R47-Y144 WeakPolarHBondContact O-CA 3.39Å; L48-Y144 HydrophobicContact CB-CD1 3.95Å; L48-Y144 HydrophobicContact CB-CE1 3.68Å; L48-Y144 HydrophobicContact CD1-CD1 4.25Å; L48-Y144 HydrophobicContact CD1-CD2 4.28Å; L48-Y144 HydrophobicContact CD1-CE1 4.07Å; L48-Y144 HydrophobicContact CD1-CE2 4.07Å; L48-Y144 HydrophobicContact CD1-CG 4.36Å; L48-Y144 HydrophobicContact CG-CE1 4.29Å; H133-Y144 PolarHBondContact N-O 2.89Å; H133-Y144 PolarHBondContact O-N 3.44Å
145	V	96.8	Very high	93.3	Very high	10 Å²	10	51.5 Å²	51.5	6%	0.061	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.9	168	179.8	0	0	0	0	107.8	R46 R47 L49 M56 W130 Y131 F132	R46-V145 CarbonylContact C-O 3.53Å; R46-V145 VanDerWaalsContact CA-O 3.3Å; R46-V145 WeakPolarHBondContact CA-O 3.4Å; R47-V145 PolarHBondContact N-O 2.82Å; R47-V145 PolarHBondContact O-N 3.31Å; L49-V145 HydrophobicContact CD1-CB 4.26Å; L49-V145 HydrophobicContact CD1-CG2 3.56Å; L49-V145 HydrophobicContact CG-CG2 4.27Å; M56-V145 HydrophobicContact CB-CG2 4.19Å; M56-V145 HydrophobicContact CG-CG2 4.25Å; W130-V145 HydrophobicContact CE3-CG1 3.73Å; W130-V145 HydrophobicContact CZ3-CG1 3.99Å; Y131-V145 CarbonylContact O-C 3.57Å; Y131-V145 WeakPolarHBondContact O-CA 3.38Å; F132-V145 HydrophobicContact CD1-CG2 3.93Å; F132-V145 HydrophobicContact CE1-CG1 4.28Å; F132-V145 HydrophobicContact CE1-CG2 4.21Å
146	E	96.5	Very high	92.7	Very high	17 Å²	17	55.1 Å²	55.1	8%	0.079	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125	159.7	-52.9	-155.5	138.3	0	0	108.9	K44 E45 R46 W130 Y131	K44-E146 VanDerWaalsContact CE-OE2 3.26Å; K44-E146 WeakPolarHBondContact CE-OE2 3.25Å; K44-E146 IonicContact NZ-OE2 2.88Å; K44-E146 PolarHBondContact NZ-OE2 3.25Å; E45-E146 CarbonylContact O-C 3.51Å; E45-E146 WeakPolarHBondContact O-CA 3.36Å; R46-E146 HydrophobicContact CB-CG 4.2Å; R46-E146 HydrophobicContact CG-CG 4.07Å; R46-E146 IonicContact CZ-OE1 3.41Å; R46-E146 IonicContact NE-OE1 2.89Å; R46-E146 PolarHBondContact NE-OE1 3.09Å; R46-E146 IonicContact NH2-OE1 3.48Å; R46-E146 PolarHBondContact NH2-OE1 3.03Å; W130-E146 CarbonylContact C-O 3.55Å; W130-E146 VanDerWaalsContact CA-O 3.29Å; W130-E146 WeakPolarHBondContact CA-O 3.46Å; Y131-E146 HydrophobicContact CD2-CB 4.49Å; Y131-E146 PolarHBondContact N-O 2.89Å; Y131-E146 PolarHBondContact O-N 2.82Å
147	F	95.3	Very high	92	Very high	31 Å²	31	56.7 Å²	56.7	14%	0.136	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133	174.2	171.9	-115.7	0	0	0	109.1	Y43 K44 E45 N128 W130 V149	Y43-F147 HydrophobicContact CD1-CD1 4.38Å; Y43-F147 HydrophobicContact CD1-CE1 4.41Å; Y43-F147 HydrophobicContact CE1-CD1 4.41Å; K44-F147 CarbonylContact C-O 3.55Å; K44-F147 VanDerWaalsContact CA-O 3.28Å; K44-F147 WeakPolarHBondContact CA-O 3.27Å; E45-F147 HydrophobicContact CG-CB 4.49Å; E45-F147 PolarHBondContact N-O 3Å; E45-F147 PolarHBondContact O-N 3.36Å; N128-F147 HydrophobicContact CB-CE2 4.29Å; W130-F147 AromaticContact CD2-CD2 3.52Å; W130-F147 HydrophobicContact CD2-CD2 3.52Å; W130-F147 HydrophobicContact CD2-CE2 4.19Å; W130-F147 HydrophobicContact CD2-CG 4.4Å; W130-F147 AromaticContact CE2-CD2 3.22Å; W130-F147 AromaticContact CE2-CE2 3.41Å; W130-F147 VanDerWaalsContact CE2-CE2 3.41Å; W130-F147 HydrophobicContact CE3-CB 4.11Å; W130-F147 AromaticContact CE3-CD2 3.88Å; W130-F147 HydrophobicContact CE3-CD2 3.88Å; W130-F147 HydrophobicContact CE3-CG 4.32Å; W130-F147 HydrophobicContact CG-CD2 4.14Å; W130-F147 AromaticContact CH2-CD2 3.71Å; W130-F147 HydrophobicContact CH2-CD2 3.71Å; W130-F147 HydrophobicContact CH2-CE2 4.06Å; W130-F147 HydrophobicContact CH2-CG 4.09Å; W130-F147 AromaticContact CZ2-CD2 3.33Å; W130-F147 HydrophobicContact CZ2-CD2 3.33Å; W130-F147 AromaticContact CZ2-CE2 3.34Å; W130-F147 HydrophobicContact CZ2-CE2 3.34Å; W130-F147 HydrophobicContact CZ2-CG 4.16Å; W130-F147 HydrophobicContact CZ2-CZ 4.18Å; W130-F147 HydrophobicContact CZ3-CB 4.12Å; W130-F147 AromaticContact CZ3-CD2 3.96Å; W130-F147 HydrophobicContact CZ3-CD2 3.96Å; W130-F147 HydrophobicContact CZ3-CG 4.17Å; W130-F147 AromaticContact NE1-CD2 3.65Å; W130-F147 AromaticContact NE1-CE2 3.57Å; F147-V149 HydrophobicContact CE1-CB 4.28Å; F147-V149 HydrophobicContact CE1-CG1 4.05Å; F147-V149 HydrophobicContact CZ-CB 3.88Å; F147-V149 HydrophobicContact CZ-CG1 4.13Å
148	S	93.5	Very high	91.4	Very high	25 Å²	25	52.8 Å²	52.8	18%	0.175	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.5	167.5	53.2	0	0	0	0	112.4	Y43 N128 E129	Y43-S148 CarbonylContact O-C 3.55Å; Y43-S148 WeakPolarHBondContact O-CA 3.29Å; Y43-S148 WeakPolarHBondContact O-CB 3.48Å; N128-S148 CarbonylContact C-O 3.57Å; N128-S148 WeakPolarHBondContact CA-O 3.27Å; E129-S148 PolarHBondContact N-O 3.16Å; E129-S148 PolarHBondContact O-N 2.8Å
