A0A090KM77_HUMAN Loading...

HLA class I antigen

AlphaFold DB , UniProt , Accession A0A090KM77, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 366 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	34.6	Very low	39.5	Very low	244 Å²	244	152.5 Å²	152.5	100%	1.202	79%	0.785	S	S	*	*				0	97.4	0	-73.3	166.4	170.2	0	0	108.3
2	R	32.9	Very low	39.6	Very low	248 Å²	248	151.8 Å²	151.8	94%	0.936	78%	0.783	S	S	*	*			trans	-111.2	106.2	169.2	-96.5	-178.5	173.8	167.7	-1.9	105.6	M4	R2-M4 PolarHBondContact O-N 3.23Å
3	V	35.4	Very low	39.4	Very low	145 Å²	145	150.2 Å²	150.2	88%	0.879	78%	0.775	S	S	*	*			trans	-76.1	105.4	173.6	179.1	0	0	0	0	106.3	A5	V3-A5 PolarHBondContact O-N 3.35Å
4	M	38.4	Very low	39.4	Very low	183 Å²	183	144.8 Å²	144.8	90%	0.901	76%	0.757	S	S	*	*			trans	-85.6	97.5	176.8	-155.8	164.4	69.4	0	0	106.8	R2	R2-M4 PolarHBondContact O-N 3.23Å
5	A	41.1	Very low	39.2	Very low	77 Å²	77	139.3 Å²	139.3	64%	0.636	75%	0.749	S	S	*	*			trans	-64.2	139.7	173.9	0	0	0	0	0	109.6	V3 R7	V3-A5 PolarHBondContact O-N 3.35Å; A5-R7 PolarHBondContact O-N 3.12Å
6	P	42.3	Very low	38.9	Very low	92 Å²	92	134.1 Å²	134.1	60%	0.597	74%	0.739	S	S	*	*			trans	-72.5	119.7	-176.2	17	-11.2	0	0	0	110.2	A8 L9	P6-A8 PolarHBondContact O-N 3.26Å; P6-L9 PolarHBondContact O-N 2.9Å; P6-L9 VanDerWaalsContact O-N 3.12Å
7	R	47.5	Very low	38.7	Very low	229 Å²	229	134.8 Å²	134.8	86%	0.864	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-5.8	173	-97.3	177.3	166.2	166.5	-5.5	115	A5	A5-R7 PolarHBondContact O-N 3.12Å
8	A	44.1	Very low	38.8	Very low	72 Å²	72	132.2 Å²	132.2	60%	0.595	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-20.3	175.8	0	0	0	0	0	113.7	P6	P6-A8 PolarHBondContact O-N 3.26Å
9	L	39.3	Very low	38.8	Very low	121 Å²	121	132.8 Å²	132.8	63%	0.634	74%	0.74	S	S	*	*	S	Bend	trans	-84.4	-17.9	-178.5	-126	89.2	0	0	0	113.9	P6	P6-L9 PolarHBondContact O-N 2.9Å; P6-L9 VanDerWaalsContact O-N 3.12Å
10	L	37.4	Very low	38.7	Very low	133 Å²	133	131.2 Å²	131.2	70%	0.696	73%	0.734	S	S	*	*	S	Bend	trans	-83.4	-15.1	-177.8	-96.5	144.2	0	0	0	113.9
11	L	41.9	Very low	38.6	Very low	133 Å²	133	133.7 Å²	133.7	70%	0.696	74%	0.74	S	S	*	*	S	Bend	trans	-89.9	-16.5	177.8	-74.3	166.7	0	0	0	113.6	L13 S14	L11-L13 VanDerWaalsContact C-N 3.34Å; L11-S14 PolarHBondContact O-OG 3.12Å; L11-S14 VanDerWaalsContact O-OG 3.12Å
12	L	39.8	Very low	38.8	Very low	144 Å²	144	127.3 Å²	127.3	75%	0.754	72%	0.715	S	S	*	*	S	Bend	trans	-81.7	-14.4	175.5	-76.6	163.6	0	0	0	113
13	L	37.2	Very low	39.8	Very low	131 Å²	131	122.1 Å²	122.1	69%	0.686	70%	0.696	S	S	*	*	S	Bend	trans	-95.3	-11.2	177.2	-73.3	164.4	0	0	0	113.4	L11	L11-L13 VanDerWaalsContact C-N 3.34Å
14	S	39.1	Very low	40.6	Very low	75 Å²	75	117.4 Å²	117.4	52%	0.524	67%	0.671	S	S	.	*	S	Bend	trans	-90.3	-12.4	176	46.5	0	0	0	0	114.1	L11	L11-S14 PolarHBondContact O-OG 3.12Å; L11-S14 VanDerWaalsContact O-OG 3.12Å
15	G	37.2	Very low	42.2	Very low	62 Å²	62	111.6 Å²	111.6	64%	0.639	65%	0.648	S	S	*	*	S	Bend	trans	-87.1	-13.5	177.9	0	0	0	0	0	115.1
16	G	34.6	Very low	44.6	Very low	57 Å²	57	111.4 Å²	111.4	59%	0.588	64%	0.643	S	S	*	*	S	Bend	trans	-99.1	-5.1	-178	0	0	0	0	0	115.2
17	L	35.8	Very low	47.1	Very low	146 Å²	146	108.4 Å²	108.4	76%	0.764	62%	0.62	S	S	*	*	S	Bend	trans	-97.5	1.3	-176.9	-79.3	163.4	0	0	0	113.8
18	A	39.9	Very low	49.5	Very low	87 Å²	87	98.6 Å²	98.6	72%	0.719	59%	0.587	S	S	*	*	S	Bend	trans	-99.3	2.3	179.9	0	0	0	0	0	114.2
19	L	39.2	Very low	52.1	Low	144 Å²	144	95.2 Å²	95.2	75%	0.754	56%	0.559	S	S	*	*	S	Bend	trans	-133.3	35.7	-174.1	-95.1	158.2	0	0	0	112.7
20	T	35.5	Very low	54.9	Low	101 Å²	101	91.8 Å²	91.8	62%	0.62	54%	0.537	S	S	*	.			trans	-142.9	60.5	158	62.5	0	0	0	0	108	T22	T20-T22 PolarHBondContact O-N 2.98Å
21	E	37.9	Very low	57.8	Low	183 Å²	183	86.3 Å²	86.3	86%	0.855	51%	0.508	S	S	*	.			trans	-62.7	91.7	142	-120.7	175.8	-173.9	0	0	103.8	W23	E21-W23 PolarHBondContact O-N 2.61Å
22	T	39	Very low	60.5	Low	110 Å²	110	84.1 Å²	84.1	68%	0.675	49%	0.492	S	S	*	.			trans	-49.6	119.1	162.7	46.8	0	0	0	0	104.4	T20 A24	T20-T22 PolarHBondContact O-N 2.98Å; T22-A24 PolarHBondContact O-N 2.92Å
23	W	52.3	Low	63.3	Low	140 Å²	140	77.8 Å²	77.8	53%	0.53	46%	0.46	S	S	.	.			trans	-60.1	70.9	168.9	-73.3	76.6	0	0	0	107.8	E21 C25 E288	E21-W23 PolarHBondContact O-N 2.61Å; W23-C25 PolarHBondContact O-N 3Å; W23-E288 HydrophobicContact CD2-CB 3.72Å; W23-E288 VanDerWaalsContact CE3-CA 3.42Å; W23-E288 HydrophobicContact CE3-CB 3Å; W23-E288 HydrophobicContact CE3-CG 4.39Å; W23-E288 HydrophobicContact CH2-CB 3.83Å; W23-E288 HydrophobicContact CZ2-CB 4.42Å; W23-E288 HydrophobicContact CZ3-CB 3.09Å; W23-E288 HydrophobicContact CZ3-CG 4.45Å; W23-E288 VanDerWaalsContact CZ3-N 3.32Å
24	A	53.1	Low	66.2	Low	45 Å²	45	73.7 Å²	73.7	37%	0.372	44%	0.441	S	S	.	.			trans	-82.3	100.1	178	0	0	0	0	0	102.4	T22 S26 P129	T22-A24 PolarHBondContact O-N 2.92Å; A24-S26 PolarHBondContact O-N 3.09Å; A24-P129 HydrophobicContact CB-CB 3.68Å; A24-P129 HydrophobicContact CB-CG 3.2Å; A24-P129 WeakPolarHBondContact O-CG 3.42Å
25	C	72.4	Confident	69.1	Low	61 Å²	61	70.1 Å²	70.1	41%	0.412	42%	0.416	S	S	.	.			trans	-55.4	106.8	-170	-63.5	0	0	0	0	110.1	W23	W23-C25 PolarHBondContact O-N 3Å
26	S	90.9	Very high	71.9	Confident	74 Å²	74	69.3 Å²	69.3	52%	0.517	40%	0.399	S	S	.	.			trans	-82.1	146	164.2	55.4	0	0	0	0	108.6	A24 L127	A24-S26 PolarHBondContact O-N 3.09Å; S26-L127 VanDerWaalsContact CA-O 3.26Å; S26-L127 WeakPolarHBondContact CA-O 2.84Å; S26-L127 WeakPolarHBondContact CB-O 3.35Å
27	H	95.3	Very high	74.8	Confident	28 Å²	28	67.5 Å²	67.5	13%	0.13	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	152.3	177.8	-67.6	-76.9	0	0	0	110.4	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.25Å; H27-D53 WeakPolarHBondContact CA-OD1 3.32Å; H27-D53 IonicContact CE1-OD2 2.75Å; H27-D53 IonicContact CG-OD2 3.56Å; H27-D53 IonicContact ND1-OD1 2.79Å; H27-D53 IonicContact ND1-OD2 3.21Å; H27-D53 PolarHBondContact ND1-OD2 3.14Å; H27-D126 CarbonylContact O-C 3.49Å; H27-D126 WeakPolarHBondContact O-CA 3.48Å; H27-L127 PolarHBondContact N-O 3.26Å; H27-L127 VanDerWaalsContact N-O 3.12Å; H27-L127 PolarHBondContact O-N 2.85Å; H27-L192 HydrophobicContact CB-CD1 4.46Å; H27-L196 HydrophobicContact CB-CD1 3.66Å; H27-L196 HydrophobicContact CB-CD2 3.98Å; H27-L196 HydrophobicContact CB-CG 4.4Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.38Å
28	S	97.3	Very high	77.3	Confident	23 Å²	23	67.5 Å²	67.5	16%	0.161	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	149.9	-179.1	66.9	0	0	0	0	111.5	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.36Å; S28-D53 PolarHBondContact N-OD1 2.94Å; S28-D53 PolarHBondContact O-N 3.01Å; S28-D53 PolarHBondContact OG-OD1 2.78Å; S28-C125 WeakPolarHBondContact CA-O 3.46Å; S28-D126 WeakPolarHBondContact CB-OD1 3.23Å
29	M	98.4	Very high	79.1	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.3	167.8	-174.8	172.1	61.3	0	0	108.2	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.26Å; M29-Y31 HydrophobicContact CG-CE2 4.11Å; M29-Y31 HydrophobicContact SD-CE2 4.09Å; M29-Y51 CarbonylContact C-O 3.53Å; M29-Y51 WeakPolarHBondContact CA-O 3.34Å; M29-V52 HydrophobicContact CG-CG2 4.29Å; M29-F57 HydrophobicContact CG-CE1 4.4Å; M29-F57 HydrophobicContact SD-CZ 4.28Å; M29-G124 CarbonylContact O-C 3.53Å; M29-G124 WeakPolarHBondContact O-CA 3.26Å; M29-C125 PolarHBondContact N-O 2.85Å; M29-C125 PolarHBondContact O-N 2.92Å; M29-C188 HydrophobicContact CE-CB 4.21Å; M29-C188 VanDerWaalsContact CE-O 3.24Å; M29-C188 WeakPolarHBondContact CE-O 3.45Å; M29-C188 WeakPolarHBondContact CE-SG 3.26Å; M29-W191 HydrophobicContact CE-CB 4.04Å; M29-W191 HydrophobicContact SD-CB 4.41Å; M29-L192 HydrophobicContact CB-CB 4.05Å; M29-L192 HydrophobicContact CB-CD1 4.03Å; M29-L192 HydrophobicContact CB-CD2 3.94Å; M29-L192 HydrophobicContact CB-CG 4.22Å; M29-L192 HydrophobicContact CE-CB 4.31Å; M29-L192 HydrophobicContact SD-CB 4.42Å; M29-Y195 HydrophobicContact SD-CD2 3.71Å; M29-Y195 HydrophobicContact SD-CE2 3.56Å; M29-Y195 VanDerWaalsContact SD-CE2 3.56Å
30	R	98.4	Very high	81	Confident	49 Å²	49	63 Å²	63	19%	0.185	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134.1	-175.5	-56.1	-61.7	-177.2	74.9	3.3	110.6	F32 G50 Y51 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.42Å; R30-F32 HydrophobicContact CB-CE2 3.6Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; R30-G50 CarbonylContact O-C 3.57Å; R30-G50 WeakPolarHBondContact O-CA 3.47Å; R30-Y51 PolarHBondContact N-O 3.28Å; R30-Y51 PolarHBondContact O-N 2.97Å; R30-D126 IonicContact CZ-OD1 3.78Å; R30-D126 VanDerWaalsContact CZ-OD1 3.31Å; R30-D126 IonicContact NE-OD1 3.52Å; R30-D126 PolarHBondContact NE-OD1 3.5Å; R30-D126 VanDerWaalsContact NE-OD1 3.09Å; R30-D126 IonicContact NH2-OD1 3.44Å; R30-D126 PolarHBondContact NH2-OD1 2.87Å; R30-D126 IonicContact NH2-OD2 2.58Å; R30-D126 PolarHBondContact NH2-OD2 3.36Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.3Å; R30-Y137 PolarHBondContact NH2-OH 2.83Å
31	Y	98.6	Very high	83.1	Confident	19 Å²	19	67.6 Å²	67.6	8%	0.075	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.7	168.3	-69.1	-93.1	0	0	0	109.2	M29 V49 F57 V58 M122 S123	M29-Y31 HydrophobicContact CE-CE2 4.26Å; M29-Y31 HydrophobicContact CG-CE2 4.11Å; M29-Y31 HydrophobicContact SD-CE2 4.09Å; Y31-V49 CarbonylContact C-O 3.54Å; Y31-V49 WeakPolarHBondContact CA-O 3.07Å; Y31-F57 HydrophobicContact CE1-CZ 4.08Å; Y31-F57 HydrophobicContact CE2-CZ 4.49Å; Y31-F57 AromaticContact CZ-CZ 3.74Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.35Å; Y31-V58 HydrophobicContact CE1-CG2 3.87Å; Y31-M122 WeakPolarHBondContact O-CA 3.32Å; Y31-S123 PolarHBondContact N-O 2.92Å; Y31-S123 PolarHBondContact O-N 3.29Å
32	F	98.8	Very high	85.3	Confident	86 Å²	86	61.7 Å²	61.7	38%	0.377	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123	174.8	-57.1	-94.7	0	0	0	108.1	R30 S48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.42Å; R30-F32 HydrophobicContact CB-CE2 3.6Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; F32-S48 CarbonylContact O-C 3.53Å; F32-S48 VanDerWaalsContact O-CA 3.29Å; F32-S48 WeakPolarHBondContact O-CA 3.49Å; F32-S48 PolarHBondContact O-OG 2.86Å; F32-V49 HydrophobicContact CB-CG2 3.9Å; F32-V49 HydrophobicContact CD2-CG2 4.38Å; F32-V49 PolarHBondContact N-O 3.02Å; F32-V49 PolarHBondContact O-N 2.92Å; F32-Y51 HydrophobicContact CD2-CD2 4.21Å; F32-Y51 HydrophobicContact CE2-CD2 4.27Å; F32-R121 CarbonylContact C-O 3.53Å; F32-R121 WeakPolarHBondContact CA-O 3.32Å; F32-M122 HydrophobicContact CD1-CB 3.98Å; F32-M122 HydrophobicContact CD1-CG 3.68Å; F32-M122 HydrophobicContact CE1-CB 4.09Å; F32-M122 HydrophobicContact CE1-CG 3.37Å; F32-M122 HydrophobicContact CZ-CG 3.98Å
33	S	98.6	Very high	87.8	Confident	11 Å²	11	61.6 Å²	61.6	8%	0.077	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.7	175.6	-54.9	0	0	0	0	109.8	I47 S48 Q120 R121	S33-I47 CarbonylContact C-O 3.58Å; S33-I47 WeakPolarHBondContact CA-O 3.41Å; S33-S48 PolarHBondContact OG-OG 2.87Å; S33-Q120 CarbonylContact O-C 3.6Å; S33-Q120 VanDerWaalsContact O-CA 3.3Å; S33-Q120 WeakPolarHBondContact O-CA 3.4Å; S33-R121 PolarHBondContact N-O 3.35Å; S33-R121 PolarHBondContact O-N 2.94Å
34	T	98.8	Very high	89.8	Confident	45 Å²	45	56.1 Å²	56.1	28%	0.276	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.1	177.6	-57.6	0	0	0	0	109.2	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 4.03Å; T34-F46 WeakPolarHBondContact O-CA 3.43Å; T34-I47 PolarHBondContact N-O 3.34Å; T34-I47 PolarHBondContact O-N 3.18Å; T34-T118 HydrophobicContact CG2-CG2 3.9Å; T34-L119 WeakPolarHBondContact CA-O 3.21Å; T34-Q120 HydrophobicContact CG2-CG 4.08Å
35	S	98.4	Very high	91.9	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.007	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.6	173	-73.9	0	0	0	0	110.5	R45 F46 D98 T118 L119	S35-R45 CarbonylContact C-O 3.58Å; S35-R45 VanDerWaalsContact CA-O 3.27Å; S35-R45 WeakPolarHBondContact CA-O 3.34Å; S35-F46 VanDerWaalsContact OG-CD2 3.31Å; S35-F46 WeakPolarHBondContact OG-CD2 3.4Å; S35-D98 WeakPolarHBondContact OG-CB 3.45Å; S35-D98 PolarHBondContact OG-OD2 3.07Å; S35-T118 CarbonylContact O-C 3.54Å; S35-T118 WeakPolarHBondContact O-CA 3.35Å; S35-L119 PolarHBondContact N-O 2.97Å; S35-L119 PolarHBondContact O-N 3.02Å
36	V	97.6	Very high	93.1	Very high	45 Å²	45	55.9 Å²	55.9	27%	0.273	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	115	179.2	-173.5	0	0	0	0	109.3	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 4.03Å; V36-P44 CarbonylContact O-C 3.52Å; V36-P44 WeakPolarHBondContact O-CA 3.25Å; V36-P44 WeakPolarHBondContact O-CB 3.49Å; V36-R45 PolarHBondContact N-O 3.09Å; V36-R45 PolarHBondContact O-N 3.47Å; V36-H117 WeakPolarHBondContact CA-O 3.16Å; V36-T118 HydrophobicContact CG2-CG2 4.21Å
37	S	94.8	Very high	93.5	Very high	19 Å²	19	54.5 Å²	54.5	13%	0.133	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	130.3	173.5	61.8	0	0	0	0	110.5	S116 H117	S37-S116 WeakPolarHBondContact O-CA 3.37Å; S37-S116 WeakPolarHBondContact O-CB 3.26Å; S37-S116 PolarHBondContact O-OG 2.92Å; S37-H117 PolarHBondContact N-O 3.4Å; S37-H117 PolarHBondContact OG-N 3.33Å; S37-H117 PolarHBondContact OG-O 3.5Å
38	W	87.8	Confident	93.6	Very high	145 Å²	145	53.3 Å²	53.3	55%	0.549	29%	0.286	S	S	.	.			trans	-120.9	98.6	173.1	-159.4	-56.3	0	0	0	110.7	G40 R41	W38-G40 PolarHBondContact O-N 3.19Å; W38-R41 HydrophobicContact CB-CB 4.11Å; W38-R41 HydrophobicContact CG-CB 3.89Å; W38-R41 HydrophobicContact CG-CG 4.06Å; W38-R41 VanDerWaalsContact NE1-CD 3.28Å; W38-R41 PolarHBondContact O-N 3.15Å; W38-R41 VanDerWaalsContact O-N 3.09Å
39	P	79.2	Confident	93.7	Very high	48 Å²	48	53.5 Å²	53.5	31%	0.312	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	130.5	178.9	-27.4	36.5	0	0	0	112	R41 E113 G115	P39-R41 VanDerWaalsContact C-N 3.29Å; P39-R41 PolarHBondContact O-N 3.5Å; P39-E113 WeakPolarHBondContact CB-O 3.26Å; P39-E113 WeakPolarHBondContact CG-O 3.39Å; P39-G115 WeakPolarHBondContact CG-O 3.46Å
40	G	77.2	Confident	93.7	Very high	89 Å²	89	53.4 Å²	53.4	92%	0.918	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	0.6	179.8	0	0	0	0	0	116.2	W38	W38-G40 PolarHBondContact O-N 3.19Å
41	R	81	Confident	93.7	Very high	197 Å²	197	54.4 Å²	54.4	74%	0.743	29%	0.29	S	S	*	.	S	Bend	trans	-114.7	14.3	176.2	-66.8	-167.1	-175.1	-122	-1.3	114.7	W38 P39	W38-R41 HydrophobicContact CB-CB 4.11Å; W38-R41 HydrophobicContact CG-CB 3.89Å; W38-R41 HydrophobicContact CG-CG 4.06Å; W38-R41 VanDerWaalsContact NE1-CD 3.28Å; W38-R41 PolarHBondContact O-N 3.15Å; W38-R41 VanDerWaalsContact O-N 3.09Å; P39-R41 VanDerWaalsContact C-N 3.29Å; P39-R41 PolarHBondContact O-N 3.5Å
42	G	83.9	Confident	93.7	Very high	60 Å²	60	53.5 Å²	53.5	62%	0.619	29%	0.286	S	S	*	.	S	Bend	trans	105.6	-146.4	176.2	0	0	0	0	0	112.5
43	E	90.3	Very high	93.5	Very high	108 Å²	108	50.8 Å²	50.8	51%	0.505	28%	0.276	S	S	.	.	S	Bend	trans	-76.5	155.1	-178.7	-59.9	-56.2	169.8	0	0	112.5	R45 R99	E43-R45 PolarHBondContact O-N 2.81Å; E43-R99 VanDerWaalsContact CD-NE 3.32Å; E43-R99 IonicContact OE1-CZ 3.02Å; E43-R99 IonicContact OE1-NE 2.84Å; E43-R99 IonicContact OE1-NH1 3.89Å; E43-R99 PolarHBondContact OE1-NH1 2.63Å; E43-R99 IonicContact OE1-NH2 3.17Å; E43-R99 PolarHBondContact OE1-NH2 3.48Å; E43-R99 WeakPolarHBondContact OE2-CD 3.42Å; E43-R99 IonicContact OE2-CZ 3.38Å; E43-R99 IonicContact OE2-NE 3.76Å; E43-R99 PolarHBondContact OE2-NE 2.97Å; E43-R99 IonicContact OE2-NH1 3.7Å; E43-R99 IonicContact OE2-NH2 3.33Å; E43-R99 PolarHBondContact OE2-NH2 3.2Å
44	P	94.8	Very high	93.4	Very high	25 Å²	25	53.2 Å²	53.2	16%	0.162	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-55.9	131.1	171.6	-24.2	34.6	0	0	0	111.1	V36 F46 R99 L102	V36-P44 CarbonylContact O-C 3.52Å; V36-P44 WeakPolarHBondContact O-CA 3.25Å; V36-P44 WeakPolarHBondContact O-CB 3.49Å; P44-F46 PolarHBondContact O-N 2.99Å; P44-R99 HydrophobicContact CG-CB 4.41Å; P44-R99 HydrophobicContact CG-CG 4.23Å; P44-L102 HydrophobicContact CB-CD1 3.67Å; P44-L102 HydrophobicContact CG-CD1 3.84Å
45	R	97	Very high	93.3	Very high	99 Å²	99	52.5 Å²	52.5	37%	0.374	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	128.9	173	-179.2	-179.6	-174.6	179.9	-3.3	108.7	S35 V36 E43 I47 D61 S62 D63	S35-R45 CarbonylContact C-O 3.58Å; S35-R45 VanDerWaalsContact CA-O 3.27Å; S35-R45 WeakPolarHBondContact CA-O 3.34Å; V36-R45 PolarHBondContact N-O 3.09Å; V36-R45 PolarHBondContact O-N 3.47Å; E43-R45 PolarHBondContact O-N 2.81Å; R45-I47 HydrophobicContact CG-CG1 4.3Å; R45-D61 IonicContact CZ-OD1 3.03Å; R45-D61 IonicContact CZ-OD2 2.58Å; R45-D61 IonicContact NE-OD1 2.59Å; R45-D61 PolarHBondContact NE-OD1 2.94Å; R45-D61 IonicContact NE-OD2 3.87Å; R45-D61 IonicContact NH2-OD1 3.22Å; R45-D61 PolarHBondContact NH2-OD1 2.77Å; R45-D61 IonicContact NH2-OD2 3.59Å; R45-D61 PolarHBondContact NH2-OD2 2.79Å; R45-S62 WeakPolarHBondContact CA-OG 3.47Å; R45-D63 WeakPolarHBondContact CD-OD2 3.32Å; R45-D63 HydrophobicContact CG-CB 4.48Å; R45-D63 WeakPolarHBondContact CG-OD2 3.19Å; R45-D63 IonicContact NE-OD2 3.68Å
46	F	98.3	Very high	93.2	Very high	1 Å²	1	54.9 Å²	54.9	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.3	176.4	174.6	-92.5	0	0	0	110.1	T34 S35 P44 F60 S62 Y91 Q94 A95 D98	T34-F46 WeakPolarHBondContact O-CA 3.43Å; S35-F46 VanDerWaalsContact OG-CD2 3.31Å; S35-F46 WeakPolarHBondContact OG-CD2 3.4Å; P44-F46 PolarHBondContact O-N 2.99Å; F46-F60 AromaticContact CD1-CD1 3.61Å; F46-F60 HydrophobicContact CD1-CD1 3.61Å; F46-F60 AromaticContact CD1-CE1 3.73Å; F46-F60 HydrophobicContact CD1-CE1 3.73Å; F46-F60 AromaticContact CE1-CD1 3.81Å; F46-F60 HydrophobicContact CE1-CD1 3.81Å; F46-F60 HydrophobicContact CE1-CE1 4.21Å; F46-S62 PolarHBondContact N-OG 2.91Å; F46-S62 PolarHBondContact O-N 2.69Å; F46-S62 PolarHBondContact O-OG 3.11Å; F46-Y91 HydrophobicContact CE1-CD1 4.31Å; F46-Q94 HydrophobicContact CE2-CB 4.1Å; F46-Q94 HydrophobicContact CE2-CG 3.64Å; F46-Q94 HydrophobicContact CZ-CB 3.87Å; F46-Q94 HydrophobicContact CZ-CG 3.76Å; F46-A95 HydrophobicContact CB-CB 3.63Å; F46-A95 HydrophobicContact CD1-CB 3.78Å; F46-A95 HydrophobicContact CD2-CB 4.04Å; F46-A95 HydrophobicContact CE1-CB 4.45Å; F46-A95 HydrophobicContact CG-CB 3.55Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.37Å
47	I	98.6	Very high	93.3	Very high	45 Å²	45	52.8 Å²	52.8	23%	0.231	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134.2	173.1	-57.8	175.4	0	0	0	107.8	S33 T34 R45 V49 F60	S33-I47 CarbonylContact C-O 3.58Å; S33-I47 WeakPolarHBondContact CA-O 3.41Å; T34-I47 PolarHBondContact N-O 3.34Å; T34-I47 PolarHBondContact O-N 3.18Å; R45-I47 HydrophobicContact CG-CG1 4.3Å; I47-V49 HydrophobicContact CG2-CG1 4.47Å; I47-F60 WeakPolarHBondContact CA-O 3.38Å
48	S	98.6	Very high	93.4	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138	170.3	-162.2	0	0	0	0	110.5	F32 S33 R59 F60	F32-S48 CarbonylContact O-C 3.53Å; F32-S48 VanDerWaalsContact O-CA 3.29Å; F32-S48 WeakPolarHBondContact O-CA 3.49Å; F32-S48 PolarHBondContact O-OG 2.86Å; S33-S48 PolarHBondContact OG-OG 2.87Å; S48-R59 CarbonylContact O-C 3.49Å; S48-R59 WeakPolarHBondContact O-CA 3.39Å; S48-F60 PolarHBondContact N-O 3.19Å; S48-F60 PolarHBondContact O-N 2.84Å
49	V	98.8	Very high	93.9	Very high	27 Å²	27	48.6 Å²	48.6	16%	0.164	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.4	175.2	-62.9	0	0	0	0	109.6	Y31 F32 I47 Y51 V58 R59	Y31-V49 CarbonylContact C-O 3.54Å; Y31-V49 WeakPolarHBondContact CA-O 3.07Å; F32-V49 HydrophobicContact CB-CG2 3.9Å; F32-V49 HydrophobicContact CD2-CG2 4.38Å; F32-V49 PolarHBondContact N-O 3.02Å; F32-V49 PolarHBondContact O-N 2.92Å; I47-V49 HydrophobicContact CG2-CG1 4.47Å; V49-Y51 HydrophobicContact CB-CE2 4.11Å; V49-Y51 HydrophobicContact CG2-CD2 4.35Å; V49-Y51 HydrophobicContact CG2-CE2 3.81Å; V49-V58 WeakPolarHBondContact CA-O 3.17Å; V49-R59 HydrophobicContact CG1-CB 4.49Å; V49-R59 HydrophobicContact CG1-CG 4.26Å
50	G	98.6	Very high	94.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.9	176.8	0	0	0	0	0	110.5	R30 Q56 F57 V58	R30-G50 CarbonylContact O-C 3.57Å; R30-G50 WeakPolarHBondContact O-CA 3.47Å; G50-Q56 WeakPolarHBondContact O-CA 3.03Å; G50-F57 WeakPolarHBondContact O-CD1 3.33Å; G50-F57 PolarHBondContact O-N 3.22Å; G50-V58 PolarHBondContact N-O 2.93Å; G50-V58 PolarHBondContact O-N 3.04Å
51	Y	98.5	Very high	95.9	Very high	69 Å²	69	43.1 Å²	43.1	27%	0.271	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.7	178.9	-75.5	-103.1	0	0	0	110.2	M29 R30 F32 V49 T55 Q56	M29-Y51 CarbonylContact C-O 3.53Å; M29-Y51 WeakPolarHBondContact CA-O 3.34Å; R30-Y51 PolarHBondContact N-O 3.28Å; R30-Y51 PolarHBondContact O-N 2.97Å; F32-Y51 HydrophobicContact CD2-CD2 4.21Å; F32-Y51 HydrophobicContact CE2-CD2 4.27Å; V49-Y51 HydrophobicContact CB-CE2 4.11Å; V49-Y51 HydrophobicContact CG2-CD2 4.35Å; V49-Y51 HydrophobicContact CG2-CE2 3.81Å; Y51-T55 WeakPolarHBondContact CA-O 3.36Å; Y51-T55 VanDerWaalsContact CD1-C 3.48Å; Y51-Q56 HydrophobicContact CD1-CB 4.02Å; Y51-Q56 VanDerWaalsContact CD1-N 3.3Å; Y51-Q56 HydrophobicContact CD2-CG 4.35Å; Y51-Q56 HydrophobicContact CE1-CB 3.52Å; Y51-Q56 HydrophobicContact CE1-CG 4.24Å; Y51-Q56 HydrophobicContact CE2-CB 4.06Å; Y51-Q56 HydrophobicContact CE2-CG 3.84Å; Y51-Q56 HydrophobicContact CG-CB 4.48Å
52	V	98.1	Very high	96.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120	155.9	176.7	0	0	0	0	105.7	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.36Å; M29-V52 HydrophobicContact CG-CG2 4.29Å; V52-D54 PolarHBondContact O-N 2.97Å; V52-T55 PolarHBondContact N-O 3.14Å; V52-T55 PolarHBondContact O-N 2.92Å; V52-F57 HydrophobicContact CG2-CD1 4.05Å; V52-F57 HydrophobicContact CG2-CE1 4.06Å; V52-W75 HydrophobicContact CB-CH2 4.37Å; V52-W75 HydrophobicContact CB-CZ2 4.44Å; V52-W75 HydrophobicContact CG2-CH2 3.84Å; V52-W75 HydrophobicContact CG2-CZ2 4.39Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.24Å; V52-Y195 HydrophobicContact CG2-CD2 3.98Å; V52-Y195 HydrophobicContact CG2-CG 4.45Å; V52-L196 HydrophobicContact CG1-CD2 4.04Å; V52-L203 HydrophobicContact CB-CD1 4.26Å; V52-L203 HydrophobicContact CB-CD2 4.16Å; V52-L203 HydrophobicContact CG1-CD1 3.88Å; V52-L203 HydrophobicContact CG1-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CG 4.5Å
53	D	95.7	Very high	97.2	Very high	29 Å²	29	37.4 Å²	37.4	16%	0.155	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	-123.8	-167.2	-54.5	-41.6	0	0	0	110.4	H27 S28	H27-D53 VanDerWaalsContact CA-OD1 3.25Å; H27-D53 WeakPolarHBondContact CA-OD1 3.32Å; H27-D53 IonicContact CE1-OD2 2.75Å; H27-D53 IonicContact CG-OD2 3.56Å; H27-D53 IonicContact ND1-OD1 2.79Å; H27-D53 IonicContact ND1-OD2 3.21Å; H27-D53 PolarHBondContact ND1-OD2 3.14Å; S28-D53 PolarHBondContact N-OD1 2.94Å; S28-D53 PolarHBondContact O-N 3.01Å; S28-D53 PolarHBondContact OG-OD1 2.78Å
54	D	95.6	Very high	97.4	Very high	62 Å²	62	33.8 Å²	33.8	33%	0.332	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	11	179.5	-63.7	-53.4	0	0	0	113.6	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 2.97Å; D54-Y233 HydrophobicContact CB-CE2 4.05Å; D54-P234 VanDerWaalsContact OD2-CB 3.24Å; D54-P234 WeakPolarHBondContact OD2-CB 3.38Å; D54-A235 HydrophobicContact CB-CB 4.35Å; D54-A235 WeakPolarHBondContact OD2-CB 3.38Å; D54-A235 PolarHBondContact OD2-N 2.81Å; D54-F265 HydrophobicContact CB-CE2 3.77Å; D54-F265 HydrophobicContact CB-CZ 3.71Å
55	T	96.6	Very high	97.5	Very high	30 Å²	30	38.2 Å²	38.2	18%	0.184	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	113.5	-177.1	-59.7	0	0	0	0	112.2	Y51 V52 F57 A73 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.36Å; Y51-T55 VanDerWaalsContact CD1-C 3.48Å; V52-T55 PolarHBondContact N-O 3.14Å; V52-T55 PolarHBondContact O-N 2.92Å; T55-F57 PolarHBondContact O-N 3.02Å; T55-A73 HydrophobicContact CG2-CB 4.49Å; T55-L203 HydrophobicContact CG2-CD2 4.16Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.45Å; T55-Y233 PolarHBondContact OG1-OH 3.02Å
56	Q	97.4	Very high	97.4	Very high	52 Å²	52	37.1 Å²	37.1	24%	0.243	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	128.5	173.8	-166.1	-179.7	2.1	0	0	110.3	G50 Y51 V58 R72	G50-Q56 WeakPolarHBondContact O-CA 3.03Å; Y51-Q56 HydrophobicContact CD1-CB 4.02Å; Y51-Q56 VanDerWaalsContact CD1-N 3.3Å; Y51-Q56 HydrophobicContact CD2-CG 4.35Å; Y51-Q56 HydrophobicContact CE1-CB 3.52Å; Y51-Q56 HydrophobicContact CE1-CG 4.24Å; Y51-Q56 HydrophobicContact CE2-CB 4.06Å; Y51-Q56 HydrophobicContact CE2-CG 3.84Å; Y51-Q56 HydrophobicContact CG-CB 4.48Å; Q56-V58 PolarHBondContact NE2-O 3.23Å; Q56-R72 HydrophobicContact CG-CB 4.14Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.59Å
