A0A087YEQ6_POEFO Loading...

Leucine rich repeat neuronal 2

AlphaFold DB , UniProt , Accession A0A087YEQ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 619 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	L	32.9	Very low	24.5	Very low	234 Å²	234	162.6 Å²	162.6	100%	1.225	86%	0.863	S	S	*	*				0	96.1	0	-107.5	144.7	0	0	0	108.9
2	A	20.5	Very low	24.8	Very low	92 Å²	92	159 Å²	159	76%	0.76	85%	0.851	S	S	*	*			trans	-174.2	86.2	159.2	0	0	0	0	0	104.4
3	L	21.8	Very low	24.9	Very low	169 Å²	169	162.1 Å²	162.1	89%	0.885	85%	0.853	S	S	*	*				62.7	82.2	101.4	-82.8	157.7	0	0	0	112.9
4	L	23.1	Very low	25.2	Very low	167 Å²	167	158.4 Å²	158.4	87%	0.874	85%	0.847	S	S	*	*			trans	-84.1	114.3	156	-92.8	146	0	0	0	107.8	S6	L4-S6 PolarHBondContact O-N 2.89Å
5	Q	23.6	Very low	25.2	Very low	187 Å²	187	152.5 Å²	152.5	87%	0.874	84%	0.839	S	S	*	*			trans	-74.4	101.3	162.5	-97.8	-177.1	-31.6	0	0	108.2
6	S	26.1	Very low	25.3	Very low	102 Å²	102	153.9 Å²	153.9	71%	0.713	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-88	124.4	165.6	46.8	0	0	0	0	109.4	L4	L4-S6 PolarHBondContact O-N 2.89Å
7	H	25	Very low	25.2	Very low	186 Å²	186	152.6 Å²	152.6	86%	0.861	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-81.3	117.2	156.8	-88.3	16.2	0	0	0	108	L9	H7-L9 PolarHBondContact O-N 3.2Å
8	C	22.4	Very low	25.4	Very low	118 Å²	118	150.6 Å²	150.6	80%	0.797	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-58	123.4	168.7	-89.4	0	0	0	0	110.7
9	L	24.7	Very low	25.7	Very low	167 Å²	167	148.7 Å²	148.7	87%	0.874	83%	0.831	S	S	*	*			trans	-130.3	109.7	146.1	-94	160.2	0	0	0	107.2	H7 Y11	H7-L9 PolarHBondContact O-N 3.2Å; L9-Y11 PolarHBondContact O-N 2.99Å
10	L	24.9	Very low	25.8	Very low	146 Å²	146	148.7 Å²	148.7	76%	0.764	83%	0.827	S	S	*	*			trans	-62	118.9	171.5	-92.4	129.4	0	0	0	109.6
11	Y	24.7	Very low	25.9	Very low	221 Å²	221	147.9 Å²	147.9	87%	0.867	83%	0.826	S	S	*	*			trans	-138.1	118.7	147.2	-96.8	-80.9	0	0	0	109.6	L9	L9-Y11 PolarHBondContact O-N 2.99Å
12	V	28	Very low	25.9	Very low	119 Å²	119	142.4 Å²	142.4	72%	0.721	80%	0.802	S	S	*	*			trans	-70.7	123.1	174.2	172	0	0	0	0	108.4
13	F	26.4	Very low	26.4	Very low	199 Å²	199	141 Å²	141	87%	0.873	80%	0.797	S	S	*	*			trans	-147	123.8	149.4	-99.1	-76.6	0	0	0	110.7
14	S	28.1	Very low	27.1	Very low	110 Å²	110	138 Å²	138	77%	0.769	79%	0.79	S	S	*	*			trans	-68.1	143.2	169.4	49.9	0	0	0	0	112.1
15	G	26.3	Very low	28.3	Very low	71 Å²	71	137 Å²	137	73%	0.732	79%	0.785	S	S	*	*			trans	144	105.1	152.4	0	0	0	0	0	116.8
16	M	25.9	Very low	29.4	Very low	175 Å²	175	130.9 Å²	130.9	86%	0.862	76%	0.761	S	S	*	*			trans	67.9	103.5	145.3	-61.7	-157.4	52.6	0	0	120.3	V18	M16-V18 PolarHBondContact O-N 3.18Å
17	C	24.5	Very low	30.8	Very low	132 Å²	132	131.4 Å²	131.4	89%	0.892	76%	0.762	S	S	*	*			trans	-67.9	117	157.3	-67.4	0	0	0	0	110.3
18	V	28.4	Very low	32.4	Very low	116 Å²	116	124.7 Å²	124.7	70%	0.703	74%	0.739	S	S	*	*			trans	-91	127.5	158.7	-179.4	0	0	0	0	106.8	M16 I20	M16-V18 PolarHBondContact O-N 3.18Å; V18-I20 PolarHBondContact O-N 3.17Å; V18-I20 VanDerWaalsContact O-N 3.1Å
19	P	31.4	Very low	34.5	Very low	115 Å²	115	123.6 Å²	123.6	75%	0.747	73%	0.725	S	S	*	*			trans	-70.5	110.5	173.8	28	-29.3	0	0	0	108.4	V21	P19-V21 PolarHBondContact O-N 2.76Å
20	I	26.5	Very low	36.6	Very low	147 Å²	147	119.2 Å²	119.2	75%	0.754	71%	0.706	S	S	*	*			trans	-70.7	112.1	161.3	-63.2	173.5	0	0	0	105.5	V18 V22	V18-I20 PolarHBondContact O-N 3.17Å; V18-I20 VanDerWaalsContact O-N 3.1Å; I20-V22 HydrophobicContact CG2-CG2 4.4Å; I20-V22 PolarHBondContact O-N 3.48Å
21	V	28.9	Very low	39.2	Very low	132 Å²	132	114.3 Å²	114.3	80%	0.8	68%	0.678	S	S	*	*			trans	-66.2	91.7	163.2	177.9	0	0	0	0	106.1	P19 G23	P19-V21 PolarHBondContact O-N 2.76Å; V21-G23 PolarHBondContact O-N 3.05Å
22	V	31.8	Very low	41.7	Very low	119 Å²	119	113.8 Å²	113.8	72%	0.721	68%	0.676	S	S	*	*			trans	-60.4	118.4	157.6	178.3	0	0	0	0	104.7	I20 S24	I20-V22 HydrophobicContact CG2-CG2 4.4Å; I20-V22 PolarHBondContact O-N 3.48Å; V22-S24 PolarHBondContact O-N 3.09Å
23	G	31.5	Very low	44.3	Very low	63 Å²	63	110.2 Å²	110.2	65%	0.649	65%	0.654	S	S	*	*			trans	-46.9	113.2	174.9	0	0	0	0	0	109	V21 L25	V21-G23 PolarHBondContact O-N 3.05Å; G23-L25 PolarHBondContact O-N 2.99Å; G23-L25 VanDerWaalsContact O-N 3.12Å
24	S	37.9	Very low	47.1	Very low	107 Å²	107	106 Å²	106	75%	0.748	65%	0.646	S	S	*	*			trans	-61.8	114.7	179.1	49.7	0	0	0	0	108.1	V22	V22-S24 PolarHBondContact O-N 3.09Å
25	L	46.3	Very low	50	Low	146 Å²	146	102.7 Å²	102.7	76%	0.764	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-47	135.7	156.1	-84.5	149.1	0	0	0	107.6	G23	G23-L25 PolarHBondContact O-N 2.99Å; G23-L25 VanDerWaalsContact O-N 3.12Å
26	P	48.5	Very low	53.2	Low	57 Å²	57	99.5 Å²	99.5	37%	0.37	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-53.7	137.5	177	20	-29.3	0	0	0	109.3	A28 P45	P26-A28 PolarHBondContact O-N 3.44Å; P26-P45 HydrophobicContact CG-CG 4.01Å
27	P	54.1	Low	56	Low	114 Å²	114	97.1 Å²	97.1	74%	0.74	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-62	125.4	-176.8	23.9	-31.7	0	0	0	109.6	L29	P27-L29 PolarHBondContact O-N 2.88Å
28	A	59.6	Low	59	Low	44 Å²	44	98.5 Å²	98.5	36%	0.364	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-60.5	129.8	174.5	0	0	0	0	0	109.7	P26 Q42	P26-A28 PolarHBondContact O-N 3.44Å; A28-Q42 HydrophobicContact CB-CG 4.44Å; A28-Q42 VanDerWaalsContact CB-OE1 3.23Å
29	L	65.3	Low	62.1	Low	96 Å²	96	93.8 Å²	93.8	50%	0.503	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.4	-179.3	-69.8	168	0	0	0	109.8	P27 W31 Q42 I43	P27-L29 PolarHBondContact O-N 2.88Å; L29-W31 PolarHBondContact O-N 3.43Å; L29-Q42 WeakPolarHBondContact O-CA 3.49Å; L29-Q42 WeakPolarHBondContact O-CB 3.41Å; L29-I43 HydrophobicContact CB-CB 4.36Å; L29-I43 PolarHBondContact N-O 2.84Å; L29-I43 PolarHBondContact O-N 2.95Å
30	P	70.1	Confident	64.9	Low	75 Å²	75	92 Å²	92	49%	0.487	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	130	177.1	22.1	-29.6	0	0	0	110.6	Y32	P30-Y32 HydrophobicContact CB-CE2 4.36Å; P30-Y32 HydrophobicContact CG-CE2 4.11Å
31	W	78.8	Confident	68	Low	43 Å²	43	85.7 Å²	85.7	16%	0.163	50%	0.498	C	S	.	.			trans	-98	105.3	177.5	-173.7	37.1	0	0	0	109.2	L29 V33 C41 I43 P57 V59 P74 N76	L29-W31 PolarHBondContact O-N 3.43Å; W31-V33 VanDerWaalsContact C-N 3.29Å; W31-V33 HydrophobicContact CD2-CB 4.36Å; W31-V33 HydrophobicContact CD2-CG1 3.95Å; W31-V33 HydrophobicContact CD2-CG2 3.47Å; W31-V33 VanDerWaalsContact CD2-CG2 3.47Å; W31-V33 VanDerWaalsContact CE2-CG1 3.43Å; W31-V33 HydrophobicContact CE3-CG2 3.44Å; W31-V33 VanDerWaalsContact CE3-CG2 3.44Å; W31-V33 HydrophobicContact CG-CG1 4.31Å; W31-V33 HydrophobicContact CG-CG2 4.07Å; W31-V33 HydrophobicContact CH2-CG1 4.4Å; W31-V33 HydrophobicContact CH2-CG2 4.03Å; W31-V33 HydrophobicContact CZ2-CB 4.45Å; W31-V33 HydrophobicContact CZ2-CG1 3.69Å; W31-V33 HydrophobicContact CZ2-CG2 4.06Å; W31-V33 HydrophobicContact CZ3-CG2 3.73Å; W31-V33 PolarHBondContact O-N 2.82Å; W31-C41 HydrophobicContact CE3-CB 4.03Å; W31-C41 PolarHBondContact N-O 2.97Å; W31-I43 HydrophobicContact CB-CG1 4.45Å; W31-P57 HydrophobicContact CD2-CB 4.13Å; W31-P57 HydrophobicContact CE3-CB 4.03Å; W31-P57 HydrophobicContact CH2-CB 3.84Å; W31-P57 HydrophobicContact CZ2-CB 3.92Å; W31-P57 HydrophobicContact CZ3-CB 3.9Å; W31-V59 HydrophobicContact CZ3-CG2 4.15Å; W31-P74 HydrophobicContact CH2-CB 3.5Å; W31-P74 VanDerWaalsContact CH2-CB 3.5Å; W31-P74 HydrophobicContact CH2-CG 4.21Å; W31-P74 HydrophobicContact CZ2-CB 4.38Å; W31-P74 HydrophobicContact CZ3-CB 3.81Å; W31-P74 HydrophobicContact CZ3-CG 4.01Å; W31-N76 HydrophobicContact CH2-CB 4.16Å; W31-N76 HydrophobicContact CZ2-CB 3.84Å
32	Y	76.7	Confident	70.9	Confident	210 Å²	210	81.3 Å²	81.3	82%	0.824	47%	0.469	S	S	*	.			trans	-76.1	75.1	-174.9	-63.4	-83.5	0	0	0	112	P30	P30-Y32 HydrophobicContact CB-CE2 4.36Å; P30-Y32 HydrophobicContact CG-CE2 4.11Å
33	V	83.6	Confident	73.6	Confident	44 Å²	44	77.9 Å²	77.9	27%	0.267	45%	0.446	S	S	.	.	S	Bend	trans	-131.3	157.2	174.6	-65.9	0	0	0	0	111	W31 C35 C41 P74	W31-V33 VanDerWaalsContact C-N 3.29Å; W31-V33 HydrophobicContact CD2-CB 4.36Å; W31-V33 HydrophobicContact CD2-CG1 3.95Å; W31-V33 HydrophobicContact CD2-CG2 3.47Å; W31-V33 VanDerWaalsContact CD2-CG2 3.47Å; W31-V33 VanDerWaalsContact CE2-CG1 3.43Å; W31-V33 HydrophobicContact CE3-CG2 3.44Å; W31-V33 VanDerWaalsContact CE3-CG2 3.44Å; W31-V33 HydrophobicContact CG-CG1 4.31Å; W31-V33 HydrophobicContact CG-CG2 4.07Å; W31-V33 HydrophobicContact CH2-CG1 4.4Å; W31-V33 HydrophobicContact CH2-CG2 4.03Å; W31-V33 HydrophobicContact CZ2-CB 4.45Å; W31-V33 HydrophobicContact CZ2-CG1 3.69Å; W31-V33 HydrophobicContact CZ2-CG2 4.06Å; W31-V33 HydrophobicContact CZ3-CG2 3.73Å; W31-V33 PolarHBondContact O-N 2.82Å; V33-C35 PolarHBondContact O-N 2.95Å; V33-C41 HydrophobicContact CG2-CB 4.12Å; V33-P74 HydrophobicContact CB-CB 4.49Å; V33-P74 HydrophobicContact CB-CG 4.4Å; V33-P74 HydrophobicContact CG2-CB 4.1Å; V33-P74 HydrophobicContact CG2-CG 3.72Å
34	P	84.8	Confident	76.2	Confident	109 Å²	109	76.9 Å²	76.9	71%	0.708	42%	0.424	S	S	*	.			trans	-57.6	105	170.2	-22.4	33.5	0	0	0	110.4	P74	P34-P74 WeakPolarHBondContact O-CG 3.33Å
35	C	90.1	Very high	78.5	Confident	42 Å²	42	74 Å²	74	28%	0.284	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-94	144.4	-176.4	-161.4	0	0	0	0	110.7	V33 C41	V33-C35 PolarHBondContact O-N 2.95Å; C35-C41 VanDerWaalsContact CA-SG 3.5Å; C35-C41 HydrophobicContact CB-CB 3.76Å; C35-C41 WeakPolarHBondContact CB-SG 3.42Å; C35-C41 WeakPolarHBondContact SG-CB 3.36Å; C35-C41 PolarHBondContact SG-N 3.47Å; C35-C41 CovalentContact SG-SG 2.04Å; C35-C41 PolarHBondContact SG-SG 3.38Å
36	P	91.9	Very high	80.5	Confident	3 Å²	3	69 Å²	69	2%	0.019	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-57.4	144.8	173.9	-17.2	25	0	0	0	111.8	R38 C39 V59 P70 P72	P36-R38 PolarHBondContact O-N 3.19Å; P36-C39 HydrophobicContact CB-CB 4.17Å; P36-C39 HydrophobicContact CG-CB 4.42Å; P36-C39 WeakPolarHBondContact O-CB 3.24Å; P36-C39 PolarHBondContact O-N 3.13Å; P36-V59 HydrophobicContact CG-CG1 4.21Å; P36-P70 HydrophobicContact CB-CB 3.75Å; P36-P70 HydrophobicContact CB-CG 4.27Å; P36-P70 HydrophobicContact CG-CB 4.48Å; P36-P72 WeakPolarHBondContact CG-O 3.24Å
37	V	85.5	Confident	82.1	Confident	125 Å²	125	72 Å²	72	76%	0.758	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	129.7	-176.8	178.7	0	0	0	0	110.2	C39	V37-C39 PolarHBondContact O-N 3.46Å
38	R	88.4	Confident	83.6	Confident	162 Å²	162	67.3 Å²	67.3	61%	0.611	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	-4.6	-175.3	-56.7	165.6	65.8	-153.9	-5.5	116	P36 L64	P36-R38 PolarHBondContact O-N 3.19Å; R38-L64 HydrophobicContact CB-CD1 4.02Å; R38-L64 HydrophobicContact CB-CD2 4.06Å; R38-L64 PolarHBondContact NH1-O 2.83Å; R38-L64 PolarHBondContact NH2-O 2.75Å; R38-L64 VanDerWaalsContact NH2-O 3.16Å; R38-L64 WeakPolarHBondContact O-CD1 3.44Å
39	C	91.6	Very high	84.6	Confident	16 Å²	16	65.7 Å²	65.7	11%	0.108	34%	0.337	C	S	.	.			trans	-88.3	164.5	172	-59.2	0	0	0	0	111.7	P36 V37 V59 D60 C61	P36-C39 HydrophobicContact CB-CB 4.17Å; P36-C39 HydrophobicContact CG-CB 4.42Å; P36-C39 WeakPolarHBondContact O-CB 3.24Å; P36-C39 PolarHBondContact O-N 3.13Å; V37-C39 PolarHBondContact O-N 3.46Å; C39-V59 HydrophobicContact CB-CG1 4.49Å; C39-D60 CarbonylContact C-O 3.17Å; C39-D60 WeakPolarHBondContact CA-O 3.42Å; C39-D60 WeakPolarHBondContact CB-O 3.3Å; C39-C61 HydrophobicContact CB-CB 4.14Å; C39-C61 WeakPolarHBondContact CB-SG 3.42Å; C39-C61 WeakPolarHBondContact SG-CB 3.48Å; C39-C61 CovalentContact SG-SG 2.03Å; C39-C61 PolarHBondContact SG-SG 2.9Å
40	V	90.9	Very high	85.4	Confident	78 Å²	78	66.1 Å²	66.1	47%	0.473	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.7	176.4	-177.8	0	0	0	0	109.5	Q42 D60	V40-Q42 HydrophobicContact CG1-CG 4.41Å; V40-D60 PolarHBondContact N-O 2.79Å; V40-D60 PolarHBondContact O-N 2.82Å
41	C	91.6	Very high	86.1	Confident	15 Å²	15	66.2 Å²	66.2	10%	0.101	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.9	179.1	-64.2	0	0	0	0	109.7	W31 V33 C35 T58	W31-C41 HydrophobicContact CE3-CB 4.03Å; W31-C41 PolarHBondContact N-O 2.97Å; V33-C41 HydrophobicContact CG2-CB 4.12Å; C35-C41 VanDerWaalsContact CA-SG 3.5Å; C35-C41 HydrophobicContact CB-CB 3.76Å; C35-C41 WeakPolarHBondContact CB-SG 3.42Å; C35-C41 WeakPolarHBondContact SG-CB 3.36Å; C35-C41 PolarHBondContact SG-N 3.47Å; C35-C41 CovalentContact SG-SG 2.04Å; C35-C41 PolarHBondContact SG-SG 3.38Å; C41-T58 WeakPolarHBondContact CA-O 3.07Å
42	Q	90.9	Very high	86.5	Confident	40 Å²	40	67.8 Å²	67.8	19%	0.187	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	161.2	-175.3	62.1	-169.1	-33	0	0	111.4	A28 L29 V40 K44 T58	A28-Q42 HydrophobicContact CB-CG 4.44Å; A28-Q42 VanDerWaalsContact CB-OE1 3.23Å; L29-Q42 WeakPolarHBondContact O-CA 3.49Å; L29-Q42 WeakPolarHBondContact O-CB 3.41Å; V40-Q42 HydrophobicContact CG1-CG 4.41Å; Q42-K44 VanDerWaalsContact CD-CE 3.47Å; Q42-K44 HydrophobicContact CG-CD 4.45Å; Q42-K44 HydrophobicContact CG-CG 3.85Å; Q42-T58 PolarHBondContact N-O 2.91Å; Q42-T58 WeakPolarHBondContact O-CA 3.4Å; Q42-T58 WeakPolarHBondContact O-CB 3.45Å; Q42-T58 PolarHBondContact O-N 2.86Å
43	I	88.7	Confident	87.1	Confident	47 Å²	47	62.5 Å²	62.5	24%	0.241	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	121.1	170.8	-60.9	174.1	0	0	0	107.5	L29 W31 E55 A56	L29-I43 HydrophobicContact CB-CB 4.36Å; L29-I43 PolarHBondContact N-O 2.84Å; L29-I43 PolarHBondContact O-N 2.95Å; W31-I43 HydrophobicContact CB-CG1 4.45Å; I43-E55 HydrophobicContact CG2-CB 3.71Å; I43-E55 HydrophobicContact CG2-CG 4.48Å; I43-A56 WeakPolarHBondContact CA-O 3.48Å
44	K	86.1	Confident	87.3	Confident	42 Å²	42	64.3 Å²	64.3	18%	0.183	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	155	177.2	-68.6	-163.2	175.5	178.5	0	111.2	Q42 W46 E55 A56 T58 D60	Q42-K44 VanDerWaalsContact CD-CE 3.47Å; Q42-K44 HydrophobicContact CG-CD 4.45Å; Q42-K44 HydrophobicContact CG-CG 3.85Å; K44-W46 PolarHBondContact O-N 2.85Å; K44-E55 WeakPolarHBondContact O-CA 3.25Å; K44-A56 PolarHBondContact N-O 3.48Å; K44-A56 VanDerWaalsContact N-O 3.08Å; K44-A56 PolarHBondContact O-N 2.8Å; K44-T58 HydrophobicContact CD-CG2 4.2Å; K44-T58 HydrophobicContact CG-CG2 4.46Å; K44-D60 IonicContact NZ-OD2 2.72Å; K44-D60 PolarHBondContact NZ-OD2 3.38Å
45	P	85.6	Confident	87.5	Confident	47 Å²	47	64.4 Å²	64.4	31%	0.305	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.8	130.4	160.5	-28.9	38	0	0	0	111.2	P26 Y53 H54	P26-P45 HydrophobicContact CG-CG 4.01Å; P45-Y53 HydrophobicContact CB-CE2 3.74Å; P45-Y53 HydrophobicContact CG-CE2 4.19Å; P45-H54 WeakPolarHBondContact CA-O 3.37Å
46	W	87.4	Confident	87.6	Confident	40 Å²	40	62.6 Å²	62.6	15%	0.152	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	144.2	173.2	174.3	78.8	0	0	0	108.4	K44 H54 A56 H78	K44-W46 PolarHBondContact O-N 2.85Å; W46-H54 HydrophobicContact CE3-CB 3.81Å; W46-H54 AromaticContact CE3-CD2 3.91Å; W46-H54 HydrophobicContact CZ3-CB 4.33Å; W46-H54 AromaticContact CZ3-CD2 3.69Å; W46-H54 PolarHBondContact N-O 3.48Å; W46-H54 CarbonylContact O-C 3.53Å; W46-H54 WeakPolarHBondContact O-CA 3.23Å; W46-H54 PolarHBondContact O-N 3.24Å; W46-A56 HydrophobicContact CB-CB 3.65Å; W46-A56 HydrophobicContact CG-CB 4.16Å; W46-H78 AromaticContact CD2-CE1 3.53Å; W46-H78 AromaticContact CE2-CE1 3.56Å; W46-H78 AromaticContact CE3-CE1 3.73Å; W46-H78 AromaticContact CZ2-CE1 3.82Å
47	F	83.6	Confident	87.7	Confident	120 Å²	120	64.1 Å²	64.1	53%	0.526	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.8	175.7	-66.5	-91.1	0	0	0	108.6	V52 Y53	F47-V52 VanDerWaalsContact CA-O 3.28Å; F47-V52 WeakPolarHBondContact CA-O 3.2Å; F47-Y53 HydrophobicContact CE1-CD2 4Å; F47-Y53 HydrophobicContact CE1-CG 4.47Å; F47-Y53 AromaticContact CZ-CD2 3.9Å; F47-Y53 HydrophobicContact CZ-CD2 3.9Å
48	S	83.8	Confident	88.1	Confident	15 Å²	15	58.4 Å²	58.4	11%	0.105	30%	0.295	C	S	.	.			trans	-64.8	163.9	172.2	68.8	0	0	0	0	110.9	D50 S51 V52	S48-D50 PolarHBondContact O-N 3.05Å; S48-D50 VanDerWaalsContact O-N 3.08Å; S48-D50 PolarHBondContact OG-N 2.64Å; S48-S51 WeakPolarHBondContact O-CA 3.36Å; S48-S51 PolarHBondContact O-N 2.86Å; S48-V52 PolarHBondContact N-O 3.05Å; S48-V52 WeakPolarHBondContact OG-CB 3.37Å; S48-V52 PolarHBondContact OG-N 3.03Å
49	P	80.6	Confident	88.4	Confident	10 Å²	10	50.7 Å²	50.7	7%	0.065	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-28.2	172.2	-29.3	37.5	0	0	0	113.2	S51 L127 Q151 E152 R176	P49-S51 PolarHBondContact O-N 3.39Å; P49-L127 HydrophobicContact CG-CB 4.47Å; P49-Q151 HydrophobicContact CB-CB 4.24Å; P49-Q151 VanDerWaalsContact CB-OE1 3.27Å; P49-Q151 HydrophobicContact CG-CB 4.19Å; P49-E152 HydrophobicContact CB-CG 4.22Å; P49-E152 HydrophobicContact CG-CG 4.49Å; P49-R176 PolarHBondContact O-NH1 3.31Å; P49-R176 PolarHBondContact O-NH2 3.04Å
50	D	83.6	Confident	88.5	Confident	105 Å²	105	51.3 Å²	51.3	56%	0.561	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	11	173.4	-59.4	-47.1	0	0	0	113.6	S48 V52	S48-D50 PolarHBondContact O-N 3.05Å; S48-D50 VanDerWaalsContact O-N 3.08Å; S48-D50 PolarHBondContact OG-N 2.64Å; D50-V52 VanDerWaalsContact C-N 3.26Å; D50-V52 HydrophobicContact CB-CG2 4.24Å; D50-V52 PolarHBondContact O-N 3.17Å
51	S	84.1	Confident	88.7	Confident	78 Å²	78	47.6 Å²	47.6	55%	0.545	25%	0.245	S	C	.	.			trans	61.3	26.9	-179.1	-54.2	0	0	0	0	114.4	S48 P49 R176	S48-S51 WeakPolarHBondContact O-CA 3.36Å; S48-S51 PolarHBondContact O-N 2.86Å; P49-S51 PolarHBondContact O-N 3.39Å; S51-R176 PolarHBondContact OG-NH2 2.85Å
52	V	87	Confident	88.7	Confident	75 Å²	75	48.2 Å²	48.2	46%	0.455	25%	0.248	S	C	.	.			trans	-89.2	133.3	177.5	-176.7	0	0	0	0	110.1	F47 S48 D50 H54	F47-V52 VanDerWaalsContact CA-O 3.28Å; F47-V52 WeakPolarHBondContact CA-O 3.2Å; S48-V52 PolarHBondContact N-O 3.05Å; S48-V52 WeakPolarHBondContact OG-CB 3.37Å; S48-V52 PolarHBondContact OG-N 3.03Å; D50-V52 VanDerWaalsContact C-N 3.26Å; D50-V52 HydrophobicContact CB-CG2 4.24Å; D50-V52 PolarHBondContact O-N 3.17Å; V52-H54 PolarHBondContact O-CD2 3.07Å
53	Y	88.6	Confident	88.7	Confident	100 Å²	100	52 Å²	52	39%	0.392	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	133.8	178.3	176.5	-85.1	0	0	0	111.9	P45 F47 E55	P45-Y53 HydrophobicContact CB-CE2 3.74Å; P45-Y53 HydrophobicContact CG-CE2 4.19Å; F47-Y53 HydrophobicContact CE1-CD2 4Å; F47-Y53 HydrophobicContact CE1-CG 4.47Å; F47-Y53 AromaticContact CZ-CD2 3.9Å; F47-Y53 HydrophobicContact CZ-CD2 3.9Å; Y53-E55 HydrophobicContact CE1-CG 4.11Å; Y53-E55 PolarHBondContact OH-OE1 3.44Å
54	H	88.4	Confident	88.7	Confident	81 Å²	81	50.9 Å²	50.9	38%	0.375	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	173.8	173.6	-61.5	-76.7	0	0	0	110.4	P45 W46 V52	P45-H54 WeakPolarHBondContact CA-O 3.37Å; W46-H54 HydrophobicContact CE3-CB 3.81Å; W46-H54 AromaticContact CE3-CD2 3.91Å; W46-H54 HydrophobicContact CZ3-CB 4.33Å; W46-H54 AromaticContact CZ3-CD2 3.69Å; W46-H54 PolarHBondContact N-O 3.48Å; W46-H54 CarbonylContact O-C 3.53Å; W46-H54 WeakPolarHBondContact O-CA 3.23Å; W46-H54 PolarHBondContact O-N 3.24Å; V52-H54 PolarHBondContact O-CD2 3.07Å
55	E	89.4	Confident	89	Confident	112 Å²	112	54.8 Å²	54.8	52%	0.523	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.7	171.3	-68.7	-176	169.7	0	0	109.5	I43 K44 Y53	I43-E55 HydrophobicContact CG2-CB 3.71Å; I43-E55 HydrophobicContact CG2-CG 4.48Å; K44-E55 WeakPolarHBondContact O-CA 3.25Å; Y53-E55 HydrophobicContact CE1-CG 4.11Å; Y53-E55 PolarHBondContact OH-OE1 3.44Å
56	A	90.9	Very high	89.4	Confident	3 Å²	3	53.8 Å²	53.8	3%	0.025	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	137.7	-171.4	0	0	0	0	0	113	I43 K44 W46 T58 H78	I43-A56 WeakPolarHBondContact CA-O 3.48Å; K44-A56 PolarHBondContact N-O 3.48Å; K44-A56 VanDerWaalsContact N-O 3.08Å; K44-A56 PolarHBondContact O-N 2.8Å; W46-A56 HydrophobicContact CB-CB 3.65Å; W46-A56 HydrophobicContact CG-CB 4.16Å; A56-T58 PolarHBondContact O-N 2.86Å; A56-T58 VanDerWaalsContact O-N 3.1Å; A56-T58 PolarHBondContact O-OG1 2.9Å; A56-T58 VanDerWaalsContact O-OG1 3.07Å; A56-H78 HydrophobicContact CB-CB 4.12Å; A56-H78 WeakPolarHBondContact CB-ND1 3.23Å
57	P	94.5	Very high	89.7	Confident	36 Å²	36	56 Å²	56	23%	0.234	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	112.1	168.6	-21.6	32.2	0	0	0	111.2	W31 N76 H78 T79	W31-P57 HydrophobicContact CD2-CB 4.13Å; W31-P57 HydrophobicContact CE3-CB 4.03Å; W31-P57 HydrophobicContact CH2-CB 3.84Å; W31-P57 HydrophobicContact CZ2-CB 3.92Å; W31-P57 HydrophobicContact CZ3-CB 3.9Å; P57-N76 WeakPolarHBondContact CB-O 3.17Å; P57-H78 PolarHBondContact O-N 2.95Å; P57-T79 PolarHBondContact O-N 3.3Å; P57-T79 VanDerWaalsContact O-N 3.09Å
58	T	94.2	Very high	90.1	Very high	4 Å²	4	58 Å²	58	3%	0.025	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.4	-173.5	-58	0	0	0	0	111	C41 Q42 K44 A56 T79 R81	C41-T58 WeakPolarHBondContact CA-O 3.07Å; Q42-T58 PolarHBondContact N-O 2.91Å; Q42-T58 WeakPolarHBondContact O-CA 3.4Å; Q42-T58 WeakPolarHBondContact O-CB 3.45Å; Q42-T58 PolarHBondContact O-N 2.86Å; K44-T58 HydrophobicContact CD-CG2 4.2Å; K44-T58 HydrophobicContact CG-CG2 4.46Å; A56-T58 PolarHBondContact O-N 2.86Å; A56-T58 VanDerWaalsContact O-N 3.1Å; A56-T58 PolarHBondContact O-OG1 2.9Å; A56-T58 VanDerWaalsContact O-OG1 3.07Å; T58-T79 WeakPolarHBondContact CA-O 3.4Å; T58-T79 HydrophobicContact CG2-CG2 3.97Å; T58-R81 HydrophobicContact CG2-CG 4.21Å
59	V	95.7	Very high	90.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111.1	168.7	179.9	0	0	0	0	107.9	W31 P36 C39 P74 T77 T79 L80 R81	W31-V59 HydrophobicContact CZ3-CG2 4.15Å; P36-V59 HydrophobicContact CG-CG1 4.21Å; C39-V59 HydrophobicContact CB-CG1 4.49Å; V59-P74 HydrophobicContact CG2-CG 4.23Å; V59-T77 HydrophobicContact CB-CG2 4.11Å; V59-T77 HydrophobicContact CG2-CG2 3.62Å; V59-T77 VanDerWaalsContact CG2-OG1 3.28Å; V59-T77 WeakPolarHBondContact CG2-OG1 3.29Å; V59-T79 PolarHBondContact N-O 3.04Å; V59-L80 HydrophobicContact CB-CD1 3.89Å; V59-L80 HydrophobicContact CG1-CD1 3.88Å; V59-R81 PolarHBondContact O-N 3.38Å
60	D	93.8	Very high	91	Very high	29 Å²	29	58.6 Å²	58.6	16%	0.155	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	110.8	-176.3	-164.8	-27.4	0	0	0	110.6	C39 V40 K44 N62	C39-D60 CarbonylContact C-O 3.17Å; C39-D60 WeakPolarHBondContact CA-O 3.42Å; C39-D60 WeakPolarHBondContact CB-O 3.3Å; V40-D60 PolarHBondContact N-O 2.79Å; V40-D60 PolarHBondContact O-N 2.82Å; K44-D60 IonicContact NZ-OD2 2.72Å; K44-D60 PolarHBondContact NZ-OD2 3.38Å; D60-N62 WeakPolarHBondContact OD1-CB 3.3Å; D60-N62 PolarHBondContact OD1-N 3.32Å; D60-N62 PolarHBondContact OD1-ND2 2.8Å; D60-N62 VanDerWaalsContact OD1-ND2 3.1Å
61	C	94.8	Very high	91.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.			trans	-123.5	28.7	-177.3	-63.2	0	0	0	0	111.6	C39 L64 L66 P70 R81 L82 N85	C39-C61 HydrophobicContact CB-CB 4.14Å; C39-C61 WeakPolarHBondContact CB-SG 3.42Å; C39-C61 WeakPolarHBondContact SG-CB 3.48Å; C39-C61 CovalentContact SG-SG 2.03Å; C39-C61 PolarHBondContact SG-SG 2.9Å; C61-L64 HydrophobicContact CB-CD1 4.08Å; C61-L66 HydrophobicContact CB-CD1 3.97Å; C61-P70 HydrophobicContact CB-CG 4.22Å; C61-P70 WeakPolarHBondContact SG-CG 3.49Å; C61-R81 CarbonylContact C-O 3.07Å; C61-R81 WeakPolarHBondContact CA-O 3.42Å; C61-R81 WeakPolarHBondContact CB-O 3.28Å; C61-R81 PolarHBondContact N-O 2.94Å; C61-L82 HydrophobicContact CB-CD2 3.71Å; C61-N85 PolarHBondContact O-ND2 2.86Å
62	N	90.3	Very high	91.8	Very high	29 Å²	29	59.4 Å²	59.4	16%	0.155	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	148.2	-176.2	-65.1	-18.6	0	0	0	112.3	D60 L64 R81 L82 Q83	D60-N62 WeakPolarHBondContact OD1-CB 3.3Å; D60-N62 PolarHBondContact OD1-N 3.32Å; D60-N62 PolarHBondContact OD1-ND2 2.8Å; D60-N62 VanDerWaalsContact OD1-ND2 3.1Å; N62-L64 VanDerWaalsContact C-N 3.33Å; N62-L64 WeakPolarHBondContact O-CG 3.4Å; N62-L64 PolarHBondContact O-N 3.35Å; N62-R81 WeakPolarHBondContact OD1-CB 3.15Å; N62-R81 PolarHBondContact OD1-O 2.94Å; N62-L82 PolarHBondContact OD1-N 2.89Å; N62-Q83 VanDerWaalsContact CA-O 3.26Å; N62-Q83 WeakPolarHBondContact CA-O 3.32Å; N62-Q83 HydrophobicContact CB-CB 4.47Å; N62-Q83 WeakPolarHBondContact OD1-CB 3.4Å; N62-Q83 PolarHBondContact OD1-N 2.89Å
63	N	91.4	Very high	92.1	Very high	118 Å²	118	56.7 Å²	56.7	63%	0.631	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	35.2	173	-76.3	-50.7	0	0	0	115.5	Q83 S84	N63-Q83 PolarHBondContact N-O 3.01Å; N63-S84 WeakPolarHBondContact CA-O 3.22Å; N63-S84 WeakPolarHBondContact OD1-CB 3.44Å
64	L	88.9	Confident	92.4	Very high	24 Å²	24	52.6 Å²	52.6	13%	0.126	28%	0.278	C	S	.	.	S	Bend	trans	-104.1	1.4	-176.7	-67.3	-178.7	0	0	0	114.1	R38 C61 N62 L66 N85	R38-L64 HydrophobicContact CB-CD1 4.02Å; R38-L64 HydrophobicContact CB-CD2 4.06Å; R38-L64 PolarHBondContact NH1-O 2.83Å; R38-L64 PolarHBondContact NH2-O 2.75Å; R38-L64 VanDerWaalsContact NH2-O 3.16Å; R38-L64 WeakPolarHBondContact O-CD1 3.44Å; C61-L64 HydrophobicContact CB-CD1 4.08Å; N62-L64 VanDerWaalsContact C-N 3.33Å; N62-L64 WeakPolarHBondContact O-CG 3.4Å; N62-L64 PolarHBondContact O-N 3.35Å; L64-L66 VanDerWaalsContact C-N 3.25Å; L64-L66 HydrophobicContact CB-CD1 4.15Å; L64-L66 HydrophobicContact CB-CD2 3.99Å; L64-L66 HydrophobicContact CB-CG 3.72Å; L64-L66 HydrophobicContact CD1-CD1 4.4Å; L64-L66 PolarHBondContact O-N 2.96Å; L64-N85 PolarHBondContact N-OD1 2.94Å