149	V	92.1	Very high	90.9	Very high	18 Å²	18	45.5 Å²	45.5	11%	0.109	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.1	170.9	58.2	0	0	0	0	109.1	S42 Y43 L126 I127 N128 F147 F151	S42-V149 CarbonylContact C-O 3.54Å; S42-V149 WeakPolarHBondContact CA-O 3.46Å; Y43-V149 HydrophobicContact CD1-CG1 4.3Å; Y43-V149 PolarHBondContact N-O 3.05Å; Y43-V149 PolarHBondContact O-N 3.12Å; L126-V149 HydrophobicContact CD1-CG2 3.84Å; I127-V149 CarbonylContact O-C 3.58Å; I127-V149 WeakPolarHBondContact O-CA 3.4Å; N128-V149 WeakPolarHBondContact OD1-CB 3.48Å; N128-V149 WeakPolarHBondContact OD1-CG2 3.39Å; F147-V149 HydrophobicContact CE1-CB 4.28Å; F147-V149 HydrophobicContact CE1-CG1 4.05Å; F147-V149 HydrophobicContact CZ-CB 3.88Å; F147-V149 HydrophobicContact CZ-CG1 4.13Å; V149-F151 HydrophobicContact CG2-CD1 3.96Å
150	D	91.2	Very high	90.2	Very high	48 Å²	48	50 Å²	50	26%	0.257	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.9	176.2	-175.4	47.6	0	0	0	108.8	S40 S42 H125 L126 I127	S40-D150 PolarHBondContact OG-OD1 3.19Å; S42-D150 WeakPolarHBondContact CB-OD1 3.4Å; S42-D150 PolarHBondContact OG-OD1 2.8Å; H125-D150 IonicContact CD2-OD2 2.69Å; H125-D150 IonicContact NE2-OD1 2.6Å; H125-D150 IonicContact NE2-OD2 3.02Å; H125-D150 PolarHBondContact NE2-OD2 2.95Å; L126-D150 CarbonylContact C-O 3.6Å; L126-D150 WeakPolarHBondContact CA-O 3.28Å; I127-D150 PolarHBondContact N-O 2.88Å; I127-D150 PolarHBondContact O-N 2.95Å
151	F	90.1	Very high	89.6	Confident	17 Å²	17	48.7 Å²	48.7	8%	0.075	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	155.6	-174.7	68.6	-80.1	0	0	0	113.6	S40 Q41 H125 L126 V149 F153 A162 F166	S40-F151 WeakPolarHBondContact CA-O 3.37Å; Q41-F151 HydrophobicContact CB-CD1 4.27Å; Q41-F151 HydrophobicContact CB-CE1 3.67Å; Q41-F151 HydrophobicContact CB-CE2 4.02Å; Q41-F151 HydrophobicContact CB-CZ 3.55Å; Q41-F151 HydrophobicContact CG-CE2 4.5Å; Q41-F151 HydrophobicContact CG-CZ 4.26Å; Q41-F151 PolarHBondContact N-O 3.39Å; Q41-F151 WeakPolarHBondContact O-CD1 3.5Å; Q41-F151 PolarHBondContact O-N 3.32Å; H125-F151 CarbonylContact O-C 3.59Å; H125-F151 VanDerWaalsContact O-CA 3.24Å; H125-F151 WeakPolarHBondContact O-CA 3.28Å; L126-F151 HydrophobicContact CB-CB 4.26Å; L126-F151 HydrophobicContact CD1-CB 3.76Å; V149-F151 HydrophobicContact CG2-CD1 3.96Å; F151-F153 AromaticContact CD2-CD2 3.87Å; F151-F153 HydrophobicContact CD2-CD2 3.87Å; F151-F153 AromaticContact CD2-CE2 3.68Å; F151-F153 HydrophobicContact CD2-CE2 3.68Å; F151-F153 HydrophobicContact CD2-CZ 4.38Å; F151-F153 AromaticContact CE2-CD2 3.78Å; F151-F153 HydrophobicContact CE2-CD2 3.78Å; F151-F153 AromaticContact CE2-CE2 3.41Å; F151-F153 HydrophobicContact CE2-CE2 3.41Å; F151-F153 VanDerWaalsContact CE2-CE2 3.41Å; F151-F153 HydrophobicContact CE2-CZ 4.35Å; F151-A162 HydrophobicContact CE2-CB 4.26Å; F151-F166 HydrophobicContact CE1-CD2 4.43Å; F151-F166 AromaticContact CE1-CE2 3.68Å; F151-F166 HydrophobicContact CE1-CE2 3.68Å; F151-F166 HydrophobicContact CZ-CD2 4.16Å; F151-F166 AromaticContact CZ-CE2 3.86Å; F151-F166 HydrophobicContact CZ-CE2 3.86Å
152	E	88.9	Confident	88.7	Confident	36 Å²	36	45.3 Å²	45.3	17%	0.168	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	123.2	170.5	174.2	174	173.7	0	0	108.8	K39 F123 H124 H125	K39-E152 HydrophobicContact CB-CG 3.83Å; K39-E152 WeakPolarHBondContact CB-OE1 3.33Å; K39-E152 WeakPolarHBondContact CD-OE1 3.42Å; K39-E152 WeakPolarHBondContact O-CG 3.4Å; F123-E152 CarbonylContact C-O 3.33Å; F123-E152 WeakPolarHBondContact CA-O 3.21Å; H124-E152 HydrophobicContact CB-CB 4.06Å; H124-E152 HydrophobicContact CB-CG 3.87Å; H124-E152 IonicContact CD2-OE1 2.73Å; H124-E152 PolarHBondContact N-O 2.87Å; H125-E152 WeakPolarHBondContact CE1-CB 3.38Å; H125-E152 IonicContact CE1-OE2 4Å; H125-E152 IonicContact ND1-OE2 3.43Å; H125-E152 PolarHBondContact O-N 3.41Å
153	F	86	Confident	87.8	Confident	28 Å²	28	46.1 Å²	46.1	12%	0.123	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	143.4	173.5	-75.2	-72.7	0	0	0	111	M122 F123 F151 S155 Y158 A162	M122-F153 HydrophobicContact CE-CD1 4.46Å; M122-F153 HydrophobicContact CE-CE1 3.6Å; M122-F153 HydrophobicContact CE-CZ 4.4Å; M122-F153 HydrophobicContact CG-CD1 4.06Å; M122-F153 HydrophobicContact CG-CE1 3.99Å; M122-F153 HydrophobicContact SD-CE1 4.38Å; F123-F153 AromaticContact CD1-CD1 3.76Å; F123-F153 HydrophobicContact CD1-CD1 3.76Å; F123-F153 AromaticContact CD1-CE1 3.73Å; F123-F153 HydrophobicContact CD1-CE1 3.73Å; F123-F153 HydrophobicContact CD1-CG 4.45Å; F123-F153 HydrophobicContact CD1-CZ 4.39Å; F123-F153 AromaticContact CE1-CD1 3.63Å; F123-F153 HydrophobicContact CE1-CD1 3.63Å; F123-F153 AromaticContact CE1-CE1 3.08Å; F123-F153 HydrophobicContact CE1-CE1 3.08Å; F123-F153 HydrophobicContact CE1-CE2 4.42Å; F123-F153 HydrophobicContact CE1-CG 4.49Å; F123-F153 AromaticContact CE1-CZ 3.56Å; F123-F153 HydrophobicContact CE1-CZ 3.56Å; F123-F153 HydrophobicContact CZ-CD1 4.44Å; F123-F153 AromaticContact CZ-CE1 3.68Å; F123-F153 HydrophobicContact CZ-CE1 3.68Å; F123-F153 HydrophobicContact CZ-CZ 4.26Å; F151-F153 AromaticContact CD2-CD2 3.87Å; F151-F153 HydrophobicContact CD2-CD2 3.87Å; F151-F153 AromaticContact CD2-CE2 3.68Å; F151-F153 HydrophobicContact CD2-CE2 3.68Å; F151-F153 HydrophobicContact CD2-CZ 4.38Å; F151-F153 AromaticContact CE2-CD2 3.78Å; F151-F153 HydrophobicContact CE2-CD2 3.78Å; F151-F153 AromaticContact CE2-CE2 3.41Å; F151-F153 HydrophobicContact CE2-CE2 3.41Å; F151-F153 VanDerWaalsContact CE2-CE2 3.41Å; F151-F153 HydrophobicContact CE2-CZ 4.35Å; F153-S155 VanDerWaalsContact C-N 3.35Å; F153-Y158 HydrophobicContact CD1-CD2 4.32Å; F153-Y158 HydrophobicContact CD1-CG 4.28Å; F153-A162 HydrophobicContact CD2-CB 4.21Å; F153-A162 HydrophobicContact CE2-CB 3.6Å