57	F	97.9	Very high	97.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	-22	-179.8	76.4	-82.6	0	0	0	114.2	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.4Å; M29-F57 HydrophobicContact SD-CZ 4.28Å; Y31-F57 HydrophobicContact CE1-CZ 4.08Å; Y31-F57 HydrophobicContact CE2-CZ 4.49Å; Y31-F57 AromaticContact CZ-CZ 3.74Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.35Å; G50-F57 WeakPolarHBondContact O-CD1 3.33Å; G50-F57 PolarHBondContact O-N 3.22Å; V52-F57 HydrophobicContact CG2-CD1 4.05Å; V52-F57 HydrophobicContact CG2-CE1 4.06Å; T55-F57 PolarHBondContact O-N 3.02Å; F57-R72 PolarHBondContact O-N 3.44Å; F57-A73 HydrophobicContact CB-CB 4.05Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.35Å; F57-W75 HydrophobicContact CB-CZ3 3.87Å; F57-W75 AromaticContact CD1-CH2 3.97Å; F57-W75 HydrophobicContact CD1-CH2 3.97Å; F57-W75 AromaticContact CD2-CH2 3.71Å; F57-W75 HydrophobicContact CD2-CH2 3.71Å; F57-W75 AromaticContact CD2-CZ3 3.91Å; F57-W75 HydrophobicContact CD2-CZ3 3.91Å; F57-W75 AromaticContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CZ2 4.08Å; F57-W75 HydrophobicContact CG-CZ3 4.03Å; F57-V76 HydrophobicContact CB-CG1 4.38Å; F57-V76 HydrophobicContact CD2-CB 4.32Å; F57-V76 HydrophobicContact CD2-CG1 4.45Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 VanDerWaalsContact O-CG1 3.26Å; F57-V76 WeakPolarHBondContact O-CG1 3.37Å; F57-Y195 HydrophobicContact CD2-CE2 4.47Å; F57-Y195 HydrophobicContact CE2-CD2 4.26Å; F57-Y195 AromaticContact CE2-CE2 3.62Å; F57-Y195 HydrophobicContact CE2-CE2 3.62Å; F57-Y195 AromaticContact CE2-CZ 3.8Å; F57-Y195 HydrophobicContact CZ-CD2 4.3Å; F57-Y195 AromaticContact CZ-CE2 3.76Å; F57-Y195 HydrophobicContact CZ-CE2 3.76Å
58	V	98.2	Very high	97.2	Very high	1 Å²	1	44 Å²	44	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151.9	177.2	-73.6	0	0	0	0	112.6	Y31 V49 G50 Q56 E70 W84 Y91	Y31-V58 HydrophobicContact CE1-CG2 3.87Å; V49-V58 WeakPolarHBondContact CA-O 3.17Å; G50-V58 PolarHBondContact N-O 2.93Å; G50-V58 PolarHBondContact O-N 3.04Å; Q56-V58 PolarHBondContact NE2-O 3.23Å; V58-E70 WeakPolarHBondContact CA-O 3.45Å; V58-W84 HydrophobicContact CG1-CH2 3.9Å; V58-W84 HydrophobicContact CG1-CZ3 3.84Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.41Å
59	R	98.3	Very high	97.2	Very high	75 Å²	75	44 Å²	44	28%	0.283	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.6	170.9	-179.6	176.3	172	120.8	3.8	110.7	S48 V49 D61 E70 R72	S48-R59 CarbonylContact O-C 3.49Å; S48-R59 WeakPolarHBondContact O-CA 3.39Å; V49-R59 HydrophobicContact CG1-CB 4.49Å; V49-R59 HydrophobicContact CG1-CG 4.26Å; R59-D61 IonicContact NH2-OD2 3.57Å; R59-D61 PolarHBondContact NH2-OD2 2.82Å; R59-E70 PolarHBondContact N-O 3.29Å; R59-E70 PolarHBondContact O-N 2.86Å; R59-R72 HydrophobicContact CB-CG 3.93Å
60	F	98.7	Very high	97.1	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.7	165.7	179.1	-84.6	0	0	0	109	F46 I47 S48 P67 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.61Å; F46-F60 HydrophobicContact CD1-CD1 3.61Å; F46-F60 AromaticContact CD1-CE1 3.73Å; F46-F60 HydrophobicContact CD1-CE1 3.73Å; F46-F60 AromaticContact CE1-CD1 3.81Å; F46-F60 HydrophobicContact CE1-CD1 3.81Å; F46-F60 HydrophobicContact CE1-CE1 4.21Å; I47-F60 WeakPolarHBondContact CA-O 3.38Å; S48-F60 PolarHBondContact N-O 3.19Å; S48-F60 PolarHBondContact O-N 2.84Å; F60-P67 HydrophobicContact CE2-CB 3.98Å; F60-P67 HydrophobicContact CZ-CB 3.73Å; F60-Y91 HydrophobicContact CB-CD1 4.1Å; F60-Y91 HydrophobicContact CB-CD2 3.58Å; F60-Y91 HydrophobicContact CB-CE1 4.46Å; F60-Y91 HydrophobicContact CB-CE2 3.98Å; F60-Y91 HydrophobicContact CB-CG 3.66Å; F60-Y91 HydrophobicContact CD1-CG 4.31Å; F60-Y91 AromaticContact CD2-CD2 3.63Å; F60-Y91 HydrophobicContact CD2-CD2 3.63Å; F60-Y91 AromaticContact CD2-CG 3.85Å; F60-Y91 HydrophobicContact CD2-CG 3.85Å; F60-Y91 HydrophobicContact CG-CD1 4.45Å; F60-Y91 AromaticContact CG-CD2 3.78Å; F60-Y91 HydrophobicContact CG-CD2 3.78Å; F60-Y91 AromaticContact CG-CG 3.68Å; F60-Y91 HydrophobicContact CG-CG 3.68Å; F60-K92 HydrophobicContact CE2-CG 4.37Å; F60-K92 HydrophobicContact CZ-CG 4.1Å
61	D	98.4	Very high	97.1	Very high	19 Å²	19	47.8 Å²	47.8	10%	0.102	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	121.3	176.2	-160.3	-31.2	0	0	0	109.1	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 3.03Å; R45-D61 IonicContact CZ-OD2 2.58Å; R45-D61 IonicContact NE-OD1 2.59Å; R45-D61 PolarHBondContact NE-OD1 2.94Å; R45-D61 IonicContact NE-OD2 3.87Å; R45-D61 IonicContact NH2-OD1 3.22Å; R45-D61 PolarHBondContact NH2-OD1 2.77Å; R45-D61 IonicContact NH2-OD2 3.59Å; R45-D61 PolarHBondContact NH2-OD2 2.79Å; R59-D61 IonicContact NH2-OD2 3.57Å; R59-D61 PolarHBondContact NH2-OD2 2.82Å; D61-D63 PolarHBondContact O-N 2.85Å; D61-D63 PolarHBondContact OD1-N 2.82Å; D61-A64 HydrophobicContact CB-CB 4.4Å; D61-A64 WeakPolarHBondContact O-CB 3.35Å; D61-A64 PolarHBondContact O-N 3.39Å
62	S	97.2	Very high	97	Very high	35 Å²	35	50.4 Å²	50.4	25%	0.245	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-24.2	-179.6	63	0	0	0	0	113.4	R45 F46 P67	R45-S62 WeakPolarHBondContact CA-OG 3.47Å; F46-S62 PolarHBondContact N-OG 2.91Å; F46-S62 PolarHBondContact O-N 2.69Å; F46-S62 PolarHBondContact O-OG 3.11Å; S62-P67 WeakPolarHBondContact O-CG 2.96Å
63	D	95.5	Very high	96.9	Very high	102 Å²	102	50.6 Å²	50.6	55%	0.545	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-2.4	-176.1	-70.5	10.4	0	0	0	112.4	R45 D61	R45-D63 WeakPolarHBondContact CD-OD2 3.32Å; R45-D63 HydrophobicContact CG-CB 4.48Å; R45-D63 WeakPolarHBondContact CG-OD2 3.19Å; R45-D63 IonicContact NE-OD2 3.68Å; D61-D63 PolarHBondContact O-N 2.85Å; D61-D63 PolarHBondContact OD1-N 2.82Å
64	A	95.6	Very high	96.9	Very high	32 Å²	32	54.1 Å²	54.1	26%	0.264	30%	0.302	S	S	.	.	S	Bend	trans	-61.4	148.2	172.6	0	0	0	0	0	110.5	D61 S66 P67	D61-A64 HydrophobicContact CB-CB 4.4Å; D61-A64 WeakPolarHBondContact O-CB 3.35Å; D61-A64 PolarHBondContact O-N 3.39Å; A64-S66 PolarHBondContact O-N 3.43Å; A64-S66 VanDerWaalsContact O-N 3.11Å; A64-P67 WeakPolarHBondContact O-CD 3.2Å; A64-P67 VanDerWaalsContact O-CG 3.27Å; A64-P67 WeakPolarHBondContact O-CG 3.11Å
65	A	95.3	Very high	96.9	Very high	117 Å²	117	51.8 Å²	51.8	97%	0.967	29%	0.289	S	S	*	.	S	Bend	trans	-57.8	-29.7	179.2	0	0	0	0	0	113.2
66	S	95.1	Very high	96.9	Very high	77 Å²	77	50.4 Å²	50.4	54%	0.538	28%	0.28	S	S	.	.	S	Bend	trans	-134.5	89.3	171.8	-173.5	0	0	0	0	109.3	A64 R68	A64-S66 PolarHBondContact O-N 3.43Å; A64-S66 VanDerWaalsContact O-N 3.11Å; S66-R68 PolarHBondContact O-N 3.23Å
67	P	96.4	Very high	96.8	Very high	37 Å²	37	53.8 Å²	53.8	24%	0.24	30%	0.296	C	S	.	.			trans	-65.3	109.3	-175.1	-23.7	35.3	0	0	0	112.1	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.98Å; F60-P67 HydrophobicContact CZ-CB 3.73Å; S62-P67 WeakPolarHBondContact O-CG 2.96Å; A64-P67 WeakPolarHBondContact O-CD 3.2Å; A64-P67 VanDerWaalsContact O-CG 3.27Å; A64-P67 WeakPolarHBondContact O-CG 3.11Å; P67-K92 VanDerWaalsContact O-CE 3.27Å; P67-K92 WeakPolarHBondContact O-CE 3.37Å; P67-K92 PolarHBondContact O-NZ 3.05Å
68	R	97.4	Very high	96.6	Very high	152 Å²	152	59.7 Å²	59.7	57%	0.574	32%	0.324	S	S	*	.			trans	-146.2	160.5	177.1	63.9	-176.1	173.2	173.8	-0.3	110.8	S66 E70 T88	S66-R68 PolarHBondContact O-N 3.23Å; R68-E70 HydrophobicContact CG-CG 4.44Å; R68-E70 PolarHBondContact O-N 2.8Å; R68-T88 HydrophobicContact CB-CG2 4.2Å
69	G	97.1	Very high	96.6	Very high	5 Å²	5	60.2 Å²	60.2	5%	0.052	33%	0.326	C	S	.	.			trans	-64.5	129	168.7	0	0	0	0	0	109.7	T88	G69-T88 PolarHBondContact N-OG1 2.66Å
70	E	97.4	Very high	96.4	Very high	58 Å²	58	58.4 Å²	58.4	27%	0.271	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.7	-179.5	-64.4	178.5	163.6	0	0	110	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.45Å; R59-E70 PolarHBondContact N-O 3.29Å; R59-E70 PolarHBondContact O-N 2.86Å; R68-E70 HydrophobicContact CG-CG 4.44Å; R68-E70 PolarHBondContact O-N 2.8Å; E70-R72 IonicContact OE2-CZ 3.73Å; E70-R72 IonicContact OE2-NH2 2.74Å; E70-R72 PolarHBondContact OE2-NH2 2.95Å
71	P	97.8	Very high	96.3	Very high	48 Å²	48	63 Å²	63	31%	0.312	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	145.4	172.5	28.9	-33.7	0	0	0	110.7	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.79Å; P71-E77 HydrophobicContact CB-CG 3.71Å; P71-E77 HydrophobicContact CG-CG 3.96Å; P71-W84 HydrophobicContact CB-CH2 3.64Å; P71-W84 HydrophobicContact CB-CZ2 3.81Å; P71-W84 HydrophobicContact CG-CH2 4.26Å; P71-W84 HydrophobicContact CG-CZ2 4.26Å
72	R	97.3	Very high	96.3	Very high	123 Å²	123	69.9 Å²	69.9	46%	0.464	39%	0.392	S	S	.	.			trans	-128.2	-1.1	175	-60.7	-64.8	171.6	175.5	-2.8	113.1	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CG-CB 4.14Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.59Å; F57-R72 PolarHBondContact O-N 3.44Å; R59-R72 HydrophobicContact CB-CG 3.93Å; E70-R72 IonicContact OE2-CZ 3.73Å; E70-R72 IonicContact OE2-NH2 2.74Å; E70-R72 PolarHBondContact OE2-NH2 2.95Å
73	A	95.8	Very high	96.3	Very high	4 Å²	4	68.6 Å²	68.6	3%	0.033	38%	0.382	C	S	.	.	S	Bend	trans	-137.5	143.8	173.4	0	0	0	0	0	110.8	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.49Å; F57-A73 HydrophobicContact CB-CB 4.05Å; A73-W75 VanDerWaalsContact C-N 3.3Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.37Å; A73-W75 HydrophobicContact CB-CZ2 3.98Å; A73-W75 PolarHBondContact O-N 2.96Å; A73-V76 WeakPolarHBondContact O-CG1 3.46Å; A73-V76 PolarHBondContact O-N 2.89Å
74	P	95.9	Very high	96.4	Very high	103 Å²	103	65.6 Å²	65.6	67%	0.669	36%	0.363	S	S	*	.	H	α-helix	trans	-58.4	-37.7	-177.1	-26.5	34.9	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 2.81Å; P74-E77 WeakPolarHBondContact O-CB 3.32Å; P74-E77 PolarHBondContact O-N 2.94Å
75	W	95.6	Very high	96.5	Very high	14 Å²	14	69.2 Å²	69.2	5%	0.053	38%	0.378	C	S	.	.	H	α-helix	trans	-69.8	-13	-176	53	-107.2	0	0	0	114.5	V52 F57 A73 Q78 Y195 N198 T202 L203	V52-W75 HydrophobicContact CB-CH2 4.37Å; V52-W75 HydrophobicContact CB-CZ2 4.44Å; V52-W75 HydrophobicContact CG2-CH2 3.84Å; V52-W75 HydrophobicContact CG2-CZ2 4.39Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.35Å; F57-W75 HydrophobicContact CB-CZ3 3.87Å; F57-W75 AromaticContact CD1-CH2 3.97Å; F57-W75 HydrophobicContact CD1-CH2 3.97Å; F57-W75 AromaticContact CD2-CH2 3.71Å; F57-W75 HydrophobicContact CD2-CH2 3.71Å; F57-W75 AromaticContact CD2-CZ3 3.91Å; F57-W75 HydrophobicContact CD2-CZ3 3.91Å; F57-W75 AromaticContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CZ2 4.08Å; F57-W75 HydrophobicContact CG-CZ3 4.03Å; A73-W75 VanDerWaalsContact C-N 3.3Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.37Å; A73-W75 HydrophobicContact CB-CZ2 3.98Å; A73-W75 PolarHBondContact O-N 2.96Å; W75-Q78 WeakPolarHBondContact O-CG 3.3Å; W75-Y195 HydrophobicContact CE3-CD1 4.17Å; W75-Y195 HydrophobicContact CE3-CG 4.42Å; W75-Y195 HydrophobicContact CH2-CG 4.13Å; W75-Y195 AromaticContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD2 4.27Å; W75-Y195 HydrophobicContact CZ3-CE1 4.27Å; W75-Y195 AromaticContact CZ3-CG 3.56Å; W75-Y195 HydrophobicContact CZ3-CG 3.56Å; W75-N198 HydrophobicContact CB-CB 4.37Å; W75-T202 VanDerWaalsContact CD1-OG1 3.27Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.39Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.16Å; W75-L203 HydrophobicContact CZ2-CG 4.42Å
76	V	96.9	Very high	96.6	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-94.9	-16.4	172	72.3	0	0	0	0	112.1	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.38Å; F57-V76 HydrophobicContact CD2-CB 4.32Å; F57-V76 HydrophobicContact CD2-CG1 4.45Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 VanDerWaalsContact O-CG1 3.26Å; F57-V76 WeakPolarHBondContact O-CG1 3.37Å; P71-V76 HydrophobicContact CB-CG1 3.79Å; A73-V76 WeakPolarHBondContact O-CG1 3.46Å; A73-V76 PolarHBondContact O-N 2.89Å; P74-V76 PolarHBondContact O-N 2.81Å; V76-Q78 PolarHBondContact O-N 3.37Å; V76-E79 HydrophobicContact CG2-CG 3.92Å; V76-E79 VanDerWaalsContact O-CB 3.32Å; V76-E79 WeakPolarHBondContact O-CB 3.08Å; V76-E79 WeakPolarHBondContact O-CG 3.41Å; V76-E79 PolarHBondContact O-N 2.89Å; V76-Y83 HydrophobicContact CG2-CE1 4.06Å; V76-W84 HydrophobicContact CG1-CH2 4.07Å; V76-W84 HydrophobicContact CG1-CZ2 4.29Å; V76-W84 HydrophobicContact CG2-CH2 3.96Å; V76-W84 HydrophobicContact CG2-CZ2 4Å; V76-W84 WeakPolarHBondContact O-CZ2 3.38Å; V76-Y195 HydrophobicContact CG2-CE1 4.38Å
77	E	95.3	Very high	96.7	Very high	124 Å²	124	65.4 Å²	65.4	58%	0.579	33%	0.327	S	S	*	.	H	α-helix	trans	-63.6	-26.5	-179.7	-65.6	-177.8	-177.6	0	0	112.7	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.71Å; P71-E77 HydrophobicContact CG-CG 3.96Å; P74-E77 WeakPolarHBondContact O-CB 3.32Å; P74-E77 PolarHBondContact O-N 2.94Å; E77-E79 PolarHBondContact O-N 3.03Å
78	Q	94.3	Very high	96.7	Very high	124 Å²	124	64.2 Å²	64.2	58%	0.579	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.2	175.3	66.6	-179.3	14.5	0	0	114.1	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.3Å; V76-Q78 PolarHBondContact O-N 3.37Å; Q78-N198 VanDerWaalsContact NE2-CB 3.28Å; Q78-N198 PolarHBondContact NE2-ND2 2.88Å; Q78-N198 PolarHBondContact NE2-OD1 3.42Å
79	E	96.4	Very high	96.8	Very high	12 Å²	12	61.9 Å²	61.9	6%	0.056	32%	0.315	C	S	.	.	S	Bend	trans	-66.4	135.8	175.3	-65.9	-62.2	162.7	0	0	111	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 3.92Å; V76-E79 VanDerWaalsContact O-CB 3.32Å; V76-E79 WeakPolarHBondContact O-CB 3.08Å; V76-E79 WeakPolarHBondContact O-CG 3.41Å; V76-E79 PolarHBondContact O-N 2.89Å; E77-E79 PolarHBondContact O-N 3.03Å; E79-Y83 HydrophobicContact CB-CD1 3.47Å; E79-Y83 VanDerWaalsContact CB-CD1 3.47Å; E79-Y83 HydrophobicContact CB-CE1 4.06Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.02Å; E79-Y83 HydrophobicContact CG-CD2 4.46Å; E79-Y83 HydrophobicContact CG-CE1 4.21Å; E79-Y83 HydrophobicContact CG-CG 4.16Å; E79-W84 PolarHBondContact O-NE1 3.39Å; E79-R194 IonicContact OE1-CZ 3.36Å; E79-R194 IonicContact OE1-NE 3.31Å; E79-R194 PolarHBondContact OE1-NE 3.11Å; E79-R194 IonicContact OE1-NH2 3.25Å; E79-R194 PolarHBondContact OE1-NH2 3.5Å; E79-R194 IonicContact OE2-CZ 3.6Å; E79-R194 IonicContact OE2-NE 2.76Å; E79-R194 IonicContact OE2-NH2 2.87Å; E79-R194 PolarHBondContact OE2-NH2 3.37Å; E79-N198 PolarHBondContact OE1-ND2 3.47Å
80	G	95.7	Very high	96.7	Very high	36 Å²	36	65 Å²	65	37%	0.371	33%	0.327	S	S	.	.			trans	-70.5	169.9	-174.6	0	0	0	0	0	114.4	E82 Y83 W84	G80-E82 VanDerWaalsContact C-N 3.26Å; G80-E82 PolarHBondContact O-N 2.92Å; G80-Y83 WeakPolarHBondContact O-CB 3.22Å; G80-Y83 PolarHBondContact O-N 2.82Å; G80-W84 PolarHBondContact O-N 2.97Å
81	P	96.6	Very high	96.8	Very high	101 Å²	101	62.8 Å²	62.8	66%	0.656	32%	0.316	S	S	*	.	H	α-helix	trans	-57.7	-35.8	-178	22.6	-33.5	0	0	0	113.3	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 3.24Å; P81-W84 PolarHBondContact O-N 2.04Å; P81-W84 VanDerWaalsContact O-N 3.16Å; P81-D85 WeakPolarHBondContact O-CB 3.5Å; P81-D85 PolarHBondContact O-N 3Å
82	E	97.2	Very high	96.8	Very high	164 Å²	164	64.4 Å²	64.4	77%	0.766	32%	0.318	S	S	*	.	H	α-helix	trans	-60.7	-34.7	177.9	-63.1	-177.9	177.8	0	0	113	G80 R86	G80-E82 VanDerWaalsContact C-N 3.26Å; G80-E82 PolarHBondContact O-N 2.92Å; E82-R86 VanDerWaalsContact O-CB 3.23Å; E82-R86 WeakPolarHBondContact O-CB 3.33Å; E82-R86 PolarHBondContact O-N 2.87Å
83	Y	97.1	Very high	96.8	Very high	8 Å²	8	65.9 Å²	65.9	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-52.2	174.3	167.8	-92.5	0	0	0	110	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.06Å; E79-Y83 HydrophobicContact CB-CD1 3.47Å; E79-Y83 VanDerWaalsContact CB-CD1 3.47Å; E79-Y83 HydrophobicContact CB-CE1 4.06Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.02Å; E79-Y83 HydrophobicContact CG-CD2 4.46Å; E79-Y83 HydrophobicContact CG-CE1 4.21Å; E79-Y83 HydrophobicContact CG-CG 4.16Å; G80-Y83 WeakPolarHBondContact O-CB 3.22Å; G80-Y83 PolarHBondContact O-N 2.82Å; P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 3.24Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.81Å; Y83-R86 PolarHBondContact O-N 2.84Å; Y83-E87 HydrophobicContact CD1-CG 4.4Å; Y83-E87 HydrophobicContact CD2-CG 4.14Å; Y83-E87 HydrophobicContact CE1-CG 4.01Å; Y83-E87 HydrophobicContact CE2-CG 3.69Å; Y83-E87 HydrophobicContact CG-CG 4.45Å; Y83-E87 WeakPolarHBondContact O-CG 3.44Å; Y83-E87 PolarHBondContact O-N 2.89Å; Y83-W191 AromaticContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CH2 3.49Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CZ2 4.18Å; Y83-W191 AromaticContact CD2-CZ3 3.73Å; Y83-W191 HydrophobicContact CD2-CZ3 3.73Å; Y83-W191 HydrophobicContact CE2-CE3 4.2Å; Y83-W191 AromaticContact CE2-CH2 3.88Å; Y83-W191 HydrophobicContact CE2-CH2 3.88Å; Y83-W191 HydrophobicContact CE2-CZ2 4.48Å; Y83-W191 AromaticContact CE2-CZ3 3.71Å; Y83-W191 HydrophobicContact CE2-CZ3 3.71Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.44Å; Y83-Y195 PolarHBondContact OH-OH 3.02Å
84	W	97.8	Very high	96.9	Very high	39 Å²	39	68.1 Å²	68.1	15%	0.148	33%	0.334	C	S	.	.	H	α-helix	trans	-63.7	-38.4	-177.8	-67.9	112	0	0	0	113	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.9Å; V58-W84 HydrophobicContact CG1-CZ3 3.84Å; P71-W84 HydrophobicContact CB-CH2 3.64Å; P71-W84 HydrophobicContact CB-CZ2 3.81Å; P71-W84 HydrophobicContact CG-CH2 4.26Å; P71-W84 HydrophobicContact CG-CZ2 4.26Å; V76-W84 HydrophobicContact CG1-CH2 4.07Å; V76-W84 HydrophobicContact CG1-CZ2 4.29Å; V76-W84 HydrophobicContact CG2-CH2 3.96Å; V76-W84 HydrophobicContact CG2-CZ2 4Å; V76-W84 WeakPolarHBondContact O-CZ2 3.38Å; E79-W84 PolarHBondContact O-NE1 3.39Å; G80-W84 PolarHBondContact O-N 2.97Å; P81-W84 PolarHBondContact O-N 2.04Å; P81-W84 VanDerWaalsContact O-N 3.16Å; W84-T88 WeakPolarHBondContact O-CB 3.43Å; W84-T88 PolarHBondContact O-N 3.17Å; W84-T88 PolarHBondContact O-OG1 3.33Å
85	D	97.8	Very high	97	Very high	108 Å²	108	64.3 Å²	64.3	58%	0.578	31%	0.311	S	S	*	.	H	α-helix	trans	-64.4	-47.4	174.6	-75.5	-22.2	0	0	0	110.7	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.5Å; P81-D85 PolarHBondContact O-N 3Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.81Å; D85-T88 PolarHBondContact O-N 3.4Å; D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.27Å; D85-Q89 PolarHBondContact O-N 3.48Å
86	R	97.1	Very high	97.1	Very high	104 Å²	104	70 Å²	70	39%	0.392	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-46.4	178.5	-176.6	-179.8	64.2	-136.8	-6	112.1	E82 Y83 Q89 K90	E82-R86 VanDerWaalsContact O-CB 3.23Å; E82-R86 WeakPolarHBondContact O-CB 3.33Å; E82-R86 PolarHBondContact O-N 2.87Å; Y83-R86 PolarHBondContact O-N 2.84Å; R86-Q89 PolarHBondContact O-N 2.84Å; R86-K90 WeakPolarHBondContact O-CG 3.31Å; R86-K90 PolarHBondContact O-N 3.15Å
87	E	97.1	Very high	97.1	Very high	10 Å²	10	72 Å²	72	5%	0.047	36%	0.355	C	S	.	.	H	α-helix	trans	-65.4	-42.5	178.5	-66.5	-45.3	116.4	0	0	111.2	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.4Å; Y83-E87 HydrophobicContact CD2-CG 4.14Å; Y83-E87 HydrophobicContact CE1-CG 4.01Å; Y83-E87 HydrophobicContact CE2-CG 3.69Å; Y83-E87 HydrophobicContact CG-CG 4.45Å; Y83-E87 WeakPolarHBondContact O-CG 3.44Å; Y83-E87 PolarHBondContact O-N 2.89Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 2.89Å; E87-K90 WeakPolarHBondContact O-CB 3.31Å; E87-K90 PolarHBondContact O-N 2.91Å; E87-K90 WeakPolarHBondContact OE1-CE 3.32Å; E87-K90 IonicContact OE1-NZ 2.71Å; E87-K90 PolarHBondContact OE1-NZ 3.12Å; E87-K90 WeakPolarHBondContact OE2-CD 3.49Å; E87-K90 IonicContact OE2-NZ 3.09Å; E87-Y91 HydrophobicContact CB-CE2 4.08Å; E87-Y91 WeakPolarHBondContact O-CD2 3.34Å; E87-Y91 PolarHBondContact O-N 2.68Å
88	T	98.1	Very high	97.2	Very high	12 Å²	12	66.4 Å²	66.4	7%	0.074	33%	0.329	C	S	.	.	H	α-helix	trans	-56.9	-43.3	174	-63.9	0	0	0	0	112	R68 G69 W84 D85 Y91 K92	R68-T88 HydrophobicContact CB-CG2 4.2Å; G69-T88 PolarHBondContact N-OG1 2.66Å; W84-T88 WeakPolarHBondContact O-CB 3.43Å; W84-T88 PolarHBondContact O-N 3.17Å; W84-T88 PolarHBondContact O-OG1 3.33Å; D85-T88 PolarHBondContact O-N 3.4Å; T88-Y91 PolarHBondContact O-N 2.97Å; T88-K92 HydrophobicContact CG2-CD 4.19Å; T88-K92 WeakPolarHBondContact O-CG 3.41Å; T88-K92 PolarHBondContact O-N 3.04Å
89	Q	98.1	Very high	97.2	Very high	103 Å²	103	64.7 Å²	64.7	48%	0.481	32%	0.317	S	S	.	.	H	α-helix	trans	-69.3	-31.5	177	-67.6	-57.8	-27.7	0	0	113	D85 R86 E87 R93	D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.27Å; D85-Q89 PolarHBondContact O-N 3.48Å; R86-Q89 PolarHBondContact O-N 2.84Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 2.89Å; Q89-R93 WeakPolarHBondContact O-CB 3.24Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 3.38Å; Q89-R93 VanDerWaalsContact O-N 3.09Å; Q89-R93 PolarHBondContact O-NE 3.47Å
90	K	96.8	Very high	97.2	Very high	69 Å²	69	67.8 Å²	67.8	30%	0.3	34%	0.337	S	S	.	.	H	α-helix	trans	-64.5	-48.3	171.7	-73.5	173.2	179.3	172.7	0	110.9	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.31Å; R86-K90 PolarHBondContact O-N 3.15Å; E87-K90 WeakPolarHBondContact O-CB 3.31Å; E87-K90 PolarHBondContact O-N 2.91Å; E87-K90 WeakPolarHBondContact OE1-CE 3.32Å; E87-K90 IonicContact OE1-NZ 2.71Å; E87-K90 PolarHBondContact OE1-NZ 3.12Å; E87-K90 WeakPolarHBondContact OE2-CD 3.49Å; E87-K90 IonicContact OE2-NZ 3.09Å; K90-K92 PolarHBondContact O-N 2.97Å; K90-R93 PolarHBondContact O-N 3.4Å; K90-Q94 PolarHBondContact O-N 3.29Å
91	Y	98.3	Very high	97.3	Very high	12 Å²	12	68.2 Å²	68.2	5%	0.047	33%	0.334	C	S	.	.	H	α-helix	trans	-59.4	-44.4	177.5	-63.8	-51.3	0	0	0	112.3	F46 V58 F60 E87 T88 R93 Q94 A95	F46-Y91 HydrophobicContact CE1-CD1 4.31Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.41Å; F60-Y91 HydrophobicContact CB-CD1 4.1Å; F60-Y91 HydrophobicContact CB-CD2 3.58Å; F60-Y91 HydrophobicContact CB-CE1 4.46Å; F60-Y91 HydrophobicContact CB-CE2 3.98Å; F60-Y91 HydrophobicContact CB-CG 3.66Å; F60-Y91 HydrophobicContact CD1-CG 4.31Å; F60-Y91 AromaticContact CD2-CD2 3.63Å; F60-Y91 HydrophobicContact CD2-CD2 3.63Å; F60-Y91 AromaticContact CD2-CG 3.85Å; F60-Y91 HydrophobicContact CD2-CG 3.85Å; F60-Y91 HydrophobicContact CG-CD1 4.45Å; F60-Y91 AromaticContact CG-CD2 3.78Å; F60-Y91 HydrophobicContact CG-CD2 3.78Å; F60-Y91 AromaticContact CG-CG 3.68Å; F60-Y91 HydrophobicContact CG-CG 3.68Å; E87-Y91 HydrophobicContact CB-CE2 4.08Å; E87-Y91 WeakPolarHBondContact O-CD2 3.34Å; E87-Y91 PolarHBondContact O-N 2.68Å; T88-Y91 PolarHBondContact O-N 2.97Å; Y91-R93 PolarHBondContact O-N 2.95Å; Y91-Q94 PolarHBondContact O-N 2.92Å; Y91-A95 WeakPolarHBondContact O-CB 3.42Å; Y91-A95 PolarHBondContact O-N 3.43Å
92	K	97.9	Very high	97.3	Very high	83 Å²	83	63.8 Å²	63.8	36%	0.361	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-40.3	177.1	-73.4	178.2	177.8	177.2	0	112.7	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.37Å; F60-K92 HydrophobicContact CZ-CG 4.1Å; P67-K92 VanDerWaalsContact O-CE 3.27Å; P67-K92 WeakPolarHBondContact O-CE 3.37Å; P67-K92 PolarHBondContact O-NZ 3.05Å; T88-K92 HydrophobicContact CG2-CD 4.19Å; T88-K92 WeakPolarHBondContact O-CG 3.41Å; T88-K92 PolarHBondContact O-N 3.04Å; K90-K92 PolarHBondContact O-N 2.97Å; K92-Q96 WeakPolarHBondContact O-CG 3.32Å; K92-Q96 PolarHBondContact O-N 3.46Å
93	R	97.9	Very high	97.1	Very high	153 Å²	153	62 Å²	62	58%	0.577	29%	0.291	S	S	*	.	H	α-helix	trans	-66.2	-41.6	174.8	-76	-175.8	-69.6	159.4	-4.1	111.9	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.24Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 3.38Å; Q89-R93 VanDerWaalsContact O-N 3.09Å; Q89-R93 PolarHBondContact O-NE 3.47Å; K90-R93 PolarHBondContact O-N 3.4Å; Y91-R93 PolarHBondContact O-N 2.95Å; R93-Q96 PolarHBondContact O-N 3.36Å; R93-A97 PolarHBondContact O-N 3.29Å
94	Q	97.5	Very high	97.1	Very high	52 Å²	52	65 Å²	65	24%	0.243	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-45.1	176.5	-170.6	64.6	57	0	0	111.3	F46 K90 Y91 Q96 A97 D98	F46-Q94 HydrophobicContact CE2-CB 4.1Å; F46-Q94 HydrophobicContact CE2-CG 3.64Å; F46-Q94 HydrophobicContact CZ-CB 3.87Å; F46-Q94 HydrophobicContact CZ-CG 3.76Å; K90-Q94 PolarHBondContact O-N 3.29Å; Y91-Q94 PolarHBondContact O-N 2.92Å; Q94-Q96 VanDerWaalsContact C-N 3.27Å; Q94-Q96 PolarHBondContact O-N 3.47Å; Q94-A97 WeakPolarHBondContact O-CB 3.25Å; Q94-A97 PolarHBondContact O-N 3.18Å; Q94-D98 PolarHBondContact NE2-OD1 3.4Å; Q94-D98 PolarHBondContact O-N 3.31Å
95	A	97.7	Very high	97.1	Very high	23 Å²	23	63.4 Å²	63.4	19%	0.19	30%	0.302	C	S	.	.	H	α-helix	trans	-56.5	-40.9	176.1	0	0	0	0	0	112.4	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.63Å; F46-A95 HydrophobicContact CD1-CB 3.78Å; F46-A95 HydrophobicContact CD2-CB 4.04Å; F46-A95 HydrophobicContact CE1-CB 4.45Å; F46-A95 HydrophobicContact CG-CB 3.55Å; Y91-A95 WeakPolarHBondContact O-CB 3.42Å; Y91-A95 PolarHBondContact O-N 3.43Å; A95-R99 WeakPolarHBondContact O-CB 3.45Å; A95-R99 PolarHBondContact O-N 3.29Å