65	L	92.8	Very high	92.6	Very high	124 Å²	124	54.5 Å²	54.5	65%	0.649	29%	0.29	S	S	*	.			trans	60.1	33.7	-174.7	-55.3	170.9	0	0	0	112.5	N85 L86	L65-N85 PolarHBondContact N-OD1 3.06Å; L65-L86 HydrophobicContact CB-CD1 4.19Å; L65-L86 HydrophobicContact CD2-CD1 4.29Å; L65-L86 HydrophobicContact CD2-CG 4.41Å
66	L	92.6	Very high	92.7	Very high	26 Å²	26	53.8 Å²	53.8	14%	0.136	29%	0.29	C	S	.	.			trans	-69	133.2	-177.2	-59.1	174.7	0	0	0	111	C61 L64 P70 L82 N85 L86 L87	C61-L66 HydrophobicContact CB-CD1 3.97Å; L64-L66 VanDerWaalsContact C-N 3.25Å; L64-L66 HydrophobicContact CB-CD1 4.15Å; L64-L66 HydrophobicContact CB-CD2 3.99Å; L64-L66 HydrophobicContact CB-CG 3.72Å; L64-L66 HydrophobicContact CD1-CD1 4.4Å; L64-L66 PolarHBondContact O-N 2.96Å; L66-P70 HydrophobicContact CD1-CB 4.36Å; L66-P70 HydrophobicContact CD1-CG 4Å; L66-L82 HydrophobicContact CD1-CD2 3.97Å; L66-N85 HydrophobicContact CB-CB 4.2Å; L66-N85 PolarHBondContact N-OD1 3.06Å; L66-L86 CarbonylContact O-C 3.42Å; L66-L86 VanDerWaalsContact O-C 3.23Å; L66-L86 VanDerWaalsContact O-CA 3.28Å; L66-L86 WeakPolarHBondContact O-CA 3.42Å; L66-L86 WeakPolarHBondContact O-CB 3.33Å; L66-L86 PolarHBondContact O-N 3.02Å; L66-L87 HydrophobicContact CB-CD2 4.26Å; L66-L87 PolarHBondContact O-N 3.36Å
67	T	94.3	Very high	93	Very high	88 Å²	88	53.7 Å²	53.7	54%	0.54	29%	0.289	S	S	.	.	S	Bend	trans	-104	-12.2	172.3	53.9	0	0	0	0	112.7	L86 L87	T67-L86 HydrophobicContact CG2-CB 4.04Å; T67-L86 HydrophobicContact CG2-CD1 4.47Å; T67-L87 VanDerWaalsContact C-CD2 3.45Å
68	K	92.7	Very high	93	Very high	161 Å²	161	53.6 Å²	53.6	70%	0.7	29%	0.285	S	S	*	.	S	Bend	trans	-142.4	164.4	177.2	-61.8	-175.4	-179.2	-177.8	0	109.7
69	L	93.3	Very high	93.1	Very high	24 Å²	24	53.8 Å²	53.8	13%	0.126	29%	0.286	C	S	.	.			trans	-60.4	137.4	174.9	-71.9	175.6	0	0	0	111.5	L82 L90 D91 V94 L95	L69-L82 HydrophobicContact CD2-CD1 3.47Å; L69-L82 VanDerWaalsContact CD2-CD1 3.47Å; L69-L90 HydrophobicContact CD1-CD1 4.11Å; L69-L90 HydrophobicContact CD2-CD1 3.81Å; L69-L90 HydrophobicContact CG-CD1 4.17Å; L69-D91 HydrophobicContact CD1-CB 4.28Å; L69-V94 HydrophobicContact CD1-CB 4.38Å; L69-L95 HydrophobicContact CD1-CD2 4.25Å; L69-L95 HydrophobicContact CD1-CG 4.23Å
70	P	90.4	Very high	93.1	Very high	14 Å²	14	53.8 Å²	53.8	9%	0.091	29%	0.286	C	S	.	.			trans	-80.8	126.1	177.3	33.1	-31.4	0	0	0	109.8	P36 C61 L66 I73 L82	P36-P70 HydrophobicContact CB-CB 3.75Å; P36-P70 HydrophobicContact CB-CG 4.27Å; P36-P70 HydrophobicContact CG-CB 4.48Å; C61-P70 HydrophobicContact CB-CG 4.22Å; C61-P70 WeakPolarHBondContact SG-CG 3.49Å; L66-P70 HydrophobicContact CD1-CB 4.36Å; L66-P70 HydrophobicContact CD1-CG 4Å; P70-I73 WeakPolarHBondContact O-CG1 3.37Å; P70-L82 HydrophobicContact CG-CD2 4.21Å
71	L	90.5	Very high	93.2	Very high	108 Å²	108	56.1 Å²	56.1	57%	0.565	29%	0.293	S	S	*	.	S	Bend	trans	-115.9	151.4	-176.3	-64.7	175.1	0	0	0	111.4	V94	L71-V94 HydrophobicContact CD2-CG1 3.66Å; L71-V94 HydrophobicContact CD2-CG2 4.36Å
72	P	92.5	Very high	93.3	Very high	91 Å²	91	56.1 Å²	56.1	59%	0.591	29%	0.293	S	S	*	.	P	Polyproline II helix	cis	-82.9	140.2	-7.3	33	-33.2	0	0	0	112.5	P36	P36-P72 WeakPolarHBondContact CG-O 3.24Å
73	I	94.3	Very high	93.5	Very high	18 Å²	18	57 Å²	57	9%	0.092	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-86.1	131.1	174.2	-54.7	174.8	0	0	0	108.8	P70 T77 L80 V94 L95 L98	P70-I73 WeakPolarHBondContact O-CG1 3.37Å; I73-T77 HydrophobicContact CG2-CG2 4.44Å; I73-L80 HydrophobicContact CD1-CD2 4.03Å; I73-V94 HydrophobicContact CD1-CG1 4.31Å; I73-L95 HydrophobicContact CD1-CD2 4.17Å; I73-L98 HydrophobicContact CB-CD1 4.38Å; I73-L98 HydrophobicContact CG2-CD1 3.78Å; I73-L98 HydrophobicContact CG2-CD2 4.31Å
74	P	94.4	Very high	93.7	Very high	14 Å²	14	52.2 Å²	52.2	9%	0.091	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-56.5	135.6	176.7	-25.8	32.7	0	0	0	113.4	W31 V33 P34 V59 N76 T77 L98	W31-P74 HydrophobicContact CH2-CB 3.5Å; W31-P74 VanDerWaalsContact CH2-CB 3.5Å; W31-P74 HydrophobicContact CH2-CG 4.21Å; W31-P74 HydrophobicContact CZ2-CB 4.38Å; W31-P74 HydrophobicContact CZ3-CB 3.81Å; W31-P74 HydrophobicContact CZ3-CG 4.01Å; V33-P74 HydrophobicContact CB-CB 4.49Å; V33-P74 HydrophobicContact CB-CG 4.4Å; V33-P74 HydrophobicContact CG2-CB 4.1Å; V33-P74 HydrophobicContact CG2-CG 3.72Å; P34-P74 WeakPolarHBondContact O-CG 3.33Å; V59-P74 HydrophobicContact CG2-CG 4.23Å; P74-N76 VanDerWaalsContact C-N 3.28Å; P74-N76 PolarHBondContact O-N 3.38Å; P74-T77 VanDerWaalsContact O-CB 3.29Å; P74-T77 WeakPolarHBondContact O-CB 3.43Å; P74-T77 PolarHBondContact O-N 3.01Å; P74-T77 VanDerWaalsContact O-N 3.13Å; P74-T77 PolarHBondContact O-OG1 2.96Å; P74-L98 WeakPolarHBondContact O-CD2 3.22Å
75	L	92.6	Very high	93.9	Very high	121 Å²	121	51.3 Å²	51.3	63%	0.634	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-33.2	-177.1	-74.2	165.5	0	0	0	114.2	T77 G97	L75-T77 PolarHBondContact O-N 2.9Å; L75-G97 WeakPolarHBondContact CD2-O 3.4Å
76	N	92.8	Very high	94.1	Very high	98 Å²	98	47.8 Å²	47.8	52%	0.524	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	16.8	-178.5	-67.1	-16	0	0	0	112.8	W31 P57 P74 H78	W31-N76 HydrophobicContact CH2-CB 4.16Å; W31-N76 HydrophobicContact CZ2-CB 3.84Å; P57-N76 WeakPolarHBondContact CB-O 3.17Å; P74-N76 VanDerWaalsContact C-N 3.28Å; P74-N76 PolarHBondContact O-N 3.38Å; N76-H78 PolarHBondContact O-N 3.17Å
77	T	95.6	Very high	94.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.243	C	C	.	.			trans	-64.2	124.5	176.8	-60.8	0	0	0	0	109.5	V59 I73 P74 L75 T79 L80 N100 L101	V59-T77 HydrophobicContact CB-CG2 4.11Å; V59-T77 HydrophobicContact CG2-CG2 3.62Å; V59-T77 VanDerWaalsContact CG2-OG1 3.28Å; V59-T77 WeakPolarHBondContact CG2-OG1 3.29Å; I73-T77 HydrophobicContact CG2-CG2 4.44Å; P74-T77 VanDerWaalsContact O-CB 3.29Å; P74-T77 WeakPolarHBondContact O-CB 3.43Å; P74-T77 PolarHBondContact O-N 3.01Å; P74-T77 VanDerWaalsContact O-N 3.13Å; P74-T77 PolarHBondContact O-OG1 2.96Å; L75-T77 PolarHBondContact O-N 2.9Å; T77-T79 WeakPolarHBondContact CG2-O 3.36Å; T77-L80 HydrophobicContact CG2-CB 4.3Å; T77-N100 CarbonylContact O-C 3.45Å; T77-L101 HydrophobicContact CG2-CD1 4.24Å; T77-L101 WeakPolarHBondContact O-CA 3.25Å; T77-L101 PolarHBondContact O-N 3.28Å
78	H	95.5	Very high	94.4	Very high	34 Å²	34	45.1 Å²	45.1	16%	0.157	24%	0.236	C	C	.	.			trans	-96.9	-42.5	175	177.3	-82.4	0	0	0	111.6	W46 A56 P57 N76 N100 T102 D103	W46-H78 AromaticContact CD2-CE1 3.53Å; W46-H78 AromaticContact CE2-CE1 3.56Å; W46-H78 AromaticContact CE3-CE1 3.73Å; W46-H78 AromaticContact CZ2-CE1 3.82Å; A56-H78 HydrophobicContact CB-CB 4.12Å; A56-H78 WeakPolarHBondContact CB-ND1 3.23Å; P57-H78 PolarHBondContact O-N 2.95Å; N76-H78 PolarHBondContact O-N 3.17Å; H78-N100 WeakPolarHBondContact CA-O 3.27Å; H78-T102 PolarHBondContact CD2-OG1 3.45Å; H78-T102 PolarHBondContact CE1-OG1 2.94Å; H78-T102 PolarHBondContact ND1-OG1 2.87Å; H78-T102 PolarHBondContact NE2-OG1 2.88Å; H78-T102 PolarHBondContact O-N 2.74Å; H78-D103 PolarHBondContact O-N 2.84Å
79	T	95.7	Very high	94.5	Very high	8 Å²	8	40.9 Å²	40.9	5%	0.049	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125.7	-179	-60.3	0	0	0	0	109.9	P57 T58 V59 T77 R81 D103	P57-T79 PolarHBondContact O-N 3.3Å; P57-T79 VanDerWaalsContact O-N 3.09Å; T58-T79 WeakPolarHBondContact CA-O 3.4Å; T58-T79 HydrophobicContact CG2-CG2 3.97Å; V59-T79 PolarHBondContact N-O 3.04Å; T77-T79 WeakPolarHBondContact CG2-O 3.36Å; T79-R81 HydrophobicContact CG2-CG 4Å; T79-D103 WeakPolarHBondContact CA-O 3.35Å; T79-D103 HydrophobicContact CG2-CB 4.15Å; T79-D103 WeakPolarHBondContact CG2-OD1 3.44Å
80	L	96.8	Very high	94.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	115.8	176.9	178.9	60	0	0	0	110	V59 I73 T77 L82 L95 L101 D103 L104 D105	V59-L80 HydrophobicContact CB-CD1 3.89Å; V59-L80 HydrophobicContact CG1-CD1 3.88Å; I73-L80 HydrophobicContact CD1-CD2 4.03Å; T77-L80 HydrophobicContact CG2-CB 4.3Å; L80-L82 HydrophobicContact CD1-CD1 4.45Å; L80-L82 HydrophobicContact CD1-CG 4.33Å; L80-L82 HydrophobicContact CD2-CD1 3.89Å; L80-L82 HydrophobicContact CG-CD1 3.93Å; L80-L82 HydrophobicContact CG-CG 4.15Å; L80-L95 HydrophobicContact CD2-CD2 3.65Å; L80-L101 HydrophobicContact CB-CD1 3.71Å; L80-D103 PolarHBondContact N-O 2.94Å; L80-L104 HydrophobicContact CB-CD1 4Å; L80-L104 HydrophobicContact CD2-CD1 3.89Å; L80-L104 HydrophobicContact CG-CD1 4.01Å; L80-D105 PolarHBondContact O-N 3.19Å
81	R	96.1	Very high	94.3	Very high	78 Å²	78	43.3 Å²	43.3	29%	0.294	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.6	-179.5	-50.5	-173.4	68.5	165.3	-3.7	111.4	T58 V59 C61 N62 T79 D105	T58-R81 HydrophobicContact CG2-CG 4.21Å; V59-R81 PolarHBondContact O-N 3.38Å; C61-R81 CarbonylContact C-O 3.07Å; C61-R81 WeakPolarHBondContact CA-O 3.42Å; C61-R81 WeakPolarHBondContact CB-O 3.28Å; C61-R81 PolarHBondContact N-O 2.94Å; N62-R81 WeakPolarHBondContact OD1-CB 3.15Å; N62-R81 PolarHBondContact OD1-O 2.94Å; T79-R81 HydrophobicContact CG2-CG 4Å; R81-D105 HydrophobicContact CB-CB 4.45Å; R81-D105 HydrophobicContact CG-CB 4.45Å; R81-D105 IonicContact NE-OD2 3.38Å; R81-D105 IonicContact NH2-OD2 2.7Å
82	L	96.3	Very high	94.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.21	C	C	.	.			trans	-129.9	25.1	-178.1	-67.3	162.2	0	0	0	111	C61 N62 L66 L69 P70 L80 N85 L87 L104 D105 L106 N109	C61-L82 HydrophobicContact CB-CD2 3.71Å; N62-L82 PolarHBondContact OD1-N 2.89Å; L66-L82 HydrophobicContact CD1-CD2 3.97Å; L69-L82 HydrophobicContact CD2-CD1 3.47Å; L69-L82 VanDerWaalsContact CD2-CD1 3.47Å; P70-L82 HydrophobicContact CG-CD2 4.21Å; L80-L82 HydrophobicContact CD1-CD1 4.45Å; L80-L82 HydrophobicContact CD1-CG 4.33Å; L80-L82 HydrophobicContact CD2-CD1 3.89Å; L80-L82 HydrophobicContact CG-CD1 3.93Å; L80-L82 HydrophobicContact CG-CG 4.15Å; L82-N85 PolarHBondContact O-ND2 3.11Å; L82-L87 HydrophobicContact CB-CD1 4.05Å; L82-L87 HydrophobicContact CD1-CD1 4.16Å; L82-L87 HydrophobicContact CG-CD1 4.49Å; L82-L104 HydrophobicContact CD1-CD1 4.38Å; L82-D105 CarbonylContact C-O 3.59Å; L82-D105 WeakPolarHBondContact CA-O 3.46Å; L82-D105 WeakPolarHBondContact CB-O 3.43Å; L82-D105 PolarHBondContact N-O 2.87Å; L82-L106 HydrophobicContact CB-CD2 4.08Å; L82-L106 HydrophobicContact CD1-CD2 3.84Å; L82-N109 PolarHBondContact O-ND2 3.46Å
83	Q	93.8	Very high	93.8	Very high	47 Å²	47	36.4 Å²	36.4	22%	0.22	20%	0.202	C	C	.	.			trans	-59.2	147.1	179.5	172.2	179.3	17.2	0	0	112	N62 N63 N85 S107	N62-Q83 VanDerWaalsContact CA-O 3.26Å; N62-Q83 WeakPolarHBondContact CA-O 3.32Å; N62-Q83 HydrophobicContact CB-CB 4.47Å; N62-Q83 WeakPolarHBondContact OD1-CB 3.4Å; N62-Q83 PolarHBondContact OD1-N 2.89Å; N63-Q83 PolarHBondContact N-O 3.01Å; Q83-N85 PolarHBondContact O-N 2.85Å; Q83-N85 PolarHBondContact O-ND2 2.82Å; Q83-S107 VanDerWaalsContact CA-O 3.28Å; Q83-S107 WeakPolarHBondContact CA-O 3.28Å; Q83-S107 WeakPolarHBondContact CB-OG 3.48Å; Q83-S107 VanDerWaalsContact CG-OG 3.25Å; Q83-S107 WeakPolarHBondContact CG-OG 3.41Å
84	S	95.1	Very high	93.6	Very high	19 Å²	19	37.6 Å²	37.6	13%	0.133	21%	0.21	C	C	.	.	S	Bend	trans	57.6	50.2	173.7	-49.1	0	0	0	0	112.7	N63 S107 Q108	N63-S84 WeakPolarHBondContact CA-O 3.22Å; N63-S84 WeakPolarHBondContact OD1-CB 3.44Å; S84-S107 PolarHBondContact N-O 2.82Å; S84-Q108 VanDerWaalsContact CA-O 3.23Å; S84-Q108 WeakPolarHBondContact CA-O 3.46Å; S84-Q108 PolarHBondContact N-O 3.15Å; S84-Q108 PolarHBondContact OG-OE1 3.11Å
85	N	94.8	Very high	93.5	Very high	5 Å²	5	37 Å²	37	3%	0.027	21%	0.206	C	C	.	.	S	Bend	trans	-120.8	-169.9	176.8	-80.2	-60.6	0	0	0	110.9	C61 L64 L65 L66 L82 Q83 L87 Q108 N109	C61-N85 PolarHBondContact O-ND2 2.86Å; L64-N85 PolarHBondContact N-OD1 2.94Å; L65-N85 PolarHBondContact N-OD1 3.06Å; L66-N85 HydrophobicContact CB-CB 4.2Å; L66-N85 PolarHBondContact N-OD1 3.06Å; L82-N85 PolarHBondContact O-ND2 3.11Å; Q83-N85 PolarHBondContact O-N 2.85Å; Q83-N85 PolarHBondContact O-ND2 2.82Å; N85-L87 HydrophobicContact CB-CG 4.28Å; N85-Q108 PolarHBondContact N-O 3.37Å; N85-N109 WeakPolarHBondContact CA-OD1 3.4Å; N85-N109 WeakPolarHBondContact CB-OD1 3.47Å; N85-N109 PolarHBondContact O-OD1 3.03Å
86	L	96.4	Very high	93.3	Very high	49 Å²	49	36.4 Å²	36.4	26%	0.257	20%	0.2	S	C	.	.			trans	-112.7	24.1	-177	-52.3	-178	0	0	0	111.7	L65 L66 T67 N109	L65-L86 HydrophobicContact CB-CD1 4.19Å; L65-L86 HydrophobicContact CD2-CD1 4.29Å; L65-L86 HydrophobicContact CD2-CG 4.41Å; L66-L86 CarbonylContact O-C 3.42Å; L66-L86 VanDerWaalsContact O-C 3.23Å; L66-L86 VanDerWaalsContact O-CA 3.28Å; L66-L86 WeakPolarHBondContact O-CA 3.42Å; L66-L86 WeakPolarHBondContact O-CB 3.33Å; L66-L86 PolarHBondContact O-N 3.02Å; T67-L86 HydrophobicContact CG2-CB 4.04Å; T67-L86 HydrophobicContact CG2-CD1 4.47Å; L86-N109 PolarHBondContact N-OD1 2.89Å
87	L	96.4	Very high	93.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	20%	0.195	C	C	.	.			trans	-68.5	135.5	-177.6	-57.3	176.2	0	0	0	110.1	L66 T67 L82 N85 L106 N109 R110 F111	L66-L87 HydrophobicContact CB-CD2 4.26Å; L66-L87 PolarHBondContact O-N 3.36Å; T67-L87 VanDerWaalsContact C-CD2 3.45Å; L82-L87 HydrophobicContact CB-CD1 4.05Å; L82-L87 HydrophobicContact CD1-CD1 4.16Å; L82-L87 HydrophobicContact CG-CD1 4.49Å; N85-L87 HydrophobicContact CB-CG 4.28Å; L87-L106 HydrophobicContact CD1-CD2 4.08Å; L87-N109 HydrophobicContact CB-CB 4.34Å; L87-N109 VanDerWaalsContact CB-OD1 3.25Å; L87-N109 WeakPolarHBondContact CB-OD1 3.4Å; L87-N109 WeakPolarHBondContact CG-OD1 3.42Å; L87-N109 PolarHBondContact N-OD1 2.9Å; L87-R110 CarbonylContact O-C 3.15Å; L87-R110 WeakPolarHBondContact O-CA 3.43Å; L87-R110 WeakPolarHBondContact O-CB 3.42Å; L87-R110 PolarHBondContact O-N 2.88Å; L87-F111 HydrophobicContact CB-CE2 3.91Å; L87-F111 HydrophobicContact CB-CZ 3.72Å
88	S	95.7	Very high	93	Very high	58 Å²	58	34.2 Å²	34.2	41%	0.406	20%	0.198	S	C	.	.			trans	-127.5	-9.9	175.4	55.2	0	0	0	0	113.1	M116	S88-M116 WeakPolarHBondContact O-CB 3.01Å
89	V	94.6	Very high	92.7	Very high	71 Å²	71	36.3 Å²	36.3	43%	0.43	21%	0.214	S	C	.	.			trans	-143.3	142.3	175.5	62.9	0	0	0	0	108.9	M116	V89-M116 WeakPolarHBondContact CA-O 3.33Å; V89-M116 HydrophobicContact CB-CE 3.62Å; V89-M116 HydrophobicContact CG2-CE 3.69Å
90	L	93	Very high	92.6	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.031	23%	0.233	C	C	.	.			trans	-112.8	127.1	175.6	-168	69.5	0	0	0	108.8	L69 T92 L95 L104 L106 F111 M116 I117	L69-L90 HydrophobicContact CD1-CD1 4.11Å; L69-L90 HydrophobicContact CD2-CD1 3.81Å; L69-L90 HydrophobicContact CG-CD1 4.17Å; L90-T92 HydrophobicContact CD2-CG2 4.1Å; L90-T92 HydrophobicContact CG-CG2 4.4Å; L90-T92 PolarHBondContact O-N 2.98Å; L90-L95 HydrophobicContact CD1-CD1 4Å; L90-L95 HydrophobicContact CD2-CD1 3.74Å; L90-L95 HydrophobicContact CG-CD1 3.95Å; L90-L104 HydrophobicContact CD2-CD2 4.15Å; L90-L106 HydrophobicContact CD1-CD1 4.4Å; L90-L106 HydrophobicContact CD1-CD2 4.06Å; L90-L106 HydrophobicContact CD2-CD1 3.89Å; L90-F111 HydrophobicContact CB-CE1 4.24Å; L90-F111 HydrophobicContact CB-CZ 4.35Å; L90-M116 PolarHBondContact N-O 2.96Å; L90-I117 HydrophobicContact CD2-CG2 3.94Å
91	D	88.4	Confident	92.6	Very high	84 Å²	84	40.1 Å²	40.1	45%	0.449	23%	0.234	S	C	.	.			trans	-87.3	90.3	172.1	-172.1	-4.4	0	0	0	109.5	L69 A93 V94	L69-D91 HydrophobicContact CD1-CB 4.28Å; D91-A93 PolarHBondContact O-N 2.99Å; D91-A93 WeakPolarHBondContact OD1-CB 3.33Å; D91-A93 PolarHBondContact OD1-N 2.88Å; D91-V94 HydrophobicContact CB-CG2 4.46Å; D91-V94 PolarHBondContact O-N 3.29Å
92	T	85.3	Confident	92.6	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-14.3	-178.1	55.8	0	0	0	0	113.4	L90 V94 L95 H96 I117 S120 S121	L90-T92 HydrophobicContact CD2-CG2 4.1Å; L90-T92 HydrophobicContact CG-CG2 4.4Å; L90-T92 PolarHBondContact O-N 2.98Å; T92-V94 VanDerWaalsContact C-N 3.31Å; T92-V94 PolarHBondContact O-N 3.28Å; T92-L95 PolarHBondContact O-N 3.33Å; T92-H96 WeakPolarHBondContact O-CB 3.48Å; T92-H96 PolarHBondContact O-N 2.92Å; T92-I117 WeakPolarHBondContact CG2-O 3.17Å; T92-S120 VanDerWaalsContact OG1-CB 3.28Å; T92-S120 WeakPolarHBondContact OG1-CB 3.48Å; T92-S121 PolarHBondContact OG1-N 2.86Å
93	A	87.1	Confident	92.6	Very high	52 Å²	52	38.1 Å²	38.1	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-66.4	-36.6	177.3	0	0	0	0	0	111.3	D91	D91-A93 PolarHBondContact O-N 2.99Å; D91-A93 WeakPolarHBondContact OD1-CB 3.33Å; D91-A93 PolarHBondContact OD1-N 2.88Å
94	V	89	Confident	92.7	Very high	43 Å²	43	35.9 Å²	35.9	26%	0.261	22%	0.219	S	C	.	.	H	α-helix	trans	-65	-45.4	173.4	178	0	0	0	0	110.6	L69 L71 I73 D91 T92 G97	L69-V94 HydrophobicContact CD1-CB 4.38Å; L71-V94 HydrophobicContact CD2-CG1 3.66Å; L71-V94 HydrophobicContact CD2-CG2 4.36Å; I73-V94 HydrophobicContact CD1-CG1 4.31Å; D91-V94 HydrophobicContact CB-CG2 4.46Å; D91-V94 PolarHBondContact O-N 3.29Å; T92-V94 VanDerWaalsContact C-N 3.31Å; T92-V94 PolarHBondContact O-N 3.28Å; V94-G97 PolarHBondContact O-N 2.8Å
95	L	92.3	Very high	92.8	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-71.7	-31.1	-176.8	-59	-177.3	0	0	0	112.9	L69 I73 L80 L90 T92 G97 L98 L101 L104 L123	L69-L95 HydrophobicContact CD1-CD2 4.25Å; L69-L95 HydrophobicContact CD1-CG 4.23Å; I73-L95 HydrophobicContact CD1-CD2 4.17Å; L80-L95 HydrophobicContact CD2-CD2 3.65Å; L90-L95 HydrophobicContact CD1-CD1 4Å; L90-L95 HydrophobicContact CD2-CD1 3.74Å; L90-L95 HydrophobicContact CG-CD1 3.95Å; T92-L95 PolarHBondContact O-N 3.33Å; L95-G97 PolarHBondContact O-N 3.34Å; L95-L98 HydrophobicContact CD2-CD1 3.97Å; L95-L98 WeakPolarHBondContact O-CB 3.49Å; L95-L98 PolarHBondContact O-N 3.34Å; L95-L101 HydrophobicContact CB-CD2 4.29Å; L95-L101 HydrophobicContact CD2-CD2 4.26Å; L95-L104 HydrophobicContact CD1-CD2 3.95Å; L95-L123 HydrophobicContact CB-CD1 4.37Å; L95-L123 HydrophobicContact CB-CD2 3.76Å; L95-L123 HydrophobicContact CD1-CD1 4.42Å
96	H	89	Confident	93	Very high	109 Å²	109	35.2 Å²	35.2	51%	0.505	22%	0.215	S	C	.	.	H	α-helix	trans	-60	-25.6	173.1	176.2	-98.5	0	0	0	112.3	T92 L98 S122 L123	T92-H96 WeakPolarHBondContact O-CB 3.48Å; T92-H96 PolarHBondContact O-N 2.92Å; H96-L98 PolarHBondContact O-N 3.41Å; H96-S122 PolarHBondContact CD2-O 3.05Å; H96-L123 HydrophobicContact CB-CD2 4.24Å
97	G	88.1	Confident	93	Very high	41 Å²	41	33.3 Å²	33.3	42%	0.423	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-2.2	173.3	0	0	0	0	0	115.1	L75 V94 L95 P99	L75-G97 WeakPolarHBondContact CD2-O 3.4Å; V94-G97 PolarHBondContact O-N 2.8Å; L95-G97 PolarHBondContact O-N 3.34Å; G97-P99 VanDerWaalsContact O-CD 3.26Å; G97-P99 WeakPolarHBondContact O-CD 3.27Å
98	L	93	Very high	93	Very high	11 Å²	11	36.4 Å²	36.4	6%	0.058	22%	0.22	C	C	.	.			trans	-105.2	90.8	-178.7	-55.6	178	0	0	0	110	I73 P74 L95 H96 N100 L101	I73-L98 HydrophobicContact CB-CD1 4.38Å; I73-L98 HydrophobicContact CG2-CD1 3.78Å; I73-L98 HydrophobicContact CG2-CD2 4.31Å; P74-L98 WeakPolarHBondContact O-CD2 3.22Å; L95-L98 HydrophobicContact CD2-CD1 3.97Å; L95-L98 WeakPolarHBondContact O-CB 3.49Å; L95-L98 PolarHBondContact O-N 3.34Å; H96-L98 PolarHBondContact O-N 3.41Å; L98-N100 PolarHBondContact O-N 3.47Å; L98-L101 HydrophobicContact CB-CB 3.9Å; L98-L101 HydrophobicContact CD1-CD2 4.31Å; L98-L101 PolarHBondContact O-N 2.91Å
99	P	90.4	Very high	93.1	Very high	77 Å²	77	33.9 Å²	33.9	50%	0.5	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-25.3	-170	26.6	-35.7	0	0	0	113.8	G97 S125	G97-P99 VanDerWaalsContact O-CD 3.26Å; G97-P99 WeakPolarHBondContact O-CD 3.27Å; P99-S125 WeakPolarHBondContact O-CB 3.48Å; P99-S125 PolarHBondContact O-OG 3.06Å
100	N	93.4	Very high	93.2	Very high	83 Å²	83	37.1 Å²	37.1	44%	0.444	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	1.9	-175.7	-65.7	-0.8	0	0	0	113.4	T77 H78 L98 T102	T77-N100 CarbonylContact O-C 3.45Å; H78-N100 WeakPolarHBondContact CA-O 3.27Å; L98-N100 PolarHBondContact O-N 3.47Å; N100-T102 PolarHBondContact O-N 2.76Å
101	L	95.9	Very high	93.4	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.026	21%	0.205	C	C	.	.			trans	-71.4	111	-178.4	-176.8	73.4	0	0	0	109.9	T77 L80 L95 L98 S125 L126	T77-L101 HydrophobicContact CG2-CD1 4.24Å; T77-L101 WeakPolarHBondContact O-CA 3.25Å; T77-L101 PolarHBondContact O-N 3.28Å; L80-L101 HydrophobicContact CB-CD1 3.71Å; L95-L101 HydrophobicContact CB-CD2 4.29Å; L95-L101 HydrophobicContact CD2-CD2 4.26Å; L98-L101 HydrophobicContact CB-CB 3.9Å; L98-L101 HydrophobicContact CD1-CD2 4.31Å; L98-L101 PolarHBondContact O-N 2.91Å; L101-S125 CarbonylContact O-C 3.58Å; L101-L126 HydrophobicContact CD2-CD1 4.32Å; L101-L126 HydrophobicContact CG-CD1 4.1Å
102	T	95.8	Very high	93.8	Very high	17 Å²	17	35.1 Å²	35.1	10%	0.104	20%	0.199	C	C	.	.			trans	-113.5	-25	-179.7	61.7	0	0	0	0	112.6	H78 N100 L127 S128	H78-T102 PolarHBondContact CD2-OG1 3.45Å; H78-T102 PolarHBondContact CE1-OG1 2.94Å; H78-T102 PolarHBondContact ND1-OG1 2.87Å; H78-T102 PolarHBondContact NE2-OG1 2.88Å; H78-T102 PolarHBondContact O-N 2.74Å; N100-T102 PolarHBondContact O-N 2.76Å; T102-L127 HydrophobicContact CG2-CD1 4.21Å; T102-L127 HydrophobicContact CG2-CG 4.3Å; T102-L127 WeakPolarHBondContact O-CA 3.47Å; T102-L127 PolarHBondContact O-N 2.78Å; T102-S128 PolarHBondContact O-N 2.95Å
103	D	96.6	Very high	94.3	Very high	19 Å²	19	41.4 Å²	41.4	10%	0.102	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.2	-175.3	-171.3	-94	0	0	0	110.9	H78 T79 L80 S128 H130	H78-D103 PolarHBondContact O-N 2.84Å; T79-D103 WeakPolarHBondContact CA-O 3.35Å; T79-D103 HydrophobicContact CG2-CB 4.15Å; T79-D103 WeakPolarHBondContact CG2-OD1 3.44Å; L80-D103 PolarHBondContact N-O 2.94Å; D103-S128 VanDerWaalsContact OD2-CB 3.31Å; D103-S128 WeakPolarHBondContact OD2-CB 3.38Å; D103-S128 PolarHBondContact OD2-OG 2.93Å; D103-H130 IonicContact OD2-NE2 3.05Å
104	L	96.9	Very high	94.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	114.3	-177.2	177.6	60	0	0	0	111.1	L80 L82 L90 L95 L106 L126 S128 I129 H130	L80-L104 HydrophobicContact CB-CD1 4Å; L80-L104 HydrophobicContact CD2-CD1 3.89Å; L80-L104 HydrophobicContact CG-CD1 4.01Å; L82-L104 HydrophobicContact CD1-CD1 4.38Å; L90-L104 HydrophobicContact CD2-CD2 4.15Å; L95-L104 HydrophobicContact CD1-CD2 3.95Å; L104-L106 HydrophobicContact CD1-CD2 4.33Å; L104-L106 HydrophobicContact CD1-CG 4.18Å; L104-L106 HydrophobicContact CD2-CD1 3.86Å; L104-L106 HydrophobicContact CD2-CG 4.32Å; L104-L106 HydrophobicContact CG-CD1 4.03Å; L104-L106 HydrophobicContact CG-CG 3.96Å; L104-L126 HydrophobicContact CB-CD1 3.73Å; L104-L126 HydrophobicContact CB-CD2 4.32Å; L104-L126 HydrophobicContact CD2-CD2 4.43Å; L104-S128 PolarHBondContact N-O 2.87Å; L104-S128 VanDerWaalsContact N-O 3.1Å; L104-I129 HydrophobicContact CD2-CD1 4.38Å; L104-I129 WeakPolarHBondContact O-CA 3.36Å; L104-H130 PolarHBondContact O-N 2.79Å
105	D	97.4	Very high	94.8	Very high	11 Å²	11	43.6 Å²	43.6	6%	0.059	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	108.5	179.1	-179.1	3.4	0	0	0	112	L80 R81 L82 S107 H130	L80-D105 PolarHBondContact O-N 3.19Å; R81-D105 HydrophobicContact CB-CB 4.45Å; R81-D105 HydrophobicContact CG-CB 4.45Å; R81-D105 IonicContact NE-OD2 3.38Å; R81-D105 IonicContact NH2-OD2 2.7Å; L82-D105 CarbonylContact C-O 3.59Å; L82-D105 WeakPolarHBondContact CA-O 3.46Å; L82-D105 WeakPolarHBondContact CB-O 3.43Å; L82-D105 PolarHBondContact N-O 2.87Å; D105-S107 VanDerWaalsContact OD1-CB 3.3Å; D105-S107 WeakPolarHBondContact OD1-CB 3.4Å; D105-S107 PolarHBondContact OD1-N 2.81Å; D105-S107 PolarHBondContact OD1-OG 3.45Å; D105-H130 HydrophobicContact CB-CB 4.28Å
106	L	97.7	Very high	94.8	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.			trans	-117.1	17.9	178.5	-65.2	168.7	0	0	0	111.6	L82 L87 L90 L104 N109 F111 I117 I129 H130 L131 N134	L82-L106 HydrophobicContact CB-CD2 4.08Å; L82-L106 HydrophobicContact CD1-CD2 3.84Å; L87-L106 HydrophobicContact CD1-CD2 4.08Å; L90-L106 HydrophobicContact CD1-CD1 4.4Å; L90-L106 HydrophobicContact CD1-CD2 4.06Å; L90-L106 HydrophobicContact CD2-CD1 3.89Å; L104-L106 HydrophobicContact CD1-CD2 4.33Å; L104-L106 HydrophobicContact CD1-CG 4.18Å; L104-L106 HydrophobicContact CD2-CD1 3.86Å; L104-L106 HydrophobicContact CD2-CG 4.32Å; L104-L106 HydrophobicContact CG-CD1 4.03Å; L104-L106 HydrophobicContact CG-CG 3.96Å; L106-N109 PolarHBondContact O-ND2 2.97Å; L106-F111 HydrophobicContact CB-CE2 4.06Å; L106-F111 HydrophobicContact CD1-CE2 4.35Å; L106-F111 HydrophobicContact CD1-CZ 4.49Å; L106-F111 HydrophobicContact CD2-CE2 4.12Å; L106-F111 HydrophobicContact CD2-CZ 4.32Å; L106-F111 HydrophobicContact CG-CE2 4.41Å; L106-I117 HydrophobicContact CD1-CG2 4.34Å; L106-I129 HydrophobicContact CD1-CD1 4.41Å; L106-H130 CarbonylContact C-O 3.15Å; L106-H130 VanDerWaalsContact C-O 3.3Å; L106-H130 VanDerWaalsContact CA-O 3.32Å; L106-H130 WeakPolarHBondContact CA-O 3.44Å; L106-H130 WeakPolarHBondContact CB-O 3.34Å; L106-H130 PolarHBondContact N-O 3.01Å; L106-L131 HydrophobicContact CB-CD2 3.82Å; L106-L131 HydrophobicContact CD1-CD2 4.05Å; L106-N134 PolarHBondContact O-ND2 3.37Å