154	R	86.6	Confident	87.1	Confident	132 Å²	132	52 Å²	52	50%	0.498	27%	0.265	S	S	.	.	S	Bend	trans	-70.4	-34.5	170.1	-59.5	-162.2	-175.5	179.2	-8.8	112.2	T120 G121 M122 F123 P156	T120-R154 PolarHBondContact O-NE 2.89Å; T120-R154 PolarHBondContact O-NH2 2.85Å; G121-R154 VanDerWaalsContact O-CD 3.29Å; G121-R154 WeakPolarHBondContact O-CD 3.47Å; M122-R154 PolarHBondContact O-N 2.89Å; F123-R154 VanDerWaalsContact C-CG 3.49Å; F123-R154 PolarHBondContact O-NE 2.86Å; R154-P156 WeakPolarHBondContact O-CD 3.49Å
155	S	84.4	Confident	86.4	Confident	41 Å²	41	53 Å²	53	29%	0.287	27%	0.271	S	S	.	.	S	Bend	trans	-87.6	122.8	179.7	-179.4	0	0	0	0	111.2	F153 L157 Y158 S159	F153-S155 VanDerWaalsContact C-N 3.35Å; S155-L157 PolarHBondContact O-N 2.86Å; S155-L157 PolarHBondContact OG-N 2.78Å; S155-Y158 VanDerWaalsContact CB-CD2 3.5Å; S155-Y158 PolarHBondContact O-N 3.48Å; S155-Y158 VanDerWaalsContact O-N 3.14Å; S155-S159 PolarHBondContact O-N 2.74Å; S155-S159 VanDerWaalsContact O-N 3.1Å
156	P	83.2	Confident	85.6	Confident	92 Å²	92	53 Å²	53	60%	0.597	27%	0.27	S	S	*	.	H	α-helix	trans	-58.6	-27.8	173.1	-24.4	34.4	0	0	0	113.3	R154 K160	R154-P156 WeakPolarHBondContact O-CD 3.49Å; P156-K160 WeakPolarHBondContact O-CB 3.24Å; P156-K160 PolarHBondContact O-N 3.42Å
157	L	82.4	Confident	85	Confident	105 Å²	105	55.6 Å²	55.6	55%	0.55	29%	0.285	S	S	.	.	H	α-helix	trans	-64.9	-48	175.8	179.2	62.2	0	0	0	111.1	S155 K160 I161	S155-L157 PolarHBondContact O-N 2.86Å; S155-L157 PolarHBondContact OG-N 2.78Å; L157-K160 PolarHBondContact O-N 2.8Å; L157-I161 HydrophobicContact CD1-CD1 4.08Å; L157-I161 HydrophobicContact CG-CD1 4.09Å; L157-I161 WeakPolarHBondContact O-CG1 3.35Å; L157-I161 PolarHBondContact O-N 2.88Å
158	Y	81.6	Confident	84.5	Confident	46 Å²	46	59.8 Å²	59.8	18%	0.18	31%	0.305	C	S	.	.	H	α-helix	trans	-64.3	-42.8	177.1	-69	-43.9	0	0	0	111.5	L97 F153 S155 K160 I161 A162	L97-Y158 HydrophobicContact CD1-CE1 4.05Å; F153-Y158 HydrophobicContact CD1-CD2 4.32Å; F153-Y158 HydrophobicContact CD1-CG 4.28Å; S155-Y158 VanDerWaalsContact CB-CD2 3.5Å; S155-Y158 PolarHBondContact O-N 3.48Å; S155-Y158 VanDerWaalsContact O-N 3.14Å; Y158-K160 VanDerWaalsContact C-N 3.34Å; Y158-K160 PolarHBondContact O-N 2.72Å; Y158-I161 PolarHBondContact O-N 2.85Å; Y158-A162 VanDerWaalsContact O-CB 3.31Å; Y158-A162 WeakPolarHBondContact O-CB 3.36Å; Y158-A162 PolarHBondContact O-N 2.79Å
159	S	81.1	Confident	84	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.049	31%	0.309	C	S	.	.	H	α-helix	trans	-56.5	-45.4	174.6	175.1	0	0	0	0	112	S155 A162 G163	S155-S159 PolarHBondContact O-N 2.74Å; S155-S159 VanDerWaalsContact O-N 3.1Å; S159-A162 PolarHBondContact O-N 2.97Å; S159-G163 PolarHBondContact O-N 3.44Å
160	K	82	Confident	83.6	Confident	126 Å²	126	60.6 Å²	60.6	55%	0.548	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-45.5	177.6	-173.2	176.2	-178.4	178	0	112.6	P156 L157 Y158 G163 L164	P156-K160 WeakPolarHBondContact O-CB 3.24Å; P156-K160 PolarHBondContact O-N 3.42Å; L157-K160 PolarHBondContact O-N 2.8Å; Y158-K160 VanDerWaalsContact C-N 3.34Å; Y158-K160 PolarHBondContact O-N 2.72Å; K160-G163 PolarHBondContact O-N 3.43Å; K160-L164 HydrophobicContact CG-CD1 4.39Å; K160-L164 WeakPolarHBondContact O-CG 3.33Å; K160-L164 PolarHBondContact O-N 3.09Å; K160-L164 VanDerWaalsContact O-N 3.13Å
161	I	80.7	Confident	83.3	Confident	73 Å²	73	62 Å²	62	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-46.8	178.9	-67.2	168.3	0	0	0	110.3	L157 Y158 G163 L164 F165	L157-I161 HydrophobicContact CD1-CD1 4.08Å; L157-I161 HydrophobicContact CG-CD1 4.09Å; L157-I161 WeakPolarHBondContact O-CG1 3.35Å; L157-I161 PolarHBondContact O-N 2.88Å; Y158-I161 PolarHBondContact O-N 2.85Å; I161-G163 VanDerWaalsContact C-N 3.34Å; I161-G163 PolarHBondContact O-N 3.01Å; I161-L164 PolarHBondContact O-N 3.34Å; I161-F165 HydrophobicContact CG2-CD2 4.13Å; I161-F165 WeakPolarHBondContact O-CD2 3.45Å; I161-F165 PolarHBondContact O-N 2.82Å; I161-F165 VanDerWaalsContact O-N 3.15Å
162	A	78	Confident	83.3	Confident	18 Å²	18	63.8 Å²	63.8	15%	0.149	33%	0.331	C	S	.	.	H	α-helix	trans	-59.1	-45.2	178	0	0	0	0	0	111.4	F151 F153 Y158 S159 L164 F165 F166	F151-A162 HydrophobicContact CE2-CB 4.26Å; F153-A162 HydrophobicContact CD2-CB 4.21Å; F153-A162 HydrophobicContact CE2-CB 3.6Å; Y158-A162 VanDerWaalsContact O-CB 3.31Å; Y158-A162 WeakPolarHBondContact O-CB 3.36Å; Y158-A162 PolarHBondContact O-N 2.79Å; S159-A162 PolarHBondContact O-N 2.97Å; A162-L164 VanDerWaalsContact C-N 3.34Å; A162-L164 PolarHBondContact O-N 3.3Å; A162-F165 PolarHBondContact O-N 3.16Å; A162-F166 VanDerWaalsContact O-CA 3.25Å; A162-F166 WeakPolarHBondContact O-CA 3.08Å; A162-F166 VanDerWaalsContact O-CB 3.27Å; A162-F166 WeakPolarHBondContact O-CB 3.34Å; A162-F166 PolarHBondContact O-N 2.87Å