96	Q	97.1	Very high	96.9	Very high	132 Å²	132	61.3 Å²	61.3	62%	0.617	29%	0.286	S	S	*	.	H	α-helix	trans	-67	-41.6	174.7	-72.1	178.3	-10.8	0	0	112.4	K92 R93 Q94 R99 V100	K92-Q96 WeakPolarHBondContact O-CG 3.32Å; K92-Q96 PolarHBondContact O-N 3.46Å; R93-Q96 PolarHBondContact O-N 3.36Å; Q94-Q96 VanDerWaalsContact C-N 3.27Å; Q94-Q96 PolarHBondContact O-N 3.47Å; Q96-R99 WeakPolarHBondContact O-CB 3.43Å; Q96-R99 PolarHBondContact O-N 2.61Å; Q96-V100 PolarHBondContact O-N 2.98Å
97	A	96.7	Very high	96.8	Very high	44 Å²	44	58.4 Å²	58.4	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-43	176.6	0	0	0	0	0	111.9	R93 Q94 R99 V100 S101	R93-A97 PolarHBondContact O-N 3.29Å; Q94-A97 WeakPolarHBondContact O-CB 3.25Å; Q94-A97 PolarHBondContact O-N 3.18Å; A97-R99 VanDerWaalsContact C-N 3.34Å; A97-R99 PolarHBondContact O-N 2.66Å; A97-V100 PolarHBondContact O-N 2.78Å; A97-S101 WeakPolarHBondContact O-CB 3.35Å; A97-S101 PolarHBondContact O-N 3Å; A97-S101 PolarHBondContact O-OG 2.75Å
98	D	97.3	Very high	96.9	Very high	5 Å²	5	60.8 Å²	60.8	3%	0.027	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-39.8	177.4	-76.2	12.9	0	0	0	111.5	S35 F46 Q94 V100 S101 L102 L119	S35-D98 WeakPolarHBondContact OG-CB 3.45Å; S35-D98 PolarHBondContact OG-OD2 3.07Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.37Å; Q94-D98 PolarHBondContact NE2-OD1 3.4Å; Q94-D98 PolarHBondContact O-N 3.31Å; D98-V100 VanDerWaalsContact C-N 3.3Å; D98-V100 PolarHBondContact O-N 3.19Å; D98-S101 CarbonylContact O-C 3.56Å; D98-S101 PolarHBondContact O-N 3.16Å; D98-S101 VanDerWaalsContact O-N 3.12Å; D98-L102 WeakPolarHBondContact O-CB 3.39Å; D98-L102 WeakPolarHBondContact O-CG 3.4Å; D98-L102 PolarHBondContact O-N 2.87Å; D98-L119 HydrophobicContact CB-CD2 4.17Å
99	R	96	Very high	96.8	Very high	88 Å²	88	63.5 Å²	63.5	33%	0.332	31%	0.307	S	S	.	.	H	α-helix	trans	-56.6	-44.4	173.5	176.3	-171.6	-179.1	-169.5	-7.1	112	E43 P44 A95 Q96 A97	E43-R99 VanDerWaalsContact CD-NE 3.32Å; E43-R99 IonicContact OE1-CZ 3.02Å; E43-R99 IonicContact OE1-NE 2.84Å; E43-R99 IonicContact OE1-NH1 3.89Å; E43-R99 PolarHBondContact OE1-NH1 2.63Å; E43-R99 IonicContact OE1-NH2 3.17Å; E43-R99 PolarHBondContact OE1-NH2 3.48Å; E43-R99 WeakPolarHBondContact OE2-CD 3.42Å; E43-R99 IonicContact OE2-CZ 3.38Å; E43-R99 IonicContact OE2-NE 3.76Å; E43-R99 PolarHBondContact OE2-NE 2.97Å; E43-R99 IonicContact OE2-NH1 3.7Å; E43-R99 IonicContact OE2-NH2 3.33Å; E43-R99 PolarHBondContact OE2-NH2 3.2Å; P44-R99 HydrophobicContact CG-CB 4.41Å; P44-R99 HydrophobicContact CG-CG 4.23Å; A95-R99 WeakPolarHBondContact O-CB 3.45Å; A95-R99 PolarHBondContact O-N 3.29Å; Q96-R99 WeakPolarHBondContact O-CB 3.43Å; Q96-R99 PolarHBondContact O-N 2.61Å; A97-R99 VanDerWaalsContact C-N 3.34Å; A97-R99 PolarHBondContact O-N 2.66Å
100	V	96.1	Very high	96.7	Very high	77 Å²	77	65.8 Å²	65.8	47%	0.467	32%	0.323	S	S	.	.	H	α-helix	trans	-68.8	-40.6	176.2	174.7	0	0	0	0	110.4	Q96 A97 D98 R103 N104	Q96-V100 PolarHBondContact O-N 2.98Å; A97-V100 PolarHBondContact O-N 2.78Å; D98-V100 VanDerWaalsContact C-N 3.3Å; D98-V100 PolarHBondContact O-N 3.19Å; V100-R103 PolarHBondContact O-N 2.94Å; V100-N104 PolarHBondContact O-N 3.45Å; V100-N104 VanDerWaalsContact O-N 3.08Å; V100-N104 PolarHBondContact O-ND2 3.38Å
101	S	97	Very high	96.6	Very high	45 Å²	45	65.3 Å²	65.3	32%	0.315	32%	0.322	S	S	.	.	H	α-helix	trans	-62.7	-44.4	180	-59.6	0	0	0	0	111.9	A97 D98 R103 N104 L105	A97-S101 WeakPolarHBondContact O-CB 3.35Å; A97-S101 PolarHBondContact O-N 3Å; A97-S101 PolarHBondContact O-OG 2.75Å; D98-S101 CarbonylContact O-C 3.56Å; D98-S101 PolarHBondContact O-N 3.16Å; D98-S101 VanDerWaalsContact O-N 3.12Å; S101-R103 VanDerWaalsContact C-N 3.3Å; S101-R103 PolarHBondContact O-N 3.39Å; S101-N104 PolarHBondContact O-N 2.92Å; S101-N104 VanDerWaalsContact O-N 3.1Å; S101-L105 WeakPolarHBondContact O-CB 3.44Å; S101-L105 VanDerWaalsContact O-CG 3.24Å; S101-L105 WeakPolarHBondContact O-CG 3.35Å; S101-L105 PolarHBondContact O-N 2.93Å
102	L	96.8	Very high	96.3	Very high	8 Å²	8	68.4 Å²	68.4	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-56.8	-40.7	175.5	-77.9	166.5	0	0	0	112.3	P44 D98 R106 H117 L119 Y142	P44-L102 HydrophobicContact CB-CD1 3.67Å; P44-L102 HydrophobicContact CG-CD1 3.84Å; D98-L102 WeakPolarHBondContact O-CB 3.39Å; D98-L102 WeakPolarHBondContact O-CG 3.4Å; D98-L102 PolarHBondContact O-N 2.87Å; L102-R106 WeakPolarHBondContact O-CB 3.41Å; L102-R106 PolarHBondContact O-N 3.49Å; L102-R106 VanDerWaalsContact O-N 3.09Å; L102-H117 HydrophobicContact CD2-CB 4.22Å; L102-L119 HydrophobicContact CD2-CB 3.71Å; L102-L119 HydrophobicContact CG-CB 4.11Å; L102-Y142 HydrophobicContact CD2-CE2 3.98Å
103	R	94.2	Very high	95.8	Very high	126 Å²	126	70.7 Å²	70.7	48%	0.475	36%	0.357	S	S	.	.	H	α-helix	trans	-67.2	-41.5	175.3	-63.5	-175.8	-148	171.1	4.7	112.5	V100 S101 G107	V100-R103 PolarHBondContact O-N 2.94Å; S101-R103 VanDerWaalsContact C-N 3.3Å; S101-R103 PolarHBondContact O-N 3.39Å; R103-G107 PolarHBondContact O-N 2.96Å
104	N	95.7	Very high	95.2	Very high	72 Å²	72	70.2 Å²	70.2	39%	0.385	37%	0.366	S	S	.	.	H	α-helix	trans	-65.6	-45.8	178.8	-70.5	-23	0	0	0	111.3	V100 S101 G107 Y108	V100-N104 PolarHBondContact O-N 3.45Å; V100-N104 VanDerWaalsContact O-N 3.08Å; V100-N104 PolarHBondContact O-ND2 3.38Å; S101-N104 PolarHBondContact O-N 2.92Å; S101-N104 VanDerWaalsContact O-N 3.1Å; N104-G107 CarbonylContact O-C 3.55Å; N104-G107 WeakPolarHBondContact O-CA 3.38Å; N104-G107 PolarHBondContact O-N 2.98Å; N104-G107 VanDerWaalsContact O-N 3.1Å; N104-Y108 WeakPolarHBondContact O-CD1 3.31Å; N104-Y108 PolarHBondContact O-N 3.43Å
105	L	97.2	Very high	94.8	Very high	6 Å²	6	68.7 Å²	68.7	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-60.2	-46.9	179.1	-70.9	167	0	0	0	110.9	S101 G107 Y108 Y109 L119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.44Å; S101-L105 VanDerWaalsContact O-CG 3.24Å; S101-L105 WeakPolarHBondContact O-CG 3.35Å; S101-L105 PolarHBondContact O-N 2.93Å; L105-G107 PolarHBondContact O-N 2.91Å; L105-Y108 PolarHBondContact O-N 2.86Å; L105-Y109 HydrophobicContact CD2-CE2 4.27Å; L105-Y109 VanDerWaalsContact O-CD2 3.26Å; L105-Y109 WeakPolarHBondContact O-CD2 3.29Å; L105-Y109 PolarHBondContact O-N 3.39Å; L105-L119 HydrophobicContact CD1-CD1 3.9Å; L105-L119 HydrophobicContact CD1-CD2 4.34Å; L105-Y142 HydrophobicContact CB-CD1 4.37Å; L105-Y142 HydrophobicContact CB-CD2 4.25Å; L105-Y142 HydrophobicContact CB-CE1 4Å; L105-Y142 HydrophobicContact CB-CE2 3.9Å; L105-Y142 HydrophobicContact CB-CG 4.47Å; L105-Y142 HydrophobicContact CD1-CD2 3.62Å; L105-Y142 HydrophobicContact CD1-CE2 3.94Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.46Å; L105-Y147 HydrophobicContact CD2-CD1 4.37Å; L105-Y147 HydrophobicContact CD2-CD2 4.06Å; L105-Y147 HydrophobicContact CD2-CE1 3.77Å; L105-Y147 HydrophobicContact CD2-CE2 3.39Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.17Å
106	R	95.1	Very high	94.7	Very high	63 Å²	63	70.8 Å²	70.8	24%	0.238	38%	0.377	C	S	.	.	H	α-helix	trans	-52.8	-42.2	173.6	-169.3	-176.9	68.1	176.5	9.4	112.2	L102 N110 Q111 S112 E113	L102-R106 WeakPolarHBondContact O-CB 3.41Å; L102-R106 PolarHBondContact O-N 3.49Å; L102-R106 VanDerWaalsContact O-N 3.09Å; R106-N110 PolarHBondContact O-N 3.49Å; R106-N110 VanDerWaalsContact O-N 3.14Å; R106-Q111 HydrophobicContact CG-CB 3.79Å; R106-Q111 PolarHBondContact O-N 3.47Å; R106-S112 WeakPolarHBondContact CD-O 3.4Å; R106-E113 IonicContact CZ-OE1 2.94Å; R106-E113 IonicContact NH1-OE1 3.33Å; R106-E113 IonicContact NH2-OE1 3.64Å; R106-E113 PolarHBondContact NH2-OE1 3.3Å
107	G	95.2	Very high	94.7	Very high	44 Å²	44	65.1 Å²	65.1	45%	0.454	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-42.5	174.6	0	0	0	0	0	113.5	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 2.96Å; N104-G107 CarbonylContact O-C 3.55Å; N104-G107 WeakPolarHBondContact O-CA 3.38Å; N104-G107 PolarHBondContact O-N 2.98Å; N104-G107 VanDerWaalsContact O-N 3.1Å; L105-G107 PolarHBondContact O-N 2.91Å; G107-Y109 VanDerWaalsContact C-N 3.29Å; G107-Y109 PolarHBondContact O-N 3.48Å; G107-N110 PolarHBondContact O-N 2.72Å; G107-N110 PolarHBondContact O-OD1 2.95Å
108	Y	97.4	Very high	94.8	Very high	60 Å²	60	64.8 Å²	64.8	24%	0.235	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-34.5	179.3	-63.8	-11.5	0	0	0	112.7	N104 L105 I166 K170	N104-Y108 WeakPolarHBondContact O-CD1 3.31Å; N104-Y108 PolarHBondContact O-N 3.43Å; L105-Y108 PolarHBondContact O-N 2.86Å; Y108-I166 HydrophobicContact CD1-CD1 4.17Å; Y108-I166 HydrophobicContact CD2-CB 4.49Å; Y108-I166 HydrophobicContact CD2-CD1 4.39Å; Y108-I166 HydrophobicContact CE1-CD1 4.48Å; Y108-I166 HydrophobicContact CE1-CG2 4.26Å; Y108-I166 HydrophobicContact CE2-CB 4.18Å; Y108-I166 HydrophobicContact CE2-CG2 3.94Å; Y108-I166 HydrophobicContact CG-CD1 4.15Å; Y108-K170 PolarHBondContact OH-NZ 3.4Å
109	Y	97.3	Very high	94.8	Very high	68 Å²	68	65.1 Å²	65.1	27%	0.267	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	4.1	178	-68.8	-72	0	0	0	113.9	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.27Å; L105-Y109 VanDerWaalsContact O-CD2 3.26Å; L105-Y109 WeakPolarHBondContact O-CD2 3.29Å; L105-Y109 PolarHBondContact O-N 3.39Å; G107-Y109 VanDerWaalsContact C-N 3.29Å; G107-Y109 PolarHBondContact O-N 3.48Å; Y109-Q111 PolarHBondContact O-N 3.27Å; Y109-Y142 AromaticContact CD2-CD1 3.74Å; Y109-Y142 HydrophobicContact CD2-CD1 3.74Å; Y109-Y142 AromaticContact CD2-CE1 3.54Å; Y109-Y142 HydrophobicContact CD2-CE1 3.54Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.86Å; Y109-Y142 HydrophobicContact CE2-CE1 3.86Å; Y109-Y142 HydrophobicContact CG-CE1 4.44Å; Y109-Y147 HydrophobicContact CE2-CD2 4.35Å; Y109-Y147 HydrophobicContact CE2-CE2 4.05Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.41Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.36Å; Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 3.33Å; Y109-D161 PolarHBondContact OH-OD2 3.36Å; Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.44Å; Y109-A163 HydrophobicContact CE1-CB 3.61Å; Y109-A163 HydrophobicContact CE2-CB 3.91Å; Y109-A163 VanDerWaalsContact CZ-CB 3.47Å
110	N	95.8	Very high	95	Very high	152 Å²	152	64.6 Å²	64.6	81%	0.813	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	41	-177.9	-57.4	-57.8	0	0	0	113.3	R106 G107	R106-N110 PolarHBondContact O-N 3.49Å; R106-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-N 2.72Å; G107-N110 PolarHBondContact O-OD1 2.95Å
111	Q	95.4	Very high	95.1	Very high	59 Å²	59	63.5 Å²	63.5	28%	0.276	34%	0.335	S	S	.	.			trans	-87.3	154.6	-177.3	-70.2	164.5	-34.6	0	0	111.8	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.79Å; R106-Q111 PolarHBondContact O-N 3.47Å; Y109-Q111 PolarHBondContact O-N 3.27Å; Q111-H117 PolarHBondContact NE2-CE1 3.48Å; Q111-H117 PolarHBondContact OE1-CE1 3.33Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.25Å; Q111-Y142 PolarHBondContact OE1-OH 2.88Å; Q111-D143 PolarHBondContact NE2-OD2 3.35Å
112	S	91.8	Very high	95.1	Very high	77 Å²	77	62.4 Å²	62.4	54%	0.538	33%	0.325	S	S	.	.			trans	-71.8	158.2	-179.5	63.5	0	0	0	0	112.6	R106 D114	R106-S112 WeakPolarHBondContact CD-O 3.4Å; S112-D114 VanDerWaalsContact C-N 3.29Å; S112-D114 PolarHBondContact O-N 2.89Å
113	E	85.7	Confident	95.2	Very high	130 Å²	130	62.6 Å²	62.6	61%	0.607	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-22.3	-179.9	-59.1	-151.2	123.1	0	0	114	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.26Å; P39-E113 WeakPolarHBondContact CG-O 3.39Å; R106-E113 IonicContact CZ-OE1 2.94Å; R106-E113 IonicContact NH1-OE1 3.33Å; R106-E113 IonicContact NH2-OE1 3.64Å; R106-E113 PolarHBondContact NH2-OE1 3.3Å; E113-G115 VanDerWaalsContact C-N 3.3Å
114	D	85.9	Confident	95.4	Very high	144 Å²	144	56.6 Å²	56.6	77%	0.77	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-5.8	-177.1	-56.7	-42.6	0	0	0	113.1	S112	S112-D114 VanDerWaalsContact C-N 3.29Å; S112-D114 PolarHBondContact O-N 2.89Å
115	G	89.8	Confident	95.5	Very high	20 Å²	20	53.2 Å²	53.2	21%	0.206	29%	0.286	C	S	.	.			trans	-74.9	132.6	177.4	0	0	0	0	0	113.1	P39 E113 H117	P39-G115 WeakPolarHBondContact CG-O 3.46Å; E113-G115 VanDerWaalsContact C-N 3.3Å; G115-H117 PolarHBondContact O-CD2 2.96Å; G115-H117 VanDerWaalsContact O-CD2 3.25Å
116	S	94.9	Very high	95.5	Very high	66 Å²	66	53.9 Å²	53.9	46%	0.462	29%	0.29	S	S	.	.			trans	-79.8	134.8	163.5	-179.6	0	0	0	0	109.2	S37	S37-S116 WeakPolarHBondContact O-CA 3.37Å; S37-S116 WeakPolarHBondContact O-CB 3.26Å; S37-S116 PolarHBondContact O-OG 2.92Å
117	H	97.2	Very high	95.6	Very high	13 Å²	13	51 Å²	51	6%	0.06	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	150.7	-176.5	-64.3	-73.1	0	0	0	110.6	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 WeakPolarHBondContact CA-O 3.16Å; S37-H117 PolarHBondContact N-O 3.4Å; S37-H117 PolarHBondContact OG-N 3.33Å; S37-H117 PolarHBondContact OG-O 3.5Å; L102-H117 HydrophobicContact CD2-CB 4.22Å; Q111-H117 PolarHBondContact NE2-CE1 3.48Å; Q111-H117 PolarHBondContact OE1-CE1 3.33Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.25Å; G115-H117 PolarHBondContact O-CD2 2.96Å; G115-H117 VanDerWaalsContact O-CD2 3.25Å; H117-Y142 HydrophobicContact CB-CE2 3.81Å; H117-Y142 WeakPolarHBondContact CB-OH 3.38Å; H117-Y142 AromaticContact CG-CZ 3.98Å; H117-Y142 AromaticContact ND1-CZ 3.86Å; H117-Y142 PolarHBondContact ND1-OH 3.29Å; H117-D143 WeakPolarHBondContact CA-OD1 3.37Å; H117-D143 IonicContact CE1-OD2 3.62Å; H117-D143 IonicContact CG-OD1 2.83Å; H117-D143 IonicContact CG-OD2 3.05Å; H117-D143 IonicContact ND1-OD1 2.78Å; H117-D143 IonicContact ND1-OD2 3.35Å; H117-D143 PolarHBondContact ND1-OD2 3.19Å
118	T	98.3	Very high	95.5	Very high	38 Å²	38	49.3 Å²	49.3	23%	0.233	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127	-176	-56.5	0	0	0	0	110.3	T34 S35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 3.9Å; S35-T118 CarbonylContact O-C 3.54Å; S35-T118 WeakPolarHBondContact O-CA 3.35Å; V36-T118 HydrophobicContact CG2-CG2 4.21Å; T118-Q120 HydrophobicContact CG2-CG 3.96Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.04Å; T118-Y142 VanDerWaalsContact O-CD2 3.3Å; T118-Y142 WeakPolarHBondContact O-CD2 3Å; T118-D143 PolarHBondContact N-OD1 3.04Å; T118-D143 PolarHBondContact O-N 3.46Å
119	L	98.6	Very high	95.1	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.063	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.5	170.6	176	62.7	0	0	0	108.4	T34 S35 D98 L102 L105	T34-L119 WeakPolarHBondContact CA-O 3.21Å; S35-L119 PolarHBondContact N-O 2.97Å; S35-L119 PolarHBondContact O-N 3.02Å; D98-L119 HydrophobicContact CB-CD2 4.17Å; L102-L119 HydrophobicContact CD2-CB 3.71Å; L102-L119 HydrophobicContact CG-CB 4.11Å; L105-L119 HydrophobicContact CD1-CD1 3.9Å; L105-L119 HydrophobicContact CD1-CD2 4.34Å
120	Q	98.8	Very high	94.7	Very high	77 Å²	77	52.3 Å²	52.3	36%	0.36	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144.6	178.3	-64.2	172.4	-86.7	0	0	109.6	S33 T34 T118 S140 A141	S33-Q120 CarbonylContact O-C 3.6Å; S33-Q120 VanDerWaalsContact O-CA 3.3Å; S33-Q120 WeakPolarHBondContact O-CA 3.4Å; T34-Q120 HydrophobicContact CG2-CG 4.08Å; T118-Q120 HydrophobicContact CG2-CG 3.96Å; Q120-S140 CarbonylContact O-C 3.58Å; Q120-S140 WeakPolarHBondContact O-CA 3.46Å; Q120-S140 WeakPolarHBondContact O-CB 3.48Å; Q120-A141 HydrophobicContact CB-CB 4.38Å; Q120-A141 PolarHBondContact N-O 2.84Å; Q120-A141 PolarHBondContact O-N 3.37Å
121	R	98.4	Very high	94.3	Very high	54 Å²	54	45.9 Å²	45.9	20%	0.204	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.5	173.9	-174.4	174.6	-176.8	-131.8	5.7	110.2	F32 S33 D138 Q139	F32-R121 CarbonylContact C-O 3.53Å; F32-R121 WeakPolarHBondContact CA-O 3.32Å; S33-R121 PolarHBondContact N-O 3.35Å; S33-R121 PolarHBondContact O-N 2.94Å; R121-D138 IonicContact CZ-OD1 2.73Å; R121-D138 IonicContact CZ-OD2 3.56Å; R121-D138 IonicContact NE-OD1 2.91Å; R121-D138 PolarHBondContact NE-OD1 3.26Å; R121-D138 IonicContact NE-OD2 2.98Å; R121-D138 PolarHBondContact NE-OD2 3.09Å; R121-D138 IonicContact NH2-OD1 3.7Å; R121-D138 PolarHBondContact NH2-OD1 2.89Å; R121-D138 IonicContact NH2-OD2 3.85Å; R121-D138 PolarHBondContact NH2-OD2 2.63Å; R121-Q139 CarbonylContact C-O 3.57Å; R121-Q139 VanDerWaalsContact CA-O 3.32Å; R121-Q139 WeakPolarHBondContact CA-O 3.45Å
122	M	98.5	Very high	94.2	Very high	21 Å²	21	51.2 Å²	51.2	10%	0.103	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.5	167.3	-174.4	-79.6	-75.6	0	0	108.6	Y31 F32 Y137 D138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.32Å; F32-M122 HydrophobicContact CD1-CB 3.98Å; F32-M122 HydrophobicContact CD1-CG 3.68Å; F32-M122 HydrophobicContact CE1-CB 4.09Å; F32-M122 HydrophobicContact CE1-CG 3.37Å; F32-M122 HydrophobicContact CZ-CG 3.98Å; M122-Y137 HydrophobicContact CE-CD1 3.94Å; M122-Y137 HydrophobicContact CE-CG 3.95Å; M122-Y137 HydrophobicContact SD-CG 4.38Å; M122-D138 WeakPolarHBondContact O-CA 3.32Å; M122-Q139 HydrophobicContact CB-CG 4.04Å; M122-Q139 HydrophobicContact CE-CG 3.92Å; M122-Q139 PolarHBondContact N-O 2.89Å; M122-Q139 PolarHBondContact O-N 2.94Å
123	S	97.7	Very high	94.4	Very high	13 Å²	13	50 Å²	50	9%	0.091	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.1	175.2	68.4	0	0	0	0	110.8	Y31 Y137 D138	Y31-S123 PolarHBondContact N-O 2.92Å; Y31-S123 PolarHBondContact O-N 3.29Å; S123-Y137 VanDerWaalsContact CA-O 3.27Å; S123-Y137 WeakPolarHBondContact CA-O 3.39Å; S123-D138 VanDerWaalsContact CB-OD1 3.23Å; S123-D138 WeakPolarHBondContact CB-OD1 3.47Å
124	G	98.1	Very high	94.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.6	-177	179.2	0	0	0	0	0	114.8	M29 G136 Y137 L184	M29-G124 CarbonylContact O-C 3.53Å; M29-G124 WeakPolarHBondContact O-CA 3.26Å; G124-G136 CarbonylContact O-C 3.59Å; G124-G136 WeakPolarHBondContact O-CA 3.4Å; G124-Y137 PolarHBondContact N-O 2.87Å; G124-Y137 PolarHBondContact O-N 2.83Å; G124-L184 WeakPolarHBondContact O-CD2 3.47Å
125	C	98.3	Very high	95.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.3	-178.4	53.6	0	0	0	0	111.2	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.46Å; M29-C125 PolarHBondContact N-O 2.85Å; M29-C125 PolarHBondContact O-N 2.92Å; C125-L133 HydrophobicContact CB-CD1 3.56Å; C125-R135 CarbonylContact C-O 3.54Å; C125-R135 WeakPolarHBondContact CA-O 3.35Å; C125-C188 HydrophobicContact CB-CB 3.93Å; C125-C188 WeakPolarHBondContact CB-SG 3.45Å; C125-C188 PolarHBondContact N-SG 3.28Å; C125-C188 VanDerWaalsContact N-SG 3.4Å; C125-C188 WeakPolarHBondContact SG-CB 3.11Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.46Å
126	D	97.8	Very high	95.8	Very high	21 Å²	21	46.6 Å²	46.6	11%	0.112	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.6	172.3	-60.1	-11	0	0	0	108.8	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.49Å; H27-D126 WeakPolarHBondContact O-CA 3.48Å; S28-D126 WeakPolarHBondContact CB-OD1 3.23Å; R30-D126 IonicContact CZ-OD1 3.78Å; R30-D126 VanDerWaalsContact CZ-OD1 3.31Å; R30-D126 IonicContact NE-OD1 3.52Å; R30-D126 PolarHBondContact NE-OD1 3.5Å; R30-D126 VanDerWaalsContact NE-OD1 3.09Å; R30-D126 IonicContact NH2-OD1 3.44Å; R30-D126 PolarHBondContact NH2-OD1 2.87Å; R30-D126 IonicContact NH2-OD2 2.58Å; R30-D126 PolarHBondContact NH2-OD2 3.36Å; D126-L134 HydrophobicContact CB-CB 4.37Å; D126-L134 PolarHBondContact O-N 3.12Å; D126-R135 HydrophobicContact CB-CB 4.44Å; D126-R135 PolarHBondContact N-O 3.09Å; D126-R135 PolarHBondContact O-N 2.66Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.14Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.3Å; D126-Y137 PolarHBondContact OD2-OH 3.36Å
127	L	96.6	Very high	95.9	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.016	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	135.8	173.4	-55.5	-176.4	0	0	0	110	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.26Å; S26-L127 WeakPolarHBondContact CA-O 2.84Å; S26-L127 WeakPolarHBondContact CB-O 3.35Å; H27-L127 PolarHBondContact N-O 3.26Å; H27-L127 VanDerWaalsContact N-O 3.12Å; H27-L127 PolarHBondContact O-N 2.85Å; L127-R132 CarbonylContact C-O 3.55Å; L127-R132 VanDerWaalsContact CA-O 3.23Å; L127-R132 WeakPolarHBondContact CA-O 3.45Å; L127-V189 HydrophobicContact CD1-CG1 4.43Å; L127-V189 HydrophobicContact CD2-CB 4.13Å; L127-V189 HydrophobicContact CD2-CG1 3.73Å; L127-V189 HydrophobicContact CD2-CG2 3.79Å; L127-L192 HydrophobicContact CB-CD2 4.49Å; L127-L192 HydrophobicContact CD1-CB 4.23Å; L127-L192 HydrophobicContact CD1-CD2 3.68Å; L127-L192 HydrophobicContact CD1-CG 3.73Å; L127-L192 HydrophobicContact CD2-CD2 4.49Å; L127-L192 HydrophobicContact CG-CD2 3.56Å; L127-L192 HydrophobicContact CG-CG 4.2Å; L127-R193 HydrophobicContact CD1-CG 3.92Å
128	G	93.1	Very high	96	Very high	8 Å²	8	45.2 Å²	45.2	8%	0.082	23%	0.226	C	C	.	.			trans	-69.9	175.5	165.2	0	0	0	0	0	111.8	D130 G131 R132	G128-D130 PolarHBondContact O-N 3.35Å; G128-G131 WeakPolarHBondContact O-CA 3.39Å; G128-G131 PolarHBondContact O-N 3.43Å; G128-R132 PolarHBondContact N-O 3.03Å
129	P	88.8	Confident	96	Very high	88 Å²	88	47.3 Å²	47.3	57%	0.571	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.6	179.5	-18.3	29.7	0	0	0	113.6	A24 G131	A24-P129 HydrophobicContact CB-CB 3.68Å; A24-P129 HydrophobicContact CB-CG 3.2Å; A24-P129 WeakPolarHBondContact O-CG 3.42Å; P129-G131 PolarHBondContact O-N 3.19Å
130	D	88.4	Confident	96	Very high	102 Å²	102	47.9 Å²	47.9	55%	0.545	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	3.4	173.8	69	-13.8	0	0	0	112.9	G128 R132	G128-D130 PolarHBondContact O-N 3.35Å; D130-R132 PolarHBondContact O-N 2.91Å; D130-R132 WeakPolarHBondContact OD1-CB 3.27Å; D130-R132 PolarHBondContact OD1-N 3.17Å; D130-R132 WeakPolarHBondContact OD2-CD 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.37Å; D130-R132 IonicContact OD2-NE 3.72Å
131	G	88.6	Confident	96	Very high	18 Å²	18	45 Å²	45	19%	0.186	23%	0.227	C	C	.	.	S	Bend	trans	71.6	9.1	-178.4	0	0	0	0	0	113.8	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.39Å; G128-G131 PolarHBondContact O-N 3.43Å; P129-G131 PolarHBondContact O-N 3.19Å; G131-R193 VanDerWaalsContact O-CZ 3.26Å; G131-R193 PolarHBondContact O-NE 3.12Å; G131-R193 PolarHBondContact O-NH2 2.79Å
132	R	93.3	Very high	96	Very high	170 Å²	170	42.9 Å²	42.9	64%	0.642	22%	0.22	S	C	*	.	S	Bend	trans	-88.4	155	179.1	-62.2	-173.3	-176.9	166.5	-2.5	111.2	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.55Å; L127-R132 VanDerWaalsContact CA-O 3.23Å; L127-R132 WeakPolarHBondContact CA-O 3.45Å; G128-R132 PolarHBondContact N-O 3.03Å; D130-R132 PolarHBondContact O-N 2.91Å; D130-R132 WeakPolarHBondContact OD1-CB 3.27Å; D130-R132 PolarHBondContact OD1-N 3.17Å; D130-R132 WeakPolarHBondContact OD2-CD 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.37Å; D130-R132 IonicContact OD2-NE 3.72Å; R132-L134 PolarHBondContact O-N 2.91Å; R132-L134 VanDerWaalsContact O-N 3.12Å
133	L	96.4	Very high	96	Very high	52 Å²	52	45 Å²	45	27%	0.272	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	118.3	174.8	-176.5	73.4	0	0	0	109.7	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.56Å; L133-R135 WeakPolarHBondContact CD1-O 3.24Å; L133-L154 HydrophobicContact CD2-CD1 4.16Å; L133-E185 HydrophobicContact CD2-CB 4.35Å; L133-E185 HydrophobicContact CD2-CG 3.64Å; L133-V189 HydrophobicContact CB-CG2 4Å; L133-V189 HydrophobicContact CD1-CG2 4.05Å
134	L	96	Very high	95.9	Very high	125 Å²	125	47.1 Å²	47.1	65%	0.654	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	-46.4	170.5	-177.2	65.7	0	0	0	110.1	D126 R132	D126-L134 HydrophobicContact CB-CB 4.37Å; D126-L134 PolarHBondContact O-N 3.12Å; R132-L134 PolarHBondContact O-N 2.91Å; R132-L134 VanDerWaalsContact O-N 3.12Å
135	R	96.3	Very high	96	Very high	93 Å²	93	54.8 Å²	54.8	35%	0.351	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	143.5	-177	-172.8	161.8	172.2	142	9.3	112.1	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.54Å; C125-R135 WeakPolarHBondContact CA-O 3.35Å; D126-R135 HydrophobicContact CB-CB 4.44Å; D126-R135 PolarHBondContact N-O 3.09Å; D126-R135 PolarHBondContact O-N 2.66Å; L133-R135 WeakPolarHBondContact CD1-O 3.24Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.45Å; R135-Y137 VanDerWaalsContact CD-OH 3.23Å; R135-Y137 WeakPolarHBondContact CD-OH 3.19Å; R135-Y137 HydrophobicContact CG-CD2 4.41Å; R135-Y137 HydrophobicContact CG-CE1 4.02Å; R135-Y137 HydrophobicContact CG-CE2 3.74Å; R135-E152 VanDerWaalsContact CZ-CD 3.42Å; R135-E152 VanDerWaalsContact CZ-CG 3.45Å; R135-E152 IonicContact CZ-OE1 3.26Å; R135-E152 IonicContact NH1-OE1 3.01Å; R135-E152 PolarHBondContact NH1-OE1 3.39Å; R135-E152 IonicContact NH1-OE2 3.57Å; R135-E152 IonicContact NH2-OE1 3.15Å; R135-E152 PolarHBondContact NH2-OE1 2.88Å