107	S	97.5	Very high	94.9	Very high	9 Å²	9	41 Å²	41	6%	0.063	20%	0.204	C	C	.	.			trans	-61.3	154	-179.6	63	0	0	0	0	112.1	Q83 S84 D105 N109 H130 E132	Q83-S107 VanDerWaalsContact CA-O 3.28Å; Q83-S107 WeakPolarHBondContact CA-O 3.28Å; Q83-S107 WeakPolarHBondContact CB-OG 3.48Å; Q83-S107 VanDerWaalsContact CG-OG 3.25Å; Q83-S107 WeakPolarHBondContact CG-OG 3.41Å; S84-S107 PolarHBondContact N-O 2.82Å; D105-S107 VanDerWaalsContact OD1-CB 3.3Å; D105-S107 WeakPolarHBondContact OD1-CB 3.4Å; D105-S107 PolarHBondContact OD1-N 2.81Å; D105-S107 PolarHBondContact OD1-OG 3.45Å; S107-N109 PolarHBondContact O-N 3.44Å; S107-N109 PolarHBondContact O-ND2 2.78Å; S107-H130 PolarHBondContact N-O 2.87Å; S107-E132 CarbonylContact C-O 3.48Å; S107-E132 VanDerWaalsContact CA-O 3.28Å; S107-E132 WeakPolarHBondContact CA-O 3.38Å
108	Q	96.8	Very high	94.8	Very high	65 Å²	65	40.2 Å²	40.2	30%	0.304	19%	0.191	S	C	.	.	S	Bend	trans	54.7	46.7	178.1	-61.3	177.9	19.3	0	0	113.6	S84 N85 E132 E133	S84-Q108 VanDerWaalsContact CA-O 3.23Å; S84-Q108 WeakPolarHBondContact CA-O 3.46Å; S84-Q108 PolarHBondContact N-O 3.15Å; S84-Q108 PolarHBondContact OG-OE1 3.11Å; N85-Q108 PolarHBondContact N-O 3.37Å; Q108-E132 PolarHBondContact N-O 2.91Å; Q108-E133 WeakPolarHBondContact CA-O 3.35Å; Q108-E133 HydrophobicContact CB-CB 4.42Å; Q108-E133 HydrophobicContact CG-CB 3.6Å; Q108-E133 HydrophobicContact CG-CG 4.16Å; Q108-E133 WeakPolarHBondContact CG-OE2 3.16Å; Q108-E133 PolarHBondContact NE2-OE1 2.63Å; Q108-E133 PolarHBondContact NE2-OE2 2.87Å
109	N	96.9	Very high	94	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.027	22%	0.219	C	C	.	.	S	Bend	trans	-115.6	-163	174.1	-84.9	-81.7	0	0	0	110.5	L82 N85 L86 L87 L106 S107 F111 N134	L82-N109 PolarHBondContact O-ND2 3.46Å; N85-N109 WeakPolarHBondContact CA-OD1 3.4Å; N85-N109 WeakPolarHBondContact CB-OD1 3.47Å; N85-N109 PolarHBondContact O-OD1 3.03Å; L86-N109 PolarHBondContact N-OD1 2.89Å; L87-N109 HydrophobicContact CB-CB 4.34Å; L87-N109 VanDerWaalsContact CB-OD1 3.25Å; L87-N109 WeakPolarHBondContact CB-OD1 3.4Å; L87-N109 WeakPolarHBondContact CG-OD1 3.42Å; L87-N109 PolarHBondContact N-OD1 2.9Å; L106-N109 PolarHBondContact O-ND2 2.97Å; S107-N109 PolarHBondContact O-N 3.44Å; S107-N109 PolarHBondContact O-ND2 2.78Å; N109-F111 HydrophobicContact CB-CD2 3.74Å; N109-F111 HydrophobicContact CB-CE2 3.77Å; N109-N134 VanDerWaalsContact CA-OD1 3.32Å; N109-N134 WeakPolarHBondContact CA-OD1 3.2Å; N109-N134 VanDerWaalsContact CB-OD1 3.27Å; N109-N134 WeakPolarHBondContact CB-OD1 3.35Å; N109-N134 PolarHBondContact N-OD1 2.84Å; N109-N134 PolarHBondContact O-OD1 3.24Å
110	R	97.2	Very high	93.4	Very high	139 Å²	139	46.6 Å²	46.6	53%	0.525	22%	0.223	S	C	.	.			trans	-115.4	28.5	-176.7	-60	-173.7	179.3	-171.8	1.2	112.8	L87 S112 N134	L87-R110 CarbonylContact O-C 3.15Å; L87-R110 WeakPolarHBondContact O-CA 3.43Å; L87-R110 WeakPolarHBondContact O-CB 3.42Å; L87-R110 PolarHBondContact O-N 2.88Å; R110-S112 PolarHBondContact O-N 2.96Å; R110-N134 PolarHBondContact N-OD1 2.8Å
111	F	97.2	Very high	93.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.212	C	C	.	.			trans	-69.5	119.6	178.2	-66.6	-75.4	0	0	0	110.5	L87 L90 L106 N109 M116 I117 N134 H135 L136	L87-F111 HydrophobicContact CB-CE2 3.91Å; L87-F111 HydrophobicContact CB-CZ 3.72Å; L90-F111 HydrophobicContact CB-CE1 4.24Å; L90-F111 HydrophobicContact CB-CZ 4.35Å; L106-F111 HydrophobicContact CB-CE2 4.06Å; L106-F111 HydrophobicContact CD1-CE2 4.35Å; L106-F111 HydrophobicContact CD1-CZ 4.49Å; L106-F111 HydrophobicContact CD2-CE2 4.12Å; L106-F111 HydrophobicContact CD2-CZ 4.32Å; L106-F111 HydrophobicContact CG-CE2 4.41Å; N109-F111 HydrophobicContact CB-CD2 3.74Å; N109-F111 HydrophobicContact CB-CE2 3.77Å; F111-M116 HydrophobicContact CD1-CB 4.33Å; F111-I117 HydrophobicContact CB-CD1 4.1Å; F111-I117 HydrophobicContact CB-CG1 4.46Å; F111-I117 HydrophobicContact CD1-CD1 4.13Å; F111-I117 HydrophobicContact CD1-CG1 3.57Å; F111-I117 HydrophobicContact CE1-CG1 3.87Å; F111-I117 HydrophobicContact CG-CD1 4.04Å; F111-I117 HydrophobicContact CG-CG1 3.99Å; F111-N134 HydrophobicContact CB-CB 4.37Å; F111-N134 WeakPolarHBondContact CB-OD1 3.18Å; F111-N134 VanDerWaalsContact CD2-OD1 3.27Å; F111-N134 WeakPolarHBondContact CD2-OD1 3.45Å; F111-N134 PolarHBondContact N-OD1 3.15Å; F111-H135 CarbonylContact O-C 3.59Å; F111-H135 VanDerWaalsContact O-CA 3.32Å; F111-H135 WeakPolarHBondContact O-CA 2.91Å; F111-H135 PolarHBondContact O-N 2.86Å; F111-L136 HydrophobicContact CB-CD2 4.25Å; F111-L136 PolarHBondContact O-N 2.98Å
112	S	96.1	Very high	92.9	Very high	48 Å²	48	46.4 Å²	46.4	34%	0.336	23%	0.228	S	C	.	.			trans	-103.1	-20	-179.1	55.7	0	0	0	0	114	R110 H135	R110-S112 PolarHBondContact O-N 2.96Å; S112-H135 WeakPolarHBondContact CA-O 3.49Å
113	R	95.5	Very high	92.7	Very high	135 Å²	135	46 Å²	46	51%	0.509	23%	0.226	S	C	.	.			trans	-142.7	140.1	-179.4	-58.7	-179	177.3	114.1	-5.3	110.3	R115 M116	R113-R115 VanDerWaalsContact C-N 3.3Å; R113-R115 HydrophobicContact CB-CG 4.1Å; R113-R115 PolarHBondContact O-N 3.11Å; R113-M116 HydrophobicContact CB-CG 4.19Å; R113-M116 WeakPolarHBondContact O-CB 3.33Å; R113-M116 PolarHBondContact O-N 2.8Å; R113-M116 VanDerWaalsContact O-N 3.08Å
114	V	94.8	Very high	92.5	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.7	-179	-173.5	0	0	0	0	112.8	M116 I117 T118 L136 L139 S143 F144	V114-M116 PolarHBondContact O-N 3.45Å; V114-I117 WeakPolarHBondContact O-CA 3.32Å; V114-I117 VanDerWaalsContact O-CB 3.29Å; V114-I117 WeakPolarHBondContact O-CB 3.4Å; V114-I117 PolarHBondContact O-N 3.49Å; V114-T118 HydrophobicContact CG1-CG2 4.11Å; V114-T118 PolarHBondContact O-N 2.89Å; V114-T118 PolarHBondContact O-OG1 2.68Å; V114-L136 HydrophobicContact CG2-CD1 4.39Å; V114-L136 HydrophobicContact CG2-CD2 4.23Å; V114-L139 HydrophobicContact CG2-CD2 3.46Å; V114-L139 VanDerWaalsContact CG2-CD2 3.46Å; V114-S143 WeakPolarHBondContact CG1-O 3.47Å; V114-F144 HydrophobicContact CG1-CD1 3.91Å; V114-F144 HydrophobicContact CG1-CE1 3.49Å; V114-F144 VanDerWaalsContact CG1-CE1 3.49Å; V114-F144 HydrophobicContact CG1-CE2 4.31Å; V114-F144 HydrophobicContact CG1-CG 4.49Å; V114-F144 HydrophobicContact CG1-CZ 3.71Å; V114-F144 HydrophobicContact CG2-CZ 3.97Å
115	R	92.5	Very high	92.3	Very high	139 Å²	139	50.9 Å²	50.9	53%	0.525	26%	0.259	S	S	.	.	H	α-helix	trans	-54.6	-27.1	175.1	72.8	179.2	-172.1	179.2	2.6	113.6	R113 I117 Q119	R113-R115 VanDerWaalsContact C-N 3.3Å; R113-R115 HydrophobicContact CB-CG 4.1Å; R113-R115 PolarHBondContact O-N 3.11Å; R115-I117 PolarHBondContact O-N 2.73Å; R115-I117 VanDerWaalsContact O-N 3.17Å; R115-Q119 WeakPolarHBondContact O-CB 3.26Å; R115-Q119 PolarHBondContact O-N 2.93Å
116	M	91.7	Very high	92.3	Very high	51 Å²	51	50.4 Å²	50.4	25%	0.251	26%	0.257	S	S	.	.	H	α-helix	trans	-71.1	-7.7	177.2	-54.9	-58.4	-60.6	0	0	112.7	S88 V89 L90 F111 R113 V114	S88-M116 WeakPolarHBondContact O-CB 3.01Å; V89-M116 WeakPolarHBondContact CA-O 3.33Å; V89-M116 HydrophobicContact CB-CE 3.62Å; V89-M116 HydrophobicContact CG2-CE 3.69Å; L90-M116 PolarHBondContact N-O 2.96Å; F111-M116 HydrophobicContact CD1-CB 4.33Å; R113-M116 HydrophobicContact CB-CG 4.19Å; R113-M116 WeakPolarHBondContact O-CB 3.33Å; R113-M116 PolarHBondContact O-N 2.8Å; R113-M116 VanDerWaalsContact O-N 3.08Å; V114-M116 PolarHBondContact O-N 3.45Å
117	I	91.5	Very high	92.2	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-110.6	-37.2	-178.2	-55.2	161.3	0	0	0	110.3	L90 T92 L106 F111 V114 R115 I129 L131	L90-I117 HydrophobicContact CD2-CG2 3.94Å; T92-I117 WeakPolarHBondContact CG2-O 3.17Å; L106-I117 HydrophobicContact CD1-CG2 4.34Å; F111-I117 HydrophobicContact CB-CD1 4.1Å; F111-I117 HydrophobicContact CB-CG1 4.46Å; F111-I117 HydrophobicContact CD1-CD1 4.13Å; F111-I117 HydrophobicContact CD1-CG1 3.57Å; F111-I117 HydrophobicContact CE1-CG1 3.87Å; F111-I117 HydrophobicContact CG-CD1 4.04Å; F111-I117 HydrophobicContact CG-CG1 3.99Å; V114-I117 WeakPolarHBondContact O-CA 3.32Å; V114-I117 VanDerWaalsContact O-CB 3.29Å; V114-I117 WeakPolarHBondContact O-CB 3.4Å; V114-I117 PolarHBondContact O-N 3.49Å; R115-I117 PolarHBondContact O-N 2.73Å; R115-I117 VanDerWaalsContact O-N 3.17Å; I117-I129 HydrophobicContact CG2-CD1 4.18Å; I117-L131 HydrophobicContact CD1-CD1 3.89Å; I117-L131 HydrophobicContact CD1-CD2 3.56Å; I117-L131 HydrophobicContact CD1-CG 4.39Å
118	T	86.5	Confident	92.2	Very high	23 Å²	23	51.8 Å²	51.8	14%	0.141	26%	0.264	C	S	.	.	H	α-helix	trans	-114.9	4.9	-165.2	54.6	0	0	0	0	115.8	V114 S143 F144 S146 L147	V114-T118 HydrophobicContact CG1-CG2 4.11Å; V114-T118 PolarHBondContact O-N 2.89Å; V114-T118 PolarHBondContact O-OG1 2.68Å; T118-S143 PolarHBondContact OG1-O 2.81Å; T118-F144 HydrophobicContact CG2-CD1 4.17Å; T118-S146 WeakPolarHBondContact CB-OG 3.4Å; T118-L147 HydrophobicContact CG2-CD1 4.48Å
119	Q	75.3	Confident	92.2	Very high	140 Å²	140	48.8 Å²	48.8	65%	0.654	25%	0.25	S	C	*	.	S	Bend	trans	-79.7	-26.7	-164.2	179.4	171.8	-2.2	0	0	116.9	R115	R115-Q119 WeakPolarHBondContact O-CB 3.26Å; R115-Q119 PolarHBondContact O-N 2.93Å
120	S	77.2	Confident	92.3	Very high	83 Å²	83	50.5 Å²	50.5	58%	0.58	26%	0.257	S	S	*	.	S	Bend	trans	-100.1	-42.1	-165.9	-45.9	0	0	0	0	115.1	T92	T92-S120 VanDerWaalsContact OG1-CB 3.28Å; T92-S120 WeakPolarHBondContact OG1-CB 3.48Å
121	S	88.1	Confident	92.3	Very high	31 Å²	31	43.9 Å²	43.9	22%	0.217	23%	0.232	C	C	.	.			trans	-147.5	145.1	-173.1	-53.5	0	0	0	0	111.1	T92	T92-S121 PolarHBondContact OG1-N 2.86Å
122	S	91.1	Very high	92.4	Very high	52 Å²	52	45.6 Å²	45.6	36%	0.364	24%	0.241	S	C	.	.			trans	-66.3	148.8	171.7	-167.3	0	0	0	0	110.7	H96 S146	H96-S122 PolarHBondContact CD2-O 3.05Å; S122-S146 CarbonylContact C-O 3.52Å; S122-S146 VanDerWaalsContact CA-O 3.28Å; S122-S146 WeakPolarHBondContact CA-O 3.09Å; S122-S146 PolarHBondContact OG-O 2.86Å
123	L	93	Very high	92.4	Very high	10 Å²	10	48 Å²	48	5%	0.052	25%	0.246	C	C	.	.			trans	-119.7	86.1	170.2	-58.3	175	0	0	0	108.4	L95 H96 S125 L126 S146 L147	L95-L123 HydrophobicContact CB-CD1 4.37Å; L95-L123 HydrophobicContact CB-CD2 3.76Å; L95-L123 HydrophobicContact CD1-CD1 4.42Å; H96-L123 HydrophobicContact CB-CD2 4.24Å; L123-S125 VanDerWaalsContact C-N 3.3Å; L123-S125 PolarHBondContact O-N 2.84Å; L123-L126 HydrophobicContact CB-CB 4.01Å; L123-L126 HydrophobicContact CD1-CD2 4.19Å; L123-L126 PolarHBondContact O-N 3.27Å; L123-S146 PolarHBondContact N-O 3.19Å; L123-L147 HydrophobicContact CB-CD2 3.7Å; L123-L147 HydrophobicContact CD1-CD2 3.98Å; L123-L147 HydrophobicContact CG-CD2 4.11Å
124	P	91.5	Very high	92.5	Very high	73 Å²	73	41.7 Å²	41.7	47%	0.474	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-20.4	-168.1	29.5	-36	0	0	0	113.9	A149	P124-A149 WeakPolarHBondContact O-CB 3.5Å
125	S	93.9	Very high	92.6	Very high	47 Å²	47	46.2 Å²	46.2	33%	0.329	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-7.5	179.8	-52.6	0	0	0	0	113.5	P99 L101 L123 L127	P99-S125 WeakPolarHBondContact O-CB 3.48Å; P99-S125 PolarHBondContact O-OG 3.06Å; L101-S125 CarbonylContact O-C 3.58Å; L123-S125 VanDerWaalsContact C-N 3.3Å; L123-S125 PolarHBondContact O-N 2.84Å; S125-L127 PolarHBondContact O-N 2Å
126	L	95.9	Very high	92.9	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.219	C	C	.	.			trans	-74.9	121	-173	-162.8	75.5	0	0	0	110.6	L101 L104 L123 I129 L147 A149 L150	L101-L126 HydrophobicContact CD2-CD1 4.32Å; L101-L126 HydrophobicContact CG-CD1 4.1Å; L104-L126 HydrophobicContact CB-CD1 3.73Å; L104-L126 HydrophobicContact CB-CD2 4.32Å; L104-L126 HydrophobicContact CD2-CD2 4.43Å; L123-L126 HydrophobicContact CB-CB 4.01Å; L123-L126 HydrophobicContact CD1-CD2 4.19Å; L123-L126 PolarHBondContact O-N 3.27Å; L126-I129 HydrophobicContact CD2-CB 4.15Å; L126-I129 HydrophobicContact CD2-CD1 4.27Å; L126-I129 HydrophobicContact CD2-CG1 4.45Å; L126-L147 HydrophobicContact CD2-CD1 4.35Å; L126-L147 HydrophobicContact CD2-CD2 3.96Å; L126-A149 CarbonylContact O-C 3.43Å; L126-L150 HydrophobicContact CD2-CD1 4.42Å; L126-L150 HydrophobicContact CG-CD1 4.46Å; L126-L150 WeakPolarHBondContact O-CA 3.23Å; L126-L150 PolarHBondContact O-N 3.2Å
127	L	96.8	Very high	93.1	Very high	36 Å²	36	38.8 Å²	38.8	19%	0.188	22%	0.218	C	C	.	.			trans	-103.5	-34.6	-177.2	-56.9	-176.5	0	0	0	112.3	P49 T102 S125 A149 Q151 E152	P49-L127 HydrophobicContact CG-CB 4.47Å; T102-L127 HydrophobicContact CG2-CD1 4.21Å; T102-L127 HydrophobicContact CG2-CG 4.3Å; T102-L127 WeakPolarHBondContact O-CA 3.47Å; T102-L127 PolarHBondContact O-N 2.78Å; S125-L127 PolarHBondContact O-N 2Å; L127-A149 HydrophobicContact CD2-CB 4.13Å; L127-A149 WeakPolarHBondContact CD2-O 2.79Å; L127-Q151 HydrophobicContact CD2-CG 4.42Å; L127-Q151 PolarHBondContact O-N 3.39Å; L127-E152 PolarHBondContact O-N 3.29Å
128	S	97.3	Very high	93.4	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.6	-179.3	176.9	0	0	0	0	111.3	T102 D103 L104 H130 E152	T102-S128 PolarHBondContact O-N 2.95Å; D103-S128 VanDerWaalsContact OD2-CB 3.31Å; D103-S128 WeakPolarHBondContact OD2-CB 3.38Å; D103-S128 PolarHBondContact OD2-OG 2.93Å; L104-S128 PolarHBondContact N-O 2.87Å; L104-S128 VanDerWaalsContact N-O 3.1Å; S128-H130 PolarHBondContact OG-NE2 3.09Å; S128-E152 WeakPolarHBondContact CA-O 3.03Å
129	I	97.4	Very high	93.9	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	125.6	172.5	-164.9	174.7	0	0	0	111.7	L104 L106 I117 L126 L131 L147 L150 E152 L153 F154	L104-I129 HydrophobicContact CD2-CD1 4.38Å; L104-I129 WeakPolarHBondContact O-CA 3.36Å; L106-I129 HydrophobicContact CD1-CD1 4.41Å; I117-I129 HydrophobicContact CG2-CD1 4.18Å; L126-I129 HydrophobicContact CD2-CB 4.15Å; L126-I129 HydrophobicContact CD2-CD1 4.27Å; L126-I129 HydrophobicContact CD2-CG1 4.45Å; I129-L131 HydrophobicContact CD1-CD1 4.16Å; I129-L131 HydrophobicContact CD1-CG 4.37Å; I129-L131 HydrophobicContact CG1-CD1 4.42Å; I129-L131 HydrophobicContact CG1-CG 4.23Å; I129-L147 HydrophobicContact CD1-CD1 4.2Å; I129-L147 HydrophobicContact CG2-CD1 4.47Å; I129-L150 HydrophobicContact CB-CD1 4.17Å; I129-L150 HydrophobicContact CG2-CD1 3.84Å; I129-L150 HydrophobicContact CG2-CD2 3.89Å; I129-L150 HydrophobicContact CG2-CG 4.49Å; I129-E152 PolarHBondContact N-O 3.35Å; I129-E152 VanDerWaalsContact N-O 3.16Å; I129-L153 HydrophobicContact CG2-CD1 3.46Å; I129-L153 VanDerWaalsContact CG2-CD1 3.46Å; I129-F154 PolarHBondContact O-N 3.06Å; I129-F154 VanDerWaalsContact O-N 3.11Å
130	H	98.1	Very high	95	Very high	41 Å²	41	38.6 Å²	38.6	19%	0.19	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.6	177.9	-62.2	-94.2	0	0	0	110.6	D103 L104 D105 L106 S107 S128 E132 F154	D103-H130 IonicContact OD2-NE2 3.05Å; L104-H130 PolarHBondContact O-N 2.79Å; D105-H130 HydrophobicContact CB-CB 4.28Å; L106-H130 CarbonylContact C-O 3.15Å; L106-H130 VanDerWaalsContact C-O 3.3Å; L106-H130 VanDerWaalsContact CA-O 3.32Å; L106-H130 WeakPolarHBondContact CA-O 3.44Å; L106-H130 WeakPolarHBondContact CB-O 3.34Å; L106-H130 PolarHBondContact N-O 3.01Å; S107-H130 PolarHBondContact N-O 2.87Å; S128-H130 PolarHBondContact OG-NE2 3.09Å; H130-E132 VanDerWaalsContact C-OE2 3.28Å; H130-E132 WeakPolarHBondContact CA-OE2 3.49Å; H130-E132 WeakPolarHBondContact CB-OE2 3.13Å; H130-E132 IonicContact CG-OE2 3.17Å; H130-E132 IonicContact ND1-OE1 2.91Å; H130-E132 PolarHBondContact ND1-OE1 3.5Å; H130-E132 IonicContact ND1-OE2 3.39Å; H130-F154 AromaticContact CE1-CD2 3.37Å; H130-F154 WeakPolarHBondContact CE1-CD2 3.47Å; H130-F154 AromaticContact CE1-CE2 3.29Å; H130-F154 WeakPolarHBondContact CE1-CE2 3.27Å; H130-F154 AromaticContact CE1-CZ 3.93Å; H130-F154 AromaticContact CG-CD2 3.91Å; H130-F154 AromaticContact ND1-CD2 3.33Å; H130-F154 VanDerWaalsContact ND1-CD2 3.33Å; H130-F154 WeakPolarHBondContact ND1-CD2 3.44Å; H130-F154 AromaticContact ND1-CE2 3.78Å; H130-F154 AromaticContact ND1-CG 3.74Å; H130-F154 AromaticContact NE2-CD2 3.97Å; H130-F154 AromaticContact NE2-CE2 3.78Å
131	L	98.1	Very high	95.9	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.224	C	C	.	.			trans	-129.9	20.4	-179	-69.4	169.3	0	0	0	111.9	L106 I117 I129 N134 L136 F144 F154 L155 N158	L106-L131 HydrophobicContact CB-CD2 3.82Å; L106-L131 HydrophobicContact CD1-CD2 4.05Å; I117-L131 HydrophobicContact CD1-CD1 3.89Å; I117-L131 HydrophobicContact CD1-CD2 3.56Å; I117-L131 HydrophobicContact CD1-CG 4.39Å; I129-L131 HydrophobicContact CD1-CD1 4.16Å; I129-L131 HydrophobicContact CD1-CG 4.37Å; I129-L131 HydrophobicContact CG1-CD1 4.42Å; I129-L131 HydrophobicContact CG1-CG 4.23Å; L131-N134 PolarHBondContact O-ND2 2.95Å; L131-L136 HydrophobicContact CB-CD1 4.49Å; L131-F144 HydrophobicContact CD1-CE1 3.93Å; L131-F144 HydrophobicContact CD1-CZ 4.4Å; L131-F154 CarbonylContact C-O 3.07Å; L131-F154 WeakPolarHBondContact CA-O 3.39Å; L131-F154 WeakPolarHBondContact CB-O 3.46Å; L131-F154 PolarHBondContact N-O 3.17Å; L131-L155 HydrophobicContact CB-CD2 3.87Å; L131-L155 HydrophobicContact CD1-CD2 3.92Å; L131-N158 PolarHBondContact O-ND2 3.09Å
132	E	97.6	Very high	96.2	Very high	37 Å²	37	41.3 Å²	41.3	17%	0.173	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	152.4	177.9	-57.6	92.9	137.2	0	0	111.5	S107 Q108 H130 N134 F154 S156	S107-E132 CarbonylContact C-O 3.48Å; S107-E132 VanDerWaalsContact CA-O 3.28Å; S107-E132 WeakPolarHBondContact CA-O 3.38Å; Q108-E132 PolarHBondContact N-O 2.91Å; H130-E132 VanDerWaalsContact C-OE2 3.28Å; H130-E132 WeakPolarHBondContact CA-OE2 3.49Å; H130-E132 WeakPolarHBondContact CB-OE2 3.13Å; H130-E132 IonicContact CG-OE2 3.17Å; H130-E132 IonicContact ND1-OE1 2.91Å; H130-E132 PolarHBondContact ND1-OE1 3.5Å; H130-E132 IonicContact ND1-OE2 3.39Å; E132-N134 PolarHBondContact O-N 3.39Å; E132-N134 VanDerWaalsContact O-N 3.15Å; E132-N134 PolarHBondContact O-ND2 3.45Å; E132-N134 VanDerWaalsContact O-ND2 3.16Å; E132-F154 HydrophobicContact CG-CB 3.95Å; E132-F154 WeakPolarHBondContact OE1-CB 3.5Å; E132-F154 WeakPolarHBondContact OE2-CB 3.28Å; E132-S156 WeakPolarHBondContact CA-O 3.14Å
133	E	97.1	Very high	96.4	Very high	97 Å²	97	39.2 Å²	39.2	45%	0.453	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	35.9	173.9	-63.1	-176.9	-121.6	0	0	113.9	Q108 S156 H157	Q108-E133 WeakPolarHBondContact CA-O 3.35Å; Q108-E133 HydrophobicContact CB-CB 4.42Å; Q108-E133 HydrophobicContact CG-CB 3.6Å; Q108-E133 HydrophobicContact CG-CG 4.16Å; Q108-E133 WeakPolarHBondContact CG-OE2 3.16Å; Q108-E133 PolarHBondContact NE2-OE1 2.63Å; Q108-E133 PolarHBondContact NE2-OE2 2.87Å; E133-S156 PolarHBondContact N-O 2.71Å; E133-H157 WeakPolarHBondContact CA-O 3.38Å; E133-H157 HydrophobicContact CG-CB 3.79Å
134	N	97.3	Very high	96.6	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.016	21%	0.211	C	C	.	.	S	Bend	trans	-98.9	-161.7	171.1	-86.6	-82.9	0	0	0	110.4	L106 N109 R110 F111 L131 E132 L136 N158	L106-N134 PolarHBondContact O-ND2 3.37Å; N109-N134 VanDerWaalsContact CA-OD1 3.32Å; N109-N134 WeakPolarHBondContact CA-OD1 3.2Å; N109-N134 VanDerWaalsContact CB-OD1 3.27Å; N109-N134 WeakPolarHBondContact CB-OD1 3.35Å; N109-N134 PolarHBondContact N-OD1 2.84Å; N109-N134 PolarHBondContact O-OD1 3.24Å; R110-N134 PolarHBondContact N-OD1 2.8Å; F111-N134 HydrophobicContact CB-CB 4.37Å; F111-N134 WeakPolarHBondContact CB-OD1 3.18Å; F111-N134 VanDerWaalsContact CD2-OD1 3.27Å; F111-N134 WeakPolarHBondContact CD2-OD1 3.45Å; F111-N134 PolarHBondContact N-OD1 3.15Å; L131-N134 PolarHBondContact O-ND2 2.95Å; E132-N134 PolarHBondContact O-N 3.39Å; E132-N134 VanDerWaalsContact O-N 3.15Å; E132-N134 PolarHBondContact O-ND2 3.45Å; E132-N134 VanDerWaalsContact O-ND2 3.16Å; N134-L136 HydrophobicContact CB-CG 4.47Å; N134-N158 WeakPolarHBondContact CA-OD1 3.45Å; N134-N158 WeakPolarHBondContact CB-OD1 3.36Å; N134-N158 PolarHBondContact N-OD1 3.31Å; N134-N158 PolarHBondContact O-OD1 2.95Å
135	H	97.4	Very high	96.7	Very high	97 Å²	97	38.3 Å²	38.3	45%	0.449	21%	0.21	S	C	.	.			trans	-118.8	25.2	-178.9	-57.5	-33.1	0	0	0	112.4	F111 S112 S137 N158	F111-H135 CarbonylContact O-C 3.59Å; F111-H135 VanDerWaalsContact O-CA 3.32Å; F111-H135 WeakPolarHBondContact O-CA 2.91Å; F111-H135 PolarHBondContact O-N 2.86Å; S112-H135 WeakPolarHBondContact CA-O 3.49Å; H135-S137 PolarHBondContact O-N 2.79Å; H135-N158 PolarHBondContact N-OD1 2.85Å
136	L	98.1	Very high	96.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.			trans	-64.2	132.4	179.9	-59.8	176.3	0	0	0	109.6	F111 V114 L131 N134 L155 N158 N159 L160	F111-L136 HydrophobicContact CB-CD2 4.25Å; F111-L136 PolarHBondContact O-N 2.98Å; V114-L136 HydrophobicContact CG2-CD1 4.39Å; V114-L136 HydrophobicContact CG2-CD2 4.23Å; L131-L136 HydrophobicContact CB-CD1 4.49Å; N134-L136 HydrophobicContact CB-CG 4.47Å; L136-L155 HydrophobicContact CD1-CD2 3.61Å; L136-N158 HydrophobicContact CB-CB 4.23Å; L136-N158 WeakPolarHBondContact CB-OD1 3.28Å; L136-N158 PolarHBondContact N-OD1 3.3Å; L136-N159 CarbonylContact O-C 3.42Å; L136-N159 VanDerWaalsContact O-CA 3.25Å; L136-N159 WeakPolarHBondContact O-CA 3.32Å; L136-N159 PolarHBondContact O-N 3.34Å; L136-L160 HydrophobicContact CB-CD2 3.85Å; L136-L160 PolarHBondContact O-N 2.8Å
137	S	97.1	Very high	96.6	Very high	35 Å²	35	37 Å²	37	25%	0.245	20%	0.2	C	C	.	.			trans	-117	-26.6	-175.2	53.1	0	0	0	0	114.2	H135 N159 L160 H161	H135-S137 PolarHBondContact O-N 2.79Å; S137-N159 WeakPolarHBondContact CA-O 3.43Å; S137-L160 WeakPolarHBondContact O-CA 3.44Å; S137-H161 PolarHBondContact O-CE1 3.18Å; S137-H161 PolarHBondContact O-N 2.98Å; S137-H161 VanDerWaalsContact O-N 3.11Å; S137-H161 PolarHBondContact O-ND1 3.11Å; S137-H161 VanDerWaalsContact O-ND1 3.16Å
138	H	97.1	Very high	96.5	Very high	90 Å²	90	38 Å²	38	42%	0.417	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	145.2	-177.3	-54	75.6	0	0	0	110	H161 S162	H138-H161 AromaticContact CD2-NE2 3.95Å; H138-H161 AromaticContact CE1-CE1 3.23Å; H138-H161 PolarHBondContact CE1-CE1 2.96Å; H138-H161 AromaticContact CE1-NE2 3.3Å; H138-H161 PolarHBondContact CE1-NE2 3.06Å; H138-H161 VanDerWaalsContact CE1-NE2 3.3Å; H138-H161 AromaticContact ND1-CE1 3.85Å; H138-H161 AromaticContact NE2-CE1 3.51Å; H138-H161 AromaticContact NE2-NE2 3.11Å; H138-H161 PolarHBondContact NE2-NE2 3.45Å; H138-H161 VanDerWaalsContact NE2-NE2 3.11Å; H138-S162 WeakPolarHBondContact CA-O 3.46Å
139	L	97.8	Very high	96.5	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	100.7	166.8	-56.9	-176	0	0	0	109.5	V114 F144 L155 L160 S162 I163 A164 A167 F168	V114-L139 HydrophobicContact CG2-CD2 3.46Å; V114-L139 VanDerWaalsContact CG2-CD2 3.46Å; L139-F144 HydrophobicContact CD1-CE2 4.46Å; L139-F144 HydrophobicContact CD2-CE2 4.09Å; L139-F144 HydrophobicContact CD2-CZ 4.29Å; L139-L155 HydrophobicContact CD1-CD1 4.02Å; L139-L160 HydrophobicContact CD1-CD1 4.23Å; L139-L160 HydrophobicContact CD2-CD1 4.46Å; L139-L160 HydrophobicContact CD2-CD2 3.92Å; L139-L160 HydrophobicContact CG-CD1 4.26Å; L139-L160 HydrophobicContact CG-CD2 3.93Å; L139-S162 PolarHBondContact N-O 2.99Å; L139-S162 VanDerWaalsContact N-O 3.07Å; L139-I163 HydrophobicContact CB-CG1 4.33Å; L139-I163 HydrophobicContact CB-CG2 4.26Å; L139-I163 HydrophobicContact CD1-CD1 4.16Å; L139-I163 HydrophobicContact CD1-CG1 4Å; L139-I163 HydrophobicContact CD1-CG2 4.35Å; L139-I163 HydrophobicContact CG-CG1 4.24Å; L139-A164 WeakPolarHBondContact O-CB 3.43Å; L139-A164 PolarHBondContact O-N 3.22Å; L139-A167 HydrophobicContact CB-CB 3.91Å; L139-F168 HydrophobicContact CD1-CE1 3.89Å; L139-F168 HydrophobicContact CD1-CZ 3.8Å
140	P	96.9	Very high	96.4	Very high	71 Å²	71	39 Å²	39	46%	0.461	22%	0.218	S	C	.	.			trans	-67.8	170.4	172	28.1	-34.1	0	0	0	112.1	S143 A167	P140-S143 WeakPolarHBondContact CD-OG 3.5Å; P140-S143 WeakPolarHBondContact O-CB 3.47Å; P140-S143 PolarHBondContact O-N 2.92Å; P140-S143 PolarHBondContact O-OG 2.88Å; P140-A167 VanDerWaalsContact O-CA 3.31Å; P140-A167 WeakPolarHBondContact O-CA 3.35Å; P140-A167 WeakPolarHBondContact O-CB 3.14Å
141	E	96.2	Very high	96.4	Very high	134 Å²	134	38.9 Å²	38.9	63%	0.626	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	141.7	176.2	-169.3	173.1	-179.6	0	0	111.5	S143	E141-S143 PolarHBondContact O-N 3.08Å
142	A	94.5	Very high	96.4	Very high	38 Å²	38	39.9 Å²	39.9	31%	0.314	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	34.2	180	0	0	0	0	0	114.5	F144 S145 G166	A142-F144 PolarHBondContact O-N 2.77Å; A142-S145 PolarHBondContact O-N 3.38Å; A142-S145 PolarHBondContact O-OG 2.73Å; A142-G166 PolarHBondContact N-O 3.19Å
143	S	96.1	Very high	96.5	Very high	7 Å²	7	38.1 Å²	38.1	5%	0.049	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-34.4	-176.2	-80.5	0	0	0	0	113.9	V114 T118 P140 E141 A167	V114-S143 WeakPolarHBondContact CG1-O 3.47Å; T118-S143 PolarHBondContact OG1-O 2.81Å; P140-S143 WeakPolarHBondContact CD-OG 3.5Å; P140-S143 WeakPolarHBondContact O-CB 3.47Å; P140-S143 PolarHBondContact O-N 2.92Å; P140-S143 PolarHBondContact O-OG 2.88Å; E141-S143 PolarHBondContact O-N 3.08Å; S143-A167 PolarHBondContact N-O 3.03Å