163	G	79.3	Confident	83.2	Confident	19 Å²	19	64.6 Å²	64.6	20%	0.196	34%	0.336	C	S	.	.	H	α-helix	trans	-60.4	-38.7	176.9	0	0	0	0	0	114	S159 K160 I161	S159-G163 PolarHBondContact O-N 3.44Å; K160-G163 PolarHBondContact O-N 3.43Å; I161-G163 VanDerWaalsContact C-N 3.34Å; I161-G163 PolarHBondContact O-N 3.01Å
164	L	83.1	Confident	83.4	Confident	122 Å²	122	64.2 Å²	64.2	64%	0.639	34%	0.336	S	S	*	.	H	α-helix	trans	-69.2	-35.9	178.9	-71.2	172.3	0	0	0	113.1	K160 I161 A162	K160-L164 HydrophobicContact CG-CD1 4.39Å; K160-L164 WeakPolarHBondContact O-CG 3.33Å; K160-L164 PolarHBondContact O-N 3.09Å; K160-L164 VanDerWaalsContact O-N 3.13Å; I161-L164 PolarHBondContact O-N 3.34Å; A162-L164 VanDerWaalsContact C-N 3.34Å; A162-L164 PolarHBondContact O-N 3.3Å
165	F	80.6	Confident	83.6	Confident	101 Å²	101	61.7 Å²	61.7	44%	0.443	33%	0.332	S	S	.	.	H	α-helix	trans	-113.7	12.4	-173.1	-61.7	-74.3	0	0	0	114.2	I161 A162 D167 Q168 V169	I161-F165 HydrophobicContact CG2-CD2 4.13Å; I161-F165 WeakPolarHBondContact O-CD2 3.45Å; I161-F165 PolarHBondContact O-N 2.82Å; I161-F165 VanDerWaalsContact O-N 3.15Å; A162-F165 PolarHBondContact O-N 3.16Å; F165-D167 VanDerWaalsContact C-N 3.35Å; F165-D167 PolarHBondContact O-N 3.04Å; F165-Q168 WeakPolarHBondContact O-CB 3.34Å; F165-Q168 PolarHBondContact O-N 3.24Å; F165-Q168 VanDerWaalsContact O-N 3.09Å; F165-V169 WeakPolarHBondContact O-CG2 3.46Å; F165-V169 PolarHBondContact O-N 2.86Å
166	F	81.8	Confident	84.2	Confident	10 Å²	10	60.2 Å²	60.2	4%	0.044	32%	0.323	C	S	.	.	H	α-helix	trans	-53.2	-47.8	-171.9	-171.1	-105	0	0	0	113.3	Y43 F151 A162 Q168 V169 V170 Y200 K202	Y43-F166 AromaticContact CD2-CE1 3.98Å; Y43-F166 HydrophobicContact CD2-CE1 3.98Å; Y43-F166 HydrophobicContact CD2-CZ 4.45Å; Y43-F166 HydrophobicContact CG-CE1 4.05Å; Y43-F166 HydrophobicContact CG-CZ 4.06Å; F151-F166 HydrophobicContact CE1-CD2 4.43Å; F151-F166 AromaticContact CE1-CE2 3.68Å; F151-F166 HydrophobicContact CE1-CE2 3.68Å; F151-F166 HydrophobicContact CZ-CD2 4.16Å; F151-F166 AromaticContact CZ-CE2 3.86Å; F151-F166 HydrophobicContact CZ-CE2 3.86Å; A162-F166 VanDerWaalsContact O-CA 3.25Å; A162-F166 WeakPolarHBondContact O-CA 3.08Å; A162-F166 VanDerWaalsContact O-CB 3.27Å; A162-F166 WeakPolarHBondContact O-CB 3.34Å; A162-F166 PolarHBondContact O-N 2.87Å; F166-Q168 VanDerWaalsContact C-N 3.28Å; F166-Q168 PolarHBondContact O-N 2.73Å; F166-V169 PolarHBondContact O-N 3.32Å; F166-V169 VanDerWaalsContact O-N 3.17Å; F166-V170 HydrophobicContact CD1-CG2 4.11Å; F166-V170 HydrophobicContact CE1-CG2 3.62Å; F166-V170 HydrophobicContact CE2-CG2 4.17Å; F166-V170 HydrophobicContact CZ-CG2 3.64Å; F166-V170 WeakPolarHBondContact O-CG2 3.24Å; F166-V170 PolarHBondContact O-N 2.96Å; F166-Y200 AromaticContact CD1-CE2 3.93Å; F166-Y200 HydrophobicContact CD1-CE2 3.93Å; F166-Y200 HydrophobicContact CE1-CD2 4.34Å; F166-Y200 HydrophobicContact CE1-CE2 4.05Å; F166-K202 HydrophobicContact CD1-CG 4.46Å
167	D	82.5	Confident	84.7	Confident	72 Å²	72	56.8 Å²	56.8	39%	0.385	30%	0.298	S	S	.	.	H	α-helix	trans	-63.3	-37.1	-178.1	-64.4	-37.4	0	0	0	112.8	F165 T171 Y200 K202	F165-D167 VanDerWaalsContact C-N 3.35Å; F165-D167 PolarHBondContact O-N 3.04Å; D167-T171 VanDerWaalsContact O-CB 3.28Å; D167-T171 WeakPolarHBondContact O-CB 3.33Å; D167-T171 PolarHBondContact O-N 2.91Å; D167-T171 PolarHBondContact O-OG1 2.86Å; D167-Y200 VanDerWaalsContact OD1-CE2 3.29Å; D167-Y200 WeakPolarHBondContact OD1-CE2 3.41Å; D167-Y200 VanDerWaalsContact OD1-CZ 3.27Å; D167-Y200 PolarHBondContact OD1-OH 3.22Å; D167-Y200 PolarHBondContact OD2-OH 3.4Å; D167-K202 IonicContact OD1-NZ 3.64Å; D167-K202 IonicContact OD2-NZ 2.69Å; D167-K202 PolarHBondContact OD2-NZ 2.71Å
168	Q	84.6	Confident	85.2	Confident	119 Å²	119	52.5 Å²	52.5	56%	0.556	28%	0.275	S	S	*	.	H	α-helix	trans	-68.8	-44.2	177.5	-173.1	171.3	5.7	0	0	110	F165 F166 T171 V172	F165-Q168 WeakPolarHBondContact O-CB 3.34Å; F165-Q168 PolarHBondContact O-N 3.24Å; F165-Q168 VanDerWaalsContact O-N 3.09Å; F166-Q168 VanDerWaalsContact C-N 3.28Å; F166-Q168 PolarHBondContact O-N 2.73Å; Q168-T171 PolarHBondContact O-N 3.43Å; Q168-V172 HydrophobicContact CG-CG2 4.38Å; Q168-V172 WeakPolarHBondContact O-CG2 3.21Å; Q168-V172 PolarHBondContact O-N 2.88Å
169	V	82.8	Confident	85.9	Confident	44 Å²	44	54.3 Å²	54.3	27%	0.267	29%	0.288	S	S	.	.	H	α-helix	trans	-58.5	-50.7	176.7	172.1	0	0	0	0	110.9	W72 F165 F166 T171 V172 M173	W72-V169 HydrophobicContact CH2-CB 4.45Å; W72-V169 HydrophobicContact CH2-CG2 4.14Å; W72-V169 HydrophobicContact CZ3-CB 4.21Å; W72-V169 HydrophobicContact CZ3-CG1 3.93Å; W72-V169 HydrophobicContact CZ3-CG2 4.13Å; F165-V169 WeakPolarHBondContact O-CG2 3.46Å; F165-V169 PolarHBondContact O-N 2.86Å; F166-V169 PolarHBondContact O-N 3.32Å; F166-V169 VanDerWaalsContact O-N 3.17Å; V169-T171 PolarHBondContact O-N 3.25Å; V169-V172 PolarHBondContact O-N 2.87Å; V169-M173 HydrophobicContact CG1-CG 4.41Å; V169-M173 WeakPolarHBondContact O-CB 3.48Å; V169-M173 WeakPolarHBondContact O-CG 3.22Å; V169-M173 PolarHBondContact O-N 2.79Å