136	G	97.8	Very high	96	Very high	5 Å²	5	60.9 Å²	60.9	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	150.6	170.7	0	0	0	0	0	111.1	G124	G124-G136 CarbonylContact O-C 3.59Å; G124-G136 WeakPolarHBondContact O-CA 3.4Å
137	Y	97.9	Very high	96	Very high	39 Å²	39	60.3 Å²	60.3	15%	0.153	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	138.4	-178.4	-53.9	-97.1	0	0	0	110.6	R30 M122 S123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.3Å; R30-Y137 PolarHBondContact NH2-OH 2.83Å; M122-Y137 HydrophobicContact CE-CD1 3.94Å; M122-Y137 HydrophobicContact CE-CG 3.95Å; M122-Y137 HydrophobicContact SD-CG 4.38Å; S123-Y137 VanDerWaalsContact CA-O 3.27Å; S123-Y137 WeakPolarHBondContact CA-O 3.39Å; G124-Y137 PolarHBondContact N-O 2.87Å; G124-Y137 PolarHBondContact O-N 2.83Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.14Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.3Å; D126-Y137 PolarHBondContact OD2-OH 3.36Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.45Å; R135-Y137 VanDerWaalsContact CD-OH 3.23Å; R135-Y137 WeakPolarHBondContact CD-OH 3.19Å; R135-Y137 HydrophobicContact CG-CD2 4.41Å; R135-Y137 HydrophobicContact CG-CE1 4.02Å; R135-Y137 HydrophobicContact CG-CE2 3.74Å
138	D	98.3	Very high	96.1	Very high	11 Å²	11	60.8 Å²	60.8	6%	0.059	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	105.6	160.8	-156.3	79.2	0	0	0	108.4	R121 M122 S123 L150 L180	R121-D138 IonicContact CZ-OD1 2.73Å; R121-D138 IonicContact CZ-OD2 3.56Å; R121-D138 IonicContact NE-OD1 2.91Å; R121-D138 PolarHBondContact NE-OD1 3.26Å; R121-D138 IonicContact NE-OD2 2.98Å; R121-D138 PolarHBondContact NE-OD2 3.09Å; R121-D138 IonicContact NH2-OD1 3.7Å; R121-D138 PolarHBondContact NH2-OD1 2.89Å; R121-D138 IonicContact NH2-OD2 3.85Å; R121-D138 PolarHBondContact NH2-OD2 2.63Å; M122-D138 WeakPolarHBondContact O-CA 3.32Å; S123-D138 VanDerWaalsContact CB-OD1 3.23Å; S123-D138 WeakPolarHBondContact CB-OD1 3.47Å; D138-L150 HydrophobicContact CB-CB 3.93Å; D138-L150 HydrophobicContact CB-CD2 4.16Å; D138-L150 WeakPolarHBondContact O-CB 3.23Å; D138-L150 PolarHBondContact O-N 2.82Å; D138-L180 HydrophobicContact CB-CD1 4.22Å
139	Q	98.5	Very high	96.4	Very high	81 Å²	81	61.8 Å²	61.8	38%	0.379	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	144.2	-177	62.7	-169.5	60.1	0	0	110.8	R121 M122 I148 A149	R121-Q139 CarbonylContact C-O 3.57Å; R121-Q139 VanDerWaalsContact CA-O 3.32Å; R121-Q139 WeakPolarHBondContact CA-O 3.45Å; M122-Q139 HydrophobicContact CB-CG 4.04Å; M122-Q139 HydrophobicContact CE-CG 3.92Å; M122-Q139 PolarHBondContact N-O 2.89Å; M122-Q139 PolarHBondContact O-N 2.94Å; Q139-I148 WeakPolarHBondContact CA-O 3.36Å; Q139-A149 HydrophobicContact CB-CB 3.9Å
140	S	98.6	Very high	96.9	Very high	24 Å²	24	58.2 Å²	58.2	17%	0.168	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.9	179.9	-58	0	0	0	0	111.1	Q120 Y147 I148	Q120-S140 CarbonylContact O-C 3.58Å; Q120-S140 WeakPolarHBondContact O-CA 3.46Å; Q120-S140 WeakPolarHBondContact O-CB 3.48Å; S140-Y147 WeakPolarHBondContact O-CB 3.23Å; S140-Y147 PolarHBondContact O-N 2.96Å; S140-I148 PolarHBondContact N-O 3.45Å; S140-I148 PolarHBondContact O-N 2.82Å
141	A	98.8	Very high	97.3	Very high	16 Å²	16	55.4 Å²	55.4	13%	0.132	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	146	177.1	0	0	0	0	0	110.1	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.38Å; Q120-A141 PolarHBondContact N-O 2.84Å; Q120-A141 PolarHBondContact O-N 3.37Å; A141-K145 CarbonylContact C-O 3.59Å; A141-K145 WeakPolarHBondContact CA-O 3.43Å; A141-K145 WeakPolarHBondContact CB-O 3.39Å
142	Y	98.6	Very high	97.8	Very high	11 Å²	11	61 Å²	61	4%	0.043	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.3	177.4	-174.9	-121.4	0	0	0	109.9	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 3.98Å; L105-Y142 HydrophobicContact CB-CD1 4.37Å; L105-Y142 HydrophobicContact CB-CD2 4.25Å; L105-Y142 HydrophobicContact CB-CE1 4Å; L105-Y142 HydrophobicContact CB-CE2 3.9Å; L105-Y142 HydrophobicContact CB-CG 4.47Å; L105-Y142 HydrophobicContact CD1-CD2 3.62Å; L105-Y142 HydrophobicContact CD1-CE2 3.94Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.46Å; Y109-Y142 AromaticContact CD2-CD1 3.74Å; Y109-Y142 HydrophobicContact CD2-CD1 3.74Å; Y109-Y142 AromaticContact CD2-CE1 3.54Å; Y109-Y142 HydrophobicContact CD2-CE1 3.54Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.86Å; Y109-Y142 HydrophobicContact CE2-CE1 3.86Å; Y109-Y142 HydrophobicContact CG-CE1 4.44Å; Q111-Y142 PolarHBondContact OE1-OH 2.88Å; H117-Y142 HydrophobicContact CB-CE2 3.81Å; H117-Y142 WeakPolarHBondContact CB-OH 3.38Å; H117-Y142 AromaticContact CG-CZ 3.98Å; H117-Y142 AromaticContact ND1-CZ 3.86Å; H117-Y142 PolarHBondContact ND1-OH 3.29Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.04Å; T118-Y142 VanDerWaalsContact O-CD2 3.3Å; T118-Y142 WeakPolarHBondContact O-CD2 3Å; Y142-G144 PolarHBondContact O-N 3.48Å; Y142-K145 PolarHBondContact N-O 3.09Å; Y142-K145 PolarHBondContact O-N 3.27Å
143	D	97.8	Very high	97.9	Very high	64 Å²	64	56.6 Å²	56.6	34%	0.342	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	41.1	-174.5	-65.7	-21.3	0	0	0	113.1	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 3.35Å; H117-D143 WeakPolarHBondContact CA-OD1 3.37Å; H117-D143 IonicContact CE1-OD2 3.62Å; H117-D143 IonicContact CG-OD1 2.83Å; H117-D143 IonicContact CG-OD2 3.05Å; H117-D143 IonicContact ND1-OD1 2.78Å; H117-D143 IonicContact ND1-OD2 3.35Å; H117-D143 PolarHBondContact ND1-OD2 3.19Å; T118-D143 PolarHBondContact N-OD1 3.04Å; T118-D143 PolarHBondContact O-N 3.46Å; D143-K145 VanDerWaalsContact C-N 3.3Å; D143-K145 PolarHBondContact O-N 2.86Å
144	G	97.2	Very high	98	Very high	59 Å²	59	54.5 Å²	54.5	61%	0.608	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	8.4	177.9	0	0	0	0	0	115.3	Y142	Y142-G144 PolarHBondContact O-N 3.48Å
145	K	98.4	Very high	98.1	Very high	161 Å²	161	56.5 Å²	56.5	70%	0.7	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	145.4	177.1	-63.3	179.3	-178.7	176.6	0	110.9	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.59Å; A141-K145 WeakPolarHBondContact CA-O 3.43Å; A141-K145 WeakPolarHBondContact CB-O 3.39Å; Y142-K145 PolarHBondContact N-O 3.09Å; Y142-K145 PolarHBondContact O-N 3.27Å; D143-K145 VanDerWaalsContact C-N 3.3Å; D143-K145 PolarHBondContact O-N 2.86Å; K145-Y147 PolarHBondContact O-N 3.33Å
146	D	98.6	Very high	98.1	Very high	127 Å²	127	54 Å²	54	68%	0.679	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.9	135.7	174.7	-68	-22.4	0	0	0	110.7	A160	D146-A160 HydrophobicContact CB-CB 4.29Å; D146-A160 WeakPolarHBondContact O-CB 3.3Å
147	Y	98.7	Very high	98.2	Very high	10 Å²	10	54.4 Å²	54.4	4%	0.039	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-62.1	179	-179.9	-108.2	0	0	0	110.3	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.37Å; L105-Y147 HydrophobicContact CD2-CD2 4.06Å; L105-Y147 HydrophobicContact CD2-CE1 3.77Å; L105-Y147 HydrophobicContact CD2-CE2 3.39Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.17Å; Y109-Y147 HydrophobicContact CE2-CD2 4.35Å; Y109-Y147 HydrophobicContact CE2-CE2 4.05Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.41Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.36Å; S140-Y147 WeakPolarHBondContact O-CB 3.23Å; S140-Y147 PolarHBondContact O-N 2.96Å; K145-Y147 PolarHBondContact O-N 3.33Å; Y147-A160 WeakPolarHBondContact O-CB 3.25Å; Y147-A160 PolarHBondContact O-N 3.19Å; Y147-A163 PolarHBondContact OH-O 3.03Å; Y147-A164 HydrophobicContact CD2-CB 3.82Å; Y147-A164 HydrophobicContact CE1-CB 4.43Å; Y147-A164 HydrophobicContact CE2-CB 3.67Å; Y147-A164 HydrophobicContact CG-CB 4.27Å; Y147-A164 WeakPolarHBondContact O-CB 3.31Å; Y147-T167 HydrophobicContact CE1-CG2 4.19Å; Y147-T167 PolarHBondContact OH-OG1 2.89Å
148	I	98.7	Very high	98.2	Very high	12 Å²	12	56.3 Å²	56.3	6%	0.062	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	141.1	-179.7	-161.7	167.9	0	0	0	111	Q139 S140 W157 T158 T167 Q168 L171	Q139-I148 WeakPolarHBondContact CA-O 3.36Å; S140-I148 PolarHBondContact N-O 3.45Å; S140-I148 PolarHBondContact O-N 2.82Å; I148-W157 HydrophobicContact CD1-CB 4.47Å; I148-W157 HydrophobicContact CD1-CE3 4.21Å; I148-W157 HydrophobicContact CG1-CB 4.48Å; I148-W157 HydrophobicContact CG1-CE3 4.03Å; I148-T158 WeakPolarHBondContact CA-O 3.04Å; I148-T167 HydrophobicContact CD1-CG2 3.98Å; I148-Q168 HydrophobicContact CD1-CB 4.01Å; I148-L171 HydrophobicContact CD1-CD1 3.74Å
149	A	98.7	Very high	98.2	Very high	30 Å²	30	56.9 Å²	56.9	25%	0.248	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	139.5	178.1	0	0	0	0	0	111.6	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.9Å; A149-W157 CarbonylContact O-C 3.41Å; A149-W157 WeakPolarHBondContact O-CA 3.37Å; A149-T158 PolarHBondContact N-O 3.48Å; A149-T158 PolarHBondContact O-N 3.42Å
150	L	98.7	Very high	98.2	Very high	13 Å²	13	55.8 Å²	55.8	7%	0.068	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.8	166.9	-176.1	68.5	0	0	0	108.5	D138 L154 W157 A177 L180 L184	D138-L150 HydrophobicContact CB-CB 3.93Å; D138-L150 HydrophobicContact CB-CD2 4.16Å; D138-L150 WeakPolarHBondContact O-CB 3.23Å; D138-L150 PolarHBondContact O-N 2.82Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.32Å; L150-W157 HydrophobicContact CB-CE3 4.1Å; L150-W157 HydrophobicContact CB-CH2 4.31Å; L150-W157 HydrophobicContact CB-CZ3 3.86Å; L150-W157 HydrophobicContact CD1-CD2 4.21Å; L150-W157 HydrophobicContact CD1-CE3 4.33Å; L150-W157 HydrophobicContact CD1-CH2 4.16Å; L150-W157 HydrophobicContact CD1-CZ2 3.98Å; L150-W157 HydrophobicContact CD1-CZ3 4.32Å; L150-A177 HydrophobicContact CD1-CB 3.99Å; L150-L180 HydrophobicContact CD2-CB 4.21Å; L150-L180 HydrophobicContact CD2-CD1 4.48Å; L150-L184 HydrophobicContact CD2-CD1 3.91Å
151	N	98.4	Very high	98.2	Very high	42 Å²	42	57.2 Å²	57.2	23%	0.225	32%	0.316	C	S	.	.			trans	-73.4	163.8	-179.5	-67.7	-26.2	0	0	0	111.5	D153 L154 S156 W157 T158	N151-D153 PolarHBondContact O-N 3.05Å; N151-D153 VanDerWaalsContact O-N 3.09Å; N151-L154 WeakPolarHBondContact O-CA 3.43Å; N151-L154 PolarHBondContact O-N 2.93Å; N151-S156 WeakPolarHBondContact CB-O 3.15Å; N151-S156 WeakPolarHBondContact CB-OG 3.42Å; N151-S156 PolarHBondContact N-O 2.93Å; N151-S156 PolarHBondContact ND2-OG 3.43Å; N151-W157 PolarHBondContact ND2-N 3.04Å; N151-T158 PolarHBondContact ND2-OG1 2.86Å; N151-T158 WeakPolarHBondContact OD1-CB 3.48Å; N151-T158 PolarHBondContact OD1-OG1 2.88Å
152	E	97.3	Very high	98.2	Very high	137 Å²	137	61.7 Å²	61.7	64%	0.64	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.8	-179.9	-66.9	178.4	-162.1	0	0	113.7	R135 L154	R135-E152 VanDerWaalsContact CZ-CD 3.42Å; R135-E152 VanDerWaalsContact CZ-CG 3.45Å; R135-E152 IonicContact CZ-OE1 3.26Å; R135-E152 IonicContact NH1-OE1 3.01Å; R135-E152 PolarHBondContact NH1-OE1 3.39Å; R135-E152 IonicContact NH1-OE2 3.57Å; R135-E152 IonicContact NH2-OE1 3.15Å; R135-E152 PolarHBondContact NH2-OE1 2.88Å; E152-L154 PolarHBondContact O-N 3.39Å
153	D	97.1	Very high	98.1	Very high	77 Å²	77	61.4 Å²	61.4	41%	0.412	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-8	174.9	70.2	3.7	0	0	0	113.7	N151 R155 S156	N151-D153 PolarHBondContact O-N 3.05Å; N151-D153 VanDerWaalsContact O-N 3.09Å; D153-R155 VanDerWaalsContact O-CG 3.32Å; D153-R155 WeakPolarHBondContact O-CG 3.48Å; D153-R155 PolarHBondContact O-N 3.29Å; D153-R155 VanDerWaalsContact O-N 3.17Å; D153-R155 PolarHBondContact OD1-N 2.93Å; D153-S156 PolarHBondContact OD1-N 2.99Å; D153-S156 PolarHBondContact OD1-OG 3.15Å; D153-S156 VanDerWaalsContact OD1-OG 3.09Å; D153-S156 WeakPolarHBondContact OD2-CB 3.35Å; D153-S156 PolarHBondContact OD2-OG 2.61Å
154	L	97.7	Very high	98.2	Very high	8 Å²	8	58.3 Å²	58.3	4%	0.042	33%	0.326	C	S	.	.	S	Bend	trans	53.6	27.4	-175.4	-53.5	-179.2	0	0	0	113.6	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.16Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.32Å; N151-L154 WeakPolarHBondContact O-CA 3.43Å; N151-L154 PolarHBondContact O-N 2.93Å; E152-L154 PolarHBondContact O-N 3.39Å; L154-R181 HydrophobicContact CB-CB 4.08Å; L154-R181 HydrophobicContact CB-CG 3.86Å; L154-R181 HydrophobicContact CD1-CG 4.17Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; L154-E185 HydrophobicContact CD1-CG 4.2Å
155	R	97.4	Very high	98.2	Very high	167 Å²	167	59.1 Å²	59.1	63%	0.63	31%	0.314	S	S	*	.	S	Bend	trans	-134	-33	-173.6	-71.4	168.3	-174.7	-113.6	11.2	112.6	D153 A177	D153-R155 VanDerWaalsContact O-CG 3.32Å; D153-R155 WeakPolarHBondContact O-CG 3.48Å; D153-R155 PolarHBondContact O-N 3.29Å; D153-R155 VanDerWaalsContact O-N 3.17Å; D153-R155 PolarHBondContact OD1-N 2.93Å; R155-A177 WeakPolarHBondContact O-CB 3.17Å
156	S	97.8	Very high	98.2	Very high	40 Å²	40	54.2 Å²	54.2	28%	0.28	30%	0.295	S	S	.	.			trans	-114.5	165.6	-177.5	63.6	0	0	0	0	111.8	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.15Å; N151-S156 WeakPolarHBondContact CB-OG 3.42Å; N151-S156 PolarHBondContact N-O 2.93Å; N151-S156 PolarHBondContact ND2-OG 3.43Å; D153-S156 PolarHBondContact OD1-N 2.99Å; D153-S156 PolarHBondContact OD1-OG 3.15Å; D153-S156 VanDerWaalsContact OD1-OG 3.09Å; D153-S156 WeakPolarHBondContact OD2-CB 3.35Å; D153-S156 PolarHBondContact OD2-OG 2.61Å
157	W	98.6	Very high	98.2	Very high	14 Å²	14	49.7 Å²	49.7	5%	0.053	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.7	-175.9	-60.5	90.5	0	0	0	110.6	I148 A149 L150 N151 Q168 L171 A176 A177 L180	I148-W157 HydrophobicContact CD1-CB 4.47Å; I148-W157 HydrophobicContact CD1-CE3 4.21Å; I148-W157 HydrophobicContact CG1-CB 4.48Å; I148-W157 HydrophobicContact CG1-CE3 4.03Å; A149-W157 CarbonylContact O-C 3.41Å; A149-W157 WeakPolarHBondContact O-CA 3.37Å; L150-W157 HydrophobicContact CB-CE3 4.1Å; L150-W157 HydrophobicContact CB-CH2 4.31Å; L150-W157 HydrophobicContact CB-CZ3 3.86Å; L150-W157 HydrophobicContact CD1-CD2 4.21Å; L150-W157 HydrophobicContact CD1-CE3 4.33Å; L150-W157 HydrophobicContact CD1-CH2 4.16Å; L150-W157 HydrophobicContact CD1-CZ2 3.98Å; L150-W157 HydrophobicContact CD1-CZ3 4.32Å; N151-W157 PolarHBondContact ND2-N 3.04Å; W157-Q168 HydrophobicContact CB-CG 4.09Å; W157-Q168 PolarHBondContact O-NE2 3.02Å; W157-L171 HydrophobicContact CD2-CD1 3.99Å; W157-L171 HydrophobicContact CE3-CD1 4.02Å; W157-L171 HydrophobicContact CH2-CD1 3.8Å; W157-L171 HydrophobicContact CZ2-CB 4.19Å; W157-L171 HydrophobicContact CZ2-CD1 3.81Å; W157-L171 HydrophobicContact CZ2-CG 4.44Å; W157-L171 HydrophobicContact CZ3-CD1 3.92Å; W157-A176 HydrophobicContact CZ2-CB 4.29Å; W157-A177 HydrophobicContact CZ2-CB 4.31Å; W157-L180 HydrophobicContact CH2-CD1 3.35Å; W157-L180 HydrophobicContact CZ2-CD1 3.82Å; W157-L180 HydrophobicContact CZ3-CD1 4.44Å
158	T	98.6	Very high	98.2	Very high	78 Å²	78	51.1 Å²	51.1	48%	0.479	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.9	166.5	-66	0	0	0	0	108.9	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.04Å; A149-T158 PolarHBondContact N-O 3.48Å; A149-T158 PolarHBondContact O-N 3.42Å; N151-T158 PolarHBondContact ND2-OG1 2.86Å; N151-T158 WeakPolarHBondContact OD1-CB 3.48Å; N151-T158 PolarHBondContact OD1-OG1 2.88Å
159	A	98.6	Very high	98.2	Very high	23 Å²	23	57.9 Å²	57.9	19%	0.19	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132	174.2	0	0	0	0	0	110	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.74Å; A159-Q165 HydrophobicContact CB-CG 3.98Å; A159-Q168 HydrophobicContact CB-CB 4.39Å
160	A	98.4	Very high	98.1	Very high	59 Å²	59	61.9 Å²	61.9	49%	0.488	32%	0.315	S	S	.	.	S	Bend	trans	-74.3	-30.8	-176.8	0	0	0	0	0	113.2	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.29Å; D146-A160 WeakPolarHBondContact O-CB 3.3Å; Y147-A160 WeakPolarHBondContact O-CB 3.25Å; Y147-A160 PolarHBondContact O-N 3.19Å
161	D	98.2	Very high	98.1	Very high	53 Å²	53	63.2 Å²	63.2	28%	0.283	32%	0.322	S	S	.	.	S	Bend	trans	-150.8	-176.1	-178.7	67.7	29.2	0	0	0	113.2	Y109 A163 A164 Q165	Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 3.33Å; Y109-D161 PolarHBondContact OH-OD2 3.36Å; D161-A163 VanDerWaalsContact C-N 3.31Å; D161-A163 PolarHBondContact O-N 2.87Å; D161-A163 WeakPolarHBondContact OD1-CA 3.35Å; D161-A163 WeakPolarHBondContact OD1-CB 3.44Å; D161-A163 PolarHBondContact OD1-N 3.33Å; D161-A164 PolarHBondContact O-N 3.25Å; D161-A164 PolarHBondContact OD1-N 2.69Å; D161-Q165 WeakPolarHBondContact O-CG 3.45Å; D161-Q165 PolarHBondContact O-N 3.04Å
162	T	98	Very high	98.1	Very high	110 Å²	110	65.8 Å²	65.8	68%	0.675	33%	0.333	S	S	*	.	H	α-helix	trans	-65.4	-28.3	-179.2	59.9	0	0	0	0	114.3
163	A	97.8	Very high	98.1	Very high	5 Å²	5	63.4 Å²	63.4	4%	0.041	34%	0.336	C	S	.	.	H	α-helix	trans	-72.6	-43.6	174.6	0	0	0	0	0	110	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.44Å; Y109-A163 HydrophobicContact CE1-CB 3.61Å; Y109-A163 HydrophobicContact CE2-CB 3.91Å; Y109-A163 VanDerWaalsContact CZ-CB 3.47Å; Y147-A163 PolarHBondContact OH-O 3.03Å; D161-A163 VanDerWaalsContact C-N 3.31Å; D161-A163 PolarHBondContact O-N 2.87Å; D161-A163 WeakPolarHBondContact OD1-CA 3.35Å; D161-A163 WeakPolarHBondContact OD1-CB 3.44Å; D161-A163 PolarHBondContact OD1-N 3.33Å; A163-Q165 VanDerWaalsContact C-N 3.26Å; A163-Q165 PolarHBondContact O-N 2.76Å; A163-I166 VanDerWaalsContact O-CB 3.25Å; A163-I166 WeakPolarHBondContact O-CB 3.48Å; A163-I166 PolarHBondContact O-N 2.74Å
164	A	98.3	Very high	98.1	Very high	0 Å²	0	63 Å²	63	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-60.4	-33	174.5	0	0	0	0	0	113.3	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.82Å; Y147-A164 HydrophobicContact CE1-CB 4.43Å; Y147-A164 HydrophobicContact CE2-CB 3.67Å; Y147-A164 HydrophobicContact CG-CB 4.27Å; Y147-A164 WeakPolarHBondContact O-CB 3.31Å; A159-A164 HydrophobicContact CB-CB 3.74Å; D161-A164 PolarHBondContact O-N 3.25Å; D161-A164 PolarHBondContact OD1-N 2.69Å; A164-I166 PolarHBondContact O-N 2.86Å; A164-T167 WeakPolarHBondContact O-CB 3.39Å; A164-T167 PolarHBondContact O-N 2.82Å; A164-Q168 PolarHBondContact O-N 3.09Å
165	Q	98.6	Very high	98.1	Very high	75 Å²	75	70.5 Å²	70.5	35%	0.35	37%	0.372	S	S	.	.	H	α-helix	trans	-59.9	-28	173.5	-72.4	174.6	11.6	0	0	113	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 3.98Å; D161-Q165 WeakPolarHBondContact O-CG 3.45Å; D161-Q165 PolarHBondContact O-N 3.04Å; A163-Q165 VanDerWaalsContact C-N 3.26Å; A163-Q165 PolarHBondContact O-N 2.76Å; Q165-R169 WeakPolarHBondContact O-CG 3.33Å; Q165-R169 PolarHBondContact O-N 2.87Å; Q165-R169 VanDerWaalsContact O-N 3.14Å
166	I	98	Very high	98.1	Very high	59 Å²	59	63.3 Å²	63.3	30%	0.303	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-45.4	174.1	-57.3	170.9	0	0	0	109.7	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.17Å; Y108-I166 HydrophobicContact CD2-CB 4.49Å; Y108-I166 HydrophobicContact CD2-CD1 4.39Å; Y108-I166 HydrophobicContact CE1-CD1 4.48Å; Y108-I166 HydrophobicContact CE1-CG2 4.26Å; Y108-I166 HydrophobicContact CE2-CB 4.18Å; Y108-I166 HydrophobicContact CE2-CG2 3.94Å; Y108-I166 HydrophobicContact CG-CD1 4.15Å; A163-I166 VanDerWaalsContact O-CB 3.25Å; A163-I166 WeakPolarHBondContact O-CB 3.48Å; A163-I166 PolarHBondContact O-N 2.74Å; A164-I166 PolarHBondContact O-N 2.86Å; I166-K170 WeakPolarHBondContact O-CG 3.27Å; I166-K170 PolarHBondContact O-N 2.81Å
167	T	98	Very high	98.1	Very high	31 Å²	31	61.7 Å²	61.7	19%	0.19	34%	0.337	C	S	.	.	H	α-helix	trans	-65	-44.1	175.2	-68.1	0	0	0	0	111.3	Y147 I148 A164 R169 K170 L171	Y147-T167 HydrophobicContact CE1-CG2 4.19Å; Y147-T167 PolarHBondContact OH-OG1 2.89Å; I148-T167 HydrophobicContact CD1-CG2 3.98Å; A164-T167 WeakPolarHBondContact O-CB 3.39Å; A164-T167 PolarHBondContact O-N 2.82Å; T167-R169 PolarHBondContact O-N 2.72Å; T167-K170 WeakPolarHBondContact O-CB 3.47Å; T167-K170 PolarHBondContact O-N 2.74Å; T167-L171 HydrophobicContact CG2-CD1 3.81Å; T167-L171 HydrophobicContact CG2-CG 4.05Å; T167-L171 WeakPolarHBondContact O-CG 3.34Å; T167-L171 PolarHBondContact O-N 2.89Å
168	Q	98.6	Very high	98.1	Very high	41 Å²	41	66.7 Å²	66.7	19%	0.192	36%	0.361	C	S	.	.	H	α-helix	trans	-52.1	-52.3	177.5	175.5	175	10	0	0	111.8	I148 W157 A159 A164 K170 L171 E172	I148-Q168 HydrophobicContact CD1-CB 4.01Å; W157-Q168 HydrophobicContact CB-CG 4.09Å; W157-Q168 PolarHBondContact O-NE2 3.02Å; A159-Q168 HydrophobicContact CB-CB 4.39Å; A164-Q168 PolarHBondContact O-N 3.09Å; Q168-K170 PolarHBondContact O-N 2.71Å; Q168-L171 PolarHBondContact O-N 2.9Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; Q168-E172 HydrophobicContact CG-CG 4.35Å; Q168-E172 VanDerWaalsContact CG-OE1 3.27Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.49Å; Q168-E172 PolarHBondContact NE2-OE1 2.81Å; Q168-E172 WeakPolarHBondContact O-CG 3.47Å; Q168-E172 PolarHBondContact O-N 3.4Å
169	R	98.5	Very high	97.9	Very high	154 Å²	154	70 Å²	70	58%	0.581	37%	0.371	S	S	*	.	H	α-helix	trans	-58.9	-36.4	179.4	-68.2	170.9	-165.1	148.1	8.4	112.5	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.33Å; Q165-R169 PolarHBondContact O-N 2.87Å; Q165-R169 VanDerWaalsContact O-N 3.14Å; T167-R169 PolarHBondContact O-N 2.72Å; R169-A173 VanDerWaalsContact O-CB 3.27Å; R169-A173 WeakPolarHBondContact O-CB 3.45Å; R169-A173 PolarHBondContact O-N 3.04Å
170	K	97.8	Very high	97.9	Very high	113 Å²	113	70.2 Å²	70.2	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-68.4	-43.2	176.3	-70.4	177	174.9	-173.9	0	111.9	Y108 I166 T167 Q168 A173 A174	Y108-K170 PolarHBondContact OH-NZ 3.4Å; I166-K170 WeakPolarHBondContact O-CG 3.27Å; I166-K170 PolarHBondContact O-N 2.81Å; T167-K170 WeakPolarHBondContact O-CB 3.47Å; T167-K170 PolarHBondContact O-N 2.74Å; Q168-K170 PolarHBondContact O-N 2.71Å; K170-A173 PolarHBondContact O-N 2.8Å; K170-A174 VanDerWaalsContact O-CB 3.28Å; K170-A174 WeakPolarHBondContact O-CB 3.41Å; K170-A174 PolarHBondContact O-N 3.25Å
171	L	97.9	Very high	97.8	Very high	42 Å²	42	70.8 Å²	70.8	22%	0.22	36%	0.359	C	S	.	.	H	α-helix	trans	-65.4	-41.1	177.9	-67.3	175.6	0	0	0	111.5	I148 W157 T167 Q168 A174 R175 A176	I148-L171 HydrophobicContact CD1-CD1 3.74Å; W157-L171 HydrophobicContact CD2-CD1 3.99Å; W157-L171 HydrophobicContact CE3-CD1 4.02Å; W157-L171 HydrophobicContact CH2-CD1 3.8Å; W157-L171 HydrophobicContact CZ2-CB 4.19Å; W157-L171 HydrophobicContact CZ2-CD1 3.81Å; W157-L171 HydrophobicContact CZ2-CG 4.44Å; W157-L171 HydrophobicContact CZ3-CD1 3.92Å; T167-L171 HydrophobicContact CG2-CD1 3.81Å; T167-L171 HydrophobicContact CG2-CG 4.05Å; T167-L171 WeakPolarHBondContact O-CG 3.34Å; T167-L171 PolarHBondContact O-N 2.89Å; Q168-L171 PolarHBondContact O-N 2.9Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; L171-A174 CarbonylContact O-C 3.6Å; L171-A174 PolarHBondContact O-N 3.03Å; L171-R175 PolarHBondContact O-N 3.38Å; L171-A176 HydrophobicContact CB-CB 4.06Å; L171-A176 HydrophobicContact CD2-CB 3.65Å; L171-A176 HydrophobicContact CG-CB 4.44Å; L171-A176 PolarHBondContact O-N 3.14Å
172	E	98.3	Very high	97.8	Very high	95 Å²	95	71.3 Å²	71.3	44%	0.444	37%	0.37	S	S	.	.	H	α-helix	trans	-64.3	-47.6	175.4	-72	170.4	176.1	0	0	111.4	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.35Å; Q168-E172 VanDerWaalsContact CG-OE1 3.27Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.49Å; Q168-E172 PolarHBondContact NE2-OE1 2.81Å; Q168-E172 WeakPolarHBondContact O-CG 3.47Å; Q168-E172 PolarHBondContact O-N 3.4Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 3.1Å; E172-R175 PolarHBondContact O-N 3.24Å
173	A	98.2	Very high	97.8	Very high	87 Å²	87	69.2 Å²	69.2	72%	0.719	35%	0.35	S	S	*	.	H	α-helix	trans	-60.7	-35.7	176.5	0	0	0	0	0	112.6	R169 K170 R175	R169-A173 VanDerWaalsContact O-CB 3.27Å; R169-A173 WeakPolarHBondContact O-CB 3.45Å; R169-A173 PolarHBondContact O-N 3.04Å; K170-A173 PolarHBondContact O-N 2.8Å; A173-R175 VanDerWaalsContact C-N 3.32Å
174	A	97.5	Very high	97.8	Very high	70 Å²	70	69 Å²	69	58%	0.579	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.8	176.4	0	0	0	0	0	113.9	K170 L171 E172 A176	K170-A174 VanDerWaalsContact O-CB 3.28Å; K170-A174 WeakPolarHBondContact O-CB 3.41Å; K170-A174 PolarHBondContact O-N 3.25Å; L171-A174 CarbonylContact O-C 3.6Å; L171-A174 PolarHBondContact O-N 3.03Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 3.1Å; A174-A176 PolarHBondContact O-N 3.36Å
175	R	97.4	Very high	97.7	Very high	165 Å²	165	73.2 Å²	73.2	62%	0.623	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	37.3	-173.2	-56.4	-176	177.6	-163.2	1.8	113.5	L171 E172 A173 A177 E178	L171-R175 PolarHBondContact O-N 3.38Å; E172-R175 PolarHBondContact O-N 3.24Å; A173-R175 VanDerWaalsContact C-N 3.32Å; R175-A177 PolarHBondContact O-N 3.17Å; R175-A177 VanDerWaalsContact O-N 3.15Å; R175-E178 HydrophobicContact CB-CG 4.29Å; R175-E178 IonicContact NH1-OE1 3.05Å; R175-E178 WeakPolarHBondContact O-CB 3.32Å; R175-E178 PolarHBondContact O-N 3.33Å