144	F	95.8	Very high	96.5	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	20.5	-174.2	-57.3	-80.1	0	0	0	113.3	V114 T118 L131 L139 A142 S146 L147 L153 L155 L171	V114-F144 HydrophobicContact CG1-CD1 3.91Å; V114-F144 HydrophobicContact CG1-CE1 3.49Å; V114-F144 VanDerWaalsContact CG1-CE1 3.49Å; V114-F144 HydrophobicContact CG1-CE2 4.31Å; V114-F144 HydrophobicContact CG1-CG 4.49Å; V114-F144 HydrophobicContact CG1-CZ 3.71Å; V114-F144 HydrophobicContact CG2-CZ 3.97Å; T118-F144 HydrophobicContact CG2-CD1 4.17Å; L131-F144 HydrophobicContact CD1-CE1 3.93Å; L131-F144 HydrophobicContact CD1-CZ 4.4Å; L139-F144 HydrophobicContact CD1-CE2 4.46Å; L139-F144 HydrophobicContact CD2-CE2 4.09Å; L139-F144 HydrophobicContact CD2-CZ 4.29Å; A142-F144 PolarHBondContact O-N 2.77Å; F144-S146 PolarHBondContact O-N 2.79Å; F144-L147 HydrophobicContact CB-CD1 4.5Å; F144-L147 HydrophobicContact CD1-CD1 4.17Å; F144-L147 PolarHBondContact O-N 2.95Å; F144-L153 HydrophobicContact CD2-CD2 3.92Å; F144-L153 HydrophobicContact CE1-CD1 4.13Å; F144-L153 HydrophobicContact CE2-CD2 3.86Å; F144-L153 HydrophobicContact CG-CD2 4.37Å; F144-L153 HydrophobicContact CZ-CD1 4.18Å; F144-L153 HydrophobicContact CZ-CD2 4.25Å; F144-L155 HydrophobicContact CE2-CD1 4.14Å; F144-L155 HydrophobicContact CZ-CD1 4.11Å; F144-L155 HydrophobicContact CZ-CD2 4.02Å; F144-L171 HydrophobicContact CB-CD1 3.94Å; F144-L171 HydrophobicContact CB-CD2 3.78Å; F144-L171 HydrophobicContact CB-CG 4.12Å; F144-L171 HydrophobicContact CD2-CD1 4.37Å; F144-L171 HydrophobicContact CG-CD1 4.47Å; F144-L171 WeakPolarHBondContact O-CD2 3.37Å
145	S	94.3	Very high	96.6	Very high	64 Å²	64	34.4 Å²	34.4	45%	0.448	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-13.7	-177.1	65	0	0	0	0	114.2	A142 L147	A142-S145 PolarHBondContact O-N 3.38Å; A142-S145 PolarHBondContact O-OG 2.73Å; S145-L147 PolarHBondContact O-N 3.38Å
146	S	93.6	Very high	96.6	Very high	17 Å²	17	30.2 Å²	30.2	12%	0.119	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-1.1	174.4	69.1	0	0	0	0	113.6	T118 S122 L123 F144 P148	T118-S146 WeakPolarHBondContact CB-OG 3.4Å; S122-S146 CarbonylContact C-O 3.52Å; S122-S146 VanDerWaalsContact CA-O 3.28Å; S122-S146 WeakPolarHBondContact CA-O 3.09Å; S122-S146 PolarHBondContact OG-O 2.86Å; L123-S146 PolarHBondContact N-O 3.19Å; F144-S146 PolarHBondContact O-N 2.79Å; S146-P148 VanDerWaalsContact C-CD 3.41Å; S146-P148 WeakPolarHBondContact O-CD 3.41Å
147	L	95.2	Very high	96.6	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	20%	0.199	C	C	.	.			trans	-121.8	63.8	-176.3	-51.4	178.4	0	0	0	110.5	T118 L123 L126 I129 F144 S145 A149 L150 L171	T118-L147 HydrophobicContact CG2-CD1 4.48Å; L123-L147 HydrophobicContact CB-CD2 3.7Å; L123-L147 HydrophobicContact CD1-CD2 3.98Å; L123-L147 HydrophobicContact CG-CD2 4.11Å; L126-L147 HydrophobicContact CD2-CD1 4.35Å; L126-L147 HydrophobicContact CD2-CD2 3.96Å; I129-L147 HydrophobicContact CD1-CD1 4.2Å; I129-L147 HydrophobicContact CG2-CD1 4.47Å; F144-L147 HydrophobicContact CB-CD1 4.5Å; F144-L147 HydrophobicContact CD1-CD1 4.17Å; F144-L147 PolarHBondContact O-N 2.95Å; S145-L147 PolarHBondContact O-N 3.38Å; L147-A149 VanDerWaalsContact C-N 3.3Å; L147-A149 PolarHBondContact O-N 3.17Å; L147-L150 HydrophobicContact CB-CB 4.09Å; L147-L150 HydrophobicContact CB-CD2 4.43Å; L147-L150 HydrophobicContact CD1-CD1 4.5Å; L147-L150 HydrophobicContact CD1-CD2 4.21Å; L147-L150 VanDerWaalsContact O-CB 3.26Å; L147-L150 WeakPolarHBondContact O-CB 3.27Å; L147-L150 PolarHBondContact O-N 2.86Å; L147-L171 WeakPolarHBondContact O-CD2 3.39Å
148	P	94.3	Very high	96.6	Very high	57 Å²	57	33.5 Å²	33.5	37%	0.37	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.1	-166.8	27.8	-36.7	0	0	0	114.9	S146	S146-P148 VanDerWaalsContact C-CD 3.41Å; S146-P148 WeakPolarHBondContact O-CD 3.41Å
149	A	95.8	Very high	96.7	Very high	25 Å²	25	31.9 Å²	31.9	21%	0.207	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	4	179.1	0	0	0	0	0	113.6	P124 L126 L127 L147 Q151	P124-A149 WeakPolarHBondContact O-CB 3.5Å; L126-A149 CarbonylContact O-C 3.43Å; L127-A149 HydrophobicContact CD2-CB 4.13Å; L127-A149 WeakPolarHBondContact CD2-O 2.79Å; L147-A149 VanDerWaalsContact C-N 3.3Å; L147-A149 PolarHBondContact O-N 3.17Å; A149-Q151 WeakPolarHBondContact O-CG 3.23Å; A149-Q151 PolarHBondContact O-N 3.21Å
150	L	97.3	Very high	96.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.183	C	C	.	.			trans	-63.7	128.3	-173.2	-163.7	75.2	0	0	0	110.9	L126 I129 L147 L153 L171 S173 L174	L126-L150 HydrophobicContact CD2-CD1 4.42Å; L126-L150 HydrophobicContact CG-CD1 4.46Å; L126-L150 WeakPolarHBondContact O-CA 3.23Å; L126-L150 PolarHBondContact O-N 3.2Å; I129-L150 HydrophobicContact CB-CD1 4.17Å; I129-L150 HydrophobicContact CG2-CD1 3.84Å; I129-L150 HydrophobicContact CG2-CD2 3.89Å; I129-L150 HydrophobicContact CG2-CG 4.49Å; L147-L150 HydrophobicContact CB-CB 4.09Å; L147-L150 HydrophobicContact CB-CD2 4.43Å; L147-L150 HydrophobicContact CD1-CD1 4.5Å; L147-L150 HydrophobicContact CD1-CD2 4.21Å; L147-L150 VanDerWaalsContact O-CB 3.26Å; L147-L150 WeakPolarHBondContact O-CB 3.27Å; L147-L150 PolarHBondContact O-N 2.86Å; L150-L153 HydrophobicContact CD2-CB 4.02Å; L150-L153 HydrophobicContact CD2-CD1 4.29Å; L150-L153 HydrophobicContact CD2-CG 4.5Å; L150-L171 HydrophobicContact CB-CD2 4.07Å; L150-L171 HydrophobicContact CD2-CD2 4.05Å; L150-S173 CarbonylContact O-C 3.59Å; L150-S173 VanDerWaalsContact O-C 3.3Å; L150-L174 HydrophobicContact CB-CD1 4.49Å; L150-L174 HydrophobicContact CD2-CD1 4.1Å; L150-L174 HydrophobicContact CG-CD1 4.14Å; L150-L174 WeakPolarHBondContact O-CA 3.37Å; L150-L174 PolarHBondContact O-N 3.43Å
151	Q	97.8	Very high	96.7	Very high	38 Å²	38	32.9 Å²	32.9	18%	0.178	18%	0.182	C	C	.	.			trans	-108.6	-32.1	179.2	-58.9	-171.4	21.9	0	0	111.9	P49 L127 A149 R175 R176	P49-Q151 HydrophobicContact CB-CB 4.24Å; P49-Q151 VanDerWaalsContact CB-OE1 3.27Å; P49-Q151 HydrophobicContact CG-CB 4.19Å; L127-Q151 HydrophobicContact CD2-CG 4.42Å; L127-Q151 PolarHBondContact O-N 3.39Å; A149-Q151 WeakPolarHBondContact O-CG 3.23Å; A149-Q151 PolarHBondContact O-N 3.21Å; Q151-R175 PolarHBondContact O-N 3.14Å; Q151-R176 PolarHBondContact O-N 2.78Å
152	E	98.3	Very high	96.7	Very high	20 Å²	20	29.1 Å²	29.1	9%	0.093	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	127.1	-177.6	-54.5	-171.5	136.3	0	0	111.2	P49 L127 S128 I129 F154 R176	P49-E152 HydrophobicContact CB-CG 4.22Å; P49-E152 HydrophobicContact CG-CG 4.49Å; L127-E152 PolarHBondContact O-N 3.29Å; S128-E152 WeakPolarHBondContact CA-O 3.03Å; I129-E152 PolarHBondContact N-O 3.35Å; I129-E152 VanDerWaalsContact N-O 3.16Å; E152-F154 HydrophobicContact CB-CE2 3.67Å; E152-F154 HydrophobicContact CB-CZ 4.05Å; E152-R176 HydrophobicContact CB-CB 4.49Å; E152-R176 HydrophobicContact CG-CB 4.18Å; E152-R176 HydrophobicContact CG-CG 4.34Å; E152-R176 VanDerWaalsContact OE1-CD 3.3Å; E152-R176 WeakPolarHBondContact OE1-CD 3.26Å; E152-R176 IonicContact OE1-CZ 2.88Å; E152-R176 IonicContact OE1-NE 3.04Å; E152-R176 IonicContact OE1-NH1 2.69Å; E152-R176 PolarHBondContact OE1-NH1 3.07Å
153	L	98.4	Very high	96.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	115.2	179.8	176.7	56.7	0	0	0	110.5	I129 F144 L150 L155 F168 L171 L174 R176 L177 H178	I129-L153 HydrophobicContact CG2-CD1 3.46Å; I129-L153 VanDerWaalsContact CG2-CD1 3.46Å; F144-L153 HydrophobicContact CD2-CD2 3.92Å; F144-L153 HydrophobicContact CE1-CD1 4.13Å; F144-L153 HydrophobicContact CE2-CD2 3.86Å; F144-L153 HydrophobicContact CG-CD2 4.37Å; F144-L153 HydrophobicContact CZ-CD1 4.18Å; F144-L153 HydrophobicContact CZ-CD2 4.25Å; L150-L153 HydrophobicContact CD2-CB 4.02Å; L150-L153 HydrophobicContact CD2-CD1 4.29Å; L150-L153 HydrophobicContact CD2-CG 4.5Å; L153-L155 HydrophobicContact CD1-CD1 4.18Å; L153-L155 HydrophobicContact CD1-CD2 4.36Å; L153-L155 HydrophobicContact CD1-CG 3.98Å; L153-L155 HydrophobicContact CD2-CD1 3.9Å; L153-L155 HydrophobicContact CG-CD1 3.91Å; L153-L155 HydrophobicContact CG-CG 4.05Å; L153-F168 HydrophobicContact CD2-CD1 4.37Å; L153-F168 HydrophobicContact CD2-CE1 4.18Å; L153-L171 HydrophobicContact CD2-CD1 4.04Å; L153-L174 HydrophobicContact CB-CD1 3.84Å; L153-L174 HydrophobicContact CB-CD2 4.49Å; L153-R176 PolarHBondContact N-O 2.64Å; L153-L177 HydrophobicContact CB-CD1 4.12Å; L153-L177 HydrophobicContact CD2-CD1 3.9Å; L153-L177 HydrophobicContact CG-CD1 4Å; L153-H178 PolarHBondContact O-N 3.28Å
154	F	98.5	Very high	97	Very high	22 Å²	22	28.6 Å²	28.6	10%	0.096	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.3	-179.8	-51.6	-92.6	0	0	0	111.9	I129 H130 L131 E132 E152 H178	I129-F154 PolarHBondContact O-N 3.06Å; I129-F154 VanDerWaalsContact O-N 3.11Å; H130-F154 AromaticContact CE1-CD2 3.37Å; H130-F154 WeakPolarHBondContact CE1-CD2 3.47Å; H130-F154 AromaticContact CE1-CE2 3.29Å; H130-F154 WeakPolarHBondContact CE1-CE2 3.27Å; H130-F154 AromaticContact CE1-CZ 3.93Å; H130-F154 AromaticContact CG-CD2 3.91Å; H130-F154 AromaticContact ND1-CD2 3.33Å; H130-F154 VanDerWaalsContact ND1-CD2 3.33Å; H130-F154 WeakPolarHBondContact ND1-CD2 3.44Å; H130-F154 AromaticContact ND1-CE2 3.78Å; H130-F154 AromaticContact ND1-CG 3.74Å; H130-F154 AromaticContact NE2-CD2 3.97Å; H130-F154 AromaticContact NE2-CE2 3.78Å; L131-F154 CarbonylContact C-O 3.07Å; L131-F154 WeakPolarHBondContact CA-O 3.39Å; L131-F154 WeakPolarHBondContact CB-O 3.46Å; L131-F154 PolarHBondContact N-O 3.17Å; E132-F154 HydrophobicContact CG-CB 3.95Å; E132-F154 WeakPolarHBondContact OE1-CB 3.5Å; E132-F154 WeakPolarHBondContact OE2-CB 3.28Å; E152-F154 HydrophobicContact CB-CE2 3.67Å; E152-F154 HydrophobicContact CB-CZ 4.05Å; F154-H178 HydrophobicContact CD1-CB 3.82Å; F154-H178 AromaticContact CD1-CD2 3.89Å; F154-H178 AromaticContact CD1-CE1 3.99Å; F154-H178 AromaticContact CD1-CG 3.53Å; F154-H178 AromaticContact CD1-ND1 3.58Å; F154-H178 AromaticContact CE1-CD2 3.79Å; F154-H178 AromaticContact CE1-CE1 3.58Å; F154-H178 AromaticContact CE1-CG 3.83Å; F154-H178 AromaticContact CE1-ND1 3.67Å; F154-H178 AromaticContact CE1-NE2 3.68Å
155	L	98.3	Very high	97.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.183	C	C	.	.			trans	-126.5	18.6	-177	-69	167.8	0	0	0	112	L131 L136 L139 F144 L153 N158 L160 H178 I179 N182	L131-L155 HydrophobicContact CB-CD2 3.87Å; L131-L155 HydrophobicContact CD1-CD2 3.92Å; L136-L155 HydrophobicContact CD1-CD2 3.61Å; L139-L155 HydrophobicContact CD1-CD1 4.02Å; F144-L155 HydrophobicContact CE2-CD1 4.14Å; F144-L155 HydrophobicContact CZ-CD1 4.11Å; F144-L155 HydrophobicContact CZ-CD2 4.02Å; L153-L155 HydrophobicContact CD1-CD1 4.18Å; L153-L155 HydrophobicContact CD1-CD2 4.36Å; L153-L155 HydrophobicContact CD1-CG 3.98Å; L153-L155 HydrophobicContact CD2-CD1 3.9Å; L153-L155 HydrophobicContact CG-CD1 3.91Å; L153-L155 HydrophobicContact CG-CG 4.05Å; L155-N158 PolarHBondContact O-ND2 3.5Å; L155-N158 VanDerWaalsContact O-ND2 3.08Å; L155-L160 HydrophobicContact CB-CD1 4.3Å; L155-H178 CarbonylContact C-O 3.28Å; L155-H178 WeakPolarHBondContact CA-O 3.07Å; L155-H178 PolarHBondContact N-O 2.97Å; L155-I179 HydrophobicContact CB-CG2 3.99Å; L155-I179 HydrophobicContact CD1-CG2 4.08Å; L155-N182 PolarHBondContact O-ND2 2.64Å
156	S	97.7	Very high	97.2	Very high	9 Å²	9	28.8 Å²	28.8	6%	0.063	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	154.7	-175.7	-57.9	0	0	0	0	112	E132 E133 N158 H178 N180	E132-S156 WeakPolarHBondContact CA-O 3.14Å; E133-S156 PolarHBondContact N-O 2.71Å; S156-N158 VanDerWaalsContact C-N 3.29Å; S156-N158 PolarHBondContact O-N 2.95Å; S156-N158 PolarHBondContact O-ND2 3.06Å; S156-H178 PolarHBondContact N-O 3.31Å; S156-N180 CarbonylContact C-O 3.18Å; S156-N180 WeakPolarHBondContact CA-O 3.43Å; S156-N180 PolarHBondContact OG-ND2 3.34Å
157	H	97.6	Very high	97.4	Very high	99 Å²	99	28 Å²	28	46%	0.458	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	38.3	176.2	-58.8	94.5	0	0	0	114	E133 N180 N181	E133-H157 WeakPolarHBondContact CA-O 3.38Å; E133-H157 HydrophobicContact CG-CB 3.79Å; H157-N180 PolarHBondContact N-O 2.83Å; H157-N181 WeakPolarHBondContact CA-O 3.46Å; H157-N181 VanDerWaalsContact CD2-CB 3.42Å; H157-N181 WeakPolarHBondContact CD2-CB 3.17Å
158	N	98	Very high	97.5	Very high	6 Å²	6	27.8 Å²	27.8	3%	0.032	16%	0.16	C	C	.	.	S	Bend	trans	-102.3	-166.2	170.3	-85.7	-85.7	0	0	0	110.1	L131 N134 H135 L136 L155 S156 L160 N182	L131-N158 PolarHBondContact O-ND2 3.09Å; N134-N158 WeakPolarHBondContact CA-OD1 3.45Å; N134-N158 WeakPolarHBondContact CB-OD1 3.36Å; N134-N158 PolarHBondContact N-OD1 3.31Å; N134-N158 PolarHBondContact O-OD1 2.95Å; H135-N158 PolarHBondContact N-OD1 2.85Å; L136-N158 HydrophobicContact CB-CB 4.23Å; L136-N158 WeakPolarHBondContact CB-OD1 3.28Å; L136-N158 PolarHBondContact N-OD1 3.3Å; L155-N158 PolarHBondContact O-ND2 3.5Å; L155-N158 VanDerWaalsContact O-ND2 3.08Å; S156-N158 VanDerWaalsContact C-N 3.29Å; S156-N158 PolarHBondContact O-N 2.95Å; S156-N158 PolarHBondContact O-ND2 3.06Å; N158-L160 HydrophobicContact CB-CG 4.17Å; N158-N182 VanDerWaalsContact CA-OD1 3.29Å; N158-N182 WeakPolarHBondContact CA-OD1 3.37Å; N158-N182 WeakPolarHBondContact CB-OD1 3.28Å; N158-N182 PolarHBondContact N-OD1 3Å; N158-N182 PolarHBondContact O-OD1 3.1Å
159	N	97.8	Very high	97.6	Very high	56 Å²	56	28 Å²	28	30%	0.299	16%	0.158	S	C	.	.			trans	-111.7	27.8	177.3	-68	-54.4	0	0	0	112.1	L136 S137 H161 N182 R183	L136-N159 CarbonylContact O-C 3.42Å; L136-N159 VanDerWaalsContact O-CA 3.25Å; L136-N159 WeakPolarHBondContact O-CA 3.32Å; L136-N159 PolarHBondContact O-N 3.34Å; S137-N159 WeakPolarHBondContact CA-O 3.43Å; N159-H161 PolarHBondContact O-N 3.2Å; N159-H161 VanDerWaalsContact O-N 3.14Å; N159-H161 PolarHBondContact O-ND1 3.41Å; N159-H161 VanDerWaalsContact O-ND1 3.16Å; N159-N182 PolarHBondContact N-OD1 2.8Å; N159-R183 PolarHBondContact OD1-NE 3.23Å
160	L	98.2	Very high	97.5	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.			trans	-64.7	115.2	-175.5	-61.2	174.7	0	0	0	110.1	L136 S137 L139 L155 N158 N182 R183 L184	L136-L160 HydrophobicContact CB-CD2 3.85Å; L136-L160 PolarHBondContact O-N 2.8Å; S137-L160 WeakPolarHBondContact O-CA 3.44Å; L139-L160 HydrophobicContact CD1-CD1 4.23Å; L139-L160 HydrophobicContact CD2-CD1 4.46Å; L139-L160 HydrophobicContact CD2-CD2 3.92Å; L139-L160 HydrophobicContact CG-CD1 4.26Å; L139-L160 HydrophobicContact CG-CD2 3.93Å; L155-L160 HydrophobicContact CB-CD1 4.3Å; N158-L160 HydrophobicContact CB-CG 4.17Å; L160-N182 HydrophobicContact CB-CB 4Å; L160-N182 VanDerWaalsContact CB-OD1 3.24Å; L160-N182 WeakPolarHBondContact CB-OD1 3.4Å; L160-N182 VanDerWaalsContact CG-OD1 3.32Å; L160-N182 WeakPolarHBondContact CG-OD1 3.49Å; L160-N182 PolarHBondContact N-OD1 3.15Å; L160-R183 CarbonylContact O-C 3.22Å; L160-R183 VanDerWaalsContact O-C 3.23Å; L160-R183 VanDerWaalsContact O-CA 3.3Å; L160-R183 WeakPolarHBondContact O-CA 3.23Å; L160-R183 PolarHBondContact O-N 3Å; L160-L184 PolarHBondContact O-N 3.49Å
161	H	97.1	Very high	97.5	Very high	94 Å²	94	28 Å²	28	44%	0.435	16%	0.16	S	C	.	.			trans	-117.6	-6.7	173.4	56.2	-79.5	0	0	0	112.4	S137 H138 N159 R183	S137-H161 PolarHBondContact O-CE1 3.18Å; S137-H161 PolarHBondContact O-N 2.98Å; S137-H161 VanDerWaalsContact O-N 3.11Å; S137-H161 PolarHBondContact O-ND1 3.11Å; S137-H161 VanDerWaalsContact O-ND1 3.16Å; H138-H161 AromaticContact CD2-NE2 3.95Å; H138-H161 AromaticContact CE1-CE1 3.23Å; H138-H161 PolarHBondContact CE1-CE1 2.96Å; H138-H161 AromaticContact CE1-NE2 3.3Å; H138-H161 PolarHBondContact CE1-NE2 3.06Å; H138-H161 VanDerWaalsContact CE1-NE2 3.3Å; H138-H161 AromaticContact ND1-CE1 3.85Å; H138-H161 AromaticContact NE2-CE1 3.51Å; H138-H161 AromaticContact NE2-NE2 3.11Å; H138-H161 PolarHBondContact NE2-NE2 3.45Å; H138-H161 VanDerWaalsContact NE2-NE2 3.11Å; N159-H161 PolarHBondContact O-N 3.2Å; N159-H161 VanDerWaalsContact O-N 3.14Å; N159-H161 PolarHBondContact O-ND1 3.41Å; N159-H161 VanDerWaalsContact O-ND1 3.16Å; H161-R183 HydrophobicContact CB-CB 4.02Å
162	S	97.3	Very high	97.3	Very high	55 Å²	55	31.3 Å²	31.3	39%	0.385	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	134.6	176.2	-175	0	0	0	0	111.4	H138 L139	H138-S162 WeakPolarHBondContact CA-O 3.46Å; L139-S162 PolarHBondContact N-O 2.99Å; L139-S162 VanDerWaalsContact N-O 3.07Å
163	I	98.1	Very high	97.2	Very high	7 Å²	7	33.1 Å²	33.1	4%	0.036	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.1	171.6	-60.6	176.7	0	0	0	106.2	L139 A167 F168 L184 W191	L139-I163 HydrophobicContact CB-CG1 4.33Å; L139-I163 HydrophobicContact CB-CG2 4.26Å; L139-I163 HydrophobicContact CD1-CD1 4.16Å; L139-I163 HydrophobicContact CD1-CG1 4Å; L139-I163 HydrophobicContact CD1-CG2 4.35Å; L139-I163 HydrophobicContact CG-CG1 4.24Å; I163-A167 HydrophobicContact CG2-CB 3.65Å; I163-F168 HydrophobicContact CD1-CZ 4.46Å; I163-F168 HydrophobicContact CG2-CE2 3.96Å; I163-F168 HydrophobicContact CG2-CZ 4.34Å; I163-L184 HydrophobicContact CD1-CD1 3.84Å; I163-L184 HydrophobicContact CD1-CD2 4.09Å; I163-L184 HydrophobicContact CG1-CD2 4.03Å; I163-W191 HydrophobicContact CB-CD2 4.13Å; I163-W191 HydrophobicContact CB-CG 4.35Å; I163-W191 HydrophobicContact CB-CZ2 4.05Å; I163-W191 HydrophobicContact CD1-CE3 4.44Å; I163-W191 HydrophobicContact CD1-CZ3 4.44Å; I163-W191 HydrophobicContact CG2-CB 4.45Å; I163-W191 HydrophobicContact CG2-CD2 4.15Å; I163-W191 HydrophobicContact CG2-CG 3.88Å; I163-W191 PolarHBondContact O-NE1 3.09Å
164	A	97.9	Very high	97.1	Very high	26 Å²	26	33.1 Å²	33.1	22%	0.215	19%	0.194	C	C	.	.			trans	-71.3	147.1	177.6	0	0	0	0	0	110.7	L139 G166 A167	L139-A164 WeakPolarHBondContact O-CB 3.43Å; L139-A164 PolarHBondContact O-N 3.22Å; A164-G166 PolarHBondContact O-N 2.9Å; A164-A167 VanDerWaalsContact O-CB 3.22Å; A164-A167 WeakPolarHBondContact O-CB 3.48Å; A164-A167 PolarHBondContact O-N 3.26Å
165	P	97.3	Very high	97.1	Very high	60 Å²	60	36.1 Å²	36.1	39%	0.39	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	130	162	-25	35.7	0	0	0	109.7	A167 R190	P165-A167 VanDerWaalsContact C-N 3.33Å; P165-A167 PolarHBondContact O-N 2.84Å; P165-R190 HydrophobicContact CB-CB 4.01Å; P165-R190 HydrophobicContact CG-CB 4.43Å
166	G	96.3	Very high	97.1	Very high	10 Å²	10	39 Å²	39	10%	0.103	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	11.9	-176.9	0	0	0	0	0	115.7	A142 A164 F168 N169	A142-G166 PolarHBondContact N-O 3.19Å; A164-G166 PolarHBondContact O-N 2.9Å; G166-F168 PolarHBondContact O-N 2.85Å; G166-F168 VanDerWaalsContact O-N 3.14Å; G166-N169 VanDerWaalsContact CA-OD1 3.29Å; G166-N169 WeakPolarHBondContact CA-OD1 3.44Å; G166-N169 WeakPolarHBondContact O-CB 3.19Å; G166-N169 PolarHBondContact O-N 2.95Å; G166-N169 PolarHBondContact O-ND2 1.98Å
167	A	98	Very high	97.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29	174.2	0	0	0	0	0	113.8	L139 P140 S143 I163 A164 P165	L139-A167 HydrophobicContact CB-CB 3.91Å; P140-A167 VanDerWaalsContact O-CA 3.31Å; P140-A167 WeakPolarHBondContact O-CA 3.35Å; P140-A167 WeakPolarHBondContact O-CB 3.14Å; S143-A167 PolarHBondContact N-O 3.03Å; I163-A167 HydrophobicContact CG2-CB 3.65Å; A164-A167 VanDerWaalsContact O-CB 3.22Å; A164-A167 WeakPolarHBondContact O-CB 3.48Å; A164-A167 PolarHBondContact O-N 3.26Å; P165-A167 VanDerWaalsContact C-N 3.33Å; P165-A167 PolarHBondContact O-N 2.84Å
168	F	97.6	Very high	97.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	13.8	179.6	-54.3	-67.3	0	0	0	113.7	L139 L153 I163 G166 G170 L171 L177 W191 L195	L139-F168 HydrophobicContact CD1-CE1 3.89Å; L139-F168 HydrophobicContact CD1-CZ 3.8Å; L153-F168 HydrophobicContact CD2-CD1 4.37Å; L153-F168 HydrophobicContact CD2-CE1 4.18Å; I163-F168 HydrophobicContact CD1-CZ 4.46Å; I163-F168 HydrophobicContact CG2-CE2 3.96Å; I163-F168 HydrophobicContact CG2-CZ 4.34Å; G166-F168 PolarHBondContact O-N 2.85Å; G166-F168 VanDerWaalsContact O-N 3.14Å; F168-G170 PolarHBondContact O-N 3.42Å; F168-L171 HydrophobicContact CB-CD1 4.21Å; F168-L171 HydrophobicContact CD1-CD1 4.01Å; F168-L171 WeakPolarHBondContact O-CB 3.45Å; F168-L171 PolarHBondContact O-N 3.18Å; F168-L177 HydrophobicContact CE1-CD1 4.1Å; F168-L177 HydrophobicContact CE1-CD2 4.19Å; F168-L177 HydrophobicContact CE2-CD2 4.16Å; F168-L177 HydrophobicContact CZ-CD1 4.38Å; F168-L177 HydrophobicContact CZ-CD2 3.89Å; F168-W191 HydrophobicContact CD2-CB 4.49Å; F168-W191 WeakPolarHBondContact CD2-O 3.42Å; F168-W191 HydrophobicContact CE2-CB 4.3Å; F168-L195 HydrophobicContact CB-CD1 3.95Å; F168-L195 HydrophobicContact CB-CD2 3.99Å; F168-L195 HydrophobicContact CB-CG 4.05Å; F168-L195 HydrophobicContact CD2-CD1 3.91Å; F168-L195 HydrophobicContact CG-CD1 3.94Å
169	N	96.4	Very high	97.2	Very high	61 Å²	61	35.1 Å²	35.1	33%	0.326	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	135.8	175.1	-72.7	-5.3	0	0	0	110.8	G166	G166-N169 VanDerWaalsContact CA-OD1 3.29Å; G166-N169 WeakPolarHBondContact CA-OD1 3.44Å; G166-N169 WeakPolarHBondContact O-CB 3.19Å; G166-N169 PolarHBondContact O-N 2.95Å; G166-N169 PolarHBondContact O-ND2 1.98Å
170	G	93.8	Very high	97.1	Very high	24 Å²	24	33.2 Å²	33.2	25%	0.247	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	1.9	-177.1	0	0	0	0	0	114.8	F168	F168-G170 PolarHBondContact O-N 3.42Å
171	L	96.3	Very high	97	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.206	C	C	.	.			trans	-98.7	50.5	174.3	-60.9	-173.9	0	0	0	111.8	F144 L147 L150 L153 F168 S173 L174 L195	F144-L171 HydrophobicContact CB-CD1 3.94Å; F144-L171 HydrophobicContact CB-CD2 3.78Å; F144-L171 HydrophobicContact CB-CG 4.12Å; F144-L171 HydrophobicContact CD2-CD1 4.37Å; F144-L171 HydrophobicContact CG-CD1 4.47Å; F144-L171 WeakPolarHBondContact O-CD2 3.37Å; L147-L171 WeakPolarHBondContact O-CD2 3.39Å; L150-L171 HydrophobicContact CB-CD2 4.07Å; L150-L171 HydrophobicContact CD2-CD2 4.05Å; L153-L171 HydrophobicContact CD2-CD1 4.04Å; F168-L171 HydrophobicContact CB-CD1 4.21Å; F168-L171 HydrophobicContact CD1-CD1 4.01Å; F168-L171 WeakPolarHBondContact O-CB 3.45Å; F168-L171 PolarHBondContact O-N 3.18Å; L171-S173 PolarHBondContact O-N 2.88Å; L171-S173 VanDerWaalsContact O-N 3.17Å; L171-L174 HydrophobicContact CB-CB 4.1Å; L171-L174 HydrophobicContact CD1-CD2 4.07Å; L171-L174 WeakPolarHBondContact O-CB 3.31Å; L171-L174 PolarHBondContact O-N 3.45Å; L171-L174 VanDerWaalsContact O-N 3.15Å; L171-L195 HydrophobicContact CB-CD2 4.11Å
172	D	93.8	Very high	97.1	Very high	109 Å²	109	32.8 Å²	32.8	58%	0.583	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-19.3	-171	-56	-53.7	0	0	0	113.6
173	S	95.9	Very high	97.1	Very high	57 Å²	57	37.6 Å²	37.6	40%	0.399	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	3.7	179.1	-59.1	0	0	0	0	113.9	L150 L171 R175	L150-S173 CarbonylContact O-C 3.59Å; L150-S173 VanDerWaalsContact O-C 3.3Å; L171-S173 PolarHBondContact O-N 2.88Å; L171-S173 VanDerWaalsContact O-N 3.17Å; S173-R175 PolarHBondContact O-N 3.39Å
174	L	97.8	Very high	97.1	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.196	C	C	.	.			trans	-70.4	123.6	-172.3	-162.7	77.1	0	0	0	111.4	L150 L153 L171 L177 L195 Q197 L198	L150-L174 HydrophobicContact CB-CD1 4.49Å; L150-L174 HydrophobicContact CD2-CD1 4.1Å; L150-L174 HydrophobicContact CG-CD1 4.14Å; L150-L174 WeakPolarHBondContact O-CA 3.37Å; L150-L174 PolarHBondContact O-N 3.43Å; L153-L174 HydrophobicContact CB-CD1 3.84Å; L153-L174 HydrophobicContact CB-CD2 4.49Å; L171-L174 HydrophobicContact CB-CB 4.1Å; L171-L174 HydrophobicContact CD1-CD2 4.07Å; L171-L174 WeakPolarHBondContact O-CB 3.31Å; L171-L174 PolarHBondContact O-N 3.45Å; L171-L174 VanDerWaalsContact O-N 3.15Å; L174-L177 HydrophobicContact CD2-CB 4.18Å; L174-L177 HydrophobicContact CD2-CD1 4.42Å; L174-L195 HydrophobicContact CB-CD2 3.94Å; L174-L195 HydrophobicContact CD2-CD1 4.31Å; L174-L195 HydrophobicContact CD2-CD2 3.74Å; L174-L195 HydrophobicContact CG-CD2 4.48Å; L174-Q197 CarbonylContact O-C 3.52Å; L174-L198 HydrophobicContact CD2-CD1 4.06Å; L174-L198 HydrophobicContact CG-CD1 4.12Å; L174-L198 WeakPolarHBondContact O-CA 3.33Å; L174-L198 PolarHBondContact O-N 3Å
175	R	97.6	Very high	97	Very high	85 Å²	85	40.5 Å²	40.5	32%	0.321	21%	0.212	S	C	.	.			trans	-107.1	-33.2	179.6	-63.7	-176.8	-175.3	-108.6	5.8	112.8	Q151 S173 E199 V200	Q151-R175 PolarHBondContact O-N 3.14Å; S173-R175 PolarHBondContact O-N 3.39Å; R175-E199 IonicContact CZ-OE1 2.74Å; R175-E199 IonicContact NH1-OE1 3.12Å; R175-E199 PolarHBondContact NH1-OE1 2.99Å; R175-E199 PolarHBondContact O-N 3.03Å; R175-V200 PolarHBondContact O-N 2.7Å
176	R	98.4	Very high	96.8	Very high	60 Å²	60	41.8 Å²	41.8	23%	0.226	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.9	-177.1	-53.5	-166.6	-176.9	148.4	-2.6	111.5	P49 S51 Q151 E152 L153 V200	P49-R176 PolarHBondContact O-NH1 3.31Å; P49-R176 PolarHBondContact O-NH2 3.04Å; S51-R176 PolarHBondContact OG-NH2 2.85Å; Q151-R176 PolarHBondContact O-N 2.78Å; E152-R176 HydrophobicContact CB-CB 4.49Å; E152-R176 HydrophobicContact CG-CB 4.18Å; E152-R176 HydrophobicContact CG-CG 4.34Å; E152-R176 VanDerWaalsContact OE1-CD 3.3Å; E152-R176 WeakPolarHBondContact OE1-CD 3.26Å; E152-R176 IonicContact OE1-CZ 2.88Å; E152-R176 IonicContact OE1-NE 3.04Å; E152-R176 IonicContact OE1-NH1 2.69Å; E152-R176 PolarHBondContact OE1-NH1 3.07Å; L153-R176 PolarHBondContact N-O 2.64Å; R176-V200 WeakPolarHBondContact CA-O 3.35Å; R176-V200 HydrophobicContact CB-CB 4.36Å; R176-V200 HydrophobicContact CG-CB 4.04Å; R176-V200 HydrophobicContact CG-CG2 4.18Å
177	L	98.6	Very high	96.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	116.6	178	178.6	60.1	0	0	0	110.3	L153 F168 L174 I179 L195 L198 V200 L201 M202	L153-L177 HydrophobicContact CB-CD1 4.12Å; L153-L177 HydrophobicContact CD2-CD1 3.9Å; L153-L177 HydrophobicContact CG-CD1 4Å; F168-L177 HydrophobicContact CE1-CD1 4.1Å; F168-L177 HydrophobicContact CE1-CD2 4.19Å; F168-L177 HydrophobicContact CE2-CD2 4.16Å; F168-L177 HydrophobicContact CZ-CD1 4.38Å; F168-L177 HydrophobicContact CZ-CD2 3.89Å; L174-L177 HydrophobicContact CD2-CB 4.18Å; L174-L177 HydrophobicContact CD2-CD1 4.42Å; L177-I179 HydrophobicContact CD1-CG2 3.92Å; L177-I179 HydrophobicContact CG-CG2 4.19Å; L177-L195 HydrophobicContact CD2-CD1 3.98Å; L177-L198 HydrophobicContact CB-CD1 3.77Å; L177-L198 HydrophobicContact CB-CD2 4.16Å; L177-V200 PolarHBondContact N-O 3.44Å; L177-L201 HydrophobicContact CB-CD1 4.16Å; L177-L201 HydrophobicContact CD2-CD1 4.06Å; L177-L201 HydrophobicContact CG-CD1 4.13Å; L177-M202 PolarHBondContact O-N 3.49Å