170	V	83.6	Confident	86.7	Confident	17 Å²	17	55.4 Å²	55.4	10%	0.103	29%	0.291	C	S	.	.	H	α-helix	trans	-58.1	-48.4	177.7	170.6	0	0	0	0	111	Y43 F166 V172 M173 V174	Y43-V170 HydrophobicContact CD1-CG1 4.38Å; Y43-V170 HydrophobicContact CD1-CG2 4.32Å; Y43-V170 HydrophobicContact CE1-CG1 3.59Å; Y43-V170 HydrophobicContact CE1-CG2 4.31Å; Y43-V170 HydrophobicContact CE2-CG1 4.41Å; Y43-V170 WeakPolarHBondContact OH-CG1 3.46Å; F166-V170 HydrophobicContact CD1-CG2 4.11Å; F166-V170 HydrophobicContact CE1-CG2 3.62Å; F166-V170 HydrophobicContact CE2-CG2 4.17Å; F166-V170 HydrophobicContact CZ-CG2 3.64Å; F166-V170 WeakPolarHBondContact O-CG2 3.24Å; F166-V170 PolarHBondContact O-N 2.96Å; V170-V172 PolarHBondContact O-N 3.48Å; V170-M173 PolarHBondContact O-N 2.69Å; V170-V174 HydrophobicContact CG1-CG2 4.35Å; V170-V174 WeakPolarHBondContact O-CG2 3.19Å; V170-V174 PolarHBondContact O-N 3.48Å
171	T	86.1	Confident	87.5	Confident	78 Å²	78	49.4 Å²	49.4	48%	0.479	27%	0.265	S	S	.	.	H	α-helix	trans	-60	-46	-178.9	-61.5	0	0	0	0	111.8	D167 Q168 V169 N175	D167-T171 VanDerWaalsContact O-CB 3.28Å; D167-T171 WeakPolarHBondContact O-CB 3.33Å; D167-T171 PolarHBondContact O-N 2.91Å; D167-T171 PolarHBondContact O-OG1 2.86Å; Q168-T171 PolarHBondContact O-N 3.43Å; V169-T171 PolarHBondContact O-N 3.25Å; T171-N175 VanDerWaalsContact O-CB 3.32Å; T171-N175 WeakPolarHBondContact O-CB 3.37Å; T171-N175 PolarHBondContact O-N 2.6Å; T171-N175 PolarHBondContact O-ND2 2.88Å
172	V	88.9	Confident	88.2	Confident	54 Å²	54	50.8 Å²	50.8	33%	0.327	27%	0.269	S	S	.	.	H	α-helix	trans	-68.8	-42.2	-179.3	-176.3	0	0	0	0	110.6	P71 W72 Q168 V169 V170 N175 A176	P71-V172 HydrophobicContact CB-CG1 3.71Å; P71-V172 HydrophobicContact CG-CB 4.3Å; P71-V172 HydrophobicContact CG-CG1 3.56Å; W72-V172 HydrophobicContact CH2-CB 3.84Å; W72-V172 HydrophobicContact CH2-CG1 4.07Å; W72-V172 HydrophobicContact CH2-CG2 4.18Å; W72-V172 HydrophobicContact CZ3-CB 4.31Å; W72-V172 HydrophobicContact CZ3-CG1 4.5Å; Q168-V172 HydrophobicContact CG-CG2 4.38Å; Q168-V172 WeakPolarHBondContact O-CG2 3.21Å; Q168-V172 PolarHBondContact O-N 2.88Å; V169-V172 PolarHBondContact O-N 2.87Å; V170-V172 PolarHBondContact O-N 3.48Å; V172-N175 PolarHBondContact O-N 3.33Å; V172-A176 WeakPolarHBondContact O-CB 3.29Å; V172-A176 PolarHBondContact O-N 2.97Å
173	M	88.7	Confident	89.2	Confident	53 Å²	53	55.3 Å²	55.3	26%	0.261	29%	0.294	S	S	.	.	H	α-helix	trans	-59.8	-51.2	176.9	-78.2	-64.8	-170.8	0	0	112	L70 P71 W72 V169 V170 N175 A176 F177	L70-M173 HydrophobicContact CB-SD 4.32Å; L70-M173 HydrophobicContact CD1-SD 4.48Å; L70-M173 HydrophobicContact CD2-SD 4.08Å; P71-M173 HydrophobicContact CG-CE 4.09Å; P71-M173 HydrophobicContact CG-CG 4.27Å; P71-M173 HydrophobicContact CG-SD 3.68Å; P71-M173 WeakPolarHBondContact O-CE 3.24Å; W72-M173 HydrophobicContact CE3-CE 3.94Å; W72-M173 HydrophobicContact CZ3-CE 4.38Å; W72-M173 HydrophobicContact CZ3-CG 4.44Å; V169-M173 HydrophobicContact CG1-CG 4.41Å; V169-M173 WeakPolarHBondContact O-CB 3.48Å; V169-M173 WeakPolarHBondContact O-CG 3.22Å; V169-M173 PolarHBondContact O-N 2.79Å; V170-M173 PolarHBondContact O-N 2.69Å; M173-N175 VanDerWaalsContact C-N 3.31Å; M173-N175 PolarHBondContact O-N 3.03Å; M173-A176 WeakPolarHBondContact O-CB 3.41Å; M173-A176 PolarHBondContact O-N 3.23Å; M173-A176 VanDerWaalsContact O-N 3.1Å; M173-F177 WeakPolarHBondContact O-CD2 3.28Å; M173-F177 PolarHBondContact O-N 2.81Å; M173-F177 VanDerWaalsContact O-N 3.16Å
174	V	88.2	Confident	90	Very high	20 Å²	20	58.2 Å²	58.2	12%	0.121	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-42.7	179.4	174.7	0	0	0	0	110.9	V170 A176 F177 M178	V170-V174 HydrophobicContact CG1-CG2 4.35Å; V170-V174 WeakPolarHBondContact O-CG2 3.19Å; V170-V174 PolarHBondContact O-N 3.48Å; V174-A176 VanDerWaalsContact C-N 3.28Å; V174-A176 PolarHBondContact O-N 2.85Å; V174-F177 PolarHBondContact O-N 2.6Å; V174-M178 HydrophobicContact CG1-CG 4.25Å; V174-M178 VanDerWaalsContact O-CG 3.31Å; V174-M178 WeakPolarHBondContact O-CG 3.46Å; V174-M178 PolarHBondContact O-N 3.04Å
175	N	92.1	Very high	90.7	Very high	79 Å²	79	55.7 Å²	55.7	42%	0.422	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-35.3	176.7	-74.6	-27.1	0	0	0	112.5	T171 V172 M173 M178 N179	T171-N175 VanDerWaalsContact O-CB 3.32Å; T171-N175 WeakPolarHBondContact O-CB 3.37Å; T171-N175 PolarHBondContact O-N 2.6Å; T171-N175 PolarHBondContact O-ND2 2.88Å; V172-N175 PolarHBondContact O-N 3.33Å; M173-N175 VanDerWaalsContact C-N 3.31Å; M173-N175 PolarHBondContact O-N 3.03Å; N175-M178 PolarHBondContact O-N 3.04Å; N175-N179 VanDerWaalsContact O-CB 3.31Å; N175-N179 WeakPolarHBondContact O-CB 3.43Å; N175-N179 PolarHBondContact O-N 3.26Å; N175-N179 PolarHBondContact O-ND2 3.29Å
176	A	95.6	Very high	91.5	Very high	10 Å²	10	52.5 Å²	52.5	8%	0.083	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-47.7	175.9	0	0	0	0	0	111.8	F69 L70 V172 M173 V174 M178 N179 R180	F69-A176 HydrophobicContact CD2-CB 4.18Å; F69-A176 WeakPolarHBondContact O-CB 3.26Å; L70-A176 HydrophobicContact CD2-CB 3.88Å; V172-A176 WeakPolarHBondContact O-CB 3.29Å; V172-A176 PolarHBondContact O-N 2.97Å; M173-A176 WeakPolarHBondContact O-CB 3.41Å; M173-A176 PolarHBondContact O-N 3.23Å; M173-A176 VanDerWaalsContact O-N 3.1Å; V174-A176 VanDerWaalsContact C-N 3.28Å; V174-A176 PolarHBondContact O-N 2.85Å; A176-M178 PolarHBondContact O-N 3.11Å; A176-N179 PolarHBondContact O-N 3.22Å; A176-R180 PolarHBondContact O-N 3.3Å