176	A	97.3	Very high	97.7	Very high	15 Å²	15	70.7 Å²	70.7	12%	0.124	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-30.6	-174.7	0	0	0	0	0	113.2	W157 L171 A174 E178 Q179 L180	W157-A176 HydrophobicContact CZ2-CB 4.29Å; L171-A176 HydrophobicContact CB-CB 4.06Å; L171-A176 HydrophobicContact CD2-CB 3.65Å; L171-A176 HydrophobicContact CG-CB 4.44Å; L171-A176 PolarHBondContact O-N 3.14Å; A174-A176 PolarHBondContact O-N 3.36Å; A176-E178 VanDerWaalsContact C-N 3.28Å; A176-E178 PolarHBondContact O-N 3.22Å; A176-Q179 PolarHBondContact O-N 2.89Å; A176-L180 PolarHBondContact O-N 3.38Å; A176-L180 VanDerWaalsContact O-N 3.12Å
177	A	97.9	Very high	97.6	Very high	7 Å²	7	70.4 Å²	70.4	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-60.5	-34.6	176.7	0	0	0	0	0	112.6	L150 R155 W157 R175 Q179 L180 R181	L150-A177 HydrophobicContact CD1-CB 3.99Å; R155-A177 WeakPolarHBondContact O-CB 3.17Å; W157-A177 HydrophobicContact CZ2-CB 4.31Å; R175-A177 PolarHBondContact O-N 3.17Å; R175-A177 VanDerWaalsContact O-N 3.15Å; A177-Q179 VanDerWaalsContact C-N 3.35Å; A177-Q179 PolarHBondContact O-N 2.85Å; A177-L180 PolarHBondContact O-N 2.87Å; A177-R181 WeakPolarHBondContact O-CB 3.36Å; A177-R181 PolarHBondContact O-N 3.04Å
178	E	97.6	Very high	97.6	Very high	118 Å²	118	69 Å²	69	55%	0.551	36%	0.355	S	S	*	.	H	α-helix	trans	-64.2	-40.5	178.7	-63.9	178.1	-177.5	0	0	111.5	R175 A176 A182	R175-E178 HydrophobicContact CB-CG 4.29Å; R175-E178 IonicContact NH1-OE1 3.05Å; R175-E178 WeakPolarHBondContact O-CB 3.32Å; R175-E178 PolarHBondContact O-N 3.33Å; A176-E178 VanDerWaalsContact C-N 3.28Å; A176-E178 PolarHBondContact O-N 3.22Å; E178-A182 WeakPolarHBondContact O-CB 3.5Å; E178-A182 PolarHBondContact O-N 2.84Å
179	Q	96	Very high	97.6	Very high	147 Å²	147	67.3 Å²	67.3	69%	0.687	35%	0.347	S	S	*	.	H	α-helix	trans	-69.2	-44	177.9	-64.7	-179.6	-4.8	0	0	111.8	A176 A177 A182 Y183	A176-Q179 PolarHBondContact O-N 2.89Å; A177-Q179 VanDerWaalsContact C-N 3.35Å; A177-Q179 PolarHBondContact O-N 2.85Å; Q179-A182 PolarHBondContact O-N 3.31Å; Q179-Y183 PolarHBondContact O-N 2.72Å; Q179-Y183 VanDerWaalsContact O-N 3.07Å
180	L	97	Very high	97.6	Very high	29 Å²	29	66 Å²	66	15%	0.152	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-43.1	177.1	-72.4	170.3	0	0	0	111.2	D138 L150 W157 A176 A177 A182 Y183 L184	D138-L180 HydrophobicContact CB-CD1 4.22Å; L150-L180 HydrophobicContact CD2-CB 4.21Å; L150-L180 HydrophobicContact CD2-CD1 4.48Å; W157-L180 HydrophobicContact CH2-CD1 3.35Å; W157-L180 HydrophobicContact CZ2-CD1 3.82Å; W157-L180 HydrophobicContact CZ3-CD1 4.44Å; A176-L180 PolarHBondContact O-N 3.38Å; A176-L180 VanDerWaalsContact O-N 3.12Å; A177-L180 PolarHBondContact O-N 2.87Å; L180-A182 PolarHBondContact O-N 2.85Å; L180-Y183 WeakPolarHBondContact O-CB 3.38Å; L180-Y183 PolarHBondContact O-N 3.2Å; L180-L184 WeakPolarHBondContact O-CB 3.25Å; L180-L184 VanDerWaalsContact O-CG 3.24Å; L180-L184 WeakPolarHBondContact O-CG 3.42Å; L180-L184 PolarHBondContact O-N 2.62Å
181	R	97.9	Very high	97.6	Very high	71 Å²	71	62.9 Å²	62.9	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	-59	-45.6	175	-175.8	173.1	180	-134.7	-14.5	112	L154 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.08Å; L154-R181 HydrophobicContact CB-CG 3.86Å; L154-R181 HydrophobicContact CD1-CG 4.17Å; A177-R181 WeakPolarHBondContact O-CB 3.36Å; A177-R181 PolarHBondContact O-N 3.04Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.86Å; R181-L184 PolarHBondContact O-N 2.85Å; R181-E185 HydrophobicContact CG-CG 4.09Å; R181-E185 IonicContact CZ-OE1 3.55Å; R181-E185 VanDerWaalsContact CZ-OE1 3.25Å; R181-E185 IonicContact CZ-OE2 3.55Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 2.73Å; R181-E185 PolarHBondContact NE-OE1 2.82Å; R181-E185 IonicContact NE-OE2 3.95Å; R181-E185 PolarHBondContact NE-OE2 3.2Å; R181-E185 IonicContact NH2-OE1 2.66Å; R181-E185 PolarHBondContact NH2-OE1 3Å; R181-E185 IonicContact NH2-OE2 3.31Å; R181-E185 PolarHBondContact NH2-OE2 3.46Å; R181-E185 WeakPolarHBondContact O-CB 3.43Å; R181-E185 PolarHBondContact O-N 2.99Å
182	A	97.9	Very high	97.6	Very high	63 Å²	63	60.9 Å²	60.9	52%	0.521	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-39.1	176.7	0	0	0	0	0	112.5	E178 Q179 L180 G186	E178-A182 WeakPolarHBondContact O-CB 3.5Å; E178-A182 PolarHBondContact O-N 2.84Å; Q179-A182 PolarHBondContact O-N 3.31Å; L180-A182 PolarHBondContact O-N 2.85Å; A182-G186 PolarHBondContact O-N 3.41Å; A182-G186 VanDerWaalsContact O-N 3.14Å
183	Y	96.9	Very high	97.5	Very high	67 Å²	67	62 Å²	62	26%	0.263	32%	0.323	S	S	.	.	I	π-helix	trans	-66.3	-48	173.5	167.6	-102.1	0	0	0	112.1	Q179 L180 R181 T187 C188	Q179-Y183 PolarHBondContact O-N 2.72Å; Q179-Y183 VanDerWaalsContact O-N 3.07Å; L180-Y183 WeakPolarHBondContact O-CB 3.38Å; L180-Y183 PolarHBondContact O-N 3.2Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.86Å; Y183-T187 HydrophobicContact CD2-CG2 4Å; Y183-T187 HydrophobicContact CE2-CG2 3.96Å; Y183-T187 PolarHBondContact O-N 2.86Å; Y183-T187 VanDerWaalsContact O-N 3.11Å; Y183-C188 HydrophobicContact CE1-CB 4.08Å; Y183-C188 HydrophobicContact CE2-CB 4.5Å; Y183-C188 WeakPolarHBondContact O-CB 3.33Å; Y183-C188 PolarHBondContact O-N 2.81Å
184	L	98.1	Very high	97.4	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	31%	0.31	C	S	.	.	I	π-helix	trans	-69.5	-39.7	-174.9	-70.1	171.4	0	0	0	112.7	G124 L150 L154 L180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.47Å; L150-L184 HydrophobicContact CD2-CD1 3.91Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; L180-L184 WeakPolarHBondContact O-CB 3.25Å; L180-L184 VanDerWaalsContact O-CG 3.24Å; L180-L184 WeakPolarHBondContact O-CG 3.42Å; L180-L184 PolarHBondContact O-N 2.62Å; R181-L184 PolarHBondContact O-N 2.85Å; L184-V189 WeakPolarHBondContact O-CG2 3.38Å
185	E	97.4	Very high	97.4	Very high	87 Å²	87	60.3 Å²	60.3	41%	0.407	28%	0.283	S	S	.	.	I	π-helix	trans	-79.6	-24.6	177.7	-69.3	-178.9	167.7	0	0	113.2	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.35Å; L133-E185 HydrophobicContact CD2-CG 3.64Å; L154-E185 HydrophobicContact CD1-CG 4.2Å; R181-E185 HydrophobicContact CG-CG 4.09Å; R181-E185 IonicContact CZ-OE1 3.55Å; R181-E185 VanDerWaalsContact CZ-OE1 3.25Å; R181-E185 IonicContact CZ-OE2 3.55Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 2.73Å; R181-E185 PolarHBondContact NE-OE1 2.82Å; R181-E185 IonicContact NE-OE2 3.95Å; R181-E185 PolarHBondContact NE-OE2 3.2Å; R181-E185 IonicContact NH2-OE1 2.66Å; R181-E185 PolarHBondContact NH2-OE1 3Å; R181-E185 IonicContact NH2-OE2 3.31Å; R181-E185 PolarHBondContact NH2-OE2 3.46Å; R181-E185 WeakPolarHBondContact O-CB 3.43Å; R181-E185 PolarHBondContact O-N 2.99Å
186	G	97.3	Very high	97.3	Very high	23 Å²	23	53.1 Å²	53.1	24%	0.237	26%	0.257	C	S	.	.	I	π-helix	trans	-109.2	-89.6	-177.6	0	0	0	0	0	112.4	A182 C188 V189 E190	A182-G186 PolarHBondContact O-N 3.41Å; A182-G186 VanDerWaalsContact O-N 3.14Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 3.14Å; G186-V189 WeakPolarHBondContact O-CB 3.22Å; G186-V189 PolarHBondContact O-N 3.22Å; G186-V189 VanDerWaalsContact O-N 3.13Å; G186-E190 WeakPolarHBondContact O-CG 3.43Å; G186-E190 PolarHBondContact O-N 3.28Å
187	T	97	Very high	97.2	Very high	53 Å²	53	58.4 Å²	58.4	33%	0.325	28%	0.279	S	S	.	.	I	π-helix	trans	-55.3	-43.2	-170.2	-57.1	0	0	0	0	113.2	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 4Å; Y183-T187 HydrophobicContact CE2-CG2 3.96Å; Y183-T187 PolarHBondContact O-N 2.86Å; Y183-T187 VanDerWaalsContact O-N 3.11Å; T187-V189 PolarHBondContact O-N 2.84Å; T187-E190 PolarHBondContact O-N 3.19Å; T187-W191 VanDerWaalsContact CG2-CD1 3.45Å; T187-W191 PolarHBondContact O-N 3.14Å
188	C	98	Very high	97.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60	-48	179.2	-171.2	0	0	0	0	111.5	M29 C125 Y183 G186 E190 W191 L192	M29-C188 HydrophobicContact CE-CB 4.21Å; M29-C188 VanDerWaalsContact CE-O 3.24Å; M29-C188 WeakPolarHBondContact CE-O 3.45Å; M29-C188 WeakPolarHBondContact CE-SG 3.26Å; C125-C188 HydrophobicContact CB-CB 3.93Å; C125-C188 WeakPolarHBondContact CB-SG 3.45Å; C125-C188 PolarHBondContact N-SG 3.28Å; C125-C188 VanDerWaalsContact N-SG 3.4Å; C125-C188 WeakPolarHBondContact SG-CB 3.11Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.46Å; Y183-C188 HydrophobicContact CE1-CB 4.08Å; Y183-C188 HydrophobicContact CE2-CB 4.5Å; Y183-C188 WeakPolarHBondContact O-CB 3.33Å; Y183-C188 PolarHBondContact O-N 2.81Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 3.14Å; C188-E190 PolarHBondContact O-N 3.07Å; C188-W191 PolarHBondContact O-N 3.4Å; C188-L192 WeakPolarHBondContact O-CB 3.14Å; C188-L192 PolarHBondContact O-N 3.42Å
189	V	97.9	Very high	97	Very high	7 Å²	7	55 Å²	55	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-45.2	177.9	175.8	0	0	0	0	111.2	L127 L133 L184 G186 T187 L192 R193	L127-V189 HydrophobicContact CD1-CG1 4.43Å; L127-V189 HydrophobicContact CD2-CB 4.13Å; L127-V189 HydrophobicContact CD2-CG1 3.73Å; L127-V189 HydrophobicContact CD2-CG2 3.79Å; L133-V189 HydrophobicContact CB-CG2 4Å; L133-V189 HydrophobicContact CD1-CG2 4.05Å; L184-V189 WeakPolarHBondContact O-CG2 3.38Å; G186-V189 WeakPolarHBondContact O-CB 3.22Å; G186-V189 PolarHBondContact O-N 3.22Å; G186-V189 VanDerWaalsContact O-N 3.13Å; T187-V189 PolarHBondContact O-N 2.84Å; V189-L192 PolarHBondContact O-N 3.02Å; V189-R193 WeakPolarHBondContact O-CG 3.35Å; V189-R193 PolarHBondContact O-N 3.38Å
190	E	97.7	Very high	96.9	Very high	127 Å²	127	53.2 Å²	53.2	59%	0.593	25%	0.254	S	S	*	.	H	α-helix	trans	-61.4	-46	179.3	-71.7	173.9	173.9	0	0	112.2	G186 T187 C188 R194	G186-E190 WeakPolarHBondContact O-CG 3.43Å; G186-E190 PolarHBondContact O-N 3.28Å; T187-E190 PolarHBondContact O-N 3.19Å; C188-E190 PolarHBondContact O-N 3.07Å; E190-R194 PolarHBondContact O-N 2.98Å; E190-R194 VanDerWaalsContact O-N 3.08Å
191	W	97.7	Very high	96.6	Very high	46 Å²	46	60.5 Å²	60.5	17%	0.174	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-43	178.3	-82	102.7	0	0	0	112.3	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.04Å; M29-W191 HydrophobicContact SD-CB 4.41Å; Y83-W191 AromaticContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CH2 3.49Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CZ2 4.18Å; Y83-W191 AromaticContact CD2-CZ3 3.73Å; Y83-W191 HydrophobicContact CD2-CZ3 3.73Å; Y83-W191 HydrophobicContact CE2-CE3 4.2Å; Y83-W191 AromaticContact CE2-CH2 3.88Å; Y83-W191 HydrophobicContact CE2-CH2 3.88Å; Y83-W191 HydrophobicContact CE2-CZ2 4.48Å; Y83-W191 AromaticContact CE2-CZ3 3.71Å; Y83-W191 HydrophobicContact CE2-CZ3 3.71Å; T187-W191 VanDerWaalsContact CG2-CD1 3.45Å; T187-W191 PolarHBondContact O-N 3.14Å; C188-W191 PolarHBondContact O-N 3.4Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 3.24Å; W191-R194 WeakPolarHBondContact O-CB 3.5Å; W191-R194 PolarHBondContact O-N 3.13Å; W191-R194 VanDerWaalsContact O-N 3.16Å; W191-Y195 HydrophobicContact CB-CE2 3.99Å; W191-Y195 HydrophobicContact CE3-CD1 4.45Å; W191-Y195 AromaticContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE2 4.2Å; W191-Y195 AromaticContact CE3-CZ 3.39Å; W191-Y195 AromaticContact CZ3-CE1 3.95Å; W191-Y195 HydrophobicContact CZ3-CE1 3.95Å; W191-Y195 VanDerWaalsContact O-CD2 3.25Å; W191-Y195 WeakPolarHBondContact O-CD2 3.35Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 3.45Å
192	L	98	Very high	96.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-45	177	174.9	50.3	0	0	0	111.2	H27 M29 V52 L127 C188 V189 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.46Å; M29-L192 HydrophobicContact CB-CB 4.05Å; M29-L192 HydrophobicContact CB-CD1 4.03Å; M29-L192 HydrophobicContact CB-CD2 3.94Å; M29-L192 HydrophobicContact CB-CG 4.22Å; M29-L192 HydrophobicContact CE-CB 4.31Å; M29-L192 HydrophobicContact SD-CB 4.42Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.24Å; L127-L192 HydrophobicContact CB-CD2 4.49Å; L127-L192 HydrophobicContact CD1-CB 4.23Å; L127-L192 HydrophobicContact CD1-CD2 3.68Å; L127-L192 HydrophobicContact CD1-CG 3.73Å; L127-L192 HydrophobicContact CD2-CD2 4.49Å; L127-L192 HydrophobicContact CG-CD2 3.56Å; L127-L192 HydrophobicContact CG-CG 4.2Å; C188-L192 WeakPolarHBondContact O-CB 3.14Å; C188-L192 PolarHBondContact O-N 3.42Å; V189-L192 PolarHBondContact O-N 3.02Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.37Å; L192-Y195 PolarHBondContact O-N 3.25Å; L192-L196 HydrophobicContact CD1-CD1 3.82Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.82Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 2.84Å
193	R	96.5	Very high	95.9	Very high	119 Å²	119	56.4 Å²	56.4	45%	0.449	26%	0.264	S	S	.	.	H	α-helix	trans	-59.3	-43.3	174.2	-71.8	176.5	-174.5	159.5	-0.8	112.5	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.92Å; G131-R193 VanDerWaalsContact O-CZ 3.26Å; G131-R193 PolarHBondContact O-NE 3.12Å; G131-R193 PolarHBondContact O-NH2 2.79Å; V189-R193 WeakPolarHBondContact O-CG 3.35Å; V189-R193 PolarHBondContact O-N 3.38Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 3.24Å; R193-L196 PolarHBondContact O-N 3.48Å; R193-E197 PolarHBondContact O-N 3.42Å
194	R	96.8	Very high	95.6	Very high	121 Å²	121	57.6 Å²	57.6	46%	0.457	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-43.8	176.5	178.5	179.4	174.1	116.2	-5.4	111.5	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 3.36Å; E79-R194 IonicContact OE1-NE 3.31Å; E79-R194 PolarHBondContact OE1-NE 3.11Å; E79-R194 IonicContact OE1-NH2 3.25Å; E79-R194 PolarHBondContact OE1-NH2 3.5Å; E79-R194 IonicContact OE2-CZ 3.6Å; E79-R194 IonicContact OE2-NE 2.76Å; E79-R194 IonicContact OE2-NH2 2.87Å; E79-R194 PolarHBondContact OE2-NH2 3.37Å; E190-R194 PolarHBondContact O-N 2.98Å; E190-R194 VanDerWaalsContact O-N 3.08Å; W191-R194 WeakPolarHBondContact O-CB 3.5Å; W191-R194 PolarHBondContact O-N 3.13Å; W191-R194 VanDerWaalsContact O-N 3.16Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.37Å; R194-E197 PolarHBondContact O-N 2.95Å; R194-N198 WeakPolarHBondContact O-CB 3.24Å; R194-N198 PolarHBondContact O-N 3.4Å; R194-N198 PolarHBondContact O-OD1 2.83Å
195	Y	97.2	Very high	95.2	Very high	1 Å²	1	61.6 Å²	61.6	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-67.8	-39.5	178.5	-62.1	-33.2	0	0	0	112.6	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.71Å; M29-Y195 HydrophobicContact SD-CE2 3.56Å; M29-Y195 VanDerWaalsContact SD-CE2 3.56Å; V52-Y195 HydrophobicContact CG2-CD2 3.98Å; V52-Y195 HydrophobicContact CG2-CG 4.45Å; F57-Y195 HydrophobicContact CD2-CE2 4.47Å; F57-Y195 HydrophobicContact CE2-CD2 4.26Å; F57-Y195 AromaticContact CE2-CE2 3.62Å; F57-Y195 HydrophobicContact CE2-CE2 3.62Å; F57-Y195 AromaticContact CE2-CZ 3.8Å; F57-Y195 HydrophobicContact CZ-CD2 4.3Å; F57-Y195 AromaticContact CZ-CE2 3.76Å; F57-Y195 HydrophobicContact CZ-CE2 3.76Å; W75-Y195 HydrophobicContact CE3-CD1 4.17Å; W75-Y195 HydrophobicContact CE3-CG 4.42Å; W75-Y195 HydrophobicContact CH2-CG 4.13Å; W75-Y195 AromaticContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD2 4.27Å; W75-Y195 HydrophobicContact CZ3-CE1 4.27Å; W75-Y195 AromaticContact CZ3-CG 3.56Å; W75-Y195 HydrophobicContact CZ3-CG 3.56Å; V76-Y195 HydrophobicContact CG2-CE1 4.38Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.44Å; Y83-Y195 PolarHBondContact OH-OH 3.02Å; W191-Y195 HydrophobicContact CB-CE2 3.99Å; W191-Y195 HydrophobicContact CE3-CD1 4.45Å; W191-Y195 AromaticContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE2 4.2Å; W191-Y195 AromaticContact CE3-CZ 3.39Å; W191-Y195 AromaticContact CZ3-CE1 3.95Å; W191-Y195 HydrophobicContact CZ3-CE1 3.95Å; W191-Y195 VanDerWaalsContact O-CD2 3.25Å; W191-Y195 WeakPolarHBondContact O-CD2 3.35Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 3.45Å; L192-Y195 PolarHBondContact O-N 3.25Å; Y195-E197 VanDerWaalsContact C-N 3.28Å; Y195-E197 PolarHBondContact O-N 3.44Å; Y195-N198 PolarHBondContact O-N 3.23Å; Y195-G199 WeakPolarHBondContact O-CA 3.39Å; Y195-G199 PolarHBondContact O-N 2.97Å; Y195-L203 WeakPolarHBondContact O-CD1 3.45Å
196	L	95.8	Very high	95	Very high	14 Å²	14	59.5 Å²	59.5	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-35.2	174.5	-71.1	169.4	0	0	0	112.4	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.66Å; H27-L196 HydrophobicContact CB-CD2 3.98Å; H27-L196 HydrophobicContact CB-CG 4.4Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.38Å; V52-L196 HydrophobicContact CG1-CD2 4.04Å; L192-L196 HydrophobicContact CD1-CD1 3.82Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.82Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.46Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 2.84Å; R193-L196 PolarHBondContact O-N 3.48Å; L196-K200 WeakPolarHBondContact O-CA 3.37Å; L196-K200 WeakPolarHBondContact O-CB 3.28Å; L196-K200 PolarHBondContact O-N 3.48Å; L196-K200 VanDerWaalsContact O-N 3.13Å; L196-L203 HydrophobicContact CD2-CB 4.11Å; L196-L203 HydrophobicContact CD2-CD1 4.33Å; L196-Q204 PolarHBondContact O-NE2 3.15Å
197	E	95.4	Very high	94.9	Very high	125 Å²	125	61.4 Å²	61.4	58%	0.584	29%	0.287	S	S	*	.	H	α-helix	trans	-72.8	-48.2	174.4	-171	60.2	-150.6	0	0	111.2	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.42Å; R194-E197 PolarHBondContact O-N 2.95Å; Y195-E197 VanDerWaalsContact C-N 3.28Å; Y195-E197 PolarHBondContact O-N 3.44Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 3.14Å; E197-K200 WeakPolarHBondContact O-CB 3.48Å; E197-K200 PolarHBondContact O-N 3.17Å
198	N	96.3	Very high	94.9	Very high	52 Å²	52	62 Å²	62	28%	0.278	29%	0.292	S	S	.	.	H	α-helix	trans	-60.8	-39.5	179.2	-70.6	-5.7	0	0	0	112.6	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.37Å; Q78-N198 VanDerWaalsContact NE2-CB 3.28Å; Q78-N198 PolarHBondContact NE2-ND2 2.88Å; Q78-N198 PolarHBondContact NE2-OD1 3.42Å; E79-N198 PolarHBondContact OE1-ND2 3.47Å; R194-N198 WeakPolarHBondContact O-CB 3.24Å; R194-N198 PolarHBondContact O-N 3.4Å; R194-N198 PolarHBondContact O-OD1 2.83Å; Y195-N198 PolarHBondContact O-N 3.23Å
199	G	95.1	Very high	94.9	Very high	3 Å²	3	62.6 Å²	62.6	3%	0.031	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	20.4	-176.1	0	0	0	0	0	113.5	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.39Å; Y195-G199 PolarHBondContact O-N 2.97Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 3.14Å; G199-E201 VanDerWaalsContact C-N 3.27Å; G199-E201 PolarHBondContact O-N 3.24Å; G199-E201 VanDerWaalsContact O-N 3.17Å; G199-T202 CarbonylContact O-C 3.59Å; G199-T202 PolarHBondContact O-N 3.26Å; G199-T202 PolarHBondContact O-OG1 3.13Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 PolarHBondContact O-N 3.05Å
200	K	93.1	Very high	94.9	Very high	109 Å²	109	69.7 Å²	69.7	47%	0.474	33%	0.326	S	S	.	.	H	α-helix	trans	-50.1	-44	-171.9	-177.7	173.1	-174.3	173.7	0	113.9	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.37Å; L196-K200 WeakPolarHBondContact O-CB 3.28Å; L196-K200 PolarHBondContact O-N 3.48Å; L196-K200 VanDerWaalsContact O-N 3.13Å; E197-K200 WeakPolarHBondContact O-CB 3.48Å; E197-K200 PolarHBondContact O-N 3.17Å; K200-T202 PolarHBondContact O-N 3.32Å; K200-Q204 HydrophobicContact CG-CB 4.47Å; K200-Q204 HydrophobicContact CG-CG 4.5Å; K200-Q204 WeakPolarHBondContact O-CB 3.21Å; K200-Q204 PolarHBondContact O-N 3.01Å; K200-Q204 VanDerWaalsContact O-N 3.14Å
201	E	90.5	Very high	94.8	Very high	181 Å²	181	65.7 Å²	65.7	85%	0.846	31%	0.31	S	S	*	.	H	α-helix	trans	-64.1	-25.3	179.8	-62.7	-175.2	166.1	0	0	113.4	G199 R205	G199-E201 VanDerWaalsContact C-N 3.27Å; G199-E201 PolarHBondContact O-N 3.24Å; G199-E201 VanDerWaalsContact O-N 3.17Å; E201-R205 WeakPolarHBondContact O-CD 3.38Å
202	T	90.2	Very high	94.7	Very high	46 Å²	46	67.3 Å²	67.3	28%	0.282	32%	0.32	S	S	.	.	H	α-helix	trans	-105.1	-34	-177	50.1	0	0	0	0	114.3	W75 G199 K200 R205	W75-T202 VanDerWaalsContact CD1-OG1 3.27Å; G199-T202 CarbonylContact O-C 3.59Å; G199-T202 PolarHBondContact O-N 3.26Å; G199-T202 PolarHBondContact O-OG1 3.13Å; K200-T202 PolarHBondContact O-N 3.32Å; T202-R205 WeakPolarHBondContact O-CG 3.24Å; T202-R205 PolarHBondContact O-NE 2.9Å
203	L	91.7	Very high	94.7	Very high	3 Å²	3	68.5 Å²	68.5	2%	0.016	33%	0.327	C	S	.	.	H	α-helix	trans	-97	-26.1	-172.3	-63.5	172.3	0	0	0	112.6	V52 T55 W75 Y195 L196 G199	V52-L203 HydrophobicContact CB-CD1 4.26Å; V52-L203 HydrophobicContact CB-CD2 4.16Å; V52-L203 HydrophobicContact CG1-CD1 3.88Å; V52-L203 HydrophobicContact CG1-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CG 4.5Å; T55-L203 HydrophobicContact CG2-CD2 4.16Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.39Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.16Å; W75-L203 HydrophobicContact CZ2-CG 4.42Å; Y195-L203 WeakPolarHBondContact O-CD1 3.45Å; L196-L203 HydrophobicContact CD2-CB 4.11Å; L196-L203 HydrophobicContact CD2-CD1 4.33Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 PolarHBondContact O-N 3.05Å
204	Q	89.5	Confident	94.7	Very high	92 Å²	92	64.4 Å²	64.4	43%	0.43	32%	0.315	S	S	.	.	S	Bend	trans	-104.6	23.2	177.2	-57.6	179.4	33.4	0	0	111.4	L196 K200	L196-Q204 PolarHBondContact O-NE2 3.15Å; K200-Q204 HydrophobicContact CG-CB 4.47Å; K200-Q204 HydrophobicContact CG-CG 4.5Å; K200-Q204 WeakPolarHBondContact O-CB 3.21Å; K200-Q204 PolarHBondContact O-N 3.01Å; K200-Q204 VanDerWaalsContact O-N 3.14Å
205	R	90.4	Very high	94.6	Very high	85 Å²	85	61.1 Å²	61.1	32%	0.321	31%	0.305	S	S	.	.			trans	-99	146.4	172.3	76.6	-173.7	171.8	168.7	11.8	109	E201 T202 E207 Y233	E201-R205 WeakPolarHBondContact O-CD 3.38Å; T202-R205 WeakPolarHBondContact O-CG 3.24Å; T202-R205 PolarHBondContact O-NE 2.9Å; R205-E207 IonicContact CZ-OE1 3.54Å; R205-E207 IonicContact NE-OE1 2.67Å; R205-E207 PolarHBondContact NE-OE1 2.98Å; R205-E207 IonicContact NH1-OE1 3.67Å; R205-E207 PolarHBondContact NH1-OE1 3.45Å; R205-E207 VanDerWaalsContact NH1-OE1 3.17Å; R205-E207 IonicContact NH2-OE1 2.73Å; R205-E207 PolarHBondContact NH2-OE1 3.25Å; R205-Y233 HydrophobicContact CG-CD1 4.22Å; R205-Y233 VanDerWaalsContact O-CD1 3.31Å; R205-Y233 WeakPolarHBondContact O-CD1 3.5Å
206	A	93.3	Very high	94.5	Very high	43 Å²	43	64.7 Å²	64.7	36%	0.355	32%	0.321	S	S	.	.			trans	-118.5	120.7	166.9	0	0	0	0	0	108.4	Y233 E288	A206-Y233 CarbonylContact C-O 3.56Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å; A206-E288 HydrophobicContact CB-CG 3.39Å
207	E	95	Very high	94.4	Very high	62 Å²	62	68.6 Å²	68.6	29%	0.29	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-99.7	113.9	174.9	-67.7	-172.1	-141.9	0	0	108.5	R205 F232 Y233 H287	R205-E207 IonicContact CZ-OE1 3.54Å; R205-E207 IonicContact NE-OE1 2.67Å; R205-E207 PolarHBondContact NE-OE1 2.98Å; R205-E207 IonicContact NH1-OE1 3.67Å; R205-E207 PolarHBondContact NH1-OE1 3.45Å; R205-E207 VanDerWaalsContact NH1-OE1 3.17Å; R205-E207 IonicContact NH2-OE1 2.73Å; R205-E207 PolarHBondContact NH2-OE1 3.25Å; E207-F232 WeakPolarHBondContact O-CA 3.06Å; E207-F232 WeakPolarHBondContact O-CB 3.34Å; E207-Y233 PolarHBondContact N-O 2.91Å; E207-Y233 PolarHBondContact O-N 2.81Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; E207-H287 PolarHBondContact O-CE1 2.79Å; E207-H287 VanDerWaalsContact O-CE1 3.27Å
208	P	96.7	Very high	94.2	Very high	67 Å²	67	67.7 Å²	67.7	44%	0.435	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-68	147.7	-179.8	25.6	-32.7	0	0	0	111.4	L290	P208-L290 HydrophobicContact CB-CD2 3.9Å
209	P	97.6	Very high	94	Very high	11 Å²	11	67.7 Å²	67.7	7%	0.071	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-65.7	137.7	179	26.5	-34	0	0	0	112.2	T211 A229 F232 I237 M285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.97Å; P209-T211 HydrophobicContact CG-CG2 4.09Å; P209-A229 HydrophobicContact CB-CB 3.91Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.94Å; P209-F232 HydrophobicContact CB-CG 4.19Å; P209-I237 HydrophobicContact CB-CD1 4.21Å; P209-I237 HydrophobicContact CG-CD1 4.13Å; P209-M285 HydrophobicContact CB-SD 3.88Å; P209-M285 HydrophobicContact CG-SD 3.41Å; P209-M285 WeakPolarHBondContact CG-SD 3.45Å; P209-H287 HydrophobicContact CG-CB 4.32Å; P209-L290 HydrophobicContact CG-CD1 4.09Å; P209-L290 HydrophobicContact CG-CD2 4.43Å; P209-L290 HydrophobicContact CG-CG 4.38Å
210	K	97.6	Very high	93.7	Very high	157 Å²	157	74.7 Å²	74.7	68%	0.683	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	116.9	161.9	-65.5	170.8	-173.9	163.8	0	108	L230	K210-L230 HydrophobicContact CB-CB 4.47Å; K210-L230 PolarHBondContact N-O 3.31Å; K210-L230 PolarHBondContact O-N 3.34Å