178	H	98.6	Very high	96.7	Very high	32 Å²	32	43.4 Å²	43.4	15%	0.148	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	107.7	180	-68.2	-139.5	0	0	0	109.5	L153 F154 L155 S156 M202	L153-H178 PolarHBondContact O-N 3.28Å; F154-H178 HydrophobicContact CD1-CB 3.82Å; F154-H178 AromaticContact CD1-CD2 3.89Å; F154-H178 AromaticContact CD1-CE1 3.99Å; F154-H178 AromaticContact CD1-CG 3.53Å; F154-H178 AromaticContact CD1-ND1 3.58Å; F154-H178 AromaticContact CE1-CD2 3.79Å; F154-H178 AromaticContact CE1-CE1 3.58Å; F154-H178 AromaticContact CE1-CG 3.83Å; F154-H178 AromaticContact CE1-ND1 3.67Å; F154-H178 AromaticContact CE1-NE2 3.68Å; L155-H178 CarbonylContact C-O 3.28Å; L155-H178 WeakPolarHBondContact CA-O 3.07Å; L155-H178 PolarHBondContact N-O 2.97Å; S156-H178 PolarHBondContact N-O 3.31Å; H178-M202 PolarHBondContact CE1-SD 2.78Å; H178-M202 PolarHBondContact ND1-SD 2.92Å
179	I	97.6	Very high	96.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.			trans	-123.7	28.2	-179.6	48.9	173.8	0	0	0	111.6	L155 L177 N182 L184 L201 M202 L203 N206	L155-I179 HydrophobicContact CB-CG2 3.99Å; L155-I179 HydrophobicContact CD1-CG2 4.08Å; L177-I179 HydrophobicContact CD1-CG2 3.92Å; L177-I179 HydrophobicContact CG-CG2 4.19Å; I179-N182 PolarHBondContact O-ND2 3.47Å; I179-L184 HydrophobicContact CD1-CD1 4.45Å; I179-L201 HydrophobicContact CD1-CD1 4.33Å; I179-L201 HydrophobicContact CG1-CD1 4.38Å; I179-M202 WeakPolarHBondContact CG1-O 3.27Å; I179-M202 PolarHBondContact N-O 2.82Å; I179-L203 HydrophobicContact CD1-CD2 3.29Å; I179-L203 HydrophobicContact CD1-CG 3.86Å; I179-L203 HydrophobicContact CG1-CD2 3.69Å; I179-L203 HydrophobicContact CG1-CG 4Å; I179-N206 PolarHBondContact O-ND2 3.17Å
180	N	95.9	Very high	96.6	Very high	16 Å²	16	48 Å²	48	9%	0.086	24%	0.244	C	C	.	.			trans	-63.7	156.9	-177.5	-45	-67.5	0	0	0	113	S156 H157 N182 M202 L203 G204	S156-N180 CarbonylContact C-O 3.18Å; S156-N180 WeakPolarHBondContact CA-O 3.43Å; S156-N180 PolarHBondContact OG-ND2 3.34Å; H157-N180 PolarHBondContact N-O 2.83Å; N180-N182 VanDerWaalsContact C-N 3.27Å; N180-N182 PolarHBondContact O-N 3.05Å; N180-N182 PolarHBondContact O-ND2 3.19Å; N180-N182 VanDerWaalsContact O-ND2 3.11Å; N180-M202 WeakPolarHBondContact ND2-CB 3.35Å; N180-M202 WeakPolarHBondContact OD1-CA 3.49Å; N180-M202 WeakPolarHBondContact OD1-CB 3.46Å; N180-M202 PolarHBondContact OD1-O 2.87Å; N180-L203 PolarHBondContact OD1-N 2.95Å; N180-G204 CarbonylContact C-O 3.54Å; N180-G204 WeakPolarHBondContact CA-O 3.41Å; N180-G204 PolarHBondContact OD1-N 3.5Å
181	N	97.4	Very high	96.7	Very high	77 Å²	77	47.4 Å²	47.4	41%	0.412	23%	0.234	S	C	.	.	S	Bend	trans	53	47.1	169.3	-62.9	83.4	0	0	0	112.1	H157 G204	H157-N181 WeakPolarHBondContact CA-O 3.46Å; H157-N181 VanDerWaalsContact CD2-CB 3.42Å; H157-N181 WeakPolarHBondContact CD2-CB 3.17Å; N181-G204 PolarHBondContact N-O 2.79Å
182	N	98.1	Very high	96.7	Very high	8 Å²	8	47.5 Å²	47.5	4%	0.043	23%	0.234	C	C	.	.	S	Bend	trans	-109.6	-160.7	172.9	-85.4	-74.5	0	0	0	109.1	L155 N158 N159 L160 I179 N180 N206	L155-N182 PolarHBondContact O-ND2 2.64Å; N158-N182 VanDerWaalsContact CA-OD1 3.29Å; N158-N182 WeakPolarHBondContact CA-OD1 3.37Å; N158-N182 WeakPolarHBondContact CB-OD1 3.28Å; N158-N182 PolarHBondContact N-OD1 3Å; N158-N182 PolarHBondContact O-OD1 3.1Å; N159-N182 PolarHBondContact N-OD1 2.8Å; L160-N182 HydrophobicContact CB-CB 4Å; L160-N182 VanDerWaalsContact CB-OD1 3.24Å; L160-N182 WeakPolarHBondContact CB-OD1 3.4Å; L160-N182 VanDerWaalsContact CG-OD1 3.32Å; L160-N182 WeakPolarHBondContact CG-OD1 3.49Å; L160-N182 PolarHBondContact N-OD1 3.15Å; I179-N182 PolarHBondContact O-ND2 3.47Å; N180-N182 VanDerWaalsContact C-N 3.27Å; N180-N182 PolarHBondContact O-N 3.05Å; N180-N182 PolarHBondContact O-ND2 3.19Å; N180-N182 VanDerWaalsContact O-ND2 3.11Å; N182-N206 VanDerWaalsContact CA-OD1 3.31Å; N182-N206 WeakPolarHBondContact CA-OD1 3.01Å; N182-N206 WeakPolarHBondContact CB-OD1 3.07Å; N182-N206 PolarHBondContact N-OD1 3.3Å; N182-N206 PolarHBondContact O-OD1 3.23Å
183	R	97.6	Very high	96.8	Very high	156 Å²	156	51.1 Å²	51.1	59%	0.589	24%	0.24	S	C	*	.			trans	-120.6	28.6	-176.6	-60.7	-176.7	-176	-110.9	0.5	112.1	N159 L160 H161 N206	N159-R183 PolarHBondContact OD1-NE 3.23Å; L160-R183 CarbonylContact O-C 3.22Å; L160-R183 VanDerWaalsContact O-C 3.23Å; L160-R183 VanDerWaalsContact O-CA 3.3Å; L160-R183 WeakPolarHBondContact O-CA 3.23Å; L160-R183 PolarHBondContact O-N 3Å; H161-R183 HydrophobicContact CB-CB 4.02Å; R183-N206 PolarHBondContact N-OD1 3.16Å
184	L	97.4	Very high	96.8	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	23%	0.227	C	C	.	.			trans	-74.1	129.4	178.6	-57.5	171.4	0	0	0	110.1	L160 I163 I179 W191 L203 N206 P207	L160-L184 PolarHBondContact O-N 3.49Å; I163-L184 HydrophobicContact CD1-CD1 3.84Å; I163-L184 HydrophobicContact CD1-CD2 4.09Å; I163-L184 HydrophobicContact CG1-CD2 4.03Å; I179-L184 HydrophobicContact CD1-CD1 4.45Å; L184-W191 HydrophobicContact CD1-CH2 4.38Å; L184-W191 HydrophobicContact CD1-CZ3 4.33Å; L184-W191 HydrophobicContact CD2-CH2 4.31Å; L184-L203 HydrophobicContact CD1-CD2 4.44Å; L184-N206 HydrophobicContact CB-CB 4.13Å; L184-N206 WeakPolarHBondContact CB-OD1 3.22Å; L184-N206 WeakPolarHBondContact CG-OD1 3.19Å; L184-N206 PolarHBondContact N-OD1 2.78Å; L184-P207 WeakPolarHBondContact O-CD 3.45Å
185	T	96.1	Very high	96.8	Very high	92 Å²	92	49.2 Å²	49.2	56%	0.564	23%	0.227	S	C	*	.			trans	-102.9	-10.7	-179.7	55.9	0	0	0	0	113.5	P207	T185-P207 WeakPolarHBondContact CA-O 2.89Å; T185-P207 HydrophobicContact CG2-CG 4.23Å
186	T	94.4	Very high	96.6	Very high	87 Å²	87	47.6 Å²	47.6	53%	0.534	23%	0.228	S	C	.	.			trans	-140.4	165.2	-178.1	58.1	0	0	0	0	110.1	W191	T186-W191 WeakPolarHBondContact O-CH2 3.26Å
187	I	95.1	Very high	96.5	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.051	24%	0.239	C	C	.	.			trans	-117.6	121.8	167.7	-60.7	178.6	0	0	0	107.5	W191 F192 L203 V208 L211 P212 F216 M230	I187-W191 HydrophobicContact CG2-CZ3 4.44Å; I187-F192 HydrophobicContact CG2-CE2 3.82Å; I187-F192 HydrophobicContact CG2-CZ 4.43Å; I187-L203 HydrophobicContact CD1-CD1 4.16Å; I187-V208 HydrophobicContact CG1-CG1 4.34Å; I187-V208 HydrophobicContact CG1-CG2 4.35Å; I187-L211 HydrophobicContact CD1-CD2 3.51Å; I187-P212 HydrophobicContact CB-CG 4.5Å; I187-F216 HydrophobicContact CD1-CE1 4.18Å; I187-F216 HydrophobicContact CD1-CZ 3.68Å; I187-F216 HydrophobicContact CG2-CE1 4.15Å; I187-F216 HydrophobicContact CG2-CZ 4.39Å; I187-M230 HydrophobicContact CD1-CE 4.28Å
188	D	95.6	Very high	96.5	Very high	33 Å²	33	49.4 Å²	49.4	18%	0.176	24%	0.239	C	C	.	.			trans	-102.6	118.6	174.2	-171.1	-29.9	0	0	0	109.4	R190 W191	D188-R190 PolarHBondContact O-N 3.48Å; D188-R190 VanDerWaalsContact OD1-CB 3.23Å; D188-R190 WeakPolarHBondContact OD1-CB 3.39Å; D188-R190 VanDerWaalsContact OD1-CG 3.28Å; D188-R190 WeakPolarHBondContact OD1-CG 3.45Å; D188-R190 IonicContact OD1-CZ 3.84Å; D188-R190 PolarHBondContact OD1-N 2.67Å; D188-R190 IonicContact OD1-NE 3.06Å; D188-R190 PolarHBondContact OD1-NE 3.05Å; D188-R190 IonicContact OD2-CZ 3.04Å; D188-R190 VanDerWaalsContact OD2-CZ 3.25Å; D188-R190 IonicContact OD2-NE 2.64Å; D188-R190 PolarHBondContact OD2-NE 3.16Å; D188-R190 IonicContact OD2-NH2 3.07Å; D188-R190 PolarHBondContact OD2-NH2 3.16Å; D188-W191 HydrophobicContact CB-CD2 3.94Å; D188-W191 VanDerWaalsContact CB-CE2 3.49Å; D188-W191 HydrophobicContact CB-CG 4.22Å; D188-W191 HydrophobicContact CB-CZ2 3.9Å; D188-W191 WeakPolarHBondContact O-CB 3.23Å; D188-W191 VanDerWaalsContact O-CG 3.24Å; D188-W191 PolarHBondContact O-N 3.41Å; D188-W191 VanDerWaalsContact O-N 3.1Å
189	P	95.8	Very high	96.5	Very high	43 Å²	43	50 Å²	50	28%	0.279	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-55	-23.9	178.4	-22.2	28.9	0	0	0	114	W191 F192 G215	P189-W191 PolarHBondContact O-N 3.05Å; P189-F192 PolarHBondContact O-N 3.28Å; P189-G215 WeakPolarHBondContact CA-O 3.32Å
190	R	96.4	Very high	96.5	Very high	116 Å²	116	51.4 Å²	51.4	44%	0.438	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-69.5	-18.1	-178.4	-62.7	177.3	-70	178.5	-1.4	113.5	P165 D188 F192	P165-R190 HydrophobicContact CB-CB 4.01Å; P165-R190 HydrophobicContact CG-CB 4.43Å; D188-R190 PolarHBondContact O-N 3.48Å; D188-R190 VanDerWaalsContact OD1-CB 3.23Å; D188-R190 WeakPolarHBondContact OD1-CB 3.39Å; D188-R190 VanDerWaalsContact OD1-CG 3.28Å; D188-R190 WeakPolarHBondContact OD1-CG 3.45Å; D188-R190 IonicContact OD1-CZ 3.84Å; D188-R190 PolarHBondContact OD1-N 2.67Å; D188-R190 IonicContact OD1-NE 3.06Å; D188-R190 PolarHBondContact OD1-NE 3.05Å; D188-R190 IonicContact OD2-CZ 3.04Å; D188-R190 VanDerWaalsContact OD2-CZ 3.25Å; D188-R190 IonicContact OD2-NE 2.64Å; D188-R190 PolarHBondContact OD2-NE 3.16Å; D188-R190 IonicContact OD2-NH2 3.07Å; D188-R190 PolarHBondContact OD2-NH2 3.16Å; R190-F192 VanDerWaalsContact C-N 3.25Å; R190-F192 PolarHBondContact O-N 3.04Å
191	W	96.4	Very high	96.7	Very high	11 Å²	11	50.6 Å²	50.6	4%	0.042	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-61.5	-39.4	173.9	-57.9	-22.7	0	0	0	111.3	I163 F168 L184 T186 I187 D188 P189	I163-W191 HydrophobicContact CB-CD2 4.13Å; I163-W191 HydrophobicContact CB-CG 4.35Å; I163-W191 HydrophobicContact CB-CZ2 4.05Å; I163-W191 HydrophobicContact CD1-CE3 4.44Å; I163-W191 HydrophobicContact CD1-CZ3 4.44Å; I163-W191 HydrophobicContact CG2-CB 4.45Å; I163-W191 HydrophobicContact CG2-CD2 4.15Å; I163-W191 HydrophobicContact CG2-CG 3.88Å; I163-W191 PolarHBondContact O-NE1 3.09Å; F168-W191 HydrophobicContact CD2-CB 4.49Å; F168-W191 WeakPolarHBondContact CD2-O 3.42Å; F168-W191 HydrophobicContact CE2-CB 4.3Å; L184-W191 HydrophobicContact CD1-CH2 4.38Å; L184-W191 HydrophobicContact CD1-CZ3 4.33Å; L184-W191 HydrophobicContact CD2-CH2 4.31Å; T186-W191 WeakPolarHBondContact O-CH2 3.26Å; I187-W191 HydrophobicContact CG2-CZ3 4.44Å; D188-W191 HydrophobicContact CB-CD2 3.94Å; D188-W191 VanDerWaalsContact CB-CE2 3.49Å; D188-W191 HydrophobicContact CB-CG 4.22Å; D188-W191 HydrophobicContact CB-CZ2 3.9Å; D188-W191 WeakPolarHBondContact O-CB 3.23Å; D188-W191 VanDerWaalsContact O-CG 3.24Å; D188-W191 PolarHBondContact O-N 3.41Å; D188-W191 VanDerWaalsContact O-N 3.1Å; P189-W191 PolarHBondContact O-N 3.05Å
192	F	96.7	Very high	96.7	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-90.4	-0.9	-168.8	-55.3	-57.4	0	0	0	114.4	I187 P189 R190 A194 L195 L201 L203 F216 A218 L219	I187-F192 HydrophobicContact CG2-CE2 3.82Å; I187-F192 HydrophobicContact CG2-CZ 4.43Å; P189-F192 PolarHBondContact O-N 3.28Å; R190-F192 VanDerWaalsContact C-N 3.25Å; R190-F192 PolarHBondContact O-N 3.04Å; F192-A194 PolarHBondContact O-N 3.17Å; F192-L195 HydrophobicContact CD1-CD1 4.33Å; F192-L195 PolarHBondContact O-N 2.84Å; F192-L201 HydrophobicContact CD1-CD2 4.5Å; F192-L201 HydrophobicContact CE1-CD1 4.27Å; F192-L201 HydrophobicContact CE1-CD2 3.8Å; F192-L201 HydrophobicContact CZ-CD2 3.89Å; F192-L203 HydrophobicContact CZ-CD1 4.29Å; F192-F216 HydrophobicContact CD2-CD1 4.44Å; F192-F216 AromaticContact CE2-CD1 3.99Å; F192-F216 HydrophobicContact CE2-CD1 3.99Å; F192-F216 HydrophobicContact CE2-CE1 4.18Å; F192-F216 HydrophobicContact CZ-CE1 4.46Å; F192-A218 HydrophobicContact CB-CB 4.18Å; F192-A218 WeakPolarHBondContact O-CB 3.5Å; F192-L219 HydrophobicContact CB-CD1 4.37Å; F192-L219 HydrophobicContact CB-CD2 3.63Å; F192-L219 HydrophobicContact CB-CG 3.87Å; F192-L219 HydrophobicContact CD1-CD1 4.1Å; F192-L219 HydrophobicContact CD1-CD2 4.05Å; F192-L219 HydrophobicContact CD1-CG 4.42Å; F192-L219 HydrophobicContact CD2-CD1 4.32Å; F192-L219 HydrophobicContact CG-CD1 4Å; F192-L219 HydrophobicContact CG-CD2 3.99Å; F192-L219 HydrophobicContact CG-CG 4.06Å
193	R	95.6	Very high	96.6	Very high	185 Å²	185	49.1 Å²	49.1	70%	0.698	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-58.6	-31.8	-176.3	-76.4	-178.7	177.4	-172.9	-1	114	L195	R193-L195 VanDerWaalsContact C-N 3.32Å
194	A	95.4	Very high	96.6	Very high	16 Å²	16	41.9 Å²	41.9	13%	0.132	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-88.6	3.6	178.8	0	0	0	0	0	113.3	F192 P196	F192-A194 PolarHBondContact O-N 3.17Å; A194-P196 WeakPolarHBondContact O-CD 3.35Å
195	L	97.2	Very high	96.5	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	22%	0.222	C	C	.	.			trans	-121.3	47.7	-169.8	-58.1	180	0	0	0	113.8	F168 L171 L174 L177 F192 R193 Q197 L198 L219	F168-L195 HydrophobicContact CB-CD1 3.95Å; F168-L195 HydrophobicContact CB-CD2 3.99Å; F168-L195 HydrophobicContact CB-CG 4.05Å; F168-L195 HydrophobicContact CD2-CD1 3.91Å; F168-L195 HydrophobicContact CG-CD1 3.94Å; L171-L195 HydrophobicContact CB-CD2 4.11Å; L174-L195 HydrophobicContact CB-CD2 3.94Å; L174-L195 HydrophobicContact CD2-CD1 4.31Å; L174-L195 HydrophobicContact CD2-CD2 3.74Å; L174-L195 HydrophobicContact CG-CD2 4.48Å; L177-L195 HydrophobicContact CD2-CD1 3.98Å; F192-L195 HydrophobicContact CD1-CD1 4.33Å; F192-L195 PolarHBondContact O-N 2.84Å; R193-L195 VanDerWaalsContact C-N 3.32Å; L195-Q197 PolarHBondContact O-N 3.05Å; L195-L198 HydrophobicContact CB-CB 4.25Å; L195-L198 WeakPolarHBondContact O-CB 3.4Å; L195-L198 PolarHBondContact O-N 3.22Å; L195-L219 HydrophobicContact CB-CD2 4.15Å; L195-L219 WeakPolarHBondContact O-CD2 3.35Å
196	P	95.3	Very high	96.6	Very high	51 Å²	51	38.5 Å²	38.5	33%	0.331	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.2	-177.4	30	-35.9	0	0	0	113.7	A194 L198 T220 S221	A194-P196 WeakPolarHBondContact O-CD 3.35Å; P196-L198 VanDerWaalsContact C-N 3.35Å; P196-T220 PolarHBondContact O-OG1 3.46Å; P196-S221 WeakPolarHBondContact O-CB 3.43Å; P196-S221 PolarHBondContact O-N 3.39Å; P196-S221 PolarHBondContact O-OG 3.38Å; P196-S221 VanDerWaalsContact O-OG 3.13Å
197	Q	96.3	Very high	96.7	Very high	98 Å²	98	37.7 Å²	37.7	46%	0.458	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2	179.2	-61.7	-59.9	-44.4	0	0	113.6	L174 L195 E199	L174-Q197 CarbonylContact O-C 3.52Å; L195-Q197 PolarHBondContact O-N 3.05Å; Q197-E199 PolarHBondContact O-N 3.25Å
198	L	98.1	Very high	96.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.19	C	C	.	.			trans	-66.8	127	-177.5	-163.6	76.2	0	0	0	110.4	L174 L177 L195 P196 L201 L219 S221 L222	L174-L198 HydrophobicContact CD2-CD1 4.06Å; L174-L198 HydrophobicContact CG-CD1 4.12Å; L174-L198 WeakPolarHBondContact O-CA 3.33Å; L174-L198 PolarHBondContact O-N 3Å; L177-L198 HydrophobicContact CB-CD1 3.77Å; L177-L198 HydrophobicContact CB-CD2 4.16Å; L195-L198 HydrophobicContact CB-CB 4.25Å; L195-L198 WeakPolarHBondContact O-CB 3.4Å; L195-L198 PolarHBondContact O-N 3.22Å; P196-L198 VanDerWaalsContact C-N 3.35Å; L198-L201 HydrophobicContact CD2-CB 3.99Å; L198-L201 HydrophobicContact CD2-CD1 4.26Å; L198-L201 HydrophobicContact CD2-CG 4.5Å; L198-L219 HydrophobicContact CB-CD2 3.98Å; L198-L219 HydrophobicContact CD2-CD1 4.42Å; L198-L219 HydrophobicContact CD2-CD2 3.82Å; L198-S221 CarbonylContact O-C 3.21Å; L198-S221 VanDerWaalsContact O-C 3.26Å; L198-L222 HydrophobicContact CB-CD1 4.49Å; L198-L222 HydrophobicContact CD2-CD1 4.16Å; L198-L222 HydrophobicContact CG-CD1 4.24Å; L198-L222 WeakPolarHBondContact O-CA 3.49Å; L198-L222 PolarHBondContact O-N 3.03Å
199	E	97.9	Very high	96.6	Very high	44 Å²	44	41.8 Å²	41.8	21%	0.206	21%	0.21	C	C	.	.			trans	-103.2	-34.9	-178.4	-64.4	177.5	-166.6	0	0	112	R175 Q197 R223 S224	R175-E199 IonicContact CZ-OE1 2.74Å; R175-E199 IonicContact NH1-OE1 3.12Å; R175-E199 PolarHBondContact NH1-OE1 2.99Å; R175-E199 PolarHBondContact O-N 3.03Å; Q197-E199 PolarHBondContact O-N 3.25Å; E199-R223 PolarHBondContact O-N 3.38Å; E199-S224 PolarHBondContact O-N 3.08Å
200	V	98.5	Very high	96.5	Very high	30 Å²	30	42.2 Å²	42.2	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	122.6	-177.2	-175.2	0	0	0	0	110.2	R175 R176 L177 M202	R175-V200 PolarHBondContact O-N 2.7Å; R176-V200 WeakPolarHBondContact CA-O 3.35Å; R176-V200 HydrophobicContact CB-CB 4.36Å; R176-V200 HydrophobicContact CG-CB 4.04Å; R176-V200 HydrophobicContact CG-CG2 4.18Å; L177-V200 PolarHBondContact N-O 3.44Å; V200-M202 HydrophobicContact CG1-CG 4.18Å
201	L	98.6	Very high	96.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	118.7	173.9	178.9	57.6	0	0	0	110.1	L177 I179 F192 L198 L203 F216 L219 L222 S224 L225 V226	L177-L201 HydrophobicContact CB-CD1 4.16Å; L177-L201 HydrophobicContact CD2-CD1 4.06Å; L177-L201 HydrophobicContact CG-CD1 4.13Å; I179-L201 HydrophobicContact CD1-CD1 4.33Å; I179-L201 HydrophobicContact CG1-CD1 4.38Å; F192-L201 HydrophobicContact CD1-CD2 4.5Å; F192-L201 HydrophobicContact CE1-CD1 4.27Å; F192-L201 HydrophobicContact CE1-CD2 3.8Å; F192-L201 HydrophobicContact CZ-CD2 3.89Å; L198-L201 HydrophobicContact CD2-CB 3.99Å; L198-L201 HydrophobicContact CD2-CD1 4.26Å; L198-L201 HydrophobicContact CD2-CG 4.5Å; L201-L203 HydrophobicContact CD1-CD1 4.29Å; L201-L203 HydrophobicContact CD1-CG 4.11Å; L201-L203 HydrophobicContact CD2-CD1 3.67Å; L201-L203 HydrophobicContact CD2-CG 4.37Å; L201-L203 HydrophobicContact CG-CD1 3.93Å; L201-L203 HydrophobicContact CG-CG 4.12Å; L201-F216 HydrophobicContact CD2-CD1 4.14Å; L201-F216 HydrophobicContact CD2-CE1 4.08Å; L201-L219 HydrophobicContact CD2-CD1 3.59Å; L201-L222 HydrophobicContact CB-CD1 3.81Å; L201-L222 HydrophobicContact CB-CD2 4.47Å; L201-S224 PolarHBondContact N-O 2.87Å; L201-L225 HydrophobicContact CB-CD1 4.06Å; L201-L225 HydrophobicContact CD2-CD1 3.97Å; L201-L225 HydrophobicContact CG-CD1 4.04Å; L201-V226 PolarHBondContact O-N 2.78Å
202	M	98.4	Very high	96.3	Very high	51 Å²	51	38.6 Å²	38.6	25%	0.251	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.8	173.3	-48.3	-170.2	74	0	0	110.1	L177 H178 I179 N180 V200 V226	L177-M202 PolarHBondContact O-N 3.49Å; H178-M202 PolarHBondContact CE1-SD 2.78Å; H178-M202 PolarHBondContact ND1-SD 2.92Å; I179-M202 WeakPolarHBondContact CG1-O 3.27Å; I179-M202 PolarHBondContact N-O 2.82Å; N180-M202 WeakPolarHBondContact ND2-CB 3.35Å; N180-M202 WeakPolarHBondContact OD1-CA 3.49Å; N180-M202 WeakPolarHBondContact OD1-CB 3.46Å; N180-M202 PolarHBondContact OD1-O 2.87Å; V200-M202 HydrophobicContact CG1-CG 4.18Å; M202-V226 HydrophobicContact CB-CB 4.42Å; M202-V226 HydrophobicContact CE-CB 4.26Å; M202-V226 HydrophobicContact CE-CG1 4.17Å; M202-V226 HydrophobicContact CE-CG2 4.21Å; M202-V226 HydrophobicContact CG-CB 4.38Å; M202-V226 HydrophobicContact CG-CG2 4.43Å
203	L	96.8	Very high	96.2	Very high	2 Å²	2	43 Å²	43	1%	0.01	23%	0.23	C	C	.	.			trans	-121.2	0.5	-173.2	-98.9	168.4	0	0	0	112.9	I179 N180 L184 I187 F192 L201 N206 F216 V226 L227	I179-L203 HydrophobicContact CD1-CD2 3.29Å; I179-L203 HydrophobicContact CD1-CG 3.86Å; I179-L203 HydrophobicContact CG1-CD2 3.69Å; I179-L203 HydrophobicContact CG1-CG 4Å; N180-L203 PolarHBondContact OD1-N 2.95Å; L184-L203 HydrophobicContact CD1-CD2 4.44Å; I187-L203 HydrophobicContact CD1-CD1 4.16Å; F192-L203 HydrophobicContact CZ-CD1 4.29Å; L201-L203 HydrophobicContact CD1-CD1 4.29Å; L201-L203 HydrophobicContact CD1-CG 4.11Å; L201-L203 HydrophobicContact CD2-CD1 3.67Å; L201-L203 HydrophobicContact CD2-CG 4.37Å; L201-L203 HydrophobicContact CG-CD1 3.93Å; L201-L203 HydrophobicContact CG-CG 4.12Å; L203-N206 PolarHBondContact O-ND2 3.11Å; L203-F216 HydrophobicContact CD1-CE1 3.75Å; L203-F216 HydrophobicContact CD1-CZ 4.27Å; L203-V226 PolarHBondContact N-O 3.46Å; L203-L227 HydrophobicContact CB-CD2 3.78Å; L203-L227 HydrophobicContact CD1-CD2 4.14Å
204	G	96.7	Very high	96.2	Very high	5 Å²	5	39.9 Å²	39.9	5%	0.052	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	160.9	-172.9	0	0	0	0	0	114	N180 N181 N206 V226 G228	N180-G204 CarbonylContact C-O 3.54Å; N180-G204 WeakPolarHBondContact CA-O 3.41Å; N180-G204 PolarHBondContact OD1-N 3.5Å; N181-G204 PolarHBondContact N-O 2.79Å; G204-N206 PolarHBondContact O-N 3.11Å; G204-V226 PolarHBondContact N-O 3.01Å; G204-G228 CarbonylContact C-O 3.5Å; G204-G228 VanDerWaalsContact C-O 3.3Å; G204-G228 WeakPolarHBondContact CA-O 3.38Å
205	G	96.3	Very high	96.2	Very high	24 Å²	24	39.1 Å²	39.1	25%	0.247	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	12.5	178.7	0	0	0	0	0	115	G228 G229	G205-G228 PolarHBondContact N-O 3.31Å; G205-G229 WeakPolarHBondContact CA-O 3.36Å
206	N	97.1	Very high	96.2	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-99.4	132.7	170.4	-77.2	-77	0	0	0	110	I179 N182 R183 L184 L203 G204 V208 M230	I179-N206 PolarHBondContact O-ND2 3.17Å; N182-N206 VanDerWaalsContact CA-OD1 3.31Å; N182-N206 WeakPolarHBondContact CA-OD1 3.01Å; N182-N206 WeakPolarHBondContact CB-OD1 3.07Å; N182-N206 PolarHBondContact N-OD1 3.3Å; N182-N206 PolarHBondContact O-OD1 3.23Å; R183-N206 PolarHBondContact N-OD1 3.16Å; L184-N206 HydrophobicContact CB-CB 4.13Å; L184-N206 WeakPolarHBondContact CB-OD1 3.22Å; L184-N206 WeakPolarHBondContact CG-OD1 3.19Å; L184-N206 PolarHBondContact N-OD1 2.78Å; L203-N206 PolarHBondContact O-ND2 3.11Å; G204-N206 PolarHBondContact O-N 3.11Å; N206-V208 VanDerWaalsContact C-N 3.25Å; N206-V208 HydrophobicContact CB-CG2 4.32Å; N206-V208 PolarHBondContact O-N 3.45Å; N206-M230 HydrophobicContact CB-CE 4.27Å; N206-M230 WeakPolarHBondContact O-CA 3.33Å; N206-M230 VanDerWaalsContact O-CB 3.3Å; N206-M230 WeakPolarHBondContact O-CB 3.34Å
207	P	96.3	Very high	96.2	Very high	70 Å²	70	39.6 Å²	39.6	46%	0.455	21%	0.214	S	C	.	.			trans	-74	69.2	-174.3	32.2	-38.6	0	0	0	113.3	L184 T185 M230	L184-P207 WeakPolarHBondContact O-CD 3.45Å; T185-P207 WeakPolarHBondContact CA-O 2.89Å; T185-P207 HydrophobicContact CG2-CG 4.23Å; P207-M230 WeakPolarHBondContact CA-O 3.3Å
208	V	95.4	Very high	96.2	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.012	20%	0.202	C	C	.	.			trans	-103.7	112.9	177.5	-177.1	0	0	0	0	108.8	I187 N206 A210 M230 L232	I187-V208 HydrophobicContact CG1-CG1 4.34Å; I187-V208 HydrophobicContact CG1-CG2 4.35Å; N206-V208 VanDerWaalsContact C-N 3.25Å; N206-V208 HydrophobicContact CB-CG2 4.32Å; N206-V208 PolarHBondContact O-N 3.45Å; V208-A210 WeakPolarHBondContact CG1-O 3.24Å; V208-M230 HydrophobicContact CB-CE 3.55Å; V208-M230 HydrophobicContact CG1-CE 4.34Å; V208-M230 HydrophobicContact CG2-CE 3.44Å; V208-M230 VanDerWaalsContact CG2-CE 3.44Å; V208-M230 PolarHBondContact N-O 3.16Å; V208-M230 VanDerWaalsContact N-O 3.11Å; V208-L232 HydrophobicContact CG1-CD2 4.36Å; V208-L232 VanDerWaalsContact O-CD2 3.23Å; V208-L232 WeakPolarHBondContact O-CD2 3.3Å
209	E	92.8	Very high	96.2	Very high	127 Å²	127	36.1 Å²	36.1	59%	0.593	20%	0.202	S	C	*	.			trans	-78.8	-25.7	-176	-62	-165.9	166.8	0	0	114	L232 R233	E209-L232 WeakPolarHBondContact O-CA 3.18Å; E209-R233 PolarHBondContact O-N 3.16Å
210	A	94.2	Very high	96	Very high	52 Å²	52	37.5 Å²	37.5	43%	0.43	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	142.3	-179.6	0	0	0	0	0	112	V208 S234	V208-A210 WeakPolarHBondContact CG1-O 3.24Å; A210-S234 WeakPolarHBondContact CA-O 3.34Å
211	L	95	Very high	96	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	129.1	173.2	-59.6	-179	0	0	0	110.6	I187 F216 L227 L232 L235 A236 A239 F251	I187-L211 HydrophobicContact CD1-CD2 3.51Å; L211-F216 HydrophobicContact CD1-CE2 4.32Å; L211-F216 HydrophobicContact CD2-CE2 4.48Å; L211-F216 HydrophobicContact CD2-CZ 4.42Å; L211-L227 HydrophobicContact CD1-CD1 3.68Å; L211-L227 HydrophobicContact CD2-CD1 4.42Å; L211-L232 HydrophobicContact CD1-CD1 4.42Å; L211-L232 HydrophobicContact CD2-CD1 4.37Å; L211-L232 HydrophobicContact CD2-CD2 3.86Å; L211-L232 HydrophobicContact CG-CD1 4.28Å; L211-L232 HydrophobicContact CG-CD2 3.78Å; L211-L235 HydrophobicContact CB-CG 4.35Å; L211-L235 HydrophobicContact CD1-CD2 3.66Å; L211-L235 HydrophobicContact CD1-CG 3.81Å; L211-L235 HydrophobicContact CG-CG 4.21Å; L211-A236 WeakPolarHBondContact O-CB 3.16Å; L211-A236 PolarHBondContact O-N 3.28Å; L211-A239 HydrophobicContact CB-CB 3.96Å; L211-F251 HydrophobicContact CD1-CE1 4.23Å
212	P	93.3	Very high	96	Very high	47 Å²	47	37.5 Å²	37.5	31%	0.305	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-73.4	161.1	177.8	31.9	-35.2	0	0	0	111.8	I187 R214 G215 A239	I187-P212 HydrophobicContact CB-CG 4.5Å; P212-R214 PolarHBondContact O-N 3.36Å; P212-G215 PolarHBondContact O-N 3.14Å; P212-A239 WeakPolarHBondContact O-CA 3.42Å
213	E	95.1	Very high	95.9	Very high	92 Å²	92	39.7 Å²	39.7	43%	0.43	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	135.9	170.1	-66.2	-68.9	-178.2	0	0	110.6	G215 A236 E237 K238	E213-G215 PolarHBondContact O-N 3.11Å; E213-G215 VanDerWaalsContact O-N 3.16Å; E213-A236 HydrophobicContact CG-CB 3.73Å; E213-A236 WeakPolarHBondContact OE1-CB 3.39Å; E213-E237 PolarHBondContact OE1-N 3.04Å; E213-K238 WeakPolarHBondContact OE2-CA 3.48Å; E213-K238 WeakPolarHBondContact OE2-CB 3.36Å; E213-K238 PolarHBondContact OE2-N 3.27Å