177	F	94.9	Very high	92.1	Very high	20 Å²	20	61.3 Å²	61.3	9%	0.088	32%	0.323	C	S	.	.	H	α-helix	trans	-60.9	-44.4	174	-80.6	-79.2	0	0	0	112.4	I59 Y66 F69 L70 W130 M173 V174 N179 R180 A181	I59-F177 HydrophobicContact CG2-CD1 3.7Å; I59-F177 HydrophobicContact CG2-CE1 4.17Å; Y66-F177 HydrophobicContact CE1-CE1 4.08Å; Y66-F177 HydrophobicContact CE1-CZ 4.23Å; Y66-F177 HydrophobicContact CE2-CZ 4.28Å; Y66-F177 AromaticContact CZ-CE1 3.96Å; Y66-F177 AromaticContact CZ-CZ 3.79Å; F69-F177 AromaticContact CE2-CD1 3.95Å; F69-F177 HydrophobicContact CE2-CD1 3.95Å; F69-F177 HydrophobicContact CE2-CE1 4.08Å; F69-F177 HydrophobicContact CE2-CG 4.22Å; F69-F177 HydrophobicContact CE2-CZ 4.48Å; F69-F177 HydrophobicContact CZ-CD1 4.15Å; F69-F177 AromaticContact CZ-CE1 3.91Å; F69-F177 HydrophobicContact CZ-CE1 3.91Å; F69-F177 HydrophobicContact CZ-CZ 4.42Å; L70-F177 HydrophobicContact CD1-CE2 4.15Å; L70-F177 HydrophobicContact CD1-CZ 4.02Å; L70-F177 HydrophobicContact CD2-CD2 3.84Å; L70-F177 HydrophobicContact CD2-CE2 3.48Å; L70-F177 VanDerWaalsContact CD2-CE2 3.48Å; L70-F177 HydrophobicContact CD2-CG 4.5Å; L70-F177 HydrophobicContact CD2-CZ 3.87Å; L70-F177 HydrophobicContact CG-CE2 4.47Å; W130-F177 HydrophobicContact CH2-CD2 4.15Å; W130-F177 HydrophobicContact CH2-CE1 4.44Å; W130-F177 HydrophobicContact CH2-CE2 4.04Å; W130-F177 HydrophobicContact CH2-CG 4.41Å; W130-F177 HydrophobicContact CH2-CZ 4.2Å; W130-F177 HydrophobicContact CZ2-CE2 4.18Å; W130-F177 HydrophobicContact CZ2-CZ 4.13Å; M173-F177 WeakPolarHBondContact O-CD2 3.28Å; M173-F177 PolarHBondContact O-N 2.81Å; M173-F177 VanDerWaalsContact O-N 3.16Å; V174-F177 PolarHBondContact O-N 2.6Å; F177-N179 VanDerWaalsContact C-N 3.31Å; F177-N179 PolarHBondContact O-N 3.39Å; F177-R180 PolarHBondContact O-N 3.46Å; F177-A181 PolarHBondContact O-N 2.89Å
178	M	93.6	Very high	92.8	Very high	14 Å²	14	59.3 Å²	59.3	7%	0.069	31%	0.314	C	S	.	.	H	α-helix	trans	-63.4	-36.6	177.4	-70.6	-55	-57.3	0	0	112.6	L49 Y51 V174 N175 A176 K182	L49-M178 HydrophobicContact CD1-SD 3.74Å; L49-M178 HydrophobicContact CD2-CE 3.73Å; L49-M178 HydrophobicContact CD2-SD 3.44Å; L49-M178 WeakPolarHBondContact CD2-SD 3.44Å; L49-M178 HydrophobicContact CG-SD 4.2Å; Y51-M178 HydrophobicContact CE2-CE 4.15Å; V174-M178 HydrophobicContact CG1-CG 4.25Å; V174-M178 VanDerWaalsContact O-CG 3.31Å; V174-M178 WeakPolarHBondContact O-CG 3.46Å; V174-M178 PolarHBondContact O-N 3.04Å; N175-M178 PolarHBondContact O-N 3.04Å; A176-M178 PolarHBondContact O-N 3.11Å; M178-K182 WeakPolarHBondContact O-CG 3.3Å; M178-K182 PolarHBondContact O-N 3.44Å
179	N	96.2	Very high	93.4	Very high	85 Å²	85	56.1 Å²	56.1	46%	0.455	31%	0.305	S	S	.	.	H	α-helix	trans	-71.8	-37.4	175.2	-72.2	-22.2	0	0	0	111.4	N175 A176 F177 A181 K182 V183	N175-N179 VanDerWaalsContact O-CB 3.31Å; N175-N179 WeakPolarHBondContact O-CB 3.43Å; N175-N179 PolarHBondContact O-N 3.26Å; N175-N179 PolarHBondContact O-ND2 3.29Å; A176-N179 PolarHBondContact O-N 3.22Å; F177-N179 VanDerWaalsContact C-N 3.31Å; F177-N179 PolarHBondContact O-N 3.39Å; N179-A181 VanDerWaalsContact C-N 3.3Å; N179-A181 PolarHBondContact O-N 3.26Å; N179-K182 WeakPolarHBondContact O-CB 3.29Å; N179-K182 PolarHBondContact O-N 3.24Å; N179-K182 VanDerWaalsContact O-N 3.17Å; N179-K182 PolarHBondContact OD1-NZ 2.89Å; N179-V183 WeakPolarHBondContact O-CG2 3.22Å; N179-V183 PolarHBondContact O-N 2.83Å
180	R	97.8	Very high	94	Very high	30 Å²	30	55.9 Å²	55.9	11%	0.113	30%	0.302	C	S	.	.	H	α-helix	trans	-60.7	-40.9	173.2	-172.4	58.1	171.4	-155.7	-7.3	111.6	I59 E68 F69 A176 F177 K182 V183 L184	I59-R180 HydrophobicContact CG1-CG 4.47Å; I59-R180 HydrophobicContact CG2-CB 4.1Å; I59-R180 HydrophobicContact CG2-CG 3.75Å; E68-R180 IonicContact OE2-CZ 3.88Å; E68-R180 IonicContact OE2-NH1 3.45Å; E68-R180 PolarHBondContact OE2-NH1 3.12Å; E68-R180 IonicContact OE2-NH2 3.87Å; E68-R180 PolarHBondContact OE2-NH2 3.47Å; F69-R180 HydrophobicContact CD1-CG 4.2Å; F69-R180 HydrophobicContact CD2-CB 3.77Å; F69-R180 HydrophobicContact CD2-CG 4.2Å; F69-R180 HydrophobicContact CE1-CG 4.18Å; F69-R180 HydrophobicContact CE2-CB 3.89Å; F69-R180 HydrophobicContact CE2-CG 4.18Å; F69-R180 HydrophobicContact CG-CB 4.17Å; F69-R180 HydrophobicContact CG-CG 4.21Å; F69-R180 HydrophobicContact CZ-CB 4.39Å; F69-R180 HydrophobicContact CZ-CG 4.19Å; A176-R180 PolarHBondContact O-N 3.3Å; F177-R180 PolarHBondContact O-N 3.46Å; R180-K182 VanDerWaalsContact C-N 3.34Å; R180-K182 PolarHBondContact O-N 3.06Å; R180-V183 PolarHBondContact O-N 3.1Å; R180-L184 HydrophobicContact CG-CD1 4.12Å; R180-L184 HydrophobicContact CG-CG 4.48Å; R180-L184 WeakPolarHBondContact O-CG 3.28Å; R180-L184 PolarHBondContact O-N 3.33Å