211	T	97	Very high	93.6	Very high	42 Å²	42	76.3 Å²	76.3	26%	0.258	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.5	-169.8	62.6	0	0	0	0	113.3	P209 W228 M285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.97Å; P209-T211 HydrophobicContact CG-CG2 4.09Å; T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 3.47Å; T211-M285 HydrophobicContact CG2-CE 3.48Å; T211-M285 VanDerWaalsContact CG2-CE 3.48Å; T211-M285 HydrophobicContact CG2-SD 3.37Å; T211-M285 WeakPolarHBondContact CG2-SD 3.18Å; T211-L294 HydrophobicContact CG2-CD1 4.3Å; T211-L296 VanDerWaalsContact CB-CD1 3.46Å; T211-L296 HydrophobicContact CG2-CD1 4.07Å
212	H	95.7	Very high	93.9	Very high	81 Å²	81	72.2 Å²	72.2	38%	0.375	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	160.3	168.8	61.5	-74.2	0	0	0	110.3	W228	H212-W228 AromaticContact CD2-CD1 3.92Å; H212-W228 VanDerWaalsContact CE1-CB 3.45Å; H212-W228 WeakPolarHBondContact CE1-CB 3.41Å; H212-W228 AromaticContact CE1-CD1 3.91Å; H212-W228 AromaticContact CE1-CG 3.66Å; H212-W228 PolarHBondContact N-O 2.58Å; H212-W228 AromaticContact NE2-CD1 3.47Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 PolarHBondContact O-N 3.26Å
213	V	97.6	Very high	94.1	Very high	24 Å²	24	70.1 Å²	70.1	15%	0.145	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123	175.3	-178	0	0	0	0	109.1	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.39Å; V213-L225 HydrophobicContact CG1-CD2 4.47Å; V213-R226 CarbonylContact C-O 3.58Å; V213-R226 WeakPolarHBondContact CA-O 3.47Å; V213-C227 HydrophobicContact CG2-CB 4.5Å; V213-W241 HydrophobicContact CG1-CH2 3.92Å; V213-W241 HydrophobicContact CG1-CZ2 4.37Å; V213-W241 HydrophobicContact CG2-CH2 4.48Å; V213-L296 HydrophobicContact CG2-CB 3.95Å; V213-W298 HydrophobicContact CB-CB 4.48Å; V213-W298 HydrophobicContact CG1-CB 3.85Å
214	T	96.3	Very high	94.4	Very high	33 Å²	33	70.8 Å²	70.8	20%	0.202	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	146.7	173	63	0	0	0	0	110.7	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-NE2 2.84Å; T214-L225 WeakPolarHBondContact O-CA 3.23Å; T214-R226 PolarHBondContact N-O 2.99Å; T214-R226 PolarHBondContact O-N 2.98Å; T214-W228 PolarHBondContact OG1-NE1 3.42Å
215	H	95.8	Very high	94.8	Very high	53 Å²	53	66.4 Å²	66.4	25%	0.245	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.3	178.2	169.8	-94.1	0	0	0	109.5	A223 L225 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.42Å; H215-L225 HydrophobicContact CB-CD2 4Å; H215-W298 HydrophobicContact CB-CD2 4.19Å; H215-W298 HydrophobicContact CB-CG 4.23Å; H215-W298 HydrophobicContact CB-CZ2 4.04Å; H215-W298 VanDerWaalsContact CB-NE1 3.27Å; H215-W298 AromaticContact CG-CE2 3.82Å; H215-W298 AromaticContact CG-CZ2 3.84Å
216	H	94.6	Very high	95.2	Very high	75 Å²	75	65 Å²	65	35%	0.347	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	103.6	-178.8	-56.4	-67.6	0	0	0	109.4	T214 L218 A223 T224 R226	T214-H216 PolarHBondContact OG1-NE2 2.84Å; H216-L218 PolarHBondContact O-N 3.12Å; H216-A223 CarbonylContact O-C 3.58Å; H216-A223 WeakPolarHBondContact O-CA 3.27Å; H216-T224 PolarHBondContact N-O 3.39Å; H216-T224 PolarHBondContact O-N 2.88Å; H216-R226 PolarHBondContact CD2-NH1 3.49Å; H216-R226 PolarHBondContact NE2-NH1 2.93Å; H216-R226 VanDerWaalsContact NE2-NH1 3.17Å
217	P	93.6	Very high	95.4	Very high	96 Å²	96	62.9 Å²	62.9	62%	0.623	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	130.7	174.4	-19.9	30.2	0	0	0	110.8
218	L	90.8	Very high	95.5	Very high	106 Å²	106	62.1 Å²	62.1	56%	0.555	32%	0.32	S	S	*	.			trans	-100.8	-41.2	173.7	-65.5	178	0	0	0	110.9	H216 E222 T224 V272	H216-L218 PolarHBondContact O-N 3.12Å; L218-E222 PolarHBondContact N-O 3.2Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.28Å; L218-V272 HydrophobicContact CD1-CG1 4.21Å; L218-V272 HydrophobicContact CD1-CG2 4.26Å
219	S	91.8	Very high	95.6	Very high	53 Å²	53	58.9 Å²	58.9	37%	0.371	30%	0.299	S	S	.	.	S	Bend	trans	-150.9	-177.9	176.8	71.7	0	0	0	0	110.3	H221 E222	S219-H221 PolarHBondContact O-N 2.83Å; S219-H221 PolarHBondContact OG-N 2.04Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; S219-E222 PolarHBondContact N-O 2.86Å; S219-E222 VanDerWaalsContact O-O 3.11Å; S219-E222 PolarHBondContact OG-N 2.81Å
220	D	88.6	Confident	95.6	Very high	149 Å²	149	60.9 Å²	60.9	80%	0.797	31%	0.309	S	S	*	.	S	Bend	trans	-63.2	-19	172.1	-65.9	-21.9	0	0	0	112.6	S275	D220-S275 WeakPolarHBondContact O-CB 3.27Å; D220-S275 PolarHBondContact O-OG 2.89Å
221	H	92.5	Very high	95.6	Very high	143 Å²	143	54.3 Å²	54.3	66%	0.662	29%	0.286	S	S	*	.	S	Bend	trans	-107.1	-16.9	-173.9	-55.7	-48.2	0	0	0	114	S219 P274 S275	S219-H221 PolarHBondContact O-N 2.83Å; S219-H221 PolarHBondContact OG-N 2.04Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; H221-P274 CarbonylContact O-C 3.57Å; H221-P274 WeakPolarHBondContact O-CA 3.46Å; H221-S275 PolarHBondContact O-N 2.79Å; H221-S275 PolarHBondContact O-OG 2.73Å
222	E	95.3	Very high	95.6	Very high	96 Å²	96	52.3 Å²	52.3	45%	0.449	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	147.1	-171.5	-66.1	179.8	168.4	0	0	112.4	L218 S219 V272 V273 S275	L218-E222 PolarHBondContact N-O 3.2Å; S219-E222 PolarHBondContact N-O 2.86Å; S219-E222 VanDerWaalsContact O-O 3.11Å; S219-E222 PolarHBondContact OG-N 2.81Å; E222-V272 HydrophobicContact CB-CG1 4.18Å; E222-V272 HydrophobicContact CG-CG1 4.41Å; E222-V273 WeakPolarHBondContact CA-O 3.37Å; E222-S275 PolarHBondContact N-OG 2.93Å
223	A	95.6	Very high	95.6	Very high	2 Å²	2	48.6 Å²	48.6	2%	0.017	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	157	172.1	0	0	0	0	0	110.8	H215 H216 V272 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.42Å; H216-A223 CarbonylContact O-C 3.58Å; H216-A223 WeakPolarHBondContact O-CA 3.27Å; A223-V272 WeakPolarHBondContact O-CA 3.37Å; A223-V273 HydrophobicContact CB-CG2 4.47Å; A223-V273 PolarHBondContact N-O 3.39Å; A223-V273 PolarHBondContact O-N 3.29Å
224	T	97.2	Very high	95.5	Very high	17 Å²	17	48.1 Å²	48.1	10%	0.104	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.9	169	-55	0	0	0	0	109.6	H216 L218 A270 V271	H216-T224 PolarHBondContact N-O 3.39Å; H216-T224 PolarHBondContact O-N 2.88Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.28Å; T224-A270 HydrophobicContact CG2-CB 3.88Å; T224-V271 WeakPolarHBondContact CA-O 3.33Å
225	L	97.8	Very high	95.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	130	163.5	-63.2	-176.5	0	0	0	108.9	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.39Å; V213-L225 HydrophobicContact CG1-CD2 4.47Å; T214-L225 WeakPolarHBondContact O-CA 3.23Å; H215-L225 HydrophobicContact CB-CD2 4Å; L225-W241 HydrophobicContact CB-CH2 3.7Å; L225-W241 HydrophobicContact CB-CZ2 3.81Å; L225-W241 HydrophobicContact CB-CZ3 4.49Å; L225-W241 HydrophobicContact CD1-CH2 4.07Å; L225-W241 HydrophobicContact CD1-CZ3 4.23Å; L225-A270 CarbonylContact O-C 3.54Å; L225-A270 WeakPolarHBondContact O-CA 3.02Å; L225-V271 HydrophobicContact CB-CG1 4.25Å; L225-V271 PolarHBondContact N-O 3.41Å; L225-V271 PolarHBondContact O-N 3.05Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.16Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CB 4.49Å; L225-E278 HydrophobicContact CD2-CG 4.36Å; L225-W298 HydrophobicContact CD1-CB 4.34Å; L225-W298 HydrophobicContact CD2-CB 3.82Å; L225-W298 HydrophobicContact CD2-CD2 4.37Å; L225-W298 HydrophobicContact CD2-CG 3.93Å
226	R	98	Very high	95.5	Very high	54 Å²	54	51.1 Å²	51.1	20%	0.204	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	118.1	176.3	-176.4	-179.7	-66.3	118	-0.3	110.4	V213 T214 H216 W228 W268 A269 A270	V213-R226 CarbonylContact C-O 3.58Å; V213-R226 WeakPolarHBondContact CA-O 3.47Å; T214-R226 PolarHBondContact N-O 2.99Å; T214-R226 PolarHBondContact O-N 2.98Å; H216-R226 PolarHBondContact CD2-NH1 3.49Å; H216-R226 PolarHBondContact NE2-NH1 2.93Å; H216-R226 VanDerWaalsContact NE2-NH1 3.17Å; R226-W228 HydrophobicContact CG-CZ2 4.36Å; R226-W268 HydrophobicContact CG-CB 4Å; R226-W268 HydrophobicContact CG-CD2 4.09Å; R226-W268 HydrophobicContact CG-CE3 3.85Å; R226-W268 HydrophobicContact CG-CG 4.21Å; R226-A269 WeakPolarHBondContact CA-O 3.31Å; R226-A270 HydrophobicContact CB-CB 4.06Å; R226-A270 HydrophobicContact CG-CB 4.13Å
227	C	97.9	Very high	95.5	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.6	175.8	-175.1	0	0	0	0	109.4	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.5Å; C227-W241 HydrophobicContact CB-CH2 4.45Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; C227-W268 CarbonylContact O-C 3.49Å; C227-W268 WeakPolarHBondContact O-CA 3.4Å; C227-W268 WeakPolarHBondContact O-CB 3.34Å; C227-A269 PolarHBondContact N-O 3.01Å; C227-A269 PolarHBondContact O-N 3.36Å; C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.48Å; C227-C283 WeakPolarHBondContact SG-CB 3.12Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 2.81Å
228	W	98.2	Very high	95.7	Very high	45 Å²	45	46.3 Å²	46.3	17%	0.17	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	138.5	-178.3	-69.4	88.6	0	0	0	111.1	T211 H212 T214 R226 L230 W268	T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 3.47Å; H212-W228 AromaticContact CD2-CD1 3.92Å; H212-W228 VanDerWaalsContact CE1-CB 3.45Å; H212-W228 WeakPolarHBondContact CE1-CB 3.41Å; H212-W228 AromaticContact CE1-CD1 3.91Å; H212-W228 AromaticContact CE1-CG 3.66Å; H212-W228 PolarHBondContact N-O 2.58Å; H212-W228 AromaticContact NE2-CD1 3.47Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 PolarHBondContact O-N 3.26Å; T214-W228 PolarHBondContact OG1-NE1 3.42Å; R226-W228 HydrophobicContact CG-CZ2 4.36Å; W228-L230 HydrophobicContact CB-CG 4.49Å; W228-L230 HydrophobicContact CE3-CD2 3.88Å; W228-L230 HydrophobicContact CZ3-CD2 4.43Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.45Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.84Å; W228-W268 HydrophobicContact CE3-CG 4.15Å; W228-W268 HydrophobicContact CG-CB 4.4Å; W228-W268 AromaticContact CH2-CD1 3.68Å; W228-W268 HydrophobicContact CH2-CG 4.28Å; W228-W268 HydrophobicContact CZ3-CB 4.31Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.07Å
229	A	98.3	Very high	95.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.3	163.1	0	0	0	0	0	107.9	P209 F232 I237 L239 Q266 K267 M285	P209-A229 HydrophobicContact CB-CB 3.91Å; A229-F232 HydrophobicContact CB-CD1 3.93Å; A229-F232 HydrophobicContact CB-CE1 3.66Å; A229-F232 WeakPolarHBondContact O-CE1 3.45Å; A229-I237 HydrophobicContact CB-CD1 3.69Å; A229-L239 HydrophobicContact CB-CD1 4.11Å; A229-L239 HydrophobicContact CB-CD2 4.24Å; A229-Q266 CarbonylContact O-C 3.56Å; A229-Q266 VanDerWaalsContact O-CA 3.25Å; A229-Q266 WeakPolarHBondContact O-CA 3.33Å; A229-K267 PolarHBondContact N-O 3.08Å; A229-K267 PolarHBondContact O-N 3.16Å; A229-K267 VanDerWaalsContact O-O 3.09Å; A229-M285 HydrophobicContact CB-CE 3.69Å; A229-M285 HydrophobicContact CB-SD 3.88Å
230	L	98.1	Very high	96.2	Very high	53 Å²	53	41.1 Å²	41.1	28%	0.277	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.2	-176.4	-59	177.7	0	0	0	111.1	K210 W228 F232 Q266	K210-L230 HydrophobicContact CB-CB 4.47Å; K210-L230 PolarHBondContact N-O 3.31Å; K210-L230 PolarHBondContact O-N 3.34Å; W228-L230 HydrophobicContact CB-CG 4.49Å; W228-L230 HydrophobicContact CE3-CD2 3.88Å; W228-L230 HydrophobicContact CZ3-CD2 4.43Å; L230-F232 VanDerWaalsContact C-N 3.35Å; L230-F232 PolarHBondContact O-N 3Å; L230-Q266 HydrophobicContact CD2-CB 3.58Å
231	G	97.3	Very high	96.6	Very high	19 Å²	19	34.1 Å²	34.1	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.4	32.3	168.5	0	0	0	0	0	113.8	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.4Å; G231-F265 PolarHBondContact N-O 3.06Å
232	F	97.1	Very high	96.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	155.8	178.7	59.9	-88.8	0	0	0	112	E207 P209 A229 L230 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.06Å; E207-F232 WeakPolarHBondContact O-CB 3.34Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.94Å; P209-F232 HydrophobicContact CB-CG 4.19Å; A229-F232 HydrophobicContact CB-CD1 3.93Å; A229-F232 HydrophobicContact CB-CE1 3.66Å; A229-F232 WeakPolarHBondContact O-CE1 3.45Å; L230-F232 VanDerWaalsContact C-N 3.35Å; L230-F232 PolarHBondContact O-N 3Å; F232-P234 VanDerWaalsContact CD2-O 3.3Å; F232-P234 WeakPolarHBondContact CD2-O 3.45Å; F232-I237 HydrophobicContact CD1-CD1 3.98Å; F232-I237 HydrophobicContact CD2-CB 4.3Å; F232-I237 HydrophobicContact CD2-CD1 4Å; F232-I237 HydrophobicContact CE1-CD1 3.89Å; F232-I237 HydrophobicContact CE1-CG2 4.45Å; F232-I237 HydrophobicContact CE2-CB 3.75Å; F232-I237 HydrophobicContact CE2-CD1 3.94Å; F232-I237 HydrophobicContact CE2-CG1 4.43Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; F232-I237 HydrophobicContact CG-CD1 4.05Å; F232-I237 HydrophobicContact CZ-CB 4.14Å; F232-I237 HydrophobicContact CZ-CD1 3.9Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; F232-T257 HydrophobicContact CE2-CG2 4.13Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; F232-T264 CarbonylContact O-C 3.52Å; F232-T264 WeakPolarHBondContact O-CA 3.34Å; F232-F265 WeakPolarHBondContact CD1-O 3.29Å; F232-F265 HydrophobicContact CD2-CB 3.99Å; F232-F265 HydrophobicContact CE1-CB 4.24Å; F232-F265 WeakPolarHBondContact CE1-O 3.39Å; F232-F265 HydrophobicContact CE2-CB 3.53Å; F232-F265 HydrophobicContact CZ-CB 3.66Å; F232-F265 PolarHBondContact N-O 3.43Å; F232-F265 PolarHBondContact O-N 2.82Å; F232-K267 HydrophobicContact CE1-CB 4.36Å; F232-K267 HydrophobicContact CZ-CB 4.12Å; F232-H287 AromaticContact CD2-CD2 3.83Å; F232-H287 AromaticContact CD2-NE2 3.69Å
233	Y	95.6	Very high	96.9	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.008	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-150	137	172.8	176.7	-84.9	0	0	0	108.5	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.05Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.45Å; T55-Y233 PolarHBondContact OG1-OH 3.02Å; R205-Y233 HydrophobicContact CG-CD1 4.22Å; R205-Y233 VanDerWaalsContact O-CD1 3.31Å; R205-Y233 WeakPolarHBondContact O-CD1 3.5Å; A206-Y233 CarbonylContact C-O 3.56Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å; E207-Y233 PolarHBondContact N-O 2.91Å; E207-Y233 PolarHBondContact O-N 2.81Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; Y233-G263 WeakPolarHBondContact CD2-O 3.3Å; Y233-F265 HydrophobicContact CD2-CD2 4.45Å; Y233-F265 AromaticContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CE2-CE2 4.48Å; Y233-H287 PolarHBondContact O-CE1 2.9Å
234	P	95	Very high	96.8	Very high	15 Å²	15	33 Å²	33	10%	0.097	17%	0.168	C	C	.	.	S	Bend	cis	-73.7	179.9	2.2	30.3	-37.4	0	0	0	112.7	D54 F232 E236 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.24Å; D54-P234 WeakPolarHBondContact OD2-CB 3.38Å; F232-P234 VanDerWaalsContact CD2-O 3.3Å; F232-P234 WeakPolarHBondContact CD2-O 3.45Å; P234-E236 VanDerWaalsContact C-N 3.31Å; P234-E236 PolarHBondContact O-N 3.41Å; P234-H287 PolarHBondContact O-NE2 2.73Å; P234-E288 WeakPolarHBondContact CD-OE1 3.43Å; P234-E288 HydrophobicContact CG-CG 4.24Å; P234-E288 WeakPolarHBondContact CG-OE1 3.36Å
235	A	96.2	Very high	96.5	Very high	16 Å²	16	34.5 Å²	34.5	13%	0.132	19%	0.188	C	C	.	.	S	Bend	trans	-70.7	-24.6	-175	0	0	0	0	0	113.7	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.35Å; D54-A235 WeakPolarHBondContact OD2-CB 3.38Å; D54-A235 PolarHBondContact OD2-N 2.81Å; A235-I237 PolarHBondContact O-N 2.91Å; A235-T257 HydrophobicContact CB-CG2 4.27Å; A235-F265 HydrophobicContact CB-CD1 3.73Å; A235-F265 HydrophobicContact CB-CD2 3.72Å; A235-F265 HydrophobicContact CB-CE1 3.71Å; A235-F265 HydrophobicContact CB-CE2 3.71Å; A235-F265 HydrophobicContact CB-CG 3.75Å; A235-F265 HydrophobicContact CB-CZ 3.72Å
236	E	95.3	Very high	96.4	Very high	132 Å²	132	40.6 Å²	40.6	62%	0.617	22%	0.216	S	C	*	.			trans	-64.6	116	179.4	-170.5	59.2	-139.4	0	0	110.1	P234 H287	P234-E236 VanDerWaalsContact C-N 3.31Å; P234-E236 PolarHBondContact O-N 3.41Å; E236-H287 PolarHBondContact O-CD2 3.27Å
237	I	95.8	Very high	96.3	Very high	10 Å²	10	42.5 Å²	42.5	5%	0.051	23%	0.23	C	C	.	.			trans	-152.7	139	-179.1	-162.6	172.5	0	0	0	109.5	P209 A229 F232 A235 L239 K267 M285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.21Å; P209-I237 HydrophobicContact CG-CD1 4.13Å; A229-I237 HydrophobicContact CB-CD1 3.69Å; F232-I237 HydrophobicContact CD1-CD1 3.98Å; F232-I237 HydrophobicContact CD2-CB 4.3Å; F232-I237 HydrophobicContact CD2-CD1 4Å; F232-I237 HydrophobicContact CE1-CD1 3.89Å; F232-I237 HydrophobicContact CE1-CG2 4.45Å; F232-I237 HydrophobicContact CE2-CB 3.75Å; F232-I237 HydrophobicContact CE2-CD1 3.94Å; F232-I237 HydrophobicContact CE2-CG1 4.43Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; F232-I237 HydrophobicContact CG-CD1 4.05Å; F232-I237 HydrophobicContact CZ-CB 4.14Å; F232-I237 HydrophobicContact CZ-CD1 3.9Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; A235-I237 PolarHBondContact O-N 2.91Å; I237-L239 HydrophobicContact CB-CD1 4.37Å; I237-L239 HydrophobicContact CD1-CD1 3.64Å; I237-L239 HydrophobicContact CG1-CD1 3.63Å; I237-L239 HydrophobicContact CG2-CD1 3.93Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.59Å; I237-M285 HydrophobicContact CD1-CG 4.14Å; I237-M285 HydrophobicContact CD1-SD 3.99Å; I237-M285 HydrophobicContact CG1-CG 4.36Å; I237-Q286 WeakPolarHBondContact CG1-O 3.41Å; I237-H287 HydrophobicContact CD1-CB 4.26Å; I237-H287 HydrophobicContact CG1-CB 4.03Å
238	T	96.4	Very high	96.1	Very high	61 Å²	61	43.4 Å²	43.4	37%	0.374	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.2	174.7	-63.4	0	0	0	0	110	T240 M285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.16Å; T238-M285 WeakPolarHBondContact O-CA 3.24Å; T238-Q286 PolarHBondContact N-O 3.32Å; T238-Q286 PolarHBondContact O-N 3.23Å
239	L	96.7	Very high	95.6	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.5	175.7	-88.7	75.9	0	0	0	108.7	A229 I237 L254 K267 A269 H284 M285	A229-L239 HydrophobicContact CB-CD1 4.11Å; A229-L239 HydrophobicContact CB-CD2 4.24Å; I237-L239 HydrophobicContact CB-CD1 4.37Å; I237-L239 HydrophobicContact CD1-CD1 3.64Å; I237-L239 HydrophobicContact CG1-CD1 3.63Å; I237-L239 HydrophobicContact CG2-CD1 3.93Å; L239-L254 HydrophobicContact CB-CD1 4.12Å; L239-K267 HydrophobicContact CD1-CD 4.17Å; L239-A269 HydrophobicContact CB-CB 4.17Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; L239-H284 WeakPolarHBondContact CA-O 3.42Å; L239-M285 HydrophobicContact CD1-CE 4.11Å; L239-M285 HydrophobicContact CD1-CG 4.03Å; L239-M285 HydrophobicContact CD1-SD 4.39Å; L239-M285 HydrophobicContact CD2-CE 4.05Å; L239-M285 HydrophobicContact CG-CE 3.94Å; L239-M285 HydrophobicContact CG-CG 4.38Å
240	T	96.8	Very high	95	Very high	43 Å²	43	55.5 Å²	55.5	26%	0.264	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	143.7	177.2	56.7	0	0	0	0	111.3	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.16Å; T240-C283 CarbonylContact O-C 3.59Å; T240-C283 WeakPolarHBondContact O-CA 3.35Å; T240-H284 PolarHBondContact N-O 3.07Å; T240-H284 PolarHBondContact O-N 2.81Å
241	W	97.8	Very high	94.5	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.008	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.9	168.4	-82.6	103.9	0	0	0	109.8	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.92Å; V213-W241 HydrophobicContact CG1-CZ2 4.37Å; V213-W241 HydrophobicContact CG2-CH2 4.48Å; L225-W241 HydrophobicContact CB-CH2 3.7Å; L225-W241 HydrophobicContact CB-CZ2 3.81Å; L225-W241 HydrophobicContact CB-CZ3 4.49Å; L225-W241 HydrophobicContact CD1-CH2 4.07Å; L225-W241 HydrophobicContact CD1-CZ3 4.23Å; C227-W241 HydrophobicContact CB-CH2 4.45Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; W241-Q248 HydrophobicContact CB-CB 4.3Å; W241-Q248 PolarHBondContact O-N 3.21Å; W241-A269 VanDerWaalsContact NE1-C 3.35Å; W241-A269 PolarHBondContact NE1-O 2.86Å; W241-V271 HydrophobicContact CB-CG1 4.38Å; W241-V271 HydrophobicContact CD2-CB 4.45Å; W241-V271 HydrophobicContact CD2-CG1 3.58Å; W241-V271 HydrophobicContact CE3-CG1 3.98Å; W241-V271 HydrophobicContact CG-CB 4.14Å; W241-V271 HydrophobicContact CG-CG1 3.78Å; W241-V271 HydrophobicContact CZ2-CG1 4.29Å; W241-V271 HydrophobicContact CZ3-CG1 4.49Å; W241-T282 VanDerWaalsContact CE3-C 3.44Å; W241-C283 HydrophobicContact CD2-CB 4.19Å; W241-C283 HydrophobicContact CE3-CB 4.11Å; W241-C283 HydrophobicContact CH2-CB 4.04Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 4.03Å
242	Q	97.4	Very high	94.3	Very high	39 Å²	39	58.7 Å²	58.7	18%	0.182	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.1	171.5	-69.4	-172.5	-4.2	0	0	110.4	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.58Å; Q242-E246 VanDerWaalsContact CA-O 3.26Å; Q242-E246 WeakPolarHBondContact CA-O 3.22Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.44Å; Q242-D247 PolarHBondContact NE2-OD1 3.09Å; Q242-Y281 CarbonylContact O-C 3.53Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.3Å; Q242-T282 PolarHBondContact N-O 2.69Å; Q242-T282 PolarHBondContact O-N 2.86Å; Q242-H284 PolarHBondContact OE1-CE1 2.98Å; Q242-H284 PolarHBondContact OE1-NE2 3.1Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.09Å
243	R	96.8	Very high	94.3	Very high	83 Å²	83	64.1 Å²	64.1	31%	0.313	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	117	168.2	-170.6	-175.4	81.1	-170.2	-3.1	108.7	G245 E246 Q248 R280 Y281	R243-G245 PolarHBondContact O-N 2.85Å; R243-G245 VanDerWaalsContact O-N 3.09Å; R243-E246 PolarHBondContact N-O 2.9Å; R243-E246 PolarHBondContact O-N 2.99Å; R243-Q248 HydrophobicContact CB-CG 3.96Å; R243-R280 WeakPolarHBondContact CA-O 3.36Å; R243-R280 HydrophobicContact CG-CB 4.34Å; R243-Y281 HydrophobicContact CB-CD1 4.1Å; R243-Y281 HydrophobicContact CB-CE1 3.9Å; R243-Y281 VanDerWaalsContact CD-CZ 3.44Å; R243-Y281 WeakPolarHBondContact CD-OH 3.45Å; R243-Y281 HydrophobicContact CG-CD1 4.34Å; R243-Y281 HydrophobicContact CG-CD2 4.32Å; R243-Y281 HydrophobicContact CG-CE1 4Å; R243-Y281 HydrophobicContact CG-CE2 3.95Å
244	D	94.3	Very high	94.3	Very high	95 Å²	95	68.2 Å²	68.2	51%	0.508	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	31.9	-174.7	-45.9	-63.2	0	0	0	113.8	R280	D244-R280 PolarHBondContact N-O 2.78Å; D244-R280 IonicContact OD1-CZ 3.82Å; D244-R280 IonicContact OD1-NE 2.98Å; D244-R280 PolarHBondContact OD1-NE 2.86Å; D244-R280 IonicContact OD1-NH2 3.8Å; D244-R280 IonicContact OD2-CZ 3.14Å; D244-R280 IonicContact OD2-NE 3Å; D244-R280 PolarHBondContact OD2-NE 3.12Å; D244-R280 IonicContact OD2-NH2 2.61Å; D244-R280 PolarHBondContact OD2-NH2 3.23Å
245	G	90.8	Very high	94.4	Very high	49 Å²	49	69.2 Å²	69.2	51%	0.505	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-0.6	-177.5	0	0	0	0	0	115.9	R243	R243-G245 PolarHBondContact O-N 2.85Å; R243-G245 VanDerWaalsContact O-N 3.09Å
246	E	95	Very high	94.4	Very high	129 Å²	129	76.7 Å²	76.7	60%	0.603	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	127	175.7	-64.5	-174.8	164.8	0	0	111.8	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.58Å; Q242-E246 VanDerWaalsContact CA-O 3.26Å; Q242-E246 WeakPolarHBondContact CA-O 3.22Å; R243-E246 PolarHBondContact N-O 2.9Å; R243-E246 PolarHBondContact O-N 2.99Å; E246-Q248 PolarHBondContact O-NE2 2.8Å
247	D	94.7	Very high	94.5	Very high	93 Å²	93	72.6 Å²	72.6	50%	0.497	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	134.5	179.4	-69.9	-24.8	0	0	0	112.6	Q242	Q242-D247 WeakPolarHBondContact CG-OD1 3.44Å; Q242-D247 PolarHBondContact NE2-OD1 3.09Å
248	Q	94.4	Very high	94.5	Very high	20 Å²	20	77 Å²	77	9%	0.093	40%	0.399	C	S	.	.			trans	-106.1	37.5	-177.6	-57.6	-59.8	-66.8	0	0	112.3	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.3Å; W241-Q248 PolarHBondContact O-N 3.21Å; R243-Q248 HydrophobicContact CB-CG 3.96Å; E246-Q248 PolarHBondContact O-NE2 2.8Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 2.97Å; Q248-D251 PolarHBondContact O-N 2.83Å; Q248-T252 WeakPolarHBondContact O-CB 3.45Å; Q248-T252 PolarHBondContact O-N 3.1Å; Q248-T252 VanDerWaalsContact O-N 3.11Å; Q248-T252 PolarHBondContact O-OG1 2.85Å; Q248-Y281 HydrophobicContact CG-CE1 4.37Å
249	T	87.4	Confident	94.6	Very high	107 Å²	107	78.5 Å²	78.5	66%	0.656	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-36.1	-169.4	-45.5	0	0	0	0	114.1
250	Q	87.1	Confident	94.6	Very high	192 Å²	192	80.6 Å²	80.6	90%	0.897	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-30.8	-178.3	-66.2	-175	7.6	0	0	113.2	Q248	Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 2.97Å
251	D	86	Confident	94.4	Very high	114 Å²	114	82.1 Å²	82.1	61%	0.61	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	2.2	-177.5	-59.3	-46.6	0	0	0	112.3	Q248	Q248-D251 PolarHBondContact O-N 2.83Å