214	R	95.4	Very high	96	Very high	120 Å²	120	40.9 Å²	40.9	45%	0.453	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	32.3	177.1	-61.1	174.7	172.3	-169	-13.2	113.7	P212 F216 V217 K238 E241	P212-R214 PolarHBondContact O-N 3.36Å; R214-F216 PolarHBondContact O-N 3.33Å; R214-F216 VanDerWaalsContact O-N 3.15Å; R214-V217 HydrophobicContact CB-CB 4.12Å; R214-V217 HydrophobicContact CB-CG1 4.32Å; R214-V217 PolarHBondContact O-N 3.07Å; R214-K238 PolarHBondContact N-O 3.36Å; R214-E241 HydrophobicContact CG-CB 4.37Å; R214-E241 WeakPolarHBondContact CG-OE2 3.31Å; R214-E241 IonicContact CZ-OE1 3.31Å; R214-E241 IonicContact CZ-OE2 3.08Å; R214-E241 IonicContact NE-OE1 2.77Å; R214-E241 IonicContact NE-OE2 3.77Å; R214-E241 PolarHBondContact NE-OE2 2.8Å; R214-E241 IonicContact NH2-OE1 3.24Å; R214-E241 PolarHBondContact NH2-OE1 3.36Å; R214-E241 IonicContact NH2-OE2 3.71Å; R214-E241 PolarHBondContact NH2-OE2 2.95Å
215	G	94.9	Very high	96.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-34.6	-179.1	0	0	0	0	0	114.3	P189 P212 E213	P189-G215 WeakPolarHBondContact CA-O 3.32Å; P212-G215 PolarHBondContact O-N 3.14Å; E213-G215 PolarHBondContact O-N 3.11Å; E213-G215 VanDerWaalsContact O-N 3.16Å
216	F	97.1	Very high	96.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	17.5	-170.2	-53.2	-74.6	0	0	0	113.4	I187 F192 L201 L203 L211 R214 A218 L219 L225 L227 L240 L243	I187-F216 HydrophobicContact CD1-CE1 4.18Å; I187-F216 HydrophobicContact CD1-CZ 3.68Å; I187-F216 HydrophobicContact CG2-CE1 4.15Å; I187-F216 HydrophobicContact CG2-CZ 4.39Å; F192-F216 HydrophobicContact CD2-CD1 4.44Å; F192-F216 AromaticContact CE2-CD1 3.99Å; F192-F216 HydrophobicContact CE2-CD1 3.99Å; F192-F216 HydrophobicContact CE2-CE1 4.18Å; F192-F216 HydrophobicContact CZ-CE1 4.46Å; L201-F216 HydrophobicContact CD2-CD1 4.14Å; L201-F216 HydrophobicContact CD2-CE1 4.08Å; L203-F216 HydrophobicContact CD1-CE1 3.75Å; L203-F216 HydrophobicContact CD1-CZ 4.27Å; L211-F216 HydrophobicContact CD1-CE2 4.32Å; L211-F216 HydrophobicContact CD2-CE2 4.48Å; L211-F216 HydrophobicContact CD2-CZ 4.42Å; R214-F216 PolarHBondContact O-N 3.33Å; R214-F216 VanDerWaalsContact O-N 3.15Å; F216-A218 PolarHBondContact O-N 3.38Å; F216-L219 HydrophobicContact CB-CD1 4.14Å; F216-L219 HydrophobicContact CD1-CD1 3.94Å; F216-L219 WeakPolarHBondContact O-CB 3.15Å; F216-L219 PolarHBondContact O-N 2.86Å; F216-L225 HydrophobicContact CD2-CD2 4.16Å; F216-L225 HydrophobicContact CE1-CD1 4.3Å; F216-L225 HydrophobicContact CE2-CD2 4.05Å; F216-L225 HydrophobicContact CG-CD2 4.46Å; F216-L225 HydrophobicContact CZ-CD1 4.46Å; F216-L225 HydrophobicContact CZ-CD2 4.24Å; F216-L227 HydrophobicContact CZ-CD2 4.24Å; F216-L240 HydrophobicContact CD2-CD2 4.46Å; F216-L243 HydrophobicContact CB-CD1 4.01Å; F216-L243 HydrophobicContact CB-CD2 3.82Å; F216-L243 HydrophobicContact CB-CG 4.11Å; F216-L243 HydrophobicContact CD2-CD1 4.34Å; F216-L243 HydrophobicContact CG-CD1 4.42Å
217	V	96.4	Very high	96.3	Very high	64 Å²	64	41.1 Å²	41.1	39%	0.388	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.8	-170.3	69.6	0	0	0	0	114.5	R214 E241	R214-V217 HydrophobicContact CB-CB 4.12Å; R214-V217 HydrophobicContact CB-CG1 4.32Å; R214-V217 PolarHBondContact O-N 3.07Å; V217-E241 WeakPolarHBondContact CA-O 3.2Å
218	A	96.1	Very high	96.3	Very high	25 Å²	25	38.4 Å²	38.4	21%	0.207	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-14.8	178.4	0	0	0	0	0	113.8	F192 F216 T220	F192-A218 HydrophobicContact CB-CB 4.18Å; F192-A218 WeakPolarHBondContact O-CB 3.5Å; F216-A218 PolarHBondContact O-N 3.38Å; A218-T220 PolarHBondContact O-N 2.91Å; A218-T220 VanDerWaalsContact O-N 3.17Å
219	L	97.1	Very high	96.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.224	C	C	.	.			trans	-91.1	64.2	-172.4	-58.8	178.9	0	0	0	111.3	F192 L195 L198 L201 F216 S221 L222 L243	F192-L219 HydrophobicContact CB-CD1 4.37Å; F192-L219 HydrophobicContact CB-CD2 3.63Å; F192-L219 HydrophobicContact CB-CG 3.87Å; F192-L219 HydrophobicContact CD1-CD1 4.1Å; F192-L219 HydrophobicContact CD1-CD2 4.05Å; F192-L219 HydrophobicContact CD1-CG 4.42Å; F192-L219 HydrophobicContact CD2-CD1 4.32Å; F192-L219 HydrophobicContact CG-CD1 4Å; F192-L219 HydrophobicContact CG-CD2 3.99Å; F192-L219 HydrophobicContact CG-CG 4.06Å; L195-L219 HydrophobicContact CB-CD2 4.15Å; L195-L219 WeakPolarHBondContact O-CD2 3.35Å; L198-L219 HydrophobicContact CB-CD2 3.98Å; L198-L219 HydrophobicContact CD2-CD1 4.42Å; L198-L219 HydrophobicContact CD2-CD2 3.82Å; L201-L219 HydrophobicContact CD2-CD1 3.59Å; F216-L219 HydrophobicContact CB-CD1 4.14Å; F216-L219 HydrophobicContact CD1-CD1 3.94Å; F216-L219 WeakPolarHBondContact O-CB 3.15Å; F216-L219 PolarHBondContact O-N 2.86Å; L219-S221 VanDerWaalsContact C-N 3.31Å; L219-S221 PolarHBondContact O-N 3.31Å; L219-L222 HydrophobicContact CB-CB 3.99Å; L219-L222 HydrophobicContact CB-CD2 4.27Å; L219-L222 HydrophobicContact CD1-CD1 4.33Å; L219-L222 HydrophobicContact CD1-CD2 3.97Å; L219-L222 WeakPolarHBondContact O-CB 3.43Å; L219-L222 PolarHBondContact O-N 2.91Å; L219-L243 HydrophobicContact CB-CD2 4.06Å; L219-L243 WeakPolarHBondContact O-CD2 3.26Å
220	T	95.4	Very high	96.5	Very high	73 Å²	73	34 Å²	34	45%	0.448	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.3	-171.2	51.2	0	0	0	0	114.4	P196 A218	P196-T220 PolarHBondContact O-OG1 3.46Å; A218-T220 PolarHBondContact O-N 2.91Å; A218-T220 VanDerWaalsContact O-N 3.17Å
221	S	97.1	Very high	96.6	Very high	30 Å²	30	32.4 Å²	32.4	21%	0.21	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	8.9	179.5	-59.3	0	0	0	0	113.6	P196 L198 L219 R223	P196-S221 WeakPolarHBondContact O-CB 3.43Å; P196-S221 PolarHBondContact O-N 3.39Å; P196-S221 PolarHBondContact O-OG 3.38Å; P196-S221 VanDerWaalsContact O-OG 3.13Å; L198-S221 CarbonylContact O-C 3.21Å; L198-S221 VanDerWaalsContact O-C 3.26Å; L219-S221 VanDerWaalsContact C-N 3.31Å; L219-S221 PolarHBondContact O-N 3.31Å; S221-R223 PolarHBondContact O-N 3.43Å
222	L	98.4	Very high	96.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.185	C	C	.	.			trans	-69.8	122.4	-172.4	-161.5	74.3	0	0	0	111	L198 L201 L219 L225 L243 E245 L246	L198-L222 HydrophobicContact CB-CD1 4.49Å; L198-L222 HydrophobicContact CD2-CD1 4.16Å; L198-L222 HydrophobicContact CG-CD1 4.24Å; L198-L222 WeakPolarHBondContact O-CA 3.49Å; L198-L222 PolarHBondContact O-N 3.03Å; L201-L222 HydrophobicContact CB-CD1 3.81Å; L201-L222 HydrophobicContact CB-CD2 4.47Å; L219-L222 HydrophobicContact CB-CB 3.99Å; L219-L222 HydrophobicContact CB-CD2 4.27Å; L219-L222 HydrophobicContact CD1-CD1 4.33Å; L219-L222 HydrophobicContact CD1-CD2 3.97Å; L219-L222 WeakPolarHBondContact O-CB 3.43Å; L219-L222 PolarHBondContact O-N 2.91Å; L222-L225 HydrophobicContact CD2-CB 4Å; L222-L225 HydrophobicContact CD2-CD1 4.28Å; L222-L225 HydrophobicContact CD2-CD2 4.4Å; L222-L225 HydrophobicContact CD2-CG 4.45Å; L222-L243 HydrophobicContact CB-CD2 4.01Å; L222-L243 HydrophobicContact CD2-CD1 4.5Å; L222-L243 HydrophobicContact CD2-CD2 3.78Å; L222-E245 CarbonylContact O-C 3.45Å; L222-E245 VanDerWaalsContact O-C 3.27Å; L222-L246 HydrophobicContact CD2-CD1 4.13Å; L222-L246 HydrophobicContact CG-CD1 4.21Å; L222-L246 WeakPolarHBondContact O-CA 3Å; L222-L246 PolarHBondContact O-N 2.99Å
223	R	98.2	Very high	96.8	Very high	96 Å²	96	36.5 Å²	36.5	36%	0.362	20%	0.195	S	C	.	.			trans	-102	-31.1	178.6	-62.2	-171.6	-178.9	-69.4	-14.1	112.7	E199 S221 E245 E247 S248	E199-R223 PolarHBondContact O-N 3.38Å; S221-R223 PolarHBondContact O-N 3.43Å; R223-E245 IonicContact CZ-OE2 3.44Å; R223-E245 IonicContact NH1-OE2 2.66Å; R223-E245 PolarHBondContact NH1-OE2 3.26Å; R223-E245 IonicContact NH2-OE2 3.88Å; R223-E247 HydrophobicContact CB-CG 4.46Å; R223-E247 IonicContact NH1-OE1 3.97Å; R223-E247 PolarHBondContact NH1-OE1 3.32Å; R223-E247 VanDerWaalsContact NH1-OE1 3.17Å; R223-E247 PolarHBondContact O-N 2.96Å; R223-S248 PolarHBondContact O-N 2.92Å
224	S	98.6	Very high	96.7	Very high	28 Å²	28	35.3 Å²	35.3	20%	0.196	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.5	-175.9	-173.8	0	0	0	0	111.9	E199 L201 S248	E199-S224 PolarHBondContact O-N 3.08Å; L201-S224 PolarHBondContact N-O 2.87Å; S224-S248 WeakPolarHBondContact CA-O 3.34Å
225	L	98.7	Very high	96.7	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.5	178.5	-179.8	56.8	0	0	0	110.5	L201 F216 L222 L227 L240 L243 L246 S248 L249 S250	L201-L225 HydrophobicContact CB-CD1 4.06Å; L201-L225 HydrophobicContact CD2-CD1 3.97Å; L201-L225 HydrophobicContact CG-CD1 4.04Å; F216-L225 HydrophobicContact CD2-CD2 4.16Å; F216-L225 HydrophobicContact CE1-CD1 4.3Å; F216-L225 HydrophobicContact CE2-CD2 4.05Å; F216-L225 HydrophobicContact CG-CD2 4.46Å; F216-L225 HydrophobicContact CZ-CD1 4.46Å; F216-L225 HydrophobicContact CZ-CD2 4.24Å; L222-L225 HydrophobicContact CD2-CB 4Å; L222-L225 HydrophobicContact CD2-CD1 4.28Å; L222-L225 HydrophobicContact CD2-CD2 4.4Å; L222-L225 HydrophobicContact CD2-CG 4.45Å; L225-L227 HydrophobicContact CD1-CD2 3.93Å; L225-L227 HydrophobicContact CD1-CG 4.15Å; L225-L227 HydrophobicContact CD2-CD1 4.02Å; L225-L227 HydrophobicContact CD2-CG 4.42Å; L225-L227 HydrophobicContact CG-CD1 4.08Å; L225-L227 HydrophobicContact CG-CD2 4.28Å; L225-L227 HydrophobicContact CG-CG 3.95Å; L225-L240 HydrophobicContact CD2-CD2 4.31Å; L225-L243 HydrophobicContact CD2-CD1 3.94Å; L225-L246 HydrophobicContact CB-CD1 3.85Å; L225-S248 PolarHBondContact N-O 2.9Å; L225-L249 HydrophobicContact CB-CD1 3.99Å; L225-L249 HydrophobicContact CD2-CD1 3.98Å; L225-L249 HydrophobicContact CG-CD1 3.99Å; L225-L249 WeakPolarHBondContact O-CA 3.15Å; L225-S250 PolarHBondContact O-N 3.33Å; L225-S250 VanDerWaalsContact O-N 3.08Å
226	V	98.5	Very high	96.8	Very high	34 Å²	34	32.1 Å²	32.1	21%	0.206	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	112.2	-178.1	-177.1	0	0	0	0	110.4	L201 M202 L203 G204	L201-V226 PolarHBondContact O-N 2.78Å; M202-V226 HydrophobicContact CB-CB 4.42Å; M202-V226 HydrophobicContact CE-CB 4.26Å; M202-V226 HydrophobicContact CE-CG1 4.17Å; M202-V226 HydrophobicContact CE-CG2 4.21Å; M202-V226 HydrophobicContact CG-CB 4.38Å; M202-V226 HydrophobicContact CG-CG2 4.43Å; L203-V226 PolarHBondContact N-O 3.46Å; G204-V226 PolarHBondContact N-O 3.01Å
227	L	97.7	Very high	96.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.217	C	C	.	.			trans	-119	31	-176.2	-59.5	175.1	0	0	0	111.6	L203 L211 F216 L225 M230 L232 L249 S250 F251 N254	L203-L227 HydrophobicContact CB-CD2 3.78Å; L203-L227 HydrophobicContact CD1-CD2 4.14Å; L211-L227 HydrophobicContact CD1-CD1 3.68Å; L211-L227 HydrophobicContact CD2-CD1 4.42Å; F216-L227 HydrophobicContact CZ-CD2 4.24Å; L225-L227 HydrophobicContact CD1-CD2 3.93Å; L225-L227 HydrophobicContact CD1-CG 4.15Å; L225-L227 HydrophobicContact CD2-CD1 4.02Å; L225-L227 HydrophobicContact CD2-CG 4.42Å; L225-L227 HydrophobicContact CG-CD1 4.08Å; L225-L227 HydrophobicContact CG-CD2 4.28Å; L225-L227 HydrophobicContact CG-CG 3.95Å; L227-M230 HydrophobicContact CB-SD 3.6Å; L227-M230 VanDerWaalsContact CB-SD 3.6Å; L227-M230 HydrophobicContact CD2-CE 4.4Å; L227-M230 HydrophobicContact CD2-SD 3.58Å; L227-M230 VanDerWaalsContact CD2-SD 3.58Å; L227-M230 HydrophobicContact CG-SD 4.17Å; L227-M230 WeakPolarHBondContact O-CG 3.23Å; L227-L232 HydrophobicContact CB-CD1 4.25Å; L227-L249 HydrophobicContact CD1-CD1 4.39Å; L227-S250 CarbonylContact C-O 3.59Å; L227-S250 WeakPolarHBondContact CA-O 3.5Å; L227-S250 WeakPolarHBondContact CB-O 3.45Å; L227-S250 PolarHBondContact N-O 3Å; L227-F251 HydrophobicContact CB-CD1 4.25Å; L227-F251 HydrophobicContact CB-CE1 4.48Å; L227-F251 HydrophobicContact CD1-CD1 4.27Å; L227-F251 HydrophobicContact CD1-CE1 3.68Å; L227-N254 PolarHBondContact O-ND2 2.88Å
228	G	96.8	Very high	96.7	Very high	12 Å²	12	38.5 Å²	38.5	12%	0.124	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	144.2	-174.9	0	0	0	0	0	113.5	G204 G205 M230 Y252	G204-G228 CarbonylContact C-O 3.5Å; G204-G228 VanDerWaalsContact C-O 3.3Å; G204-G228 WeakPolarHBondContact CA-O 3.38Å; G205-G228 PolarHBondContact N-O 3.31Å; G228-M230 VanDerWaalsContact C-N 3.31Å; G228-M230 PolarHBondContact O-N 3.46Å; G228-Y252 CarbonylContact C-O 3.5Å; G228-Y252 WeakPolarHBondContact CA-O 3.43Å
229	G	96.7	Very high	96.7	Very high	33 Å²	33	37.3 Å²	37.3	34%	0.34	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	26.4	172.8	0	0	0	0	0	114.6	G205 Y252 D253	G205-G229 WeakPolarHBondContact CA-O 3.36Å; G229-Y252 PolarHBondContact N-O 2.02Å; G229-D253 WeakPolarHBondContact CA-O 3.23Å; G229-D253 PolarHBondContact N-O 3.46Å
230	M	96.4	Very high	96.8	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.025	21%	0.206	C	C	.	.	S	Bend	trans	-90.3	-17.9	-176.3	-66	-175.6	82.9	0	0	113.6	I187 N206 P207 V208 L227 G228 L232 N254	I187-M230 HydrophobicContact CD1-CE 4.28Å; N206-M230 HydrophobicContact CB-CE 4.27Å; N206-M230 WeakPolarHBondContact O-CA 3.33Å; N206-M230 VanDerWaalsContact O-CB 3.3Å; N206-M230 WeakPolarHBondContact O-CB 3.34Å; P207-M230 WeakPolarHBondContact CA-O 3.3Å; V208-M230 HydrophobicContact CB-CE 3.55Å; V208-M230 HydrophobicContact CG1-CE 4.34Å; V208-M230 HydrophobicContact CG2-CE 3.44Å; V208-M230 VanDerWaalsContact CG2-CE 3.44Å; V208-M230 PolarHBondContact N-O 3.16Å; V208-M230 VanDerWaalsContact N-O 3.11Å; L227-M230 HydrophobicContact CB-SD 3.6Å; L227-M230 VanDerWaalsContact CB-SD 3.6Å; L227-M230 HydrophobicContact CD2-CE 4.4Å; L227-M230 HydrophobicContact CD2-SD 3.58Å; L227-M230 VanDerWaalsContact CD2-SD 3.58Å; L227-M230 HydrophobicContact CG-SD 4.17Å; L227-M230 WeakPolarHBondContact O-CG 3.23Å; G228-M230 VanDerWaalsContact C-N 3.31Å; G228-M230 PolarHBondContact O-N 3.46Å; M230-L232 HydrophobicContact CB-CD1 4.28Å; M230-L232 HydrophobicContact CB-CG 3.95Å; M230-L232 HydrophobicContact SD-CD1 4.21Å; M230-N254 PolarHBondContact N-OD1 3.29Å; M230-N254 VanDerWaalsContact N-OD1 3.07Å
231	G	96.7	Very high	96.8	Very high	18 Å²	18	36.3 Å²	36.3	19%	0.186	20%	0.197	C	C	.	.			trans	81	21.1	-173	0	0	0	0	0	113.5	R233 N254	G231-R233 PolarHBondContact O-N 2.94Å; G231-N254 PolarHBondContact N-OD1 2.74Å
232	L	97	Very high	96.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.196	C	C	.	.			trans	-60	125.3	-178.3	-71.8	167.3	0	0	0	111.4	V208 E209 L211 L227 M230 F251 N254 H255 L256	V208-L232 HydrophobicContact CG1-CD2 4.36Å; V208-L232 VanDerWaalsContact O-CD2 3.23Å; V208-L232 WeakPolarHBondContact O-CD2 3.3Å; E209-L232 WeakPolarHBondContact O-CA 3.18Å; L211-L232 HydrophobicContact CD1-CD1 4.42Å; L211-L232 HydrophobicContact CD2-CD1 4.37Å; L211-L232 HydrophobicContact CD2-CD2 3.86Å; L211-L232 HydrophobicContact CG-CD1 4.28Å; L211-L232 HydrophobicContact CG-CD2 3.78Å; L227-L232 HydrophobicContact CB-CD1 4.25Å; M230-L232 HydrophobicContact CB-CD1 4.28Å; M230-L232 HydrophobicContact CB-CG 3.95Å; M230-L232 HydrophobicContact SD-CD1 4.21Å; L232-F251 HydrophobicContact CD1-CD1 4.08Å; L232-F251 HydrophobicContact CD1-CE1 4.39Å; L232-N254 HydrophobicContact CB-CB 4.08Å; L232-N254 PolarHBondContact N-OD1 3.12Å; L232-H255 CarbonylContact O-C 3.57Å; L232-H255 WeakPolarHBondContact O-CA 3.3Å; L232-H255 WeakPolarHBondContact O-CB 3.49Å; L232-H255 PolarHBondContact O-N 3.17Å; L232-L256 HydrophobicContact CB-CD2 4.24Å; L232-L256 PolarHBondContact O-N 2.71Å; L232-L256 VanDerWaalsContact O-N 3.15Å
233	R	95.6	Very high	96.6	Very high	136 Å²	136	35.8 Å²	35.8	51%	0.513	20%	0.196	S	C	.	.			trans	-98.1	-33.8	176.9	-63.4	177.9	179.7	-82.4	-1.4	112.3	E209 G231 H255	E209-R233 PolarHBondContact O-N 3.16Å; G231-R233 PolarHBondContact O-N 2.94Å; R233-H255 HydrophobicContact CG-CB 4.17Å
234	S	92.2	Very high	96.4	Very high	68 Å²	68	38.3 Å²	38.3	48%	0.476	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	164.1	-179.3	60.9	0	0	0	0	111.5	A210	A210-S234 WeakPolarHBondContact CA-O 3.34Å
235	L	95.4	Very high	96.3	Very high	28 Å²	28	41.5 Å²	41.5	15%	0.147	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.3	173.6	-73.4	77.2	0	0	0	108.8	L211 A239 F251 L256 P260 A263	L211-L235 HydrophobicContact CB-CG 4.35Å; L211-L235 HydrophobicContact CD1-CD2 3.66Å; L211-L235 HydrophobicContact CD1-CG 3.81Å; L211-L235 HydrophobicContact CG-CG 4.21Å; L235-A239 HydrophobicContact CB-CB 4.46Å; L235-F251 HydrophobicContact CD1-CE1 4.35Å; L235-F251 HydrophobicContact CD2-CE1 3.69Å; L235-F251 HydrophobicContact CD2-CE2 4.49Å; L235-F251 HydrophobicContact CD2-CZ 3.51Å; L235-L256 HydrophobicContact CD1-CD1 4.25Å; L235-L256 HydrophobicContact CD1-CD2 3.44Å; L235-L256 VanDerWaalsContact CD1-CD2 3.44Å; L235-P260 HydrophobicContact CB-CB 4.23Å; L235-P260 HydrophobicContact CD1-CB 4.18Å; L235-P260 HydrophobicContact CD1-CG 4.31Å; L235-P260 HydrophobicContact CD2-CB 4.26Å; L235-P260 HydrophobicContact CD2-CG 4.32Å; L235-P260 HydrophobicContact CG-CB 4.46Å; L235-A263 HydrophobicContact CD2-CB 4.37Å
236	A	95.9	Very high	96.3	Very high	25 Å²	25	41.5 Å²	41.5	21%	0.207	22%	0.224	C	C	.	.			trans	-67.1	155.1	167.3	0	0	0	0	0	110.9	L211 E213 K238 A239	L211-A236 WeakPolarHBondContact O-CB 3.16Å; L211-A236 PolarHBondContact O-N 3.28Å; E213-A236 HydrophobicContact CG-CB 3.73Å; E213-A236 WeakPolarHBondContact OE1-CB 3.39Å; A236-K238 VanDerWaalsContact C-N 3.3Å; A236-K238 PolarHBondContact O-N 2.83Å; A236-A239 HydrophobicContact CB-CB 4.28Å; A236-A239 VanDerWaalsContact O-CB 3.24Å; A236-A239 WeakPolarHBondContact O-CB 3.43Å; A236-A239 PolarHBondContact O-N 3.17Å; A236-A239 VanDerWaalsContact O-N 3.16Å
237	E	95.4	Very high	96.3	Very high	114 Å²	114	42.3 Å²	42.3	53%	0.533	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-29.8	-168.6	-66.4	-171.3	168.6	0	0	113.4	E213 Q262 A263	E213-E237 PolarHBondContact OE1-N 3.04Å; E237-Q262 HydrophobicContact CB-CB 4.1Å; E237-Q262 HydrophobicContact CG-CB 4.03Å; E237-Q262 HydrophobicContact CG-CG 4.37Å; E237-Q262 CarbonylContact O-C 3.47Å; E237-A263 WeakPolarHBondContact O-CA 3.37Å; E237-A263 PolarHBondContact O-N 3.24Å
238	K	96.6	Very high	96.3	Very high	83 Å²	83	44.1 Å²	44.1	36%	0.361	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	26.7	176.7	-40.2	175.9	178.2	177.6	0	111.2	E213 R214 A236 L240 E241	E213-K238 WeakPolarHBondContact OE2-CA 3.48Å; E213-K238 WeakPolarHBondContact OE2-CB 3.36Å; E213-K238 PolarHBondContact OE2-N 3.27Å; R214-K238 PolarHBondContact N-O 3.36Å; A236-K238 VanDerWaalsContact C-N 3.3Å; A236-K238 PolarHBondContact O-N 2.83Å; K238-L240 PolarHBondContact O-N 3.33Å; K238-E241 HydrophobicContact CB-CB 3.97Å; K238-E241 VanDerWaalsContact CB-OE2 3.3Å; K238-E241 WeakPolarHBondContact CB-OE2 3.38Å; K238-E241 WeakPolarHBondContact CD-OE2 3.17Å; K238-E241 WeakPolarHBondContact O-CB 3.21Å; K238-E241 PolarHBondContact O-N 3.49Å; K238-E241 VanDerWaalsContact O-N 3.16Å
239	A	97.3	Very high	96.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.8	176.9	0	0	0	0	0	113	L211 P212 L235 A236	L211-A239 HydrophobicContact CB-CB 3.96Å; P212-A239 WeakPolarHBondContact O-CA 3.42Å; L235-A239 HydrophobicContact CB-CB 4.46Å; A236-A239 HydrophobicContact CB-CB 4.28Å; A236-A239 VanDerWaalsContact O-CB 3.24Å; A236-A239 WeakPolarHBondContact O-CB 3.43Å; A236-A239 PolarHBondContact O-N 3.17Å; A236-A239 VanDerWaalsContact O-N 3.16Å
240	L	97.3	Very high	96.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	13.1	-179.5	-55.1	176.4	0	0	0	113.4	F216 L225 K238 L243 L249 A263 V267	F216-L240 HydrophobicContact CD2-CD2 4.46Å; L225-L240 HydrophobicContact CD2-CD2 4.31Å; K238-L240 PolarHBondContact O-N 3.33Å; L240-L243 HydrophobicContact CB-CD1 4.31Å; L240-L243 HydrophobicContact CD2-CD1 4.02Å; L240-L243 PolarHBondContact O-N 2.81Å; L240-L249 HydrophobicContact CD1-CD2 3.69Å; L240-A263 HydrophobicContact CD1-CB 4.13Å; L240-A263 HydrophobicContact CG-CB 4.28Å; L240-V267 HydrophobicContact CB-CG1 3.84Å; L240-V267 HydrophobicContact CD1-CG1 4.36Å; L240-V267 HydrophobicContact CD1-CG2 4.21Å
241	E	96.6	Very high	96.6	Very high	52 Å²	52	42.5 Å²	42.5	24%	0.243	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	134.2	176.9	-174.9	-178.6	-179.1	0	0	111	R214 V217 K238	R214-E241 HydrophobicContact CG-CB 4.37Å; R214-E241 WeakPolarHBondContact CG-OE2 3.31Å; R214-E241 IonicContact CZ-OE1 3.31Å; R214-E241 IonicContact CZ-OE2 3.08Å; R214-E241 IonicContact NE-OE1 2.77Å; R214-E241 IonicContact NE-OE2 3.77Å; R214-E241 PolarHBondContact NE-OE2 2.8Å; R214-E241 IonicContact NH2-OE1 3.24Å; R214-E241 PolarHBondContact NH2-OE1 3.36Å; R214-E241 IonicContact NH2-OE2 3.71Å; R214-E241 PolarHBondContact NH2-OE2 2.95Å; V217-E241 WeakPolarHBondContact CA-O 3.2Å; K238-E241 HydrophobicContact CB-CB 3.97Å; K238-E241 VanDerWaalsContact CB-OE2 3.3Å; K238-E241 WeakPolarHBondContact CB-OE2 3.38Å; K238-E241 WeakPolarHBondContact CD-OE2 3.17Å; K238-E241 WeakPolarHBondContact O-CB 3.21Å; K238-E241 PolarHBondContact O-N 3.49Å; K238-E241 VanDerWaalsContact O-N 3.16Å
242	G	94.4	Very high	96.7	Very high	20 Å²	20	46.2 Å²	46.2	21%	0.206	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	-8.1	-178.2	0	0	0	0	0	114.9	E244	G242-E244 PolarHBondContact O-N 3Å
243	L	97.3	Very high	96.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.			trans	-91.9	58.9	-178.5	-61.6	-176.5	0	0	0	112.2	F216 L219 L222 L225 L240 L246 V267	F216-L243 HydrophobicContact CB-CD1 4.01Å; F216-L243 HydrophobicContact CB-CD2 3.82Å; F216-L243 HydrophobicContact CB-CG 4.11Å; F216-L243 HydrophobicContact CD2-CD1 4.34Å; F216-L243 HydrophobicContact CG-CD1 4.42Å; L219-L243 HydrophobicContact CB-CD2 4.06Å; L219-L243 WeakPolarHBondContact O-CD2 3.26Å; L222-L243 HydrophobicContact CB-CD2 4.01Å; L222-L243 HydrophobicContact CD2-CD1 4.5Å; L222-L243 HydrophobicContact CD2-CD2 3.78Å; L225-L243 HydrophobicContact CD2-CD1 3.94Å; L240-L243 HydrophobicContact CB-CD1 4.31Å; L240-L243 HydrophobicContact CD2-CD1 4.02Å; L240-L243 PolarHBondContact O-N 2.81Å; L243-L246 HydrophobicContact CB-CB 4.02Å; L243-L246 HydrophobicContact CB-CD2 4.37Å; L243-L246 HydrophobicContact CD1-CD2 4.08Å; L243-L246 WeakPolarHBondContact O-CB 3.28Å; L243-L246 PolarHBondContact O-N 2.77Å; L243-V267 HydrophobicContact CB-CG1 3.88Å
244	E	93.4	Very high	96.8	Very high	148 Å²	148	42.2 Å²	42.2	69%	0.692	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-34.5	-172.1	-62.9	-175.3	-176.5	0	0	113.4	G242 L246	G242-E244 PolarHBondContact O-N 3Å; E244-L246 VanDerWaalsContact C-N 3.31Å; E244-L246 PolarHBondContact O-N 2.74Å
245	E	96.8	Very high	97.1	Very high	95 Å²	95	41.4 Å²	41.4	44%	0.444	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	5.9	179.5	-68.7	-67.8	132.7	0	0	113.6	L222 R223 E247	L222-E245 CarbonylContact O-C 3.45Å; L222-E245 VanDerWaalsContact O-C 3.27Å; R223-E245 IonicContact CZ-OE2 3.44Å; R223-E245 IonicContact NH1-OE2 2.66Å; R223-E245 PolarHBondContact NH1-OE2 3.26Å; R223-E245 IonicContact NH2-OE2 3.88Å; E245-E247 WeakPolarHBondContact O-CG 3.01Å; E245-E247 PolarHBondContact O-N 2.97Å
246	L	98.4	Very high	97.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.201	C	C	.	.			trans	-69.3	120.5	-174.1	-168.1	75.6	0	0	0	111.2	L222 L225 L243 E244 L249 V267 G269 L270	L222-L246 HydrophobicContact CD2-CD1 4.13Å; L222-L246 HydrophobicContact CG-CD1 4.21Å; L222-L246 WeakPolarHBondContact O-CA 3Å; L222-L246 PolarHBondContact O-N 2.99Å; L225-L246 HydrophobicContact CB-CD1 3.85Å; L243-L246 HydrophobicContact CB-CB 4.02Å; L243-L246 HydrophobicContact CB-CD2 4.37Å; L243-L246 HydrophobicContact CD1-CD2 4.08Å; L243-L246 WeakPolarHBondContact O-CB 3.28Å; L243-L246 PolarHBondContact O-N 2.77Å; E244-L246 VanDerWaalsContact C-N 3.31Å; E244-L246 PolarHBondContact O-N 2.74Å; L246-L249 HydrophobicContact CD2-CB 4.18Å; L246-L249 HydrophobicContact CD2-CD1 4.46Å; L246-L249 HydrophobicContact CD2-CD2 4.32Å; L246-V267 HydrophobicContact CB-CG1 4.37Å; L246-V267 HydrophobicContact CD2-CB 4.36Å; L246-V267 HydrophobicContact CD2-CG1 3.87Å; L246-G269 CarbonylContact O-C 3.57Å; L246-L270 HydrophobicContact CD2-CD1 4.17Å; L246-L270 HydrophobicContact CG-CD1 4.24Å; L246-L270 WeakPolarHBondContact O-CA 3.48Å; L246-L270 PolarHBondContact O-N 2.8Å
247	E	98.4	Very high	97.2	Very high	52 Å²	52	43.3 Å²	43.3	24%	0.243	22%	0.217	C	C	.	.			trans	-105.9	-31.6	-178.1	-52.6	-164.2	172.4	0	0	112.5	R223 E245 K271 F272	R223-E247 HydrophobicContact CB-CG 4.46Å; R223-E247 IonicContact NH1-OE1 3.97Å; R223-E247 PolarHBondContact NH1-OE1 3.32Å; R223-E247 VanDerWaalsContact NH1-OE1 3.17Å; R223-E247 PolarHBondContact O-N 2.96Å; E245-E247 WeakPolarHBondContact O-CG 3.01Å; E245-E247 PolarHBondContact O-N 2.97Å; E247-K271 HydrophobicContact CB-CD 4.22Å; E247-K271 HydrophobicContact CB-CG 4.42Å; E247-K271 HydrophobicContact CG-CD 4.42Å; E247-K271 CarbonylContact O-C 3.48Å; E247-K271 WeakPolarHBondContact O-CA 3.42Å; E247-K271 WeakPolarHBondContact O-CB 3.38Å; E247-K271 PolarHBondContact O-N 2.85Å; E247-K271 IonicContact OE1-NZ 2.76Å; E247-K271 PolarHBondContact OE1-NZ 2.75Å; E247-K271 IonicContact OE2-NZ 2.67Å; E247-K271 PolarHBondContact OE2-NZ 2.95Å; E247-F272 PolarHBondContact O-N 2.67Å
248	S	98.6	Very high	97.2	Very high	37 Å²	37	43.6 Å²	43.6	26%	0.259	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.1	-176.1	-175.3	0	0	0	0	111.7	R223 S224 L225	R223-S248 PolarHBondContact O-N 2.92Å; S224-S248 WeakPolarHBondContact CA-O 3.34Å; L225-S248 PolarHBondContact N-O 2.9Å