181	A	97.4	Very high	94.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.3	-42.1	173.8	0	0	0	0	0	112.5	Y51 M56 I59 F177 N179 V183 L184 H185	Y51-A181 HydrophobicContact CD1-CB 4.49Å; Y51-A181 HydrophobicContact CD2-CB 3.76Å; Y51-A181 HydrophobicContact CE1-CB 4.25Å; Y51-A181 HydrophobicContact CE2-CB 3.46Å; Y51-A181 VanDerWaalsContact CE2-CB 3.46Å; Y51-A181 HydrophobicContact CG-CB 4.27Å; M56-A181 HydrophobicContact SD-CB 3.99Å; I59-A181 VanDerWaalsContact CD1-CA 3.43Å; I59-A181 HydrophobicContact CD1-CB 3.51Å; F177-A181 PolarHBondContact O-N 2.89Å; N179-A181 VanDerWaalsContact C-N 3.3Å; N179-A181 PolarHBondContact O-N 3.26Å; A181-V183 PolarHBondContact O-N 3.35Å; A181-L184 PolarHBondContact O-N 2.84Å; A181-H185 WeakPolarHBondContact O-CB 3.48Å; A181-H185 PolarHBondContact O-N 3.27Å
182	K	97.2	Very high	94.2	Very high	102 Å²	102	57.7 Å²	57.7	44%	0.443	32%	0.323	S	S	.	.	H	α-helix	trans	-62.6	-41	174.8	-68.7	171.1	-170.3	165.7	0	113	Y51 M178 N179 R180 G186	Y51-K182 WeakPolarHBondContact OH-CA 2.83Å; Y51-K182 VanDerWaalsContact OH-CG 3.27Å; Y51-K182 WeakPolarHBondContact OH-CG 3.29Å; Y51-K182 PolarHBondContact OH-N 3.45Å; M178-K182 WeakPolarHBondContact O-CG 3.3Å; M178-K182 PolarHBondContact O-N 3.44Å; N179-K182 WeakPolarHBondContact O-CB 3.29Å; N179-K182 PolarHBondContact O-N 3.24Å; N179-K182 VanDerWaalsContact O-N 3.17Å; N179-K182 PolarHBondContact OD1-NZ 2.89Å; R180-K182 VanDerWaalsContact C-N 3.34Å; R180-K182 PolarHBondContact O-N 3.06Å; K182-G186 WeakPolarHBondContact CA-O 3.17Å; K182-G186 WeakPolarHBondContact O-CA 3.43Å; K182-G186 PolarHBondContact O-N 2.87Å
183	V	97.4	Very high	94.2	Very high	112 Å²	112	59.7 Å²	59.7	68%	0.679	33%	0.329	S	S	*	.	H	α-helix	trans	-66	-42.2	179.6	170.3	0	0	0	0	111.2	N179 R180 A181	N179-V183 WeakPolarHBondContact O-CG2 3.22Å; N179-V183 PolarHBondContact O-N 2.83Å; R180-V183 PolarHBondContact O-N 3.1Å; A181-V183 PolarHBondContact O-N 3.35Å
184	L	97.6	Very high	94.2	Very high	80 Å²	80	66.4 Å²	66.4	42%	0.419	36%	0.356	S	S	.	.	H	α-helix	trans	-86.4	-30.6	-174.7	-63.6	-177.7	0	0	0	114.3	I59 R180 A181	I59-L184 HydrophobicContact CG1-CD1 4.14Å; R180-L184 HydrophobicContact CG-CD1 4.12Å; R180-L184 HydrophobicContact CG-CG 4.48Å; R180-L184 WeakPolarHBondContact O-CG 3.28Å; R180-L184 PolarHBondContact O-N 3.33Å; A181-L184 PolarHBondContact O-N 2.84Å
185	H	97	Very high	94.4	Very high	69 Å²	69	67.6 Å²	67.6	32%	0.319	37%	0.365	S	S	.	.	H	α-helix	trans	-126.2	2.2	-170.1	-53.3	-50.9	0	0	0	113.7	Y51 N55 A181	Y51-H185 HydrophobicContact CD1-CB 3.92Å; Y51-H185 HydrophobicContact CE1-CB 3.83Å; N55-H185 PolarHBondContact ND2-CD2 3.12Å; N55-H185 PolarHBondContact ND2-CE1 2.86Å; N55-H185 PolarHBondContact ND2-ND1 3.45Å; N55-H185 PolarHBondContact ND2-NE2 2.69Å; A181-H185 WeakPolarHBondContact O-CB 3.48Å; A181-H185 PolarHBondContact O-N 3.27Å
186	G	96.8	Very high	94.3	Very high	34 Å²	34	68.6 Å²	68.6	35%	0.351	37%	0.37	S	S	.	.			trans	75.9	-155.6	178.7	0	0	0	0	0	113.7	Y51 K182	Y51-G186 PolarHBondContact OH-O 2.95Å; K182-G186 WeakPolarHBondContact CA-O 3.17Å; K182-G186 WeakPolarHBondContact O-CA 3.43Å; K182-G186 PolarHBondContact O-N 2.87Å
187	K	95.9	Very high	94.1	Very high	195 Å²	195	71.7 Å²	71.7	85%	0.848	38%	0.384	S	S	*	.	S	Bend	trans	-66.1	136	-174.6	-172.1	-177.9	176.9	-177.6	0	110.5
188	P	96.8	Very high	93.6	Very high	30 Å²	30	74.3 Å²	74.3	20%	0.195	40%	0.399	C	S	.	.			trans	-65.5	148.2	177.3	29.7	-36.8	0	0	0	111.3	G50 Y51 I190	G50-P188 CarbonylContact O-C 3.46Å; G50-P188 VanDerWaalsContact O-CA 3.29Å; G50-P188 WeakPolarHBondContact O-CA 3.42Å; Y51-P188 HydrophobicContact CE1-CB 4.45Å; Y51-P188 HydrophobicContact CE2-CB 3.86Å; Y51-P188 WeakPolarHBondContact OH-CD 3.32Å; P188-I190 WeakPolarHBondContact CB-O 3.26Å; P188-I190 PolarHBondContact O-N 2.81Å
189	S	97.2	Very high	93.2	Very high	53 Å²	53	77.2 Å²	77.2	37%	0.371	41%	0.414	S	S	.	.	S	Bend	trans	-66.1	-24.9	179.7	70.9	0	0	0	0	113.4	G50 N139 N141	G50-S189 WeakPolarHBondContact CA-OG 3.02Å; G50-S189 PolarHBondContact O-N 2.77Å; G50-S189 PolarHBondContact O-OG 2.64Å; N139-S189 PolarHBondContact ND2-OG 3.21Å; N141-S189 WeakPolarHBondContact O-CB 3.34Å; N141-S189 PolarHBondContact O-OG 3.14Å
190	I	95.8	Very high	92.6	Very high	39 Å²	39	77.8 Å²	77.8	20%	0.2	41%	0.411	C	S	.	.	S	Bend	trans	-137.4	160.2	176.9	55.3	169.8	0	0	0	110	L48 G50 L136 P188 S192	L48-I190 HydrophobicContact CD1-CD1 4.16Å; L48-I190 HydrophobicContact CD2-CD1 3.75Å; L48-I190 HydrophobicContact CG-CD1 3.64Å; G50-I190 VanDerWaalsContact CA-CG1 3.43Å; L136-I190 HydrophobicContact CD1-CD1 4.17Å; L136-I190 HydrophobicContact CD1-CG2 4.15Å; P188-I190 WeakPolarHBondContact CB-O 3.26Å; P188-I190 PolarHBondContact O-N 2.81Å; I190-S192 PolarHBondContact O-N 3.14Å
191	A	92.1	Very high	91.8	Very high	73 Å²	73	79.5 Å²	79.5	60%	0.603	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-62.6	136.6	170.6	0	0	0	0	0	110.4	Q193	A191-Q193 PolarHBondContact O-N 2.84Å; A191-Q193 PolarHBondContact O-NE2 2.9Å
192	S	81.3	Confident	90.6	Very high	60 Å²	60	83.8 Å²	83.8	42%	0.42	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-61.1	127.6	174.8	-174.8	0	0	0	0	109.7	I190	I190-S192 PolarHBondContact O-N 3.14Å