252	T	93.9	Very high	94.1	Very high	24 Å²	24	87.5 Å²	87.5	15%	0.147	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.7	-179.8	-63.4	0	0	0	0	110.8	Q248 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.45Å; Q248-T252 PolarHBondContact O-N 3.1Å; Q248-T252 VanDerWaalsContact O-N 3.11Å; Q248-T252 PolarHBondContact O-OG1 2.85Å; T252-L254 HydrophobicContact CG2-CB 4.4Å; T252-L254 PolarHBondContact O-N 2.94Å; T252-A269 HydrophobicContact CG2-CB 3.94Å; T252-A270 CarbonylContact C-O 3.59Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å
253	E	96.1	Very high	93.8	Very high	115 Å²	115	87.6 Å²	87.6	54%	0.537	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	104.5	163.5	-174.1	-174.5	-171.8	0	0	108.8	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.25Å; E253-W268 HydrophobicContact CG-CH2 3.92Å; E253-W268 HydrophobicContact CG-CZ3 3.84Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.34Å; E253-A269 CarbonylContact O-C 3.53Å; E253-A269 WeakPolarHBondContact O-CA 3.25Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.21Å; E253-A270 PolarHBondContact O-N 2.82Å
254	L	96.4	Very high	93.8	Very high	88 Å²	88	83.9 Å²	83.9	46%	0.461	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.2	177.3	-174	67.9	0	0	0	109.9	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.12Å; T252-L254 HydrophobicContact CG2-CB 4.4Å; T252-L254 PolarHBondContact O-N 2.94Å; L254-K267 HydrophobicContact CD1-CD 4.46Å; L254-A269 HydrophobicContact CD1-CB 3.65Å
255	V	96.5	Very high	94	Very high	35 Å²	35	80.7 Å²	80.7	21%	0.212	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-83.6	153.3	175.3	-64.4	0	0	0	0	112.3	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.44Å; V255-K267 VanDerWaalsContact O-CE 3.32Å; V255-K267 WeakPolarHBondContact O-CE 3.45Å; V255-K267 WeakPolarHBondContact O-CG 3.36Å; V255-K267 PolarHBondContact O-NZ 2.87Å; V255-W268 HydrophobicContact CB-CD2 4.48Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.24Å; V255-W268 HydrophobicContact CG1-CH2 3.55Å; V255-W268 HydrophobicContact CG1-CZ2 3.18Å; V255-W268 HydrophobicContact CG1-CZ3 4.04Å; V255-W268 HydrophobicContact CG2-CD2 3.73Å; V255-W268 HydrophobicContact CG2-CE3 4.46Å; V255-W268 HydrophobicContact CG2-CG 3.72Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.07Å; V255-W268 PolarHBondContact N-O 3.35Å
256	E	96.4	Very high	94.3	Very high	173 Å²	173	80.4 Å²	80.4	81%	0.808	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-58	147.6	167.6	-68	-175.9	173.1	0	0	111.1	R258	E256-R258 PolarHBondContact O-N 3.25Å
257	T	97.6	Very high	94.5	Very high	47 Å²	47	75.3 Å²	75.3	29%	0.288	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-68.1	129.7	174.9	-55.8	0	0	0	0	108.5	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.13Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; A235-T257 HydrophobicContact CB-CG2 4.27Å; T257-F265 HydrophobicContact CG2-CB 3.79Å; T257-F265 HydrophobicContact CG2-CD1 3.93Å; T257-F265 HydrophobicContact CG2-CG 4.13Å; T257-K267 WeakPolarHBondContact OG1-CD 3.42Å; T257-K267 PolarHBondContact OG1-NZ 2.91Å; T257-K267 VanDerWaalsContact OG1-NZ 3.16Å
258	R	97.2	Very high	94.6	Very high	101 Å²	101	72.1 Å²	72.1	38%	0.381	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.2	-174.5	68.8	-168.4	-179.6	-177.4	4	111.3	E256 F265 Q266	E256-R258 PolarHBondContact O-N 3.25Å; R258-F265 WeakPolarHBondContact O-CA 3.15Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 2.97Å; R258-Q266 WeakPolarHBondContact O-CG 3.48Å; R258-Q266 PolarHBondContact O-N 3.25Å
259	P	97	Very high	94.8	Very high	93 Å²	93	71.1 Å²	71.1	60%	0.604	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	144.6	178.2	28.6	-34.5	0	0	0	111.2	F265	P259-F265 HydrophobicContact CB-CE1 4.32Å
260	A	96.2	Very high	95.3	Very high	50 Å²	50	66.1 Å²	66.1	41%	0.413	37%	0.369	S	S	.	.			trans	-87.3	-18.6	172.8	0	0	0	0	0	112.9	T264	A260-T264 WeakPolarHBondContact CB-O 3.42Å; A260-T264 PolarHBondContact N-O 3.28Å
261	G	92.8	Very high	95.8	Very high	76 Å²	76	57.1 Å²	57.1	78%	0.784	33%	0.327	S	S	*	.	S	Bend	trans	98	-8.3	178.3	0	0	0	0	0	114.9
262	D	92.4	Very high	96.3	Very high	114 Å²	114	55.1 Å²	55.1	61%	0.61	32%	0.319	S	S	*	.	S	Bend	trans	-103.4	11.1	175.7	60.5	1	0	0	0	113.1	T264	D262-T264 WeakPolarHBondContact OD1-CB 3.39Å; D262-T264 PolarHBondContact OD1-N 2.83Å; D262-T264 PolarHBondContact OD1-OG1 2.88Å
263	G	91	Very high	96.4	Very high	41 Å²	41	54 Å²	54	42%	0.423	31%	0.312	S	S	.	.	S	Bend	trans	91.7	-3.6	-174.2	0	0	0	0	0	114.3	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.3Å
264	T	96.3	Very high	96.4	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.037	30%	0.301	C	S	.	.			trans	-102.3	173.5	174.5	73.2	0	0	0	0	112.5	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.4Å; F232-T264 CarbonylContact O-C 3.52Å; F232-T264 WeakPolarHBondContact O-CA 3.34Å; A260-T264 WeakPolarHBondContact CB-O 3.42Å; A260-T264 PolarHBondContact N-O 3.28Å; D262-T264 WeakPolarHBondContact OD1-CB 3.39Å; D262-T264 PolarHBondContact OD1-N 2.83Å; D262-T264 PolarHBondContact OD1-OG1 2.88Å
265	F	97.9	Very high	96.2	Very high	27 Å²	27	49 Å²	49	12%	0.118	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	163.1	-176.9	-64	-85.8	0	0	0	112.4	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.77Å; D54-F265 HydrophobicContact CB-CZ 3.71Å; G231-F265 PolarHBondContact N-O 3.06Å; F232-F265 WeakPolarHBondContact CD1-O 3.29Å; F232-F265 HydrophobicContact CD2-CB 3.99Å; F232-F265 HydrophobicContact CE1-CB 4.24Å; F232-F265 WeakPolarHBondContact CE1-O 3.39Å; F232-F265 HydrophobicContact CE2-CB 3.53Å; F232-F265 HydrophobicContact CZ-CB 3.66Å; F232-F265 PolarHBondContact N-O 3.43Å; F232-F265 PolarHBondContact O-N 2.82Å; Y233-F265 HydrophobicContact CD2-CD2 4.45Å; Y233-F265 AromaticContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CD2-CE2 4Å; Y233-F265 HydrophobicContact CE2-CE2 4.48Å; A235-F265 HydrophobicContact CB-CD1 3.73Å; A235-F265 HydrophobicContact CB-CD2 3.72Å; A235-F265 HydrophobicContact CB-CE1 3.71Å; A235-F265 HydrophobicContact CB-CE2 3.71Å; A235-F265 HydrophobicContact CB-CG 3.75Å; A235-F265 HydrophobicContact CB-CZ 3.72Å; T257-F265 HydrophobicContact CG2-CB 3.79Å; T257-F265 HydrophobicContact CG2-CD1 3.93Å; T257-F265 HydrophobicContact CG2-CG 4.13Å; R258-F265 WeakPolarHBondContact O-CA 3.15Å; P259-F265 HydrophobicContact CB-CE1 4.32Å
266	Q	98.1	Very high	96	Very high	44 Å²	44	50.6 Å²	50.6	21%	0.206	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.4	173.9	42	167.3	-18.4	0	0	110	A229 L230 R258	A229-Q266 CarbonylContact O-C 3.56Å; A229-Q266 VanDerWaalsContact O-CA 3.25Å; A229-Q266 WeakPolarHBondContact O-CA 3.33Å; L230-Q266 HydrophobicContact CD2-CB 3.58Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 2.97Å; R258-Q266 WeakPolarHBondContact O-CG 3.48Å; R258-Q266 PolarHBondContact O-N 3.25Å
267	K	98.4	Very high	95.9	Very high	22 Å²	22	45.3 Å²	45.3	10%	0.096	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	154.5	177.1	-162.8	-176.5	-171.5	69.8	0	108.7	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 3.08Å; A229-K267 PolarHBondContact O-N 3.16Å; A229-K267 VanDerWaalsContact O-O 3.09Å; F232-K267 HydrophobicContact CE1-CB 4.36Å; F232-K267 HydrophobicContact CZ-CB 4.12Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.59Å; L239-K267 HydrophobicContact CD1-CD 4.17Å; L254-K267 HydrophobicContact CD1-CD 4.46Å; V255-K267 HydrophobicContact CG2-CG 4.44Å; V255-K267 VanDerWaalsContact O-CE 3.32Å; V255-K267 WeakPolarHBondContact O-CE 3.45Å; V255-K267 WeakPolarHBondContact O-CG 3.36Å; V255-K267 PolarHBondContact O-NZ 2.87Å; T257-K267 WeakPolarHBondContact OG1-CD 3.42Å; T257-K267 PolarHBondContact OG1-NZ 2.91Å; T257-K267 VanDerWaalsContact OG1-NZ 3.16Å
268	W	98.1	Very high	95.7	Very high	25 Å²	25	44 Å²	44	10%	0.095	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	156.4	169.5	58.5	-98.4	0	0	0	111.4	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4Å; R226-W268 HydrophobicContact CG-CD2 4.09Å; R226-W268 HydrophobicContact CG-CE3 3.85Å; R226-W268 HydrophobicContact CG-CG 4.21Å; C227-W268 CarbonylContact O-C 3.49Å; C227-W268 WeakPolarHBondContact O-CA 3.4Å; C227-W268 WeakPolarHBondContact O-CB 3.34Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.45Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.84Å; W228-W268 HydrophobicContact CE3-CG 4.15Å; W228-W268 HydrophobicContact CG-CB 4.4Å; W228-W268 AromaticContact CH2-CD1 3.68Å; W228-W268 HydrophobicContact CH2-CG 4.28Å; W228-W268 HydrophobicContact CZ3-CB 4.31Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.07Å; E253-W268 HydrophobicContact CB-CZ3 4.25Å; E253-W268 HydrophobicContact CG-CH2 3.92Å; E253-W268 HydrophobicContact CG-CZ3 3.84Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.34Å; V255-W268 HydrophobicContact CB-CD2 4.48Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.24Å; V255-W268 HydrophobicContact CG1-CH2 3.55Å; V255-W268 HydrophobicContact CG1-CZ2 3.18Å; V255-W268 HydrophobicContact CG1-CZ3 4.04Å; V255-W268 HydrophobicContact CG2-CD2 3.73Å; V255-W268 HydrophobicContact CG2-CE3 4.46Å; V255-W268 HydrophobicContact CG2-CG 3.72Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.07Å; V255-W268 PolarHBondContact N-O 3.35Å; W268-A270 HydrophobicContact CE3-CB 3.94Å; W268-A270 HydrophobicContact CZ3-CB 3.63Å
269	A	98	Very high	95.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132	173.9	0	0	0	0	0	108.5	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.31Å; C227-A269 PolarHBondContact N-O 3.01Å; C227-A269 PolarHBondContact O-N 3.36Å; L239-A269 HydrophobicContact CB-CB 4.17Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; W241-A269 VanDerWaalsContact NE1-C 3.35Å; W241-A269 PolarHBondContact NE1-O 2.86Å; T252-A269 HydrophobicContact CG2-CB 3.94Å; E253-A269 CarbonylContact O-C 3.53Å; E253-A269 WeakPolarHBondContact O-CA 3.25Å; L254-A269 HydrophobicContact CD1-CB 3.65Å
270	A	97.6	Very high	95.5	Very high	2 Å²	2	45 Å²	45	2%	0.017	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.9	179.1	0	0	0	0	0	112.1	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.88Å; L225-A270 CarbonylContact O-C 3.54Å; L225-A270 WeakPolarHBondContact O-CA 3.02Å; R226-A270 HydrophobicContact CB-CB 4.06Å; R226-A270 HydrophobicContact CG-CB 4.13Å; T252-A270 CarbonylContact C-O 3.59Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.21Å; E253-A270 PolarHBondContact O-N 2.82Å; W268-A270 HydrophobicContact CE3-CB 3.94Å; W268-A270 HydrophobicContact CZ3-CB 3.63Å
271	V	97.6	Very high	95.5	Very high	3 Å²	3	43 Å²	43	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.3	176.6	62.1	0	0	0	0	109.1	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.33Å; L225-V271 HydrophobicContact CB-CG1 4.25Å; L225-V271 PolarHBondContact N-O 3.41Å; L225-V271 PolarHBondContact O-N 3.05Å; W241-V271 HydrophobicContact CB-CG1 4.38Å; W241-V271 HydrophobicContact CD2-CB 4.45Å; W241-V271 HydrophobicContact CD2-CG1 3.58Å; W241-V271 HydrophobicContact CE3-CG1 3.98Å; W241-V271 HydrophobicContact CG-CB 4.14Å; W241-V271 HydrophobicContact CG-CG1 3.78Å; W241-V271 HydrophobicContact CZ2-CG1 4.29Å; W241-V271 HydrophobicContact CZ3-CG1 4.49Å; V271-V273 HydrophobicContact CG1-CG1 3.8Å; V271-V273 HydrophobicContact CG2-CG1 4.4Å; V271-Y281 HydrophobicContact CG1-CD1 4.01Å; V271-Y281 HydrophobicContact CG1-CE1 4.46Å; V271-Y281 HydrophobicContact CG2-CD1 4.29Å; V271-Y281 HydrophobicContact CG2-CE1 3.97Å
272	V	97.1	Very high	95.8	Very high	72 Å²	72	40.9 Å²	40.9	44%	0.436	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.3	171.3	-179.3	0	0	0	0	108.2	L218 E222 A223	L218-V272 HydrophobicContact CD1-CG1 4.21Å; L218-V272 HydrophobicContact CD1-CG2 4.26Å; E222-V272 HydrophobicContact CB-CG1 4.18Å; E222-V272 HydrophobicContact CG-CG1 4.41Å; A223-V272 WeakPolarHBondContact O-CA 3.37Å
273	V	96.3	Very high	96	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	145.2	-175.9	-52.7	0	0	0	0	110.4	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.37Å; A223-V273 HydrophobicContact CB-CG2 4.47Å; A223-V273 PolarHBondContact N-O 3.39Å; A223-V273 PolarHBondContact O-N 3.29Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.16Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; V271-V273 HydrophobicContact CG1-CG1 3.8Å; V271-V273 HydrophobicContact CG2-CG1 4.4Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; V273-Y281 HydrophobicContact CB-CD2 4.01Å; V273-Y281 HydrophobicContact CB-CE2 3.74Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.56Å; V273-Y281 HydrophobicContact CG1-CE1 3.69Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.63Å
274	P	95.9	Very high	96.3	Very high	46 Å²	46	35.5 Å²	35.5	30%	0.299	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.2	170.3	-19.5	32.1	0	0	0	111.2	H221 G276 Q277	H221-P274 CarbonylContact O-C 3.57Å; H221-P274 WeakPolarHBondContact O-CA 3.46Å; P274-G276 PolarHBondContact O-N 3.37Å; P274-Q277 HydrophobicContact CB-CB 4.39Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.48Å; P274-Q277 PolarHBondContact O-N 3.43Å
275	S	92.3	Very high	96.3	Very high	52 Å²	52	35.2 Å²	35.2	36%	0.364	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	130.4	175	-61.7	0	0	0	0	111	D220 H221 E222 Q277 E278	D220-S275 WeakPolarHBondContact O-CB 3.27Å; D220-S275 PolarHBondContact O-OG 2.89Å; H221-S275 PolarHBondContact O-N 2.79Å; H221-S275 PolarHBondContact O-OG 2.73Å; E222-S275 PolarHBondContact N-OG 2.93Å; S275-Q277 VanDerWaalsContact C-N 3.33Å; S275-E278 WeakPolarHBondContact CA-OE1 3.39Å
276	G	91	Very high	96.2	Very high	68 Å²	68	38.4 Å²	38.4	70%	0.701	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.9	-1.5	-178.2	0	0	0	0	0	115	P274 E278	P274-G276 PolarHBondContact O-N 3.37Å; G276-E278 WeakPolarHBondContact CA-OE2 3.47Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.85Å; G276-E278 PolarHBondContact N-OE2 3.03Å
277	Q	94.4	Very high	96.1	Very high	62 Å²	62	36.4 Å²	36.4	29%	0.29	20%	0.2	S	C	.	.			trans	-107.1	6.7	174.8	-60.7	-168	41.3	0	0	113.2	P274 S275 Q279 R280 Y281	P274-Q277 HydrophobicContact CB-CB 4.39Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.48Å; P274-Q277 PolarHBondContact O-N 3.43Å; S275-Q277 VanDerWaalsContact C-N 3.33Å; Q277-Q279 PolarHBondContact O-N 3.28Å; Q277-Q279 VanDerWaalsContact O-N 3.14Å; Q277-R280 WeakPolarHBondContact O-CB 3.35Å; Q277-R280 PolarHBondContact O-N 3.49Å; Q277-Y281 HydrophobicContact CB-CE2 4.48Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.48Å
278	E	94.2	Very high	95.8	Very high	20 Å²	20	37.8 Å²	37.8	9%	0.093	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-57.2	-35.7	-173	-57.5	81	-179.1	0	0	112.3	L225 V273 S275 G276 R280 Y281 W298	L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CB 4.49Å; L225-E278 HydrophobicContact CD2-CG 4.36Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; S275-E278 WeakPolarHBondContact CA-OE1 3.39Å; G276-E278 WeakPolarHBondContact CA-OE2 3.47Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.85Å; G276-E278 PolarHBondContact N-OE2 3.03Å; E278-R280 PolarHBondContact O-N 2.83Å; E278-Y281 PolarHBondContact O-N 3.49Å; E278-Y281 VanDerWaalsContact O-N 3.14Å; E278-W298 HydrophobicContact CB-CD2 4.37Å; E278-W298 HydrophobicContact CB-CE3 3.38Å; E278-W298 HydrophobicContact CB-CZ3 3.76Å; E278-W298 HydrophobicContact CG-CE3 3.75Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å
279	Q	93.9	Very high	95.5	Very high	107 Å²	107	37.6 Å²	37.6	50%	0.5	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-69.8	-15.7	180	-63.6	-58	-40.8	0	0	114.2	Q277 W298	Q277-Q279 PolarHBondContact O-N 3.28Å; Q277-Q279 VanDerWaalsContact O-N 3.14Å; Q279-W298 PolarHBondContact NE2-O 3.44Å
280	R	95.9	Very high	95.3	Very high	106 Å²	106	39 Å²	39	40%	0.4	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-79.1	-13.2	174.5	-63.2	175.4	68.3	-178.2	9	112.3	R243 D244 Q277 E278	R243-R280 WeakPolarHBondContact CA-O 3.36Å; R243-R280 HydrophobicContact CG-CB 4.34Å; D244-R280 PolarHBondContact N-O 2.78Å; D244-R280 IonicContact OD1-CZ 3.82Å; D244-R280 IonicContact OD1-NE 2.98Å; D244-R280 PolarHBondContact OD1-NE 2.86Å; D244-R280 IonicContact OD1-NH2 3.8Å; D244-R280 IonicContact OD2-CZ 3.14Å; D244-R280 IonicContact OD2-NE 3Å; D244-R280 PolarHBondContact OD2-NE 3.12Å; D244-R280 IonicContact OD2-NH2 2.61Å; D244-R280 PolarHBondContact OD2-NH2 3.23Å; Q277-R280 WeakPolarHBondContact O-CB 3.35Å; Q277-R280 PolarHBondContact O-N 3.49Å; E278-R280 PolarHBondContact O-N 2.83Å
281	Y	96.9	Very high	95	Very high	8 Å²	8	48.4 Å²	48.4	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.9	-178	-69.7	-100.3	0	0	0	110.5	Q242 R243 Q248 V271 V273 Q277 E278	Q242-Y281 CarbonylContact O-C 3.53Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.3Å; R243-Y281 HydrophobicContact CB-CD1 4.1Å; R243-Y281 HydrophobicContact CB-CE1 3.9Å; R243-Y281 VanDerWaalsContact CD-CZ 3.44Å; R243-Y281 WeakPolarHBondContact CD-OH 3.45Å; R243-Y281 HydrophobicContact CG-CD1 4.34Å; R243-Y281 HydrophobicContact CG-CD2 4.32Å; R243-Y281 HydrophobicContact CG-CE1 4Å; R243-Y281 HydrophobicContact CG-CE2 3.95Å; Q248-Y281 HydrophobicContact CG-CE1 4.37Å; V271-Y281 HydrophobicContact CG1-CD1 4.01Å; V271-Y281 HydrophobicContact CG1-CE1 4.46Å; V271-Y281 HydrophobicContact CG2-CD1 4.29Å; V271-Y281 HydrophobicContact CG2-CE1 3.97Å; V273-Y281 HydrophobicContact CB-CD2 4.01Å; V273-Y281 HydrophobicContact CB-CE2 3.74Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.56Å; V273-Y281 HydrophobicContact CG1-CE1 3.69Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.63Å; Q277-Y281 HydrophobicContact CB-CE2 4.48Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.48Å; E278-Y281 PolarHBondContact O-N 3.49Å; E278-Y281 VanDerWaalsContact O-N 3.14Å
282	T	97.4	Very high	94.7	Very high	33 Å²	33	55.5 Å²	55.5	20%	0.202	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134.2	176.8	50.9	0	0	0	0	110.2	W241 Q242 H284 T295 L296	W241-T282 VanDerWaalsContact CE3-C 3.44Å; Q242-T282 PolarHBondContact N-O 2.69Å; Q242-T282 PolarHBondContact O-N 2.86Å; T282-H284 PolarHBondContact OG1-NE2 3.08Å; T282-T295 HydrophobicContact CG2-CG2 4.07Å; T282-L296 CarbonylContact C-O 3.58Å; T282-L296 WeakPolarHBondContact CA-O 3.15Å
283	C	97.6	Very high	94.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.9	171.5	174.9	0	0	0	0	109	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.48Å; C227-C283 WeakPolarHBondContact SG-CB 3.12Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 2.81Å; T240-C283 CarbonylContact O-C 3.59Å; T240-C283 WeakPolarHBondContact O-CA 3.35Å; W241-C283 HydrophobicContact CD2-CB 4.19Å; W241-C283 HydrophobicContact CE3-CB 4.11Å; W241-C283 HydrophobicContact CH2-CB 4.04Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 4.03Å; C283-T295 CarbonylContact O-C 3.58Å; C283-T295 WeakPolarHBondContact O-CA 3.44Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.03Å; C283-L296 PolarHBondContact O-N 2.82Å
284	H	96.9	Very high	94.5	Very high	42 Å²	42	58.4 Å²	58.4	19%	0.194	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.1	175.5	-67	-101.2	0	0	0	109.5	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.42Å; T240-H284 PolarHBondContact N-O 3.07Å; T240-H284 PolarHBondContact O-N 2.81Å; Q242-H284 PolarHBondContact OE1-CE1 2.98Å; Q242-H284 PolarHBondContact OE1-NE2 3.1Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.09Å; T282-H284 PolarHBondContact OG1-NE2 3.08Å; H284-L294 CarbonylContact C-O 3.58Å; H284-L294 WeakPolarHBondContact CA-O 3.5Å; H284-T295 PolarHBondContact CE1-OG1 2.88Å; H284-T295 PolarHBondContact ND1-OG1 2.8Å
285	M	96.3	Very high	94.5	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.9	-175.2	-171.9	176.6	-56.8	0	0	111.3	P209 T211 A229 I237 T238 L239 L290 P293 L294 L296	P209-M285 HydrophobicContact CB-SD 3.88Å; P209-M285 HydrophobicContact CG-SD 3.41Å; P209-M285 WeakPolarHBondContact CG-SD 3.45Å; T211-M285 HydrophobicContact CG2-CE 3.48Å; T211-M285 VanDerWaalsContact CG2-CE 3.48Å; T211-M285 HydrophobicContact CG2-SD 3.37Å; T211-M285 WeakPolarHBondContact CG2-SD 3.18Å; A229-M285 HydrophobicContact CB-CE 3.69Å; A229-M285 HydrophobicContact CB-SD 3.88Å; I237-M285 HydrophobicContact CD1-CG 4.14Å; I237-M285 HydrophobicContact CD1-SD 3.99Å; I237-M285 HydrophobicContact CG1-CG 4.36Å; T238-M285 WeakPolarHBondContact O-CA 3.24Å; L239-M285 HydrophobicContact CD1-CE 4.11Å; L239-M285 HydrophobicContact CD1-CG 4.03Å; L239-M285 HydrophobicContact CD1-SD 4.39Å; L239-M285 HydrophobicContact CD2-CE 4.05Å; L239-M285 HydrophobicContact CG-CE 3.94Å; L239-M285 HydrophobicContact CG-CG 4.38Å; M285-L290 HydrophobicContact CG-CD1 4.4Å; M285-P293 CarbonylContact O-C 3.56Å; M285-P293 WeakPolarHBondContact O-CA 3.38Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.73Å; M285-L294 PolarHBondContact O-N 3.03Å; M285-L296 HydrophobicContact CE-CD1 4.32Å
286	Q	96.3	Very high	94.7	Very high	94 Å²	94	59.3 Å²	59.3	44%	0.439	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.4	175.4	-59.5	-179.4	7.3	0	0	109.6	I237 T238 P293	I237-Q286 WeakPolarHBondContact CG1-O 3.41Å; T238-Q286 PolarHBondContact N-O 3.32Å; T238-Q286 PolarHBondContact O-N 3.23Å; Q286-P293 HydrophobicContact CG-CB 4.01Å; Q286-P293 HydrophobicContact CG-CG 4.14Å
287	H	95.3	Very high	94.8	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.009	30%	0.3	C	S	.	.			trans	-157	150	-178.9	-174.2	-97.5	0	0	0	109.1	E207 P209 F232 Y233 P234 E236 I237 G289 L290	E207-H287 PolarHBondContact O-CE1 2.79Å; E207-H287 VanDerWaalsContact O-CE1 3.27Å; P209-H287 HydrophobicContact CG-CB 4.32Å; F232-H287 AromaticContact CD2-CD2 3.83Å; F232-H287 AromaticContact CD2-NE2 3.69Å; Y233-H287 PolarHBondContact O-CE1 2.9Å; P234-H287 PolarHBondContact O-NE2 2.73Å; E236-H287 PolarHBondContact O-CD2 3.27Å; I237-H287 HydrophobicContact CD1-CB 4.26Å; I237-H287 HydrophobicContact CG1-CB 4.03Å; H287-G289 PolarHBondContact ND1-N 2.75Å; H287-G289 PolarHBondContact O-N 2.92Å; H287-L290 HydrophobicContact CB-CD1 3.89Å; H287-L290 HydrophobicContact CB-CG 4.08Å; H287-L290 WeakPolarHBondContact O-CB 3.32Å; H287-L290 PolarHBondContact O-N 3.21Å
288	E	92	Very high	94.8	Very high	51 Å²	51	58.1 Å²	58.1	24%	0.238	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-29	-175.1	96.1	178	170.8	0	0	113.1	W23 A206 P234 L290	W23-E288 HydrophobicContact CD2-CB 3.72Å; W23-E288 VanDerWaalsContact CE3-CA 3.42Å; W23-E288 HydrophobicContact CE3-CB 3Å; W23-E288 HydrophobicContact CE3-CG 4.39Å; W23-E288 HydrophobicContact CH2-CB 3.83Å; W23-E288 HydrophobicContact CZ2-CB 4.42Å; W23-E288 HydrophobicContact CZ3-CB 3.09Å; W23-E288 HydrophobicContact CZ3-CG 4.45Å; W23-E288 VanDerWaalsContact CZ3-N 3.32Å; A206-E288 HydrophobicContact CB-CG 3.39Å; P234-E288 WeakPolarHBondContact CD-OE1 3.43Å; P234-E288 HydrophobicContact CG-CG 4.24Å; P234-E288 WeakPolarHBondContact CG-OE1 3.36Å; E288-L290 PolarHBondContact O-N 2.79Å
289	G	92.2	Very high	94.5	Very high	21 Å²	21	65.1 Å²	65.1	22%	0.216	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-9.8	177.6	0	0	0	0	0	113.1	H287	H287-G289 PolarHBondContact ND1-N 2.75Å; H287-G289 PolarHBondContact O-N 2.92Å
290	L	93.9	Very high	93.8	Very high	28 Å²	28	63.5 Å²	63.5	15%	0.147	33%	0.326	C	S	.	.			trans	-95	130.2	178.3	-62.1	172.2	0	0	0	110.4	P208 P209 M285 H287 E288 E292 L294	P208-L290 HydrophobicContact CB-CD2 3.9Å; P209-L290 HydrophobicContact CG-CD1 4.09Å; P209-L290 HydrophobicContact CG-CD2 4.43Å; P209-L290 HydrophobicContact CG-CG 4.38Å; M285-L290 HydrophobicContact CG-CD1 4.4Å; H287-L290 HydrophobicContact CB-CD1 3.89Å; H287-L290 HydrophobicContact CB-CG 4.08Å; H287-L290 WeakPolarHBondContact O-CB 3.32Å; H287-L290 PolarHBondContact O-N 3.21Å; E288-L290 PolarHBondContact O-N 2.79Å; L290-E292 VanDerWaalsContact C-N 3.29Å; L290-E292 PolarHBondContact O-N 3.32Å; L290-L294 HydrophobicContact CD1-CB 4.42Å; L290-L294 HydrophobicContact CD1-CD1 3.85Å; L290-L294 HydrophobicContact CD1-CG 3.86Å; L290-L294 HydrophobicContact CD2-CD1 3.52Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.34Å; L290-L294 HydrophobicContact CG-CG 4.47Å
291	Q	91	Very high	92.3	Very high	200 Å²	200	63.1 Å²	63.1	94%	0.935	34%	0.34	S	S	*	.	S	Bend	trans	-64.8	-36.7	174.9	-67.3	-177.7	-1.9	0	0	112
292	E	92.3	Very high	89.9	Confident	153 Å²	153	68.1 Å²	68.1	72%	0.715	38%	0.376	S	S	*	.	S	Bend	trans	-138.8	151.5	176.5	-66.2	-177	178.2	0	0	109.2	L290 L294	L290-E292 VanDerWaalsContact C-N 3.29Å; L290-E292 PolarHBondContact O-N 3.32Å; E292-L294 PolarHBondContact O-N 3.19Å
293	P	94.1	Very high	87.4	Confident	76 Å²	76	74.2 Å²	74.2	49%	0.494	40%	0.402	S	S	.	.			trans	-52.8	134.3	173.1	-26.8	35.7	0	0	0	112	M285 Q286	M285-P293 CarbonylContact O-C 3.56Å; M285-P293 WeakPolarHBondContact O-CA 3.38Å; Q286-P293 HydrophobicContact CG-CB 4.01Å; Q286-P293 HydrophobicContact CG-CG 4.14Å