249	L	98.7	Very high	97.3	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	123.2	179.8	-179.6	58.2	0	0	0	110.3	L225 L227 L240 L246 F251 L264 L270 F272 L273 D274	L225-L249 HydrophobicContact CB-CD1 3.99Å; L225-L249 HydrophobicContact CD2-CD1 3.98Å; L225-L249 HydrophobicContact CG-CD1 3.99Å; L225-L249 WeakPolarHBondContact O-CA 3.15Å; L227-L249 HydrophobicContact CD1-CD1 4.39Å; L240-L249 HydrophobicContact CD1-CD2 3.69Å; L246-L249 HydrophobicContact CD2-CB 4.18Å; L246-L249 HydrophobicContact CD2-CD1 4.46Å; L246-L249 HydrophobicContact CD2-CD2 4.32Å; L249-F251 HydrophobicContact CD1-CE1 4.4Å; L249-F251 HydrophobicContact CD1-CE2 4.14Å; L249-F251 HydrophobicContact CD1-CZ 3.92Å; L249-F251 HydrophobicContact CD2-CD2 4.46Å; L249-F251 HydrophobicContact CD2-CE2 3.46Å; L249-F251 VanDerWaalsContact CD2-CE2 3.46Å; L249-F251 HydrophobicContact CD2-CZ 3.69Å; L249-F251 HydrophobicContact CG-CD2 4.24Å; L249-F251 HydrophobicContact CG-CE2 3.62Å; L249-F251 HydrophobicContact CG-CZ 3.9Å; L249-L264 HydrophobicContact CD2-CD2 4.05Å; L249-L270 HydrophobicContact CB-CD1 3.59Å; L249-L270 HydrophobicContact CB-CD2 4.27Å; L249-L270 HydrophobicContact CD2-CD2 4.48Å; L249-F272 PolarHBondContact N-O 3.05Å; L249-L273 HydrophobicContact CB-CD1 4.39Å; L249-L273 HydrophobicContact CD2-CD1 4.41Å; L249-L273 HydrophobicContact CG-CD1 4.36Å; L249-L273 WeakPolarHBondContact O-CA 3.21Å; L249-D274 PolarHBondContact O-N 3.07Å
250	S	98.6	Very high	97.2	Very high	16 Å²	16	40.9 Å²	40.9	11%	0.112	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.9	176.1	177.6	0	0	0	0	112.2	L225 L227 Y252 D274	L225-S250 PolarHBondContact O-N 3.33Å; L225-S250 VanDerWaalsContact O-N 3.08Å; L227-S250 CarbonylContact C-O 3.59Å; L227-S250 WeakPolarHBondContact CA-O 3.5Å; L227-S250 WeakPolarHBondContact CB-O 3.45Å; L227-S250 PolarHBondContact N-O 3Å; S250-Y252 WeakPolarHBondContact OG-CB 3.42Å; S250-Y252 PolarHBondContact OG-N 2.77Å; S250-D274 PolarHBondContact OG-OD2 2.72Å
251	F	98.2	Very high	97.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.22	C	C	.	.			trans	-109.9	25.5	168.2	-62.8	-69.3	0	0	0	111.7	L211 L227 L232 L235 L249 D253 N254 L256 L273 D274 L275 N278	L211-F251 HydrophobicContact CD1-CE1 4.23Å; L227-F251 HydrophobicContact CB-CD1 4.25Å; L227-F251 HydrophobicContact CB-CE1 4.48Å; L227-F251 HydrophobicContact CD1-CD1 4.27Å; L227-F251 HydrophobicContact CD1-CE1 3.68Å; L232-F251 HydrophobicContact CD1-CD1 4.08Å; L232-F251 HydrophobicContact CD1-CE1 4.39Å; L235-F251 HydrophobicContact CD1-CE1 4.35Å; L235-F251 HydrophobicContact CD2-CE1 3.69Å; L235-F251 HydrophobicContact CD2-CE2 4.49Å; L235-F251 HydrophobicContact CD2-CZ 3.51Å; L249-F251 HydrophobicContact CD1-CE1 4.4Å; L249-F251 HydrophobicContact CD1-CE2 4.14Å; L249-F251 HydrophobicContact CD1-CZ 3.92Å; L249-F251 HydrophobicContact CD2-CD2 4.46Å; L249-F251 HydrophobicContact CD2-CE2 3.46Å; L249-F251 VanDerWaalsContact CD2-CE2 3.46Å; L249-F251 HydrophobicContact CD2-CZ 3.69Å; L249-F251 HydrophobicContact CG-CD2 4.24Å; L249-F251 HydrophobicContact CG-CE2 3.62Å; L249-F251 HydrophobicContact CG-CZ 3.9Å; F251-D253 PolarHBondContact O-N 3.48Å; F251-N254 VanDerWaalsContact C-ND2 3.3Å; F251-N254 PolarHBondContact O-ND2 3.41Å; F251-L256 HydrophobicContact CB-CD1 4.02Å; F251-L256 HydrophobicContact CD1-CD1 4.44Å; F251-L256 HydrophobicContact CG-CD1 4.1Å; F251-L273 HydrophobicContact CD2-CD1 4.2Å; F251-L273 HydrophobicContact CE2-CD1 4.33Å; F251-D274 PolarHBondContact N-O 3.42Å; F251-L275 HydrophobicContact CB-CD2 4.19Å; F251-L275 HydrophobicContact CD2-CD2 3.83Å; F251-L275 HydrophobicContact CG-CD2 4.41Å; F251-N278 PolarHBondContact O-ND2 3Å
252	Y	98.2	Very high	97.1	Very high	95 Å²	95	45.6 Å²	45.6	37%	0.373	23%	0.226	S	C	.	.			trans	-45.6	135.4	179.8	178.3	-97.3	0	0	0	112.4	G228 G229 S250 N254 N276 K277	G228-Y252 CarbonylContact C-O 3.5Å; G228-Y252 WeakPolarHBondContact CA-O 3.43Å; G229-Y252 PolarHBondContact N-O 2.02Å; S250-Y252 WeakPolarHBondContact OG-CB 3.42Å; S250-Y252 PolarHBondContact OG-N 2.77Å; Y252-N254 PolarHBondContact O-N 3.09Å; Y252-N254 PolarHBondContact O-ND2 3.13Å; Y252-N276 WeakPolarHBondContact CA-O 3.31Å; Y252-N276 HydrophobicContact CD2-CB 3.93Å; Y252-N276 HydrophobicContact CE2-CB 4.34Å; Y252-K277 HydrophobicContact CE2-CB 4.32Å; Y252-K277 HydrophobicContact CE2-CD 4.46Å
253	D	97.8	Very high	97.2	Very high	52 Å²	52	44.8 Å²	44.8	28%	0.278	22%	0.217	S	C	.	.	S	Bend	trans	56.6	53.4	171.5	-159.5	18.2	0	0	0	114.2	G229 F251 N276 K277	G229-D253 WeakPolarHBondContact CA-O 3.23Å; G229-D253 PolarHBondContact N-O 3.46Å; F251-D253 PolarHBondContact O-N 3.48Å; D253-N276 PolarHBondContact N-O 2.76Å; D253-K277 WeakPolarHBondContact CA-O 3.33Å; D253-K277 HydrophobicContact CB-CB 4.38Å; D253-K277 HydrophobicContact CB-CD 3.84Å; D253-K277 HydrophobicContact CB-CG 4.31Å; D253-K277 VanDerWaalsContact CG-CE 3.46Å; D253-K277 VanDerWaalsContact OD1-CD 3.28Å; D253-K277 WeakPolarHBondContact OD1-CD 3.3Å; D253-K277 WeakPolarHBondContact OD1-CE 3.2Å; D253-K277 IonicContact OD1-NZ 3.84Å; D253-K277 PolarHBondContact OD1-NZ 2.83Å; D253-K277 VanDerWaalsContact OD1-NZ 3.12Å; D253-K277 IonicContact OD2-NZ 3.71Å; D253-K277 PolarHBondContact OD2-NZ 3.39Å
254	N	98.3	Very high	97.2	Very high	1 Å²	1	45 Å²	45	1%	0.005	22%	0.219	C	C	.	.			trans	-117.3	-169.3	174.3	-80.3	-63.8	0	0	0	111	L227 M230 G231 L232 F251 Y252 L256 N278	L227-N254 PolarHBondContact O-ND2 2.88Å; M230-N254 PolarHBondContact N-OD1 3.29Å; M230-N254 VanDerWaalsContact N-OD1 3.07Å; G231-N254 PolarHBondContact N-OD1 2.74Å; L232-N254 HydrophobicContact CB-CB 4.08Å; L232-N254 PolarHBondContact N-OD1 3.12Å; F251-N254 VanDerWaalsContact C-ND2 3.3Å; F251-N254 PolarHBondContact O-ND2 3.41Å; Y252-N254 PolarHBondContact O-N 3.09Å; Y252-N254 PolarHBondContact O-ND2 3.13Å; N254-L256 HydrophobicContact CB-CG 4.42Å; N254-N278 WeakPolarHBondContact CA-OD1 3.31Å; N254-N278 WeakPolarHBondContact CB-OD1 3.39Å; N254-N278 PolarHBondContact O-OD1 3.41Å
255	H	97.6	Very high	97.3	Very high	51 Å²	51	44.2 Å²	44.2	24%	0.236	21%	0.213	C	C	.	.			trans	-117.7	27.9	-177.4	-60.7	-29.4	0	0	0	112	L232 R233 T257	L232-H255 CarbonylContact O-C 3.57Å; L232-H255 WeakPolarHBondContact O-CA 3.3Å; L232-H255 WeakPolarHBondContact O-CB 3.49Å; L232-H255 PolarHBondContact O-N 3.17Å; R233-H255 HydrophobicContact CG-CB 4.17Å; H255-T257 PolarHBondContact O-N 2.98Å
256	L	97.6	Very high	97.3	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.016	21%	0.213	C	C	.	.			trans	-64.8	125.6	178	-58.4	177.8	0	0	0	109.2	L232 L235 F251 N254 L275 N278 R279 I280	L232-L256 HydrophobicContact CB-CD2 4.24Å; L232-L256 PolarHBondContact O-N 2.71Å; L232-L256 VanDerWaalsContact O-N 3.15Å; L235-L256 HydrophobicContact CD1-CD1 4.25Å; L235-L256 HydrophobicContact CD1-CD2 3.44Å; L235-L256 VanDerWaalsContact CD1-CD2 3.44Å; F251-L256 HydrophobicContact CB-CD1 4.02Å; F251-L256 HydrophobicContact CD1-CD1 4.44Å; F251-L256 HydrophobicContact CG-CD1 4.1Å; N254-L256 HydrophobicContact CB-CG 4.42Å; L256-L275 HydrophobicContact CD1-CD2 4.16Å; L256-N278 HydrophobicContact CB-CB 4.3Å; L256-N278 VanDerWaalsContact CB-OD1 3.31Å; L256-N278 WeakPolarHBondContact CB-OD1 3.48Å; L256-N278 WeakPolarHBondContact CG-OD1 3.43Å; L256-N278 PolarHBondContact N-OD1 2.74Å; L256-N278 VanDerWaalsContact N-OD1 3.11Å; L256-R279 CarbonylContact O-C 3.58Å; L256-R279 WeakPolarHBondContact O-CA 3.34Å; L256-R279 PolarHBondContact O-N 2.76Å; L256-I280 WeakPolarHBondContact O-CG1 3.23Å; L256-I280 PolarHBondContact O-N 2.83Å
257	T	95.4	Very high	97.2	Very high	89 Å²	89	45.5 Å²	45.5	55%	0.546	21%	0.214	S	C	.	.	S	Bend	trans	-94.4	-11.2	177.5	57.9	0	0	0	0	112.9	H255	H255-T257 PolarHBondContact O-N 2.98Å
258	K	96.1	Very high	97	Very high	121 Å²	121	47.4 Å²	47.4	53%	0.526	23%	0.23	S	C	.	.	S	Bend	trans	-145.8	155.2	179.6	-64.5	-166.3	172.6	-136.5	0	110.3	E284	K258-E284 IonicContact NZ-OE1 2.66Å; K258-E284 PolarHBondContact NZ-OE1 2.96Å
259	V	97.6	Very high	96.9	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.042	23%	0.227	C	C	.	.			trans	-66.8	127.8	169.8	-178.8	0	0	0	0	109.1	R261 L264 L275 I280 I283 D287 F288	V259-R261 PolarHBondContact O-N 3.49Å; V259-L264 HydrophobicContact CG1-CD1 3.77Å; V259-L275 HydrophobicContact CG1-CD1 4.42Å; V259-L275 HydrophobicContact CG2-CD1 4.42Å; V259-I280 HydrophobicContact CG2-CD1 3.98Å; V259-I283 HydrophobicContact CG2-CD1 4Å; V259-D287 HydrophobicContact CB-CB 3.91Å; V259-D287 HydrophobicContact CG1-CB 4.07Å; V259-D287 HydrophobicContact CG2-CB 4.03Å; V259-D287 WeakPolarHBondContact CG2-OD2 3.22Å; V259-F288 HydrophobicContact CB-CZ 4.48Å; V259-F288 HydrophobicContact CG1-CD1 4.36Å; V259-F288 HydrophobicContact CG1-CE1 3.71Å; V259-F288 HydrophobicContact CG1-CZ 3.9Å; V259-F288 HydrophobicContact CG2-CE1 4.38Å; V259-F288 HydrophobicContact CG2-CE2 4.17Å; V259-F288 HydrophobicContact CG2-CZ 3.71Å
260	P	96.7	Very high	96.9	Very high	19 Å²	19	46.5 Å²	46.5	12%	0.123	23%	0.227	C	C	.	.			trans	-79	59.8	-178.1	32.9	-35.5	0	0	0	111.8	L235 Q262 A263 L264	L235-P260 HydrophobicContact CB-CB 4.23Å; L235-P260 HydrophobicContact CD1-CB 4.18Å; L235-P260 HydrophobicContact CD1-CG 4.31Å; L235-P260 HydrophobicContact CD2-CB 4.26Å; L235-P260 HydrophobicContact CD2-CG 4.32Å; L235-P260 HydrophobicContact CG-CB 4.46Å; P260-Q262 VanDerWaalsContact C-N 3.25Å; P260-Q262 PolarHBondContact O-N 3.3Å; P260-Q262 VanDerWaalsContact O-N 3.09Å; P260-A263 HydrophobicContact CB-CB 4.42Å; P260-A263 PolarHBondContact O-N 3.43Å; P260-L264 HydrophobicContact CG-CD1 4.31Å; P260-L264 HydrophobicContact CG-CG 4.27Å; P260-L264 PolarHBondContact O-N 2.84Å
261	R	95.8	Very high	96.9	Very high	70 Å²	70	48.5 Å²	48.5	26%	0.264	23%	0.233	S	C	.	.	H	α-helix	trans	-54.4	-35	-169.6	79.2	-179.1	87.1	178.9	9.4	114.4	V259 K265 E284 T285 D287	V259-R261 PolarHBondContact O-N 3.49Å; R261-K265 WeakPolarHBondContact O-CG 3.37Å; R261-K265 PolarHBondContact O-N 3.32Å; R261-K265 VanDerWaalsContact O-N 3.17Å; R261-E284 IonicContact CZ-OE2 3.11Å; R261-E284 IonicContact NH2-OE2 3.91Å; R261-E284 PolarHBondContact NH2-OE2 2.9Å; R261-T285 PolarHBondContact NH1-O 3.42Å; R261-D287 IonicContact CZ-OD1 3.79Å; R261-D287 IonicContact NE-OD1 3.66Å; R261-D287 PolarHBondContact NE-OD1 3.1Å; R261-D287 IonicContact NH1-OD1 2.79Å; R261-D287 IonicContact NH2-OD1 2.68Å; R261-D287 PolarHBondContact NH2-OD1 3Å
262	Q	95.7	Very high	96.9	Very high	81 Å²	81	52.4 Å²	52.4	38%	0.379	25%	0.251	S	S	.	.	H	α-helix	trans	-71	-38.6	-179.4	-61.7	-62.7	5.7	0	0	112.4	E237 P260	E237-Q262 HydrophobicContact CB-CB 4.1Å; E237-Q262 HydrophobicContact CG-CB 4.03Å; E237-Q262 HydrophobicContact CG-CG 4.37Å; E237-Q262 CarbonylContact O-C 3.47Å; P260-Q262 VanDerWaalsContact C-N 3.25Å; P260-Q262 PolarHBondContact O-N 3.3Å; P260-Q262 VanDerWaalsContact O-N 3.09Å
263	A	96.9	Very high	96.9	Very high	2 Å²	2	48.1 Å²	48.1	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-70.6	-41	175.6	0	0	0	0	0	111	L235 E237 L240 P260 K265 R266	L235-A263 HydrophobicContact CD2-CB 4.37Å; E237-A263 WeakPolarHBondContact O-CA 3.37Å; E237-A263 PolarHBondContact O-N 3.24Å; L240-A263 HydrophobicContact CD1-CB 4.13Å; L240-A263 HydrophobicContact CG-CB 4.28Å; P260-A263 HydrophobicContact CB-CB 4.42Å; P260-A263 PolarHBondContact O-N 3.43Å; A263-K265 VanDerWaalsContact C-N 3.27Å; A263-K265 PolarHBondContact O-N 3.32Å; A263-R266 VanDerWaalsContact O-CB 3.32Å; A263-R266 WeakPolarHBondContact O-CB 3Å; A263-R266 PolarHBondContact O-N 3.13Å
264	L	97.1	Very high	96.9	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-31.4	178.3	-67.4	174.1	0	0	0	112.9	L249 V259 P260 R266 V267 L270 L273	L249-L264 HydrophobicContact CD2-CD2 4.05Å; V259-L264 HydrophobicContact CG1-CD1 3.77Å; P260-L264 HydrophobicContact CG-CD1 4.31Å; P260-L264 HydrophobicContact CG-CG 4.27Å; P260-L264 PolarHBondContact O-N 2.84Å; L264-R266 PolarHBondContact O-N 3.06Å; L264-R266 VanDerWaalsContact O-N 3.13Å; L264-V267 WeakPolarHBondContact O-CG2 3.16Å; L264-V267 PolarHBondContact O-N 3.15Å; L264-V267 VanDerWaalsContact O-N 3.13Å; L264-L270 HydrophobicContact CD2-CD2 4.34Å; L264-L273 HydrophobicContact CD1-CD2 3.87Å; L264-L273 HydrophobicContact CD2-CD1 4.12Å; L264-L273 HydrophobicContact CD2-CD2 4.09Å
265	K	95.4	Very high	96.9	Very high	131 Å²	131	47.4 Å²	47.4	57%	0.57	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-16	172.4	-77.6	177.6	179.9	-176.4	0	114.2	R261 A263 V267	R261-K265 WeakPolarHBondContact O-CG 3.37Å; R261-K265 PolarHBondContact O-N 3.32Å; R261-K265 VanDerWaalsContact O-N 3.17Å; A263-K265 VanDerWaalsContact C-N 3.27Å; A263-K265 PolarHBondContact O-N 3.32Å; K265-V267 VanDerWaalsContact C-N 3.32Å
266	R	96.2	Very high	97	Very high	119 Å²	119	46 Å²	46	45%	0.449	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-3.8	177.9	-54.2	-57.3	178.1	-178	-3	113.3	A263 L264 P268	A263-R266 VanDerWaalsContact O-CB 3.32Å; A263-R266 WeakPolarHBondContact O-CB 3Å; A263-R266 PolarHBondContact O-N 3.13Å; L264-R266 PolarHBondContact O-N 3.06Å; L264-R266 VanDerWaalsContact O-N 3.13Å; R266-P268 VanDerWaalsContact C-CD 3.48Å; R266-P268 WeakPolarHBondContact O-CD 2.99Å
267	V	96.9	Very high	97	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.012	24%	0.241	C	C	.	.			trans	-125	67.8	-180	-68.5	0	0	0	0	110.9	L240 L243 L246 L264 K265 G269 L270	L240-V267 HydrophobicContact CB-CG1 3.84Å; L240-V267 HydrophobicContact CD1-CG1 4.36Å; L240-V267 HydrophobicContact CD1-CG2 4.21Å; L243-V267 HydrophobicContact CB-CG1 3.88Å; L246-V267 HydrophobicContact CB-CG1 4.37Å; L246-V267 HydrophobicContact CD2-CB 4.36Å; L246-V267 HydrophobicContact CD2-CG1 3.87Å; L264-V267 WeakPolarHBondContact O-CG2 3.16Å; L264-V267 PolarHBondContact O-N 3.15Å; L264-V267 VanDerWaalsContact O-N 3.13Å; K265-V267 VanDerWaalsContact C-N 3.32Å; V267-G269 PolarHBondContact O-N 3.32Å; V267-L270 HydrophobicContact CG2-CB 4.31Å; V267-L270 HydrophobicContact CG2-CD2 4.3Å; V267-L270 WeakPolarHBondContact O-CB 3.46Å; V267-L270 PolarHBondContact O-N 3.05Å
268	P	94.3	Very high	97.1	Very high	92 Å²	92	45.8 Å²	45.8	60%	0.597	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-19.5	-175	29.2	-36.2	0	0	0	113.7	R266 L270 N293	R266-P268 VanDerWaalsContact C-CD 3.48Å; R266-P268 WeakPolarHBondContact O-CD 2.99Å; P268-L270 PolarHBondContact O-N 3.03Å; P268-N293 PolarHBondContact O-ND2 2.75Å
269	G	96.1	Very high	97.2	Very high	17 Å²	17	45.2 Å²	45.2	18%	0.175	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-6.2	176.1	0	0	0	0	0	115.1	L246 V267 K271	L246-G269 CarbonylContact O-C 3.57Å; V267-G269 PolarHBondContact O-N 3.32Å; G269-K271 PolarHBondContact O-N 3.43Å
270	L	98.3	Very high	97.2	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.016	21%	0.209	C	C	.	.			trans	-64.6	125.5	-168.7	-165.6	72	0	0	0	112.5	L246 L249 L264 V267 P268 L273 M291 N293 L294	L246-L270 HydrophobicContact CD2-CD1 4.17Å; L246-L270 HydrophobicContact CG-CD1 4.24Å; L246-L270 WeakPolarHBondContact O-CA 3.48Å; L246-L270 PolarHBondContact O-N 2.8Å; L249-L270 HydrophobicContact CB-CD1 3.59Å; L249-L270 HydrophobicContact CB-CD2 4.27Å; L249-L270 HydrophobicContact CD2-CD2 4.48Å; L264-L270 HydrophobicContact CD2-CD2 4.34Å; V267-L270 HydrophobicContact CG2-CB 4.31Å; V267-L270 HydrophobicContact CG2-CD2 4.3Å; V267-L270 WeakPolarHBondContact O-CB 3.46Å; V267-L270 PolarHBondContact O-N 3.05Å; P268-L270 PolarHBondContact O-N 3.03Å; L270-L273 HydrophobicContact CD2-CB 3.95Å; L270-L273 HydrophobicContact CD2-CD1 4.18Å; L270-L273 HydrophobicContact CD2-CD2 4.46Å; L270-L273 HydrophobicContact CD2-CG 4.41Å; L270-M291 HydrophobicContact CD2-CE 3.89Å; L270-N293 CarbonylContact O-C 3.53Å; L270-N293 VanDerWaalsContact O-C 3.28Å; L270-L294 WeakPolarHBondContact O-CA 3.44Å; L270-L294 PolarHBondContact O-N 3.17Å
271	K	98.4	Very high	97	Very high	57 Å²	57	49.9 Å²	49.9	25%	0.248	23%	0.228	C	C	.	.			trans	-105.6	-34.6	-179.9	-58.8	176.7	-166.3	162.6	0	112.3	E247 G269 N293 K295 E296	E247-K271 HydrophobicContact CB-CD 4.22Å; E247-K271 HydrophobicContact CB-CG 4.42Å; E247-K271 HydrophobicContact CG-CD 4.42Å; E247-K271 CarbonylContact O-C 3.48Å; E247-K271 WeakPolarHBondContact O-CA 3.42Å; E247-K271 WeakPolarHBondContact O-CB 3.38Å; E247-K271 PolarHBondContact O-N 2.85Å; E247-K271 IonicContact OE1-NZ 2.76Å; E247-K271 PolarHBondContact OE1-NZ 2.75Å; E247-K271 IonicContact OE2-NZ 2.67Å; E247-K271 PolarHBondContact OE2-NZ 2.95Å; G269-K271 PolarHBondContact O-N 3.43Å; K271-N293 WeakPolarHBondContact CA-O 3.46Å; K271-K295 HydrophobicContact CB-CG 4.43Å; K271-K295 PolarHBondContact O-N 2.82Å; K271-E296 PolarHBondContact O-N 3.18Å; K271-E296 VanDerWaalsContact O-N 3.17Å
272	F	98.6	Very high	96.8	Very high	82 Å²	82	47.3 Å²	47.3	36%	0.36	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.1	-176.6	-54.5	-86.4	0	0	0	109.8	E247 L249 E296	E247-F272 PolarHBondContact O-N 2.67Å; L249-F272 PolarHBondContact N-O 3.05Å; F272-E296 HydrophobicContact CD1-CB 3.83Å; F272-E296 HydrophobicContact CE1-CB 4.29Å
273	L	98.6	Very high	96.9	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	119.6	176.2	178.9	58.4	0	0	0	110.6	L249 F251 L264 L270 L275 F288 M291 L294 E296 L297 G298	L249-L273 HydrophobicContact CB-CD1 4.39Å; L249-L273 HydrophobicContact CD2-CD1 4.41Å; L249-L273 HydrophobicContact CG-CD1 4.36Å; L249-L273 WeakPolarHBondContact O-CA 3.21Å; F251-L273 HydrophobicContact CD2-CD1 4.2Å; F251-L273 HydrophobicContact CE2-CD1 4.33Å; L264-L273 HydrophobicContact CD1-CD2 3.87Å; L264-L273 HydrophobicContact CD2-CD1 4.12Å; L264-L273 HydrophobicContact CD2-CD2 4.09Å; L270-L273 HydrophobicContact CD2-CB 3.95Å; L270-L273 HydrophobicContact CD2-CD1 4.18Å; L270-L273 HydrophobicContact CD2-CD2 4.46Å; L270-L273 HydrophobicContact CD2-CG 4.41Å; L273-L275 HydrophobicContact CD1-CG 4.28Å; L273-L275 HydrophobicContact CD2-CD1 4.07Å; L273-L275 HydrophobicContact CD2-CG 4.39Å; L273-L275 HydrophobicContact CG-CD1 4.34Å; L273-L275 HydrophobicContact CG-CG 4.15Å; L273-F288 HydrophobicContact CD2-CD1 4.35Å; L273-F288 HydrophobicContact CD2-CE1 3.89Å; L273-M291 HydrophobicContact CD2-CE 4.22Å; L273-L294 HydrophobicContact CB-CD1 3.8Å; L273-E296 PolarHBondContact N-O 3.49Å; L273-E296 VanDerWaalsContact N-O 3.09Å; L273-L297 HydrophobicContact CB-CD1 4.13Å; L273-L297 HydrophobicContact CD2-CD1 4Å; L273-L297 HydrophobicContact CG-CD1 4.06Å; L273-L297 WeakPolarHBondContact O-CA 3.35Å; L273-G298 PolarHBondContact O-N 3.31Å
274	D	98.5	Very high	96.8	Very high	39 Å²	39	45.6 Å²	45.6	21%	0.209	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	109.2	176.9	173.4	15.3	0	0	0	110.5	L249 S250 F251 N276	L249-D274 PolarHBondContact O-N 3.07Å; S250-D274 PolarHBondContact OG-OD2 2.72Å; F251-D274 PolarHBondContact N-O 3.42Å; D274-N276 WeakPolarHBondContact OD1-CB 3.33Å; D274-N276 PolarHBondContact OD1-N 3.02Å; D274-N276 PolarHBondContact OD1-ND2 2.89Å
275	L	98.4	Very high	96.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.231	C	C	.	.			trans	-109.2	12.5	174.3	-72.1	168.9	0	0	0	111.9	F251 L256 V259 L273 N278 F288 G298 L299	F251-L275 HydrophobicContact CB-CD2 4.19Å; F251-L275 HydrophobicContact CD2-CD2 3.83Å; F251-L275 HydrophobicContact CG-CD2 4.41Å; L256-L275 HydrophobicContact CD1-CD2 4.16Å; V259-L275 HydrophobicContact CG1-CD1 4.42Å; V259-L275 HydrophobicContact CG2-CD1 4.42Å; L273-L275 HydrophobicContact CD1-CG 4.28Å; L273-L275 HydrophobicContact CD2-CD1 4.07Å; L273-L275 HydrophobicContact CD2-CG 4.39Å; L273-L275 HydrophobicContact CG-CD1 4.34Å; L273-L275 HydrophobicContact CG-CG 4.15Å; L275-N278 PolarHBondContact O-ND2 3.14Å; L275-F288 HydrophobicContact CD1-CE1 3.72Å; L275-F288 HydrophobicContact CD1-CZ 3.66Å; L275-G298 PolarHBondContact N-O 2.81Å; L275-L299 HydrophobicContact CB-CD2 3.99Å; L275-L299 HydrophobicContact CD1-CD2 4.04Å
276	N	98.4	Very high	96.5	Very high	22 Å²	22	43.2 Å²	43.2	12%	0.118	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	148	-174.8	-61.3	-36.3	0	0	0	111.5	Y252 D253 D274 N278 G298 L299 N300	Y252-N276 WeakPolarHBondContact CA-O 3.31Å; Y252-N276 HydrophobicContact CD2-CB 3.93Å; Y252-N276 HydrophobicContact CE2-CB 4.34Å; D253-N276 PolarHBondContact N-O 2.76Å; D274-N276 WeakPolarHBondContact OD1-CB 3.33Å; D274-N276 PolarHBondContact OD1-N 3.02Å; D274-N276 PolarHBondContact OD1-ND2 2.89Å; N276-N278 VanDerWaalsContact C-N 3.29Å; N276-N278 PolarHBondContact O-N 3.16Å; N276-N278 PolarHBondContact O-ND2 2.99Å; N276-G298 WeakPolarHBondContact OD1-CA 3.34Å; N276-G298 PolarHBondContact OD1-O 2.87Å; N276-L299 PolarHBondContact OD1-N 2.97Å; N276-N300 CarbonylContact C-O 3.2Å; N276-N300 VanDerWaalsContact CA-O 3.23Å; N276-N300 WeakPolarHBondContact CA-O 3.29Å; N276-N300 HydrophobicContact CB-CB 4.4Å; N276-N300 WeakPolarHBondContact OD1-CA 3.48Å; N276-N300 VanDerWaalsContact OD1-CB 3.25Å; N276-N300 WeakPolarHBondContact OD1-CB 3.32Å; N276-N300 PolarHBondContact OD1-N 3.09Å; N276-N300 PolarHBondContact OD1-ND2 3.02Å; N276-N300 VanDerWaalsContact OD1-ND2 3.1Å
277	K	97.9	Very high	96.6	Very high	82 Å²	82	37.9 Å²	37.9	36%	0.357	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	36.2	174.7	-159.8	178.1	171.6	-158.1	0	113.8	Y252 D253 N300 N301	Y252-K277 HydrophobicContact CE2-CB 4.32Å; Y252-K277 HydrophobicContact CE2-CD 4.46Å; D253-K277 WeakPolarHBondContact CA-O 3.33Å; D253-K277 HydrophobicContact CB-CB 4.38Å; D253-K277 HydrophobicContact CB-CD 3.84Å; D253-K277 HydrophobicContact CB-CG 4.31Å; D253-K277 VanDerWaalsContact CG-CE 3.46Å; D253-K277 VanDerWaalsContact OD1-CD 3.28Å; D253-K277 WeakPolarHBondContact OD1-CD 3.3Å; D253-K277 WeakPolarHBondContact OD1-CE 3.2Å; D253-K277 IonicContact OD1-NZ 3.84Å; D253-K277 PolarHBondContact OD1-NZ 2.83Å; D253-K277 VanDerWaalsContact OD1-NZ 3.12Å; D253-K277 IonicContact OD2-NZ 3.71Å; D253-K277 PolarHBondContact OD2-NZ 3.39Å; K277-N300 PolarHBondContact N-O 3.48Å; K277-N301 WeakPolarHBondContact CA-O 3.37Å; K277-N301 HydrophobicContact CB-CB 4.31Å
278	N	98.4	Very high	96.6	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	19%	0.191	C	C	.	.			trans	-99.4	177.5	168.5	-82.6	-80.8	0	0	0	112	F251 N254 L256 L275 N276 I280	F251-N278 PolarHBondContact O-ND2 3Å; N254-N278 WeakPolarHBondContact CA-OD1 3.31Å; N254-N278 WeakPolarHBondContact CB-OD1 3.39Å; N254-N278 PolarHBondContact O-OD1 3.41Å; L256-N278 HydrophobicContact CB-CB 4.3Å; L256-N278 VanDerWaalsContact CB-OD1 3.31Å; L256-N278 WeakPolarHBondContact CB-OD1 3.48Å; L256-N278 WeakPolarHBondContact CG-OD1 3.43Å; L256-N278 PolarHBondContact N-OD1 2.74Å; L256-N278 VanDerWaalsContact N-OD1 3.11Å; L275-N278 PolarHBondContact O-ND2 3.14Å; N276-N278 VanDerWaalsContact C-N 3.29Å; N276-N278 PolarHBondContact O-N 3.16Å; N276-N278 PolarHBondContact O-ND2 2.99Å; N278-I280 HydrophobicContact CB-CD1 4.41Å; N278-I280 HydrophobicContact CB-CG1 4.2Å
279	R	96.8	Very high	96.7	Very high	110 Å²	110	38 Å²	38	42%	0.415	18%	0.183	S	C	.	.			trans	-105.5	32.4	-177.8	-60.6	-172.9	-178.5	176.1	1.9	112.6	L256 K281	L256-R279 CarbonylContact O-C 3.58Å; L256-R279 WeakPolarHBondContact O-CA 3.34Å; L256-R279 PolarHBondContact O-N 2.76Å; R279-K281 PolarHBondContact O-N 3.41Å
280	I	97	Very high	96.7	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.195	C	C	.	.			trans	-74.6	122.7	179.7	-57.7	175.1	0	0	0	108	L256 V259 N278 L282 I283 M302 E304 L305	L256-I280 WeakPolarHBondContact O-CG1 3.23Å; L256-I280 PolarHBondContact O-N 2.83Å; V259-I280 HydrophobicContact CG2-CD1 3.98Å; N278-I280 HydrophobicContact CB-CD1 4.41Å; N278-I280 HydrophobicContact CB-CG1 4.2Å; I280-L282 VanDerWaalsContact CG2-O 3.26Å; I280-L282 WeakPolarHBondContact CG2-O 3.48Å; I280-I283 HydrophobicContact CG2-CD1 3.81Å; I280-M302 HydrophobicContact CB-SD 3.97Å; I280-M302 HydrophobicContact CD1-SD 4.44Å; I280-M302 HydrophobicContact CG1-SD 4.49Å; I280-E304 CarbonylContact O-C 3.53Å; I280-L305 WeakPolarHBondContact O-CA 3.28Å; I280-L305 WeakPolarHBondContact O-CB 3.23Å; I280-L305 PolarHBondContact O-N 3.38Å
281	K	92.9	Very high	96.6	Very high	123 Å²	123	42 Å²	42	54%	0.535	20%	0.2	S	C	.	.			trans	-86.3	-32.4	-179.1	-70.6	178.9	179.5	-178.7	0	113.6	R279 E304 V306	R279-K281 PolarHBondContact O-N 3.41Å; K281-E304 WeakPolarHBondContact CA-O 3.46Å; K281-E304 WeakPolarHBondContact CE-OE2 3.31Å; K281-E304 HydrophobicContact CG-CB 3.98Å; K281-E304 IonicContact NZ-OE2 3.69Å; K281-V306 PolarHBondContact O-N 3.14Å
282	L	92.9	Very high	96.6	Very high	17 Å²	17	43.2 Å²	43.2	9%	0.089	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	131.1	-170.9	-179.7	66.9	0	0	0	108	I280 E284 S307	I280-L282 VanDerWaalsContact CG2-O 3.26Å; I280-L282 WeakPolarHBondContact CG2-O 3.48Å; L282-E284 HydrophobicContact CD2-CG 3.78Å; L282-E284 HydrophobicContact CG-CG 4Å; L282-S307 WeakPolarHBondContact CD1-OG 3.17Å
283	I	97	Very high	96.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	107.8	162.5	-50.8	-57.2	0	0	0	106.7	V259 I280 D287 F288 L299 L305 S307 I308 D309	V259-I283 HydrophobicContact CG2-CD1 4Å; I280-I283 HydrophobicContact CG2-CD1 3.81Å; I283-D287 HydrophobicContact CG2-CB 4.13Å; I283-F288 HydrophobicContact CD1-CE2 4.38Å; I283-F288 HydrophobicContact CG2-CD2 3.95Å; I283-F288 HydrophobicContact CG2-CE2 3.54Å; I283-L299 HydrophobicContact CD1-CD1 4.43Å; I283-L299 HydrophobicContact CD1-CD2 4.2Å; I283-L299 HydrophobicContact CG1-CD1 4.44Å; I283-L305 HydrophobicContact CD1-CD1 4.25Å; I283-L305 HydrophobicContact CG1-CD1 3.96Å; I283-S307 PolarHBondContact N-O 3.23Å; I283-I308 HydrophobicContact CB-CG1 4.29Å; I283-I308 HydrophobicContact CB-CG2 4.27Å; I283-I308 HydrophobicContact CG1-CG1 4.07Å; I283-D309 WeakPolarHBondContact O-CB 3.4Å; I283-D309 PolarHBondContact O-N 3.19Å