193	Q	89.2	Confident	90.2	Very high	95 Å²	95	82.9 Å²	82.9	44%	0.444	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-84.7	154.3	179.8	-59.8	-57.2	-50.2	0	0	110.8	R47 L48 A191	R47-Q193 WeakPolarHBondContact CD-O 3.31Å; R47-Q193 VanDerWaalsContact CG-O 3.29Å; R47-Q193 WeakPolarHBondContact CG-O 3.42Å; L48-Q193 HydrophobicContact CB-CB 4.26Å; L48-Q193 HydrophobicContact CB-CG 3.97Å; L48-Q193 HydrophobicContact CD2-CG 4.15Å; L48-Q193 HydrophobicContact CG-CG 4.36Å; L48-Q193 PolarHBondContact O-N 3.07Å; A191-Q193 PolarHBondContact O-N 2.84Å; A191-Q193 PolarHBondContact O-NE2 2.9Å
194	K	89.2	Confident	89.9	Confident	194 Å²	194	81.4 Å²	81.4	84%	0.843	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-58.8	142.6	168.6	-70.5	-174.6	-180	-179.6	0	109.2
195	P	90.6	Very high	89.4	Confident	45 Å²	45	81.4 Å²	81.4	29%	0.292	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-66.2	144.9	176.2	29.6	-35.6	0	0	0	111.1	E45 R47 I197	E45-P195 HydrophobicContact CB-CB 4.06Å; E45-P195 HydrophobicContact CG-CB 4.41Å; E45-P195 WeakPolarHBondContact OE2-CB 3.49Å; E45-P195 WeakPolarHBondContact OE2-CG 3.45Å; R47-P195 VanDerWaalsContact NH2-CG 3.28Å; P195-I197 HydrophobicContact CB-CD1 3.97Å; P195-I197 HydrophobicContact CG-CD1 3.96Å
196	N	91.9	Very high	89	Confident	100 Å²	100	82.2 Å²	82.2	54%	0.535	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	111.1	160.5	-175.9	-15.2	0	0	0	107.8	E45 R46 L198	E45-N196 CarbonylContact C-O 3.59Å; E45-N196 WeakPolarHBondContact CA-O 3.33Å; R46-N196 PolarHBondContact N-O 2.73Å; R46-N196 PolarHBondContact O-N 3.47Å; N196-L198 PolarHBondContact O-N 3.06Å
197	I	90.3	Very high	88.5	Confident	75 Å²	75	85.2 Å²	85.2	39%	0.385	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	114.5	179	-52.5	-54.6	0	0	0	108.6	Y43 E45 P195	Y43-I197 HydrophobicContact CE2-CD1 3.84Å; Y43-I197 HydrophobicContact CE2-CG2 4.19Å; Y43-I197 WeakPolarHBondContact OH-CD1 3.43Å; E45-I197 HydrophobicContact CB-CD1 3.85Å; P195-I197 HydrophobicContact CB-CD1 3.97Å; P195-I197 HydrophobicContact CG-CD1 3.96Å
198	L	84.1	Confident	88	Confident	75 Å²	75	77.9 Å²	77.9	39%	0.393	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-37	-177.8	-58.2	178	0	0	0	111.7	K44 R46 N196	K44-L198 HydrophobicContact CB-CB 4.19Å; K44-L198 HydrophobicContact CD-CB 4.25Å; K44-L198 HydrophobicContact CD-CD1 4.05Å; K44-L198 HydrophobicContact CG-CB 4.02Å; K44-L198 HydrophobicContact CG-CD1 4.06Å; K44-L198 PolarHBondContact O-N 2.94Å; R46-L198 HydrophobicContact CB-CD1 4.04Å; N196-L198 PolarHBondContact O-N 3.06Å
199	I	84.9	Confident	87.4	Confident	76 Å²	76	81.3 Å²	81.3	39%	0.39	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	136.8	177.7	-58.5	175.5	0	0	0	108.7	Y43 K44	Y43-I199 CarbonylContact C-O 3.58Å; Y43-I199 WeakPolarHBondContact CA-O 3.31Å; K44-I199 HydrophobicContact CB-CB 3.75Å; K44-I199 HydrophobicContact CB-CD1 4.13Å; K44-I199 HydrophobicContact CB-CG1 3.98Å; K44-I199 HydrophobicContact CD-CD1 4.36Å; K44-I199 PolarHBondContact N-O 3.11Å; K44-I199 PolarHBondContact O-N 3.15Å; K44-I199 VanDerWaalsContact O-N 3.09Å
200	Y	84.4	Confident	86.6	Confident	97 Å²	97	83.5 Å²	83.5	38%	0.38	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	96.9	175.6	-174.3	-98.2	0	0	0	110.8	Y43 F166 D167 K202	Y43-Y200 AromaticContact CD2-CD2 3.71Å; Y43-Y200 HydrophobicContact CD2-CD2 3.71Å; Y43-Y200 HydrophobicContact CD2-CE2 4.44Å; Y43-Y200 AromaticContact CE2-CD2 3.93Å; Y43-Y200 HydrophobicContact CE2-CD2 3.93Å; Y43-Y200 HydrophobicContact CE2-CE2 4.49Å; F166-Y200 AromaticContact CD1-CE2 3.93Å; F166-Y200 HydrophobicContact CD1-CE2 3.93Å; F166-Y200 HydrophobicContact CE1-CD2 4.34Å; F166-Y200 HydrophobicContact CE1-CE2 4.05Å; D167-Y200 VanDerWaalsContact OD1-CE2 3.29Å; D167-Y200 WeakPolarHBondContact OD1-CE2 3.41Å; D167-Y200 VanDerWaalsContact OD1-CZ 3.27Å; D167-Y200 PolarHBondContact OD1-OH 3.22Å; D167-Y200 PolarHBondContact OD2-OH 3.4Å; Y200-K202 HydrophobicContact CE1-CD 4.26Å; Y200-K202 HydrophobicContact CE1-CG 4.1Å; Y200-K202 WeakPolarHBondContact OH-CE 3.38Å; Y200-K202 PolarHBondContact OH-NZ 3.22Å
201	N	81.2	Confident	85.9	Confident	65 Å²	65	87.2 Å²	87.2	35%	0.348	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	106.2	-179.7	-73.6	-39.7	0	0	0	108.8	Q41 S42	Q41-N201 VanDerWaalsContact CA-O 3.28Å; Q41-N201 WeakPolarHBondContact CA-O 3.48Å; S42-N201 PolarHBondContact N-O 3Å; S42-N201 PolarHBondContact O-N 2.76Å
202	K	71.2	Confident	85.3	Confident	91 Å²	91	88.5 Å²	88.5	40%	0.396	44%	0.439	S	S	.	.			trans	-88.6	0	170.2	-71.5	-168.6	179.8	167.4	0	112.7	Q41 F166 D167 Y200	Q41-K202 VanDerWaalsContact CG-OXT 3.31Å; Q41-K202 WeakPolarHBondContact CG-OXT 3.38Å; Q41-K202 PolarHBondContact NE2-OXT 3.07Å; F166-K202 HydrophobicContact CD1-CG 4.46Å; D167-K202 IonicContact OD1-NZ 3.64Å; D167-K202 IonicContact OD2-NZ 2.69Å; D167-K202 PolarHBondContact OD2-NZ 2.71Å; Y200-K202 HydrophobicContact CE1-CD 4.26Å; Y200-K202 HydrophobicContact CE1-CG 4.1Å; Y200-K202 WeakPolarHBondContact OH-CE 3.38Å; Y200-K202 PolarHBondContact OH-NZ 3.22Å

Retrieved 202 of 202 residues in 122 ms (Link to these results)

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