294	L	95	Very high	84.9	Confident	58 Å²	58	79.2 Å²	79.2	30%	0.304	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.3	177	-69.3	177.4	0	0	0	110.6	T211 H284 M285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.3Å; H284-L294 CarbonylContact C-O 3.58Å; H284-L294 WeakPolarHBondContact CA-O 3.5Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.73Å; M285-L294 PolarHBondContact O-N 3.03Å; L290-L294 HydrophobicContact CD1-CB 4.42Å; L290-L294 HydrophobicContact CD1-CD1 3.85Å; L290-L294 HydrophobicContact CD1-CG 3.86Å; L290-L294 HydrophobicContact CD2-CD1 3.52Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.34Å; L290-L294 HydrophobicContact CG-CG 4.47Å; E292-L294 PolarHBondContact O-N 3.19Å
295	T	96.4	Very high	82.7	Confident	82 Å²	82	83.5 Å²	83.5	50%	0.503	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.1	170.4	-56	0	0	0	0	108.4	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 4.07Å; C283-T295 CarbonylContact O-C 3.58Å; C283-T295 WeakPolarHBondContact O-CA 3.44Å; H284-T295 PolarHBondContact CE1-OG1 2.88Å; H284-T295 PolarHBondContact ND1-OG1 2.8Å
296	L	95.6	Very high	80.7	Confident	35 Å²	35	88.4 Å²	88.4	18%	0.183	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.9	-174.4	-59.5	163.5	0	0	0	109.7	T211 V213 T282 C283 M285	T211-L296 VanDerWaalsContact CB-CD1 3.46Å; T211-L296 HydrophobicContact CG2-CD1 4.07Å; V213-L296 HydrophobicContact CG2-CB 3.95Å; T282-L296 CarbonylContact C-O 3.58Å; T282-L296 WeakPolarHBondContact CA-O 3.15Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.03Å; C283-L296 PolarHBondContact O-N 2.82Å; M285-L296 HydrophobicContact CE-CD1 4.32Å
297	S	93.8	Very high	78.8	Confident	59 Å²	59	88 Å²	88	41%	0.413	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	161.3	166.5	55.7	0	0	0	0	110	E299	S297-E299 PolarHBondContact O-N 3.22Å
298	W	94.4	Very high	77.2	Confident	46 Å²	46	93.6 Å²	93.6	17%	0.174	52%	0.523	C	S	.	.			trans	-70.8	126.2	169.8	169.5	61.4	0	0	0	110.1	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.48Å; V213-W298 HydrophobicContact CG1-CB 3.85Å; H215-W298 HydrophobicContact CB-CD2 4.19Å; H215-W298 HydrophobicContact CB-CG 4.23Å; H215-W298 HydrophobicContact CB-CZ2 4.04Å; H215-W298 VanDerWaalsContact CB-NE1 3.27Å; H215-W298 AromaticContact CG-CE2 3.82Å; H215-W298 AromaticContact CG-CZ2 3.84Å; L225-W298 HydrophobicContact CD1-CB 4.34Å; L225-W298 HydrophobicContact CD2-CB 3.82Å; L225-W298 HydrophobicContact CD2-CD2 4.37Å; L225-W298 HydrophobicContact CD2-CG 3.93Å; E278-W298 HydrophobicContact CB-CD2 4.37Å; E278-W298 HydrophobicContact CB-CE3 3.38Å; E278-W298 HydrophobicContact CB-CZ3 3.76Å; E278-W298 HydrophobicContact CG-CE3 3.75Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å; Q279-W298 PolarHBondContact NE2-O 3.44Å; W298-P300 HydrophobicContact CE3-CG 4.4Å; W298-P300 HydrophobicContact CH2-CB 4.24Å; W298-P300 HydrophobicContact CH2-CG 3.89Å; W298-P300 HydrophobicContact CZ2-CB 4.1Å; W298-P300 HydrophobicContact CZ2-CG 4.11Å; W298-P300 HydrophobicContact CZ3-CG 4.04Å
299	E	87.3	Confident	75.5	Confident	167 Å²	167	98.9 Å²	98.9	78%	0.78	55%	0.55	S	S	*	*			trans	-107.3	120.6	173.5	-158.8	160.1	-158.9	0	0	109.3	S297 S301	S297-E299 PolarHBondContact O-N 3.22Å; E299-S301 PolarHBondContact O-N 3.25Å
300	P	80	Confident	74.2	Confident	72 Å²	72	100 Å²	100	47%	0.468	56%	0.561	S	S	.	*			trans	-58.5	126	175.2	-20.4	30.5	0	0	0	109	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.4Å; W298-P300 HydrophobicContact CH2-CB 4.24Å; W298-P300 HydrophobicContact CH2-CG 3.89Å; W298-P300 HydrophobicContact CZ2-CB 4.1Å; W298-P300 HydrophobicContact CZ2-CG 4.11Å; W298-P300 HydrophobicContact CZ3-CG 4.04Å; P300-S302 PolarHBondContact O-N 3.19Å
301	S	63	Low	73.2	Confident	98 Å²	98	103.3 Å²	103.3	69%	0.685	58%	0.578	S	S	*	*			trans	-55.4	110.4	-177.9	108.9	0	0	0	0	109.3	E299 Q303	E299-S301 PolarHBondContact O-N 3.25Å; S301-Q303 PolarHBondContact O-N 3.26Å
302	S	48.1	Very low	72.4	Confident	114 Å²	114	98.1 Å²	98.1	80%	0.797	56%	0.56	S	S	*	*			trans	-78.4	68.7	166.5	61.9	0	0	0	0	107.5	P300 P304	P300-S302 PolarHBondContact O-N 3.19Å; S302-P304 WeakPolarHBondContact O-CD 3.41Å
303	Q	44.4	Very low	71.6	Confident	160 Å²	160	93.4 Å²	93.4	75%	0.748	55%	0.547	S	S	*	.			trans	-65.5	113	154.3	-80.6	-169.7	-14.4	0	0	104.9	S301 T305	S301-Q303 PolarHBondContact O-N 3.26Å; Q303-T305 PolarHBondContact O-N 3.07Å
304	P	44.1	Very low	70.9	Confident	105 Å²	105	91.4 Å²	91.4	68%	0.682	54%	0.541	S	S	*	.			trans	-59.3	114.4	166.1	25.2	-29.7	0	0	0	104.7	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.41Å; P304-I306 HydrophobicContact CB-CG1 4.49Å; P304-I306 HydrophobicContact CG-CG1 4.47Å; P304-I306 PolarHBondContact O-N 3.07Å
305	T	50.6	Low	70.4	Confident	133 Å²	133	93.6 Å²	93.6	82%	0.816	55%	0.552	S	S	*	*			trans	-63.4	80.3	160.9	-41.2	0	0	0	0	104.8	Q303 P307	Q303-T305 PolarHBondContact O-N 3.07Å; T305-P307 VanDerWaalsContact O-CD 3.3Å; T305-P307 WeakPolarHBondContact O-CD 3.07Å
306	I	55.1	Low	69.8	Low	103 Å²	103	92.2 Å²	92.2	53%	0.528	55%	0.549	S	S	.	.			trans	-50.6	119.9	167	-63.2	175.3	0	0	0	102.7	P304 I308 I311	P304-I306 HydrophobicContact CB-CG1 4.49Å; P304-I306 HydrophobicContact CG-CG1 4.47Å; P304-I306 PolarHBondContact O-N 3.07Å; I306-I308 HydrophobicContact CB-CG1 4.39Å; I306-I308 HydrophobicContact CG2-CG1 4.21Å; I306-I308 WeakPolarHBondContact O-CG1 3.26Å; I306-I308 PolarHBondContact O-N 3.32Å; I306-I311 HydrophobicContact CG2-CD1 4.09Å
307	P	56	Low	69.3	Low	86 Å²	86	94.6 Å²	94.6	56%	0.558	57%	0.565	S	S	*	*			trans	-73.5	74.9	-176.8	29.9	-33.4	0	0	0	107	T305 M309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.3Å; T305-P307 WeakPolarHBondContact O-CD 3.07Å; P307-M309 PolarHBondContact O-N 2.91Å; P307-M309 VanDerWaalsContact O-N 3.15Å; P307-G310 WeakPolarHBondContact O-CA 3.2Å; P307-G310 PolarHBondContact O-N 2.98Å; P307-I311 PolarHBondContact O-N 2.95Å; P307-I311 VanDerWaalsContact O-N 3.12Å
308	I	61.3	Low	68.9	Low	118 Å²	118	97.2 Å²	97.2	61%	0.605	57%	0.573	S	S	*	*	H	α-helix	trans	-55.2	-34.9	178.2	-66.8	167.6	0	0	0	108.2	I306 G310 I311 V312	I306-I308 HydrophobicContact CB-CG1 4.39Å; I306-I308 HydrophobicContact CG2-CG1 4.21Å; I306-I308 WeakPolarHBondContact O-CG1 3.26Å; I306-I308 PolarHBondContact O-N 3.32Å; I308-G310 PolarHBondContact O-N 3.35Å; I308-I311 PolarHBondContact O-N 2.78Å; I308-V312 HydrophobicContact CG2-CG2 4.35Å; I308-V312 WeakPolarHBondContact O-CB 3.48Å; I308-V312 VanDerWaalsContact O-CG2 3.22Å; I308-V312 WeakPolarHBondContact O-CG2 3.46Å; I308-V312 PolarHBondContact O-N 3.25Å
309	M	56.3	Low	68.4	Low	163 Å²	163	99.3 Å²	99.3	80%	0.803	59%	0.591	S	S	*	*	H	α-helix	trans	-64.8	-35.7	174	-165.6	151.9	61.4	0	0	113.6	P307 A313	P307-M309 PolarHBondContact O-N 2.91Å; P307-M309 VanDerWaalsContact O-N 3.15Å; M309-A313 VanDerWaalsContact O-CB 3.27Å; M309-A313 WeakPolarHBondContact O-CB 3.46Å; M309-A313 PolarHBondContact O-N 3.22Å
310	G	65.9	Low	68.3	Low	44 Å²	44	95.5 Å²	95.5	45%	0.454	58%	0.579	S	S	.	*	H	α-helix	trans	-70.8	-37.8	176.3	0	0	0	0	0	112.9	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.2Å; P307-G310 PolarHBondContact O-N 2.98Å; I308-G310 PolarHBondContact O-N 3.35Å; G310-G314 PolarHBondContact O-N 3.44Å
311	I	73.3	Confident	68.5	Low	97 Å²	97	97.1 Å²	97.1	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-69.6	-43	176.2	-61.7	172.5	0	0	0	110.5	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 4.09Å; P307-I311 PolarHBondContact O-N 2.95Å; P307-I311 VanDerWaalsContact O-N 3.12Å; I308-I311 PolarHBondContact O-N 2.78Å; I311-G314 PolarHBondContact O-N 2.82Å; I311-L315 HydrophobicContact CG2-CD1 3.96Å; I311-L315 WeakPolarHBondContact O-CB 3.35Å; I311-L315 WeakPolarHBondContact O-CG 3.47Å; I311-L315 PolarHBondContact O-N 2.88Å
312	V	73.9	Confident	69.5	Low	92 Å²	92	95.5 Å²	95.5	56%	0.558	58%	0.576	S	S	*	*	H	α-helix	trans	-65.5	-43.3	177.5	172.3	0	0	0	0	111.3	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.35Å; I308-V312 WeakPolarHBondContact O-CB 3.48Å; I308-V312 VanDerWaalsContact O-CG2 3.22Å; I308-V312 WeakPolarHBondContact O-CG2 3.46Å; I308-V312 PolarHBondContact O-N 3.25Å; V312-L315 PolarHBondContact O-N 3.41Å; V312-A316 WeakPolarHBondContact O-CB 3.37Å; V312-A316 PolarHBondContact O-N 3.42Å
313	A	74.6	Confident	71.1	Confident	53 Å²	53	94.2 Å²	94.2	44%	0.438	56%	0.563	S	S	.	*	H	α-helix	trans	-63.4	-43.1	175.1	0	0	0	0	0	111.9	M309 A316 V317	M309-A313 VanDerWaalsContact O-CB 3.27Å; M309-A313 WeakPolarHBondContact O-CB 3.46Å; M309-A313 PolarHBondContact O-N 3.22Å; A313-A316 PolarHBondContact O-N 2.99Å; A313-V317 WeakPolarHBondContact O-CG2 3.35Å; A313-V317 PolarHBondContact O-N 3.38Å
314	G	80.8	Confident	72.9	Confident	35 Å²	35	91.3 Å²	91.3	36%	0.361	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-43.3	176.8	0	0	0	0	0	113.1	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 3.44Å; I311-G314 PolarHBondContact O-N 2.82Å; G314-V317 PolarHBondContact O-N 3.45Å; G314-L318 PolarHBondContact O-N 3.46Å
315	L	84.3	Confident	74.6	Confident	103 Å²	103	87.9 Å²	87.9	54%	0.539	54%	0.536	S	S	.	.	H	α-helix	trans	-65.9	-41	176	-76.6	168.6	0	0	0	112.1	I311 V312 V317 L318 V319	I311-L315 HydrophobicContact CG2-CD1 3.96Å; I311-L315 WeakPolarHBondContact O-CB 3.35Å; I311-L315 WeakPolarHBondContact O-CG 3.47Å; I311-L315 PolarHBondContact O-N 2.88Å; V312-L315 PolarHBondContact O-N 3.41Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 3.02Å; L315-L318 PolarHBondContact O-N 3.4Å; L315-V319 WeakPolarHBondContact O-CG2 3.5Å; L315-V319 PolarHBondContact O-N 3.22Å
316	A	82.3	Confident	76	Confident	53 Å²	53	84.4 Å²	84.4	44%	0.438	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-43.1	176.5	0	0	0	0	0	111.6	V312 A313 V319 V320	V312-A316 WeakPolarHBondContact O-CB 3.37Å; V312-A316 PolarHBondContact O-N 3.42Å; A313-A316 PolarHBondContact O-N 2.99Å; A316-V319 PolarHBondContact O-N 2.87Å; A316-V320 VanDerWaalsContact O-CG2 3.31Å; A316-V320 WeakPolarHBondContact O-CG2 3.18Å; A316-V320 PolarHBondContact O-N 3.32Å
317	V	85.6	Confident	77.2	Confident	85 Å²	85	83.1 Å²	83.1	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-42.6	176.5	173	0	0	0	0	111.4	A313 G314 L315 V319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.35Å; A313-V317 PolarHBondContact O-N 3.38Å; G314-V317 PolarHBondContact O-N 3.45Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 3.02Å; V317-V319 PolarHBondContact O-N 3.06Å; V317-V320 PolarHBondContact O-N 3.28Å; V317-L321 HydrophobicContact CG1-CD1 3.95Å; V317-L321 HydrophobicContact CG1-CG 4.38Å; V317-L321 WeakPolarHBondContact O-CG 3.17Å; V317-L321 PolarHBondContact O-N 2.9Å
318	L	84.7	Confident	78.3	Confident	114 Å²	114	82.8 Å²	82.8	60%	0.597	51%	0.514	S	S	*	.	H	α-helix	trans	-61.5	-42	176.5	-86.2	164.2	0	0	0	112.6	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.46Å; L315-L318 PolarHBondContact O-N 3.4Å; L318-L321 PolarHBondContact O-N 2.99Å; L318-A322 WeakPolarHBondContact O-CB 3.45Å; L318-A322 PolarHBondContact O-N 2.67Å
319	V	84.6	Confident	78.8	Confident	91 Å²	91	81.3 Å²	81.3	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-63.8	-44.2	176.2	172.1	0	0	0	0	110.8	L315 A316 V317 L321 A322 V323	L315-V319 WeakPolarHBondContact O-CG2 3.5Å; L315-V319 PolarHBondContact O-N 3.22Å; A316-V319 PolarHBondContact O-N 2.87Å; V317-V319 PolarHBondContact O-N 3.06Å; V319-L321 PolarHBondContact O-N 3.05Å; V319-A322 PolarHBondContact O-N 2.98Å; V319-V323 HydrophobicContact CG1-CG2 4.5Å; V319-V323 VanDerWaalsContact O-CG2 3.31Å; V319-V323 WeakPolarHBondContact O-CG2 3.46Å; V319-V323 PolarHBondContact O-N 3.49Å
320	V	85.1	Confident	79.6	Confident	86 Å²	86	76.1 Å²	76.1	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-61.4	-44.8	177.2	171.6	0	0	0	0	111.1	A316 V317 A322 V323 L324	A316-V320 VanDerWaalsContact O-CG2 3.31Å; A316-V320 WeakPolarHBondContact O-CG2 3.18Å; A316-V320 PolarHBondContact O-N 3.32Å; V317-V320 PolarHBondContact O-N 3.28Å; V320-A322 PolarHBondContact O-N 2.73Å; V320-V323 PolarHBondContact O-N 3.3Å; V320-L324 HydrophobicContact CG1-CD1 3.92Å; V320-L324 HydrophobicContact CG1-CG 4.43Å; V320-L324 WeakPolarHBondContact O-CB 3.4Å; V320-L324 VanDerWaalsContact O-CG 3.31Å; V320-L324 WeakPolarHBondContact O-CG 3.37Å; V320-L324 PolarHBondContact O-N 2.88Å
321	L	84.9	Confident	79.8	Confident	106 Å²	106	80.2 Å²	80.2	56%	0.555	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-39.8	177.4	-72.2	172.1	0	0	0	112.3	V317 L318 V319 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.95Å; V317-L321 HydrophobicContact CG1-CG 4.38Å; V317-L321 WeakPolarHBondContact O-CG 3.17Å; V317-L321 PolarHBondContact O-N 2.9Å; L318-L321 PolarHBondContact O-N 2.99Å; V319-L321 PolarHBondContact O-N 3.05Å; L321-L324 PolarHBondContact O-N 3.25Å; L321-G325 PolarHBondContact O-N 3.35Å
322	A	82.7	Confident	79.7	Confident	65 Å²	65	81.9 Å²	81.9	54%	0.537	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-42.5	176.3	0	0	0	0	0	111.9	L318 V319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.45Å; L318-A322 PolarHBondContact O-N 2.67Å; V319-A322 PolarHBondContact O-N 2.98Å; V320-A322 PolarHBondContact O-N 2.73Å; A322-G325 PolarHBondContact O-N 3.33Å; A322-A326 WeakPolarHBondContact O-CB 3.23Å; A322-A326 PolarHBondContact O-N 3.09Å
323	V	82.8	Confident	79.1	Confident	87 Å²	87	81.4 Å²	81.4	53%	0.527	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-45.4	176.2	173	0	0	0	0	110.8	V319 V320 G325 A326 V327	V319-V323 HydrophobicContact CG1-CG2 4.5Å; V319-V323 VanDerWaalsContact O-CG2 3.31Å; V319-V323 WeakPolarHBondContact O-CG2 3.46Å; V319-V323 PolarHBondContact O-N 3.49Å; V320-V323 PolarHBondContact O-N 3.3Å; V323-G325 PolarHBondContact O-N 3.41Å; V323-A326 PolarHBondContact O-N 3.2Å; V323-V327 HydrophobicContact CG1-CG2 4.47Å; V323-V327 VanDerWaalsContact O-CG2 3.29Å; V323-V327 WeakPolarHBondContact O-CG2 3.18Å; V323-V327 PolarHBondContact O-N 3.06Å
324	L	82.1	Confident	78.4	Confident	98 Å²	98	88.7 Å²	88.7	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-42.8	176.3	-70.7	171.6	0	0	0	111.6	V320 L321 A326 V327 V328	V320-L324 HydrophobicContact CG1-CD1 3.92Å; V320-L324 HydrophobicContact CG1-CG 4.43Å; V320-L324 WeakPolarHBondContact O-CB 3.4Å; V320-L324 VanDerWaalsContact O-CG 3.31Å; V320-L324 WeakPolarHBondContact O-CG 3.37Å; V320-L324 PolarHBondContact O-N 2.88Å; L321-L324 PolarHBondContact O-N 3.25Å; L324-A326 PolarHBondContact O-N 3.44Å; L324-V327 PolarHBondContact O-N 3.3Å; L324-V328 WeakPolarHBondContact O-CG2 3.33Å; L324-V328 PolarHBondContact O-N 3.22Å
325	G	80.8	Confident	77.3	Confident	34 Å²	34	97.4 Å²	97.4	35%	0.351	55%	0.548	S	S	.	.	H	α-helix	trans	-60.5	-42.4	174.8	0	0	0	0	0	112.6	L321 A322 V323 V328 T329	L321-G325 PolarHBondContact O-N 3.35Å; A322-G325 PolarHBondContact O-N 3.33Å; V323-G325 PolarHBondContact O-N 3.41Å; G325-V328 PolarHBondContact O-N 3.3Å; G325-T329 WeakPolarHBondContact O-CB 3.31Å; G325-T329 PolarHBondContact O-N 3.05Å; G325-T329 PolarHBondContact O-OG1 3.06Å
326	A	79.2	Confident	75.7	Confident	59 Å²	59	101.3 Å²	101.3	49%	0.488	56%	0.56	S	S	.	*	H	α-helix	trans	-65.1	-41.2	175.8	0	0	0	0	0	112.2	A322 V323 L324 T329 A330	A322-A326 WeakPolarHBondContact O-CB 3.23Å; A322-A326 PolarHBondContact O-N 3.09Å; V323-A326 PolarHBondContact O-N 3.2Å; L324-A326 PolarHBondContact O-N 3.44Å; A326-T329 PolarHBondContact O-N 2.95Å; A326-A330 VanDerWaalsContact O-CB 3.31Å; A326-A330 WeakPolarHBondContact O-CB 3.27Å; A326-A330 PolarHBondContact O-N 3.02Å
327	V	79.9	Confident	74.1	Confident	76 Å²	76	103.2 Å²	103.2	46%	0.461	57%	0.57	S	S	.	*	H	α-helix	trans	-65	-44.7	177	171.5	0	0	0	0	111.2	V323 L324 T329 A330 M331	V323-V327 HydrophobicContact CG1-CG2 4.47Å; V323-V327 VanDerWaalsContact O-CG2 3.29Å; V323-V327 WeakPolarHBondContact O-CG2 3.18Å; V323-V327 PolarHBondContact O-N 3.06Å; L324-V327 PolarHBondContact O-N 3.3Å; V327-T329 VanDerWaalsContact C-N 3.35Å; V327-T329 PolarHBondContact O-N 3.38Å; V327-A330 PolarHBondContact O-N 3.32Å; V327-M331 HydrophobicContact CG1-CG 4.39Å; V327-M331 WeakPolarHBondContact O-CB 3.39Å; V327-M331 VanDerWaalsContact O-CG 3.26Å; V327-M331 WeakPolarHBondContact O-CG 3.33Å; V327-M331 PolarHBondContact O-N 2.95Å
328	V	78.9	Confident	72.4	Confident	80 Å²	80	104.2 Å²	104.2	49%	0.485	58%	0.581	S	S	.	*	H	α-helix	trans	-62.1	-44.3	176.2	172.3	0	0	0	0	110.6	L324 G325 A330 M331 M332	L324-V328 WeakPolarHBondContact O-CG2 3.33Å; L324-V328 PolarHBondContact O-N 3.22Å; G325-V328 PolarHBondContact O-N 3.3Å; V328-A330 PolarHBondContact O-N 2.99Å; V328-M331 PolarHBondContact O-N 3.07Å; V328-M332 HydrophobicContact CG1-CG 4.47Å; V328-M332 HydrophobicContact CG1-SD 4.19Å; V328-M332 WeakPolarHBondContact O-CG 3.46Å; V328-M332 PolarHBondContact O-N 3.33Å
329	T	73.2	Confident	70.2	Confident	86 Å²	86	101.8 Å²	101.8	53%	0.528	58%	0.584	S	S	.	*	H	α-helix	trans	-62.3	-44.8	177.3	-53.3	0	0	0	0	111.4	G325 A326 V327 M331 M332 C333	G325-T329 WeakPolarHBondContact O-CB 3.31Å; G325-T329 PolarHBondContact O-N 3.05Å; G325-T329 PolarHBondContact O-OG1 3.06Å; A326-T329 PolarHBondContact O-N 2.95Å; V327-T329 VanDerWaalsContact C-N 3.35Å; V327-T329 PolarHBondContact O-N 3.38Å; T329-M331 PolarHBondContact O-N 2.9Å; T329-M332 PolarHBondContact O-N 2.73Å; T329-C333 WeakPolarHBondContact O-CB 3.4Å; T329-C333 PolarHBondContact O-N 3.09Å; T329-C333 PolarHBondContact O-SG 3.17Å; T329-C333 VanDerWaalsContact O-SG 3.35Å
330	A	72.3	Confident	67.9	Low	55 Å²	55	101.1 Å²	101.1	46%	0.455	60%	0.596	S	S	.	*	H	α-helix	trans	-64.4	-38.4	176.1	0	0	0	0	0	112.6	A326 V327 V328 C333 R334	A326-A330 VanDerWaalsContact O-CB 3.31Å; A326-A330 WeakPolarHBondContact O-CB 3.27Å; A326-A330 PolarHBondContact O-N 3.02Å; V327-A330 PolarHBondContact O-N 3.32Å; V328-A330 PolarHBondContact O-N 2.99Å; A330-C333 PolarHBondContact O-N 3.22Å; A330-R334 WeakPolarHBondContact O-CB 3.21Å; A330-R334 PolarHBondContact O-N 2.58Å
331	M	70.7	Confident	65.5	Low	129 Å²	129	107.4 Å²	107.4	64%	0.635	62%	0.616	S	S	*	*	H	α-helix	trans	-67.8	-39.2	175	-73.7	-127.5	-70	0	0	112.2	V327 V328 T329 R334 R335	V327-M331 HydrophobicContact CG1-CG 4.39Å; V327-M331 WeakPolarHBondContact O-CB 3.39Å; V327-M331 VanDerWaalsContact O-CG 3.26Å; V327-M331 WeakPolarHBondContact O-CG 3.33Å; V327-M331 PolarHBondContact O-N 2.95Å; V328-M331 PolarHBondContact O-N 3.07Å; T329-M331 PolarHBondContact O-N 2.9Å; M331-R334 PolarHBondContact O-N 3.32Å; M331-R335 WeakPolarHBondContact O-CB 3.27Å; M331-R335 PolarHBondContact O-N 3.3Å
332	M	70.7	Confident	63	Low	133 Å²	133	106.1 Å²	106.1	66%	0.655	63%	0.628	S	S	*	*	H	α-helix	trans	-67.4	-39.9	174.3	-70.9	-175.4	78.9	0	0	111.7	V328 T329 R335 K336	V328-M332 HydrophobicContact CG1-CG 4.47Å; V328-M332 HydrophobicContact CG1-SD 4.19Å; V328-M332 WeakPolarHBondContact O-CG 3.46Å; V328-M332 PolarHBondContact O-N 3.33Å; T329-M332 PolarHBondContact O-N 2.73Å; M332-R335 PolarHBondContact O-N 2.59Å; M332-K336 WeakPolarHBondContact O-CB 3.43Å; M332-K336 PolarHBondContact O-N 3.03Å
333	C	60.7	Low	60.5	Low	81 Å²	81	107 Å²	107	55%	0.547	64%	0.643	S	S	.	*	H	α-helix	trans	-62.5	-41.2	172	-73.6	0	0	0	0	111.8	T329 A330 K336 S337	T329-C333 WeakPolarHBondContact O-CB 3.4Å; T329-C333 PolarHBondContact O-N 3.09Å; T329-C333 PolarHBondContact O-SG 3.17Å; T329-C333 VanDerWaalsContact O-SG 3.35Å; A330-C333 PolarHBondContact O-N 3.22Å; C333-K336 PolarHBondContact O-N 3.11Å; C333-S337 PolarHBondContact O-N 3.16Å; C333-S337 PolarHBondContact O-OG 2.87Å
334	R	60.6	Low	58.2	Low	206 Å²	206	108.4 Å²	108.4	78%	0.777	66%	0.657	S	S	*	*	H	α-helix	trans	-68.6	-33.6	175.1	-82.8	-171.9	162.8	-176.6	-3.4	113.6	A330 M331 K336 S337	A330-R334 WeakPolarHBondContact O-CB 3.21Å; A330-R334 PolarHBondContact O-N 2.58Å; M331-R334 PolarHBondContact O-N 3.32Å; R334-K336 VanDerWaalsContact C-N 3.32Å; R334-S337 PolarHBondContact O-OG 3.41Å
335	R	57.1	Low	55.8	Low	218 Å²	218	108.8 Å²	108.8	82%	0.823	67%	0.667	S	S	*	*	H	α-helix	trans	-69.9	-29.6	172.3	-115.7	-179	175.4	175.8	-1.1	112.4	M331 M332	M331-R335 WeakPolarHBondContact O-CB 3.27Å; M331-R335 PolarHBondContact O-N 3.3Å; M332-R335 PolarHBondContact O-N 2.59Å
336	K	50.1	Low	53.5	Low	185 Å²	185	111.7 Å²	111.7	80%	0.804	68%	0.682	S	S	*	*	H	α-helix	trans	-85	-18.7	179.2	-162.3	159.7	-179.4	174.7	0	113.4	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.43Å; M332-K336 PolarHBondContact O-N 3.03Å; C333-K336 PolarHBondContact O-N 3.11Å; R334-K336 VanDerWaalsContact C-N 3.32Å
337	S	50	Low	51.4	Low	93 Å²	93	117.7 Å²	117.7	65%	0.65	70%	0.7	S	S	*	*	S	Bend	trans	-89	-0.1	176.3	60.8	0	0	0	0	115.2	C333 R334 G339	C333-S337 PolarHBondContact O-N 3.16Å; C333-S337 PolarHBondContact O-OG 2.87Å; R334-S337 PolarHBondContact O-OG 3.41Å; S337-G339 VanDerWaalsContact C-N 3.33Å
338	S	48.4	Very low	49.2	Very low	106 Å²	106	118.4 Å²	118.4	74%	0.741	71%	0.714	S	S	*	*	S	Bend	trans	-93.5	23.9	175.5	80.1	0	0	0	0	114.1
339	G	39.9	Very low	46.8	Very low	64 Å²	64	119.4 Å²	119.4	66%	0.66	73%	0.73	S	S	*	*	S	Bend	trans	-150.1	87.6	177.8	0	0	0	0	0	113	S337	S337-G339 VanDerWaalsContact C-N 3.33Å
340	G	36.6	Very low	44.9	Very low	77 Å²	77	121.7 Å²	121.7	79%	0.794	75%	0.748	S	S	*	*			trans	83.4	92.4	143.9	0	0	0	0	0	120.1
341	K	33.6	Very low	43	Very low	218 Å²	218	124.9 Å²	124.9	95%	0.948	77%	0.767	S	S	*	*				57.6	115.3	116.9	-146.4	158.3	-175.5	172.1	0	120.7
342	G	32.5	Very low	41.3	Very low	79 Å²	79	126.8 Å²	126.8	81%	0.814	78%	0.78	S	S	*	*				120.7	123.6	129.1	0	0	0	0	0	118.1
343	G	31.1	Very low	39.6	Very low	83 Å²	83	126.6 Å²	126.6	86%	0.856	79%	0.792	S	S	*	*			trans	121.5	106.2	145.4	0	0	0	0	0	118
344	S	34.7	Very low	38.6	Very low	116 Å²	116	127.3 Å²	127.3	81%	0.811	80%	0.803	S	S	*	*			trans	-62.5	170.6	164.3	-154.4	0	0	0	0	111.7
345	C	31	Very low	37.4	Very low	106 Å²	106	127.3 Å²	127.3	72%	0.716	81%	0.812	S	S	*	*			cis	-172	153.4	29.5	-156.6	0	0	0	0	111.7
346	S	33.2	Very low	36.2	Very low	95 Å²	95	120 Å²	120	66%	0.664	81%	0.805	S	S	*	*			trans	62.1	114.7	140	48.7	0	0	0	0	124.8
347	Q	35.3	Very low	35.6	Very low	186 Å²	186	116.8 Å²	116.8	87%	0.869	81%	0.806	S	S	*	*				84.8	122.5	105.6	-158	164.9	9	0	0	123
348	A	31.8	Very low	35	Very low	91 Å²	91	119.9 Å²	119.9	75%	0.752	82%	0.815	S	S	*	*			trans	69.6	129.6	143.3	0	0	0	0	0	122.9
349	A	29.3	Very low	34.2	Very low	100 Å²	100	123.4 Å²	123.4	83%	0.826	82%	0.82	S	S	*	*				-161.3	113.6	119.6	0	0	0	0	0	111.2
350	C	32.6	Very low	33.8	Very low	134 Å²	134	124.6 Å²	124.6	91%	0.905	82%	0.818	S	S	*	*			trans	-84.3	148.7	154.3	-78.1	0	0	0	0	108.6
351	S	32.4	Very low	33.6	Very low	123 Å²	123	128.2 Å²	128.2	86%	0.86	82%	0.818	S	S	*	*			trans	-135.6	121.1	160.3	32.9	0	0	0	0	110.5
352	N	35.3	Very low	33.5	Very low	169 Å²	169	124.3 Å²	124.3	90%	0.904	81%	0.806	S	S	*	*			trans	-89.2	151.8	164.6	-87.2	-19.5	0	0	0	108.9
353	S	36.5	Very low	33.4	Very low	129 Å²	129	127.1 Å²	127.1	90%	0.902	81%	0.808	S	S	*	*			trans	-136.7	134.8	151.4	43.6	0	0	0	0	109.2
354	A	39	Very low	33.5	Very low	95 Å²	95	129 Å²	129	79%	0.785	81%	0.806	S	S	*	*			trans	-131.1	144.6	-174.3	0	0	0	0	0	109.3
355	Q	36	Very low	33.5	Very low	206 Å²	206	133.4 Å²	133.4	96%	0.963	81%	0.811	S	S	*	*			trans	-178.3	132.1	158.5	-113.3	168.9	-8.3	0	0	106.4
356	G	30.4	Very low	33.8	Very low	65 Å²	65	136.6 Å²	136.6	67%	0.67	85%	0.845	S	S	*	*			cis	173.2	147.3	-2.2	0	0	0	0	0	109
357	S	37.1	Very low	33.8	Very low	118 Å²	118	138.7 Å²	138.7	83%	0.825	85%	0.854	S	S	*	*			trans	73.8	107.3	146.1	-36.3	0	0	0	0	122.7
358	D	37.8	Very low	33.8	Very low	158 Å²	158	136.2 Å²	136.2	85%	0.845	85%	0.853	S	S	*	*				23.6	134	127.6	-62.2	-29.6	0	0	0	122.3
359	E	32.1	Very low	33.9	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	86%	0.859	S	S	*	*				177	137.7	97.6	-123.5	-172.6	139.6	0	0	114.7
360	S	32.2	Very low	34.1	Very low	89 Å²	89	141 Å²	141	62%	0.622	86%	0.861	S	S	*	*			trans	61.1	111.1	142.3	75.4	0	0	0	0	120.4
361	L	32.5	Very low	34.2	Very low	152 Å²	152	141.4 Å²	141.4	80%	0.796	86%	0.858	S	S	*	*				84.8	121.2	83	-82.5	169.6	0	0	0	116
362	I	31.6	Very low	34.4	Very low	136 Å²	136	142.7 Å²	142.7	70%	0.697	86%	0.858	S	S	*	*			trans	77.1	107.8	141.8	-53.6	159.2	0	0	0	118.3
363	T	30.3	Very low	34.3	Very low	139 Å²	139	140.8 Å²	140.8	85%	0.853	85%	0.854	S	S	*	*				-172.9	127.4	103	22.5	0	0	0	0	111
364	C	33.5	Very low	34.1	Very low	121 Å²	121	141.7 Å²	141.7	82%	0.818	85%	0.851	S	S	*	*			trans	-103.1	150.7	168.8	-85	0	0	0	0	110
365	K	33.6	Very low	33.7	Very low	210 Å²	210	145.6 Å²	145.6	91%	0.913	86%	0.856	S	S	*	*			trans	71	136.9	158.3	-77.2	178.7	171.2	179.2	0	115.5
366	A	37.5	Very low	33.5	Very low	173 Å²	173	140.1 Å²	140.1	100%	1.43	85%	0.846	S	S	*	*			cis	-129.5	0	43.3	0	0	0	0	0	114.1

Retrieved 366 of 366 residues in 94.1 ms (Link to these results)

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