284	E	93.9	Very high	96.5	Very high	47 Å²	47	42.5 Å²	42.5	22%	0.22	21%	0.209	C	C	.	.			trans	-80.1	162.1	-172.9	-65.7	179	-172.5	0	0	111.2	K258 R261 L282 G286 D287 S312	K258-E284 IonicContact NZ-OE1 2.66Å; K258-E284 PolarHBondContact NZ-OE1 2.96Å; R261-E284 IonicContact CZ-OE2 3.11Å; R261-E284 IonicContact NH2-OE2 3.91Å; R261-E284 PolarHBondContact NH2-OE2 2.9Å; L282-E284 HydrophobicContact CD2-CG 3.78Å; L282-E284 HydrophobicContact CG-CG 4Å; E284-G286 PolarHBondContact O-N 3.23Å; E284-D287 PolarHBondContact N-OD2 2.78Å; E284-D287 WeakPolarHBondContact O-CB 3.37Å; E284-D287 PolarHBondContact O-N 3.22Å; E284-S312 WeakPolarHBondContact O-CA 3.28Å; E284-S312 WeakPolarHBondContact O-CB 3.36Å
285	T	93.3	Very high	96.5	Very high	70 Å²	70	44.7 Å²	44.7	43%	0.429	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	127.1	173.9	-62.5	0	0	0	0	111.4	R261 D287 K310 A311	R261-T285 PolarHBondContact NH1-O 3.42Å; T285-D287 VanDerWaalsContact C-N 3.35Å; T285-D287 PolarHBondContact O-N 3.43Å; T285-K310 WeakPolarHBondContact CA-O 3.26Å; T285-K310 VanDerWaalsContact CB-O 3.32Å; T285-K310 WeakPolarHBondContact CB-O 3.36Å; T285-K310 WeakPolarHBondContact CG2-O 3.22Å; T285-K310 PolarHBondContact OG1-O 3.38Å; T285-A311 HydrophobicContact CG2-CB 4.42Å
286	G	94.6	Very high	96.4	Very high	17 Å²	17	47.5 Å²	47.5	18%	0.175	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	12.1	177.4	0	0	0	0	0	116.3	E284 F288 K289 A311	E284-G286 PolarHBondContact O-N 3.23Å; G286-F288 VanDerWaalsContact C-N 3.27Å; G286-F288 PolarHBondContact O-N 2.91Å; G286-K289 PolarHBondContact O-N 2.97Å; G286-A311 PolarHBondContact N-O 3.47Å
287	D	97.3	Very high	96.4	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.032	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-36.3	177.1	-88	-12.7	0	0	0	112.8	V259 R261 I283 E284 T285	V259-D287 HydrophobicContact CB-CB 3.91Å; V259-D287 HydrophobicContact CG1-CB 4.07Å; V259-D287 HydrophobicContact CG2-CB 4.03Å; V259-D287 WeakPolarHBondContact CG2-OD2 3.22Å; R261-D287 IonicContact CZ-OD1 3.79Å; R261-D287 IonicContact NE-OD1 3.66Å; R261-D287 PolarHBondContact NE-OD1 3.1Å; R261-D287 IonicContact NH1-OD1 2.79Å; R261-D287 IonicContact NH2-OD1 2.68Å; R261-D287 PolarHBondContact NH2-OD1 3Å; I283-D287 HydrophobicContact CG2-CB 4.13Å; E284-D287 PolarHBondContact N-OD2 2.78Å; E284-D287 WeakPolarHBondContact O-CB 3.37Å; E284-D287 PolarHBondContact O-N 3.22Å; T285-D287 VanDerWaalsContact C-N 3.35Å; T285-D287 PolarHBondContact O-N 3.43Å
288	F	97.4	Very high	96.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	23.9	177.8	-55.4	-71.1	0	0	0	112.7	V259 L273 L275 I283 G286 M291 L297 L299 S312 L313 L316	V259-F288 HydrophobicContact CB-CZ 4.48Å; V259-F288 HydrophobicContact CG1-CD1 4.36Å; V259-F288 HydrophobicContact CG1-CE1 3.71Å; V259-F288 HydrophobicContact CG1-CZ 3.9Å; V259-F288 HydrophobicContact CG2-CE1 4.38Å; V259-F288 HydrophobicContact CG2-CE2 4.17Å; V259-F288 HydrophobicContact CG2-CZ 3.71Å; L273-F288 HydrophobicContact CD2-CD1 4.35Å; L273-F288 HydrophobicContact CD2-CE1 3.89Å; L275-F288 HydrophobicContact CD1-CE1 3.72Å; L275-F288 HydrophobicContact CD1-CZ 3.66Å; I283-F288 HydrophobicContact CD1-CE2 4.38Å; I283-F288 HydrophobicContact CG2-CD2 3.95Å; I283-F288 HydrophobicContact CG2-CE2 3.54Å; G286-F288 VanDerWaalsContact C-N 3.27Å; G286-F288 PolarHBondContact O-N 2.91Å; F288-M291 HydrophobicContact CB-SD 4.2Å; F288-M291 HydrophobicContact CD1-SD 3.86Å; F288-L297 HydrophobicContact CD1-CD1 4.45Å; F288-L297 HydrophobicContact CD1-CD2 4.12Å; F288-L297 HydrophobicContact CD2-CD2 4.01Å; F288-L297 HydrophobicContact CE1-CD1 3.91Å; F288-L297 HydrophobicContact CE1-CD2 4.12Å; F288-L297 HydrophobicContact CE2-CD2 3.98Å; F288-L297 HydrophobicContact CG-CD2 4.07Å; F288-L297 HydrophobicContact CZ-CD1 4.13Å; F288-L297 HydrophobicContact CZ-CD2 4.05Å; F288-L299 HydrophobicContact CE2-CD1 4.2Å; F288-L299 HydrophobicContact CZ-CD1 4.5Å; F288-L299 HydrophobicContact CZ-CD2 4.15Å; F288-S312 PolarHBondContact N-O 2.67Å; F288-S312 VanDerWaalsContact N-O 3.08Å; F288-L313 HydrophobicContact CB-CG 4.49Å; F288-L313 HydrophobicContact CD2-CD1 4.24Å; F288-L313 HydrophobicContact CD2-CG 4.06Å; F288-L316 HydrophobicContact CB-CD1 4.4Å; F288-L316 VanDerWaalsContact O-CD2 3.28Å; F288-L316 WeakPolarHBondContact O-CD2 3.09Å
289	K	96.1	Very high	96.4	Very high	97 Å²	97	42.6 Å²	42.6	42%	0.422	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	137.1	-176.2	178.7	176.3	-179.7	-176.8	0	111.8	G286 M291 D314	G286-K289 PolarHBondContact O-N 2.97Å; K289-M291 VanDerWaalsContact C-N 3.26Å; K289-M291 PolarHBondContact O-N 2.8Å; K289-D314 WeakPolarHBondContact CA-O 3.33Å; K289-D314 HydrophobicContact CG-CB 4.39Å
290	D	96.5	Very high	96.5	Very high	80 Å²	80	37.8 Å²	37.8	43%	0.428	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	28.3	174.1	-56.2	-42.2	0	0	0	114.1	L292 D314 N315	D290-L292 HydrophobicContact CB-CD2 4.48Å; D290-L292 PolarHBondContact O-N 2.8Å; D290-D314 PolarHBondContact N-O 3.36Å; D290-N315 WeakPolarHBondContact OD1-CB 3.35Å; D290-N315 PolarHBondContact OD1-ND2 3.26Å
291	M	96.8	Very high	96.5	Very high	24 Å²	24	40.5 Å²	40.5	12%	0.118	21%	0.205	C	C	.	.			trans	-80	73.4	169.5	-56.9	-175.4	65.9	0	0	110.1	L270 L273 F288 K289 N293 L294 L316	L270-M291 HydrophobicContact CD2-CE 3.89Å; L273-M291 HydrophobicContact CD2-CE 4.22Å; F288-M291 HydrophobicContact CB-SD 4.2Å; F288-M291 HydrophobicContact CD1-SD 3.86Å; K289-M291 VanDerWaalsContact C-N 3.26Å; K289-M291 PolarHBondContact O-N 2.8Å; M291-N293 PolarHBondContact O-N 2.93Å; M291-N293 VanDerWaalsContact O-N 3.1Å; M291-L294 HydrophobicContact CB-CB 3.98Å; M291-L294 HydrophobicContact CB-CD2 4.36Å; M291-L294 HydrophobicContact CE-CD1 4.16Å; M291-L294 HydrophobicContact CE-CD2 4.21Å; M291-L294 WeakPolarHBondContact O-CB 3.48Å; M291-L294 PolarHBondContact O-N 2.78Å; M291-L294 VanDerWaalsContact O-N 3.12Å; M291-L294 HydrophobicContact SD-CD2 4.18Å; M291-L316 HydrophobicContact CB-CD2 3.52Å; M291-L316 HydrophobicContact CG-CD2 4.4Å; M291-L316 VanDerWaalsContact O-CD2 3.24Å; M291-L316 WeakPolarHBondContact O-CD2 3.25Å
292	L	96.8	Very high	96.7	Very high	83 Å²	83	34.6 Å²	34.6	44%	0.435	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.4	-163.8	-56.2	-178.6	0	0	0	114.7	D290 P317 E318	D290-L292 HydrophobicContact CB-CD2 4.48Å; D290-L292 PolarHBondContact O-N 2.8Å; L292-P317 HydrophobicContact CD2-CG 4.46Å; L292-P317 WeakPolarHBondContact O-CG 3.49Å; L292-E318 WeakPolarHBondContact O-CG 3.35Å
293	N	97.5	Very high	96.8	Very high	72 Å²	72	40.8 Å²	40.8	39%	0.385	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-2.2	-174.8	-64.7	-26.7	0	0	0	113.7	P268 L270 K271 M291 K295	P268-N293 PolarHBondContact O-ND2 2.75Å; L270-N293 CarbonylContact O-C 3.53Å; L270-N293 VanDerWaalsContact O-C 3.28Å; K271-N293 WeakPolarHBondContact CA-O 3.46Å; M291-N293 PolarHBondContact O-N 2.93Å; M291-N293 VanDerWaalsContact O-N 3.1Å; N293-K295 PolarHBondContact O-N 3.36Å
294	L	98.1	Very high	96.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.			trans	-69.9	122.4	-174.6	-167.9	71.9	0	0	0	110.1	L270 L273 M291 L297 E318 L319	L270-L294 WeakPolarHBondContact O-CA 3.44Å; L270-L294 PolarHBondContact O-N 3.17Å; L273-L294 HydrophobicContact CB-CD1 3.8Å; M291-L294 HydrophobicContact CB-CB 3.98Å; M291-L294 HydrophobicContact CB-CD2 4.36Å; M291-L294 HydrophobicContact CE-CD1 4.16Å; M291-L294 HydrophobicContact CE-CD2 4.21Å; M291-L294 WeakPolarHBondContact O-CB 3.48Å; M291-L294 PolarHBondContact O-N 2.78Å; M291-L294 VanDerWaalsContact O-N 3.12Å; M291-L294 HydrophobicContact SD-CD2 4.18Å; L294-L297 HydrophobicContact CD2-CB 4.16Å; L294-L297 HydrophobicContact CD2-CD2 4.49Å; L294-E318 CarbonylContact O-C 3.23Å; L294-L319 HydrophobicContact CD2-CD1 4.34Å; L294-L319 HydrophobicContact CG-CD1 4.28Å; L294-L319 WeakPolarHBondContact O-CA 3.42Å; L294-L319 PolarHBondContact O-N 3.4Å
295	K	97.7	Very high	96.8	Very high	84 Å²	84	40.9 Å²	40.9	37%	0.365	21%	0.209	S	C	.	.			trans	-103	-36.5	-178.3	-64.8	-172.3	176.3	-172.2	0	113.1	K271 N293 E318 T320 K321	K271-K295 HydrophobicContact CB-CG 4.43Å; K271-K295 PolarHBondContact O-N 2.82Å; N293-K295 PolarHBondContact O-N 3.36Å; K295-E318 WeakPolarHBondContact CA-O 3.25Å; K295-E318 HydrophobicContact CG-CB 4.34Å; K295-T320 PolarHBondContact O-N 3.01Å; K295-T320 PolarHBondContact O-OG1 3.24Å; K295-K321 PolarHBondContact O-N 2.97Å
296	E	97.7	Very high	96.8	Very high	59 Å²	59	38.6 Å²	38.6	28%	0.276	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	134.5	-179.1	-172.7	166.9	-172.7	0	0	110.9	K271 F272 L273 K321	K271-E296 PolarHBondContact O-N 3.18Å; K271-E296 VanDerWaalsContact O-N 3.17Å; F272-E296 HydrophobicContact CD1-CB 3.83Å; F272-E296 HydrophobicContact CE1-CB 4.29Å; L273-E296 PolarHBondContact N-O 3.49Å; L273-E296 VanDerWaalsContact N-O 3.09Å; E296-K321 HydrophobicContact CG-CB 4.35Å; E296-K321 HydrophobicContact CG-CD 4.47Å; E296-K321 IonicContact OE1-NZ 3.68Å; E296-K321 PolarHBondContact OE1-NZ 3.1Å
297	L	98.1	Very high	96.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	117.4	178.5	176.2	57.6	0	0	0	110.1	L273 F288 L294 L299 L313 L319 K321 L322 E323	L273-L297 HydrophobicContact CB-CD1 4.13Å; L273-L297 HydrophobicContact CD2-CD1 4Å; L273-L297 HydrophobicContact CG-CD1 4.06Å; L273-L297 WeakPolarHBondContact O-CA 3.35Å; F288-L297 HydrophobicContact CD1-CD1 4.45Å; F288-L297 HydrophobicContact CD1-CD2 4.12Å; F288-L297 HydrophobicContact CD2-CD2 4.01Å; F288-L297 HydrophobicContact CE1-CD1 3.91Å; F288-L297 HydrophobicContact CE1-CD2 4.12Å; F288-L297 HydrophobicContact CE2-CD2 3.98Å; F288-L297 HydrophobicContact CG-CD2 4.07Å; F288-L297 HydrophobicContact CZ-CD1 4.13Å; F288-L297 HydrophobicContact CZ-CD2 4.05Å; L294-L297 HydrophobicContact CD2-CB 4.16Å; L294-L297 HydrophobicContact CD2-CD2 4.49Å; L297-L299 HydrophobicContact CD1-CD2 4.48Å; L297-L299 HydrophobicContact CD1-CG 4.31Å; L297-L299 HydrophobicContact CD2-CD1 4.06Å; L297-L299 HydrophobicContact CD2-CG 4.43Å; L297-L299 HydrophobicContact CG-CD1 4.24Å; L297-L299 HydrophobicContact CG-CG 4.08Å; L297-L313 HydrophobicContact CD2-CD2 3.94Å; L297-L319 HydrophobicContact CB-CD1 4.14Å; L297-K321 PolarHBondContact N-O 2.84Å; L297-L322 HydrophobicContact CB-CD1 4.04Å; L297-L322 HydrophobicContact CD2-CD1 4Å; L297-L322 HydrophobicContact CG-CD1 4.08Å; L297-E323 PolarHBondContact O-N 3.32Å
298	G	97.5	Very high	96.7	Very high	5 Å²	5	37.8 Å²	37.8	5%	0.052	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.1	175.8	0	0	0	0	0	112.3	L273 L275 N276	L273-G298 PolarHBondContact O-N 3.31Å; L275-G298 PolarHBondContact N-O 2.81Å; N276-G298 WeakPolarHBondContact OD1-CA 3.34Å; N276-G298 PolarHBondContact OD1-O 2.87Å
299	L	98.2	Very high	96.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.			trans	-130	41.3	176.7	-69.6	177.2	0	0	0	110.9	L275 N276 I283 F288 L297 M302 E323 I324 N327	L275-L299 HydrophobicContact CB-CD2 3.99Å; L275-L299 HydrophobicContact CD1-CD2 4.04Å; N276-L299 PolarHBondContact OD1-N 2.97Å; I283-L299 HydrophobicContact CD1-CD1 4.43Å; I283-L299 HydrophobicContact CD1-CD2 4.2Å; I283-L299 HydrophobicContact CG1-CD1 4.44Å; F288-L299 HydrophobicContact CE2-CD1 4.2Å; F288-L299 HydrophobicContact CZ-CD1 4.5Å; F288-L299 HydrophobicContact CZ-CD2 4.15Å; L297-L299 HydrophobicContact CD1-CD2 4.48Å; L297-L299 HydrophobicContact CD1-CG 4.31Å; L297-L299 HydrophobicContact CD2-CD1 4.06Å; L297-L299 HydrophobicContact CD2-CG 4.43Å; L297-L299 HydrophobicContact CG-CD1 4.24Å; L297-L299 HydrophobicContact CG-CG 4.08Å; L299-M302 HydrophobicContact CB-CE 3.46Å; L299-M302 VanDerWaalsContact CB-CE 3.46Å; L299-M302 HydrophobicContact CD2-CE 3.65Å; L299-M302 HydrophobicContact CD2-SD 4.42Å; L299-M302 HydrophobicContact CG-CE 4.09Å; L299-M302 WeakPolarHBondContact O-CE 3.11Å; L299-E323 CarbonylContact C-O 3.5Å; L299-E323 WeakPolarHBondContact CA-O 3.47Å; L299-E323 PolarHBondContact N-O 2.83Å; L299-I324 HydrophobicContact CB-CG1 3.95Å; L299-I324 HydrophobicContact CD1-CG1 4.2Å; L299-N327 PolarHBondContact O-ND2 3.26Å; L299-N327 PolarHBondContact O-OD1 3.4Å
300	N	98.4	Very high	96.4	Very high	9 Å²	9	38.2 Å²	38.2	5%	0.048	19%	0.189	C	C	.	.			trans	-93.3	157.1	-175.5	-53.3	-58.9	0	0	0	112.4	N276 K277 M302 E323 T325	N276-N300 CarbonylContact C-O 3.2Å; N276-N300 VanDerWaalsContact CA-O 3.23Å; N276-N300 WeakPolarHBondContact CA-O 3.29Å; N276-N300 HydrophobicContact CB-CB 4.4Å; N276-N300 WeakPolarHBondContact OD1-CA 3.48Å; N276-N300 VanDerWaalsContact OD1-CB 3.25Å; N276-N300 WeakPolarHBondContact OD1-CB 3.32Å; N276-N300 PolarHBondContact OD1-N 3.09Å; N276-N300 PolarHBondContact OD1-ND2 3.02Å; N276-N300 VanDerWaalsContact OD1-ND2 3.1Å; K277-N300 PolarHBondContact N-O 3.48Å; N300-M302 PolarHBondContact O-N 3.46Å; N300-E323 WeakPolarHBondContact ND2-CB 3.42Å; N300-E323 PolarHBondContact ND2-OE2 2.96Å; N300-E323 VanDerWaalsContact ND2-OE2 3.09Å; N300-E323 VanDerWaalsContact OD1-C 3.29Å; N300-E323 WeakPolarHBondContact OD1-CB 3.35Å; N300-E323 PolarHBondContact OD1-O 3.29Å; N300-T325 CarbonylContact C-O 3.26Å; N300-T325 WeakPolarHBondContact CA-O 3.46Å; N300-T325 WeakPolarHBondContact OD1-CB 3.34Å; N300-T325 PolarHBondContact OD1-N 2.94Å; N300-T325 PolarHBondContact OD1-OG1 3.4Å
301	N	98.3	Very high	96.3	Very high	57 Å²	57	35.3 Å²	35.3	31%	0.305	18%	0.177	S	C	.	.	S	Bend	trans	57.9	27.7	170.6	-52.1	-54.3	0	0	0	114.7	K277 E303 T325 N326 N327	K277-N301 WeakPolarHBondContact CA-O 3.37Å; K277-N301 HydrophobicContact CB-CB 4.31Å; N301-E303 PolarHBondContact O-N 2.85Å; N301-T325 PolarHBondContact N-O 2.7Å; N301-N326 WeakPolarHBondContact CA-O 3.43Å; N301-N326 WeakPolarHBondContact OD1-CB 3.32Å; N301-N326 PolarHBondContact OD1-ND2 3.12Å; N301-N327 PolarHBondContact N-OD1 2.83Å
302	M	97.4	Very high	96.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.			trans	-87.1	96.5	174.3	-65.2	-169.8	-80.9	0	0	110.2	I280 L299 N300 E304 L305 N327	I280-M302 HydrophobicContact CB-SD 3.97Å; I280-M302 HydrophobicContact CD1-SD 4.44Å; I280-M302 HydrophobicContact CG1-SD 4.49Å; L299-M302 HydrophobicContact CB-CE 3.46Å; L299-M302 VanDerWaalsContact CB-CE 3.46Å; L299-M302 HydrophobicContact CD2-CE 3.65Å; L299-M302 HydrophobicContact CD2-SD 4.42Å; L299-M302 HydrophobicContact CG-CE 4.09Å; L299-M302 WeakPolarHBondContact O-CE 3.11Å; N300-M302 PolarHBondContact O-N 3.46Å; M302-E304 PolarHBondContact O-N 2.86Å; M302-E304 VanDerWaalsContact O-N 3.14Å; M302-L305 HydrophobicContact CB-CB 3.66Å; M302-L305 HydrophobicContact CE-CB 4.26Å; M302-L305 HydrophobicContact CE-CD1 4.5Å; M302-L305 HydrophobicContact CE-CD2 3.51Å; M302-L305 HydrophobicContact CE-CG 4.27Å; M302-L305 PolarHBondContact O-N 2.95Å; M302-L305 HydrophobicContact SD-CB 4.48Å; M302-N327 WeakPolarHBondContact CA-OD1 3.24Å; M302-N327 VanDerWaalsContact CB-OD1 3.31Å; M302-N327 WeakPolarHBondContact CB-OD1 3.4Å; M302-N327 PolarHBondContact N-OD1 3.23Å
303	E	95.3	Very high	96.3	Very high	146 Å²	146	30.2 Å²	30.2	68%	0.682	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.9	-177.6	-64	-174.6	172.7	0	0	113.8	N301 R329	N301-E303 PolarHBondContact O-N 2.85Å; E303-R329 VanDerWaalsContact O-CD 3.27Å; E303-R329 WeakPolarHBondContact O-CD 3.49Å; E303-R329 WeakPolarHBondContact O-CG 3.34Å
304	E	94.3	Very high	96.2	Very high	50 Å²	50	27.4 Å²	27.4	23%	0.234	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-7.3	-176.6	-64.5	-166.7	-137	0	0	113.7	I280 K281 M302 V306	I280-E304 CarbonylContact O-C 3.53Å; K281-E304 WeakPolarHBondContact CA-O 3.46Å; K281-E304 WeakPolarHBondContact CE-OE2 3.31Å; K281-E304 HydrophobicContact CG-CB 3.98Å; K281-E304 IonicContact NZ-OE2 3.69Å; M302-E304 PolarHBondContact O-N 2.86Å; M302-E304 VanDerWaalsContact O-N 3.14Å; E304-V306 PolarHBondContact O-N 3.32Å
305	L	95.9	Very high	96.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.146	C	C	.	.			trans	-67.5	120.6	-178.4	178.4	69.3	0	0	0	110	I280 I283 M302 I324 N327 R329 L330	I280-L305 WeakPolarHBondContact O-CA 3.28Å; I280-L305 WeakPolarHBondContact O-CB 3.23Å; I280-L305 PolarHBondContact O-N 3.38Å; I283-L305 HydrophobicContact CD1-CD1 4.25Å; I283-L305 HydrophobicContact CG1-CD1 3.96Å; M302-L305 HydrophobicContact CB-CB 3.66Å; M302-L305 HydrophobicContact CE-CB 4.26Å; M302-L305 HydrophobicContact CE-CD1 4.5Å; M302-L305 HydrophobicContact CE-CD2 3.51Å; M302-L305 HydrophobicContact CE-CG 4.27Å; M302-L305 PolarHBondContact O-N 2.95Å; M302-L305 HydrophobicContact SD-CB 4.48Å; L305-I324 HydrophobicContact CD2-CG2 4.24Å; L305-N327 HydrophobicContact CB-CB 4.41Å; L305-N327 HydrophobicContact CD2-CB 4.33Å; L305-R329 CarbonylContact O-C 3.56Å; L305-R329 WeakPolarHBondContact O-CB 3.14Å; L305-L330 HydrophobicContact CD2-CB 4.39Å; L305-L330 HydrophobicContact CD2-CD1 4.12Å; L305-L330 HydrophobicContact CD2-CD2 4.02Å; L305-L330 HydrophobicContact CD2-CG 4.4Å; L305-L330 HydrophobicContact CG-CB 4.44Å; L305-L330 HydrophobicContact CG-CD1 4.19Å; L305-L330 VanDerWaalsContact O-CA 3.28Å; L305-L330 WeakPolarHBondContact O-CA 3.29Å; L305-L330 PolarHBondContact O-N 3.35Å
306	V	93.6	Very high	96.1	Very high	22 Å²	22	25.5 Å²	25.5	13%	0.133	13%	0.129	C	C	.	.			trans	-107.8	-40.8	-177.2	171.1	0	0	0	0	111.9	K281 E304 R329 L330 S331 S434	K281-V306 PolarHBondContact O-N 3.14Å; E304-V306 PolarHBondContact O-N 3.32Å; V306-R329 WeakPolarHBondContact CA-O 3.14Å; V306-R329 HydrophobicContact CG2-CB 4.12Å; V306-L330 WeakPolarHBondContact O-CA 2.93Å; V306-S331 PolarHBondContact O-N 3.05Å; V306-S434 VanDerWaalsContact CG1-O 3.23Å; V306-S434 WeakPolarHBondContact CG1-O 3.01Å
307	S	93.8	Very high	96.1	Very high	6 Å²	6	24.5 Å²	24.5	4%	0.042	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	161.1	-174.3	56.9	0	0	0	0	114.6	L282 I283 Y332	L282-S307 WeakPolarHBondContact CD1-OG 3.17Å; I283-S307 PolarHBondContact N-O 3.23Å; S307-Y332 VanDerWaalsContact CA-O 3.23Å; S307-Y332 WeakPolarHBondContact CA-O 3.34Å
308	I	95.9	Very high	96	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	117.7	176.1	-59.7	178.3	0	0	0	108.4	I283 S312 L313 I324 L330 Y332 V333 H334 A337	I283-I308 HydrophobicContact CB-CG1 4.29Å; I283-I308 HydrophobicContact CB-CG2 4.27Å; I283-I308 HydrophobicContact CG1-CG1 4.07Å; I308-S312 WeakPolarHBondContact CG2-OG 3.1Å; I308-L313 HydrophobicContact CG2-CD1 4.25Å; I308-I324 HydrophobicContact CD1-CD1 3.69Å; I308-I324 HydrophobicContact CD1-CG2 4.27Å; I308-L330 HydrophobicContact CD1-CD1 4.44Å; I308-L330 HydrophobicContact CG1-CD1 4.14Å; I308-Y332 PolarHBondContact N-O 3.03Å; I308-V333 HydrophobicContact CB-CG1 4.39Å; I308-V333 HydrophobicContact CD1-CG2 4.3Å; I308-H334 WeakPolarHBondContact O-CB 3.46Å; I308-H334 PolarHBondContact O-N 3.42Å; I308-A337 HydrophobicContact CG2-CB 3.84Å
309	D	92.8	Very high	96.1	Very high	11 Å²	11	26.8 Å²	26.8	6%	0.059	14%	0.137	C	C	.	.			trans	-82.1	171	-173.5	-82.6	-13.5	0	0	0	113.5	I283 S312 A337 R453	I283-D309 WeakPolarHBondContact O-CB 3.4Å; I283-D309 PolarHBondContact O-N 3.19Å; D309-S312 WeakPolarHBondContact O-CB 3.44Å; D309-S312 PolarHBondContact O-N 2.9Å; D309-S312 PolarHBondContact O-OG 3.29Å; D309-A337 WeakPolarHBondContact O-CA 3.02Å; D309-A337 WeakPolarHBondContact O-CB 3.4Å; D309-R453 IonicContact OD1-CZ 3.77Å; D309-R453 VanDerWaalsContact OD1-CZ 3.31Å; D309-R453 IonicContact OD1-NE 3.65Å; D309-R453 PolarHBondContact OD1-NE 3.47Å; D309-R453 VanDerWaalsContact OD1-NE 3.09Å; D309-R453 IonicContact OD1-NH2 2.8Å; D309-R453 PolarHBondContact OD1-NH2 3.47Å; D309-R453 IonicContact OD2-NH2 3.81Å; D309-R453 PolarHBondContact OD2-NH2 3.3Å; D309-R453 VanDerWaalsContact OD2-NH2 3.08Å
310	K	92.9	Very high	96.1	Very high	94 Å²	94	29.1 Å²	29.1	41%	0.409	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	136.9	176.3	178.9	175.1	174.2	173.8	0	111.6	T285 S312 Q336	T285-K310 WeakPolarHBondContact CA-O 3.26Å; T285-K310 VanDerWaalsContact CB-O 3.32Å; T285-K310 WeakPolarHBondContact CB-O 3.36Å; T285-K310 WeakPolarHBondContact CG2-O 3.22Å; T285-K310 PolarHBondContact OG1-O 3.38Å; K310-S312 PolarHBondContact O-N 3.06Å; K310-Q336 HydrophobicContact CG-CB 4.2Å
311	A	94.7	Very high	96	Very high	20 Å²	20	31.6 Å²	31.6	17%	0.165	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	35.3	175.9	0	0	0	0	0	113.1	T285 G286 D314 Q336 V339	T285-A311 HydrophobicContact CG2-CB 4.42Å; G286-A311 PolarHBondContact N-O 3.47Å; A311-D314 HydrophobicContact CB-CB 4.26Å; A311-Q336 PolarHBondContact N-O 3.09Å; A311-V339 HydrophobicContact CB-CG2 4.49Å
312	S	96.5	Very high	96	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-71.5	-40.2	173.3	43.3	0	0	0	0	110.8	E284 F288 I308 D309 K310 A337	E284-S312 WeakPolarHBondContact O-CA 3.28Å; E284-S312 WeakPolarHBondContact O-CB 3.36Å; F288-S312 PolarHBondContact N-O 2.67Å; F288-S312 VanDerWaalsContact N-O 3.08Å; I308-S312 WeakPolarHBondContact CG2-OG 3.1Å; D309-S312 WeakPolarHBondContact O-CB 3.44Å; D309-S312 PolarHBondContact O-N 2.9Å; D309-S312 PolarHBondContact O-OG 3.29Å; K310-S312 PolarHBondContact O-N 3.06Å; S312-A337 PolarHBondContact N-O 3.45Å
313	L	96.8	Very high	96	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	92	170.9	-66.4	85	0	0	0	108.6	F288 L297 I308 L316 L319 L322 A337 F338 V339 L341	F288-L313 HydrophobicContact CB-CG 4.49Å; F288-L313 HydrophobicContact CD2-CD1 4.24Å; F288-L313 HydrophobicContact CD2-CG 4.06Å; L297-L313 HydrophobicContact CD2-CD2 3.94Å; I308-L313 HydrophobicContact CG2-CD1 4.25Å; L313-L316 HydrophobicContact CB-CD1 3.94Å; L313-L316 HydrophobicContact CD2-CD1 4.22Å; L313-L316 HydrophobicContact CG-CD1 4.29Å; L313-L319 HydrophobicContact CD2-CD2 4.33Å; L313-L322 HydrophobicContact CD2-CD1 3.92Å; L313-L322 HydrophobicContact CD2-CD2 3.62Å; L313-L322 HydrophobicContact CD2-CG 4.44Å; L313-A337 PolarHBondContact N-O 3.22Å; L313-F338 HydrophobicContact CB-CD1 4.17Å; L313-F338 HydrophobicContact CD1-CD1 4.1Å; L313-F338 HydrophobicContact CD1-CE1 3.95Å; L313-F338 HydrophobicContact CD2-CD1 4.37Å; L313-F338 HydrophobicContact CD2-CE1 4.37Å; L313-F338 HydrophobicContact CG-CD1 4.45Å; L313-V339 PolarHBondContact O-N 3.12Å; L313-L341 HydrophobicContact CB-CD1 4.47Å; L313-L341 HydrophobicContact CB-CD2 4.49Å
314	D	96.4	Very high	96.1	Very high	13 Å²	13	24.1 Å²	24.1	7%	0.07	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.5	-176	-173.6	29.1	0	0	0	110.9	K289 D290 A311 V339 R340	K289-D314 WeakPolarHBondContact CA-O 3.33Å; K289-D314 HydrophobicContact CG-CB 4.39Å; D290-D314 PolarHBondContact N-O 3.36Å; A311-D314 HydrophobicContact CB-CB 4.26Å; D314-V339 WeakPolarHBondContact CA-O 3.44Å; D314-V339 HydrophobicContact CB-CB 4.42Å; D314-V339 WeakPolarHBondContact OD1-CB 3.23Å; D314-V339 VanDerWaalsContact OD1-CG1 3.26Å; D314-V339 WeakPolarHBondContact OD1-CG1 3.41Å; D314-R340 IonicContact OD1-CZ 2.78Å; D314-R340 IonicContact OD1-NE 3.53Å; D314-R340 IonicContact OD1-NH1 3.34Å; D314-R340 PolarHBondContact OD1-NH1 2.88Å; D314-R340 IonicContact OD1-NH2 2.92Å; D314-R340 PolarHBondContact OD1-NH2 2.99Å; D314-R340 IonicContact OD2-CZ 2.92Å; D314-R340 IonicContact OD2-NH1 3.61Å; D314-R340 IonicContact OD2-NH2 3.09Å; D314-R340 PolarHBondContact OD2-NH2 3.31Å
315	N	96.8	Very high	96.3	Very high	44 Å²	44	23 Å²	23	24%	0.235	12%	0.121	C	C	.	.			trans	60.9	59.3	177.7	-161	36	0	0	0	113.8	D290 P317 V339	D290-N315 WeakPolarHBondContact OD1-CB 3.35Å; D290-N315 PolarHBondContact OD1-ND2 3.26Å; N315-P317 WeakPolarHBondContact O-CD 3.34Å; N315-V339 PolarHBondContact N-O 3.35Å
316	L	97.3	Very high	96.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.			trans	-116.4	78.9	175.2	-53.9	171.6	0	0	0	108.9	F288 M291 L313 E318 L319 R340 L341	F288-L316 HydrophobicContact CB-CD1 4.4Å; F288-L316 VanDerWaalsContact O-CD2 3.28Å; F288-L316 WeakPolarHBondContact O-CD2 3.09Å; M291-L316 HydrophobicContact CB-CD2 3.52Å; M291-L316 HydrophobicContact CG-CD2 4.4Å; M291-L316 VanDerWaalsContact O-CD2 3.24Å; M291-L316 WeakPolarHBondContact O-CD2 3.25Å; L313-L316 HydrophobicContact CB-CD1 3.94Å; L313-L316 HydrophobicContact CD2-CD1 4.22Å; L313-L316 HydrophobicContact CG-CD1 4.29Å; L316-E318 VanDerWaalsContact C-N 3.28Å; L316-E318 PolarHBondContact O-N 3.12Å; L316-L319 HydrophobicContact CB-CB 3.85Å; L316-L319 HydrophobicContact CB-CD2 4.35Å; L316-L319 HydrophobicContact CD1-CD2 3.83Å; L316-L319 PolarHBondContact O-N 3.36Å; L316-R340 PolarHBondContact N-O 3.18Å; L316-L341 HydrophobicContact CB-CD2 3.61Å; L316-L341 HydrophobicContact CD1-CD2 3.97Å; L316-L341 HydrophobicContact CG-CD2 4Å
317	P	96.8	Very high	96.6	Very high	37 Å²	37	25.8 Å²	25.8	24%	0.24	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-24.1	-170.9	28.4	-35.2	0	0	0	113.5	L292 N315 R343	L292-P317 HydrophobicContact CD2-CG 4.46Å; L292-P317 WeakPolarHBondContact O-CG 3.49Å; N315-P317 WeakPolarHBondContact O-CD 3.34Å; P317-R343 WeakPolarHBondContact O-CB 3.47Å; P317-R343 WeakPolarHBondContact O-CD 3.44Å; P317-R343 WeakPolarHBondContact O-CG 3.46Å
318	E	97.4	Very high	96.7	Very high	54 Å²	54	29 Å²	29	25%	0.252	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.1	-178.4	-64.4	-61.1	144.2	0	0	114	L292 L294 K295 L316 T320 R343	L292-E318 WeakPolarHBondContact O-CG 3.35Å; L294-E318 CarbonylContact O-C 3.23Å; K295-E318 WeakPolarHBondContact CA-O 3.25Å; K295-E318 HydrophobicContact CG-CB 4.34Å; L316-E318 VanDerWaalsContact C-N 3.28Å; L316-E318 PolarHBondContact O-N 3.12Å; E318-T320 PolarHBondContact O-N 3.38Å; E318-R343 IonicContact OE1-CZ 3.74Å; E318-R343 IonicContact OE1-NH1 3.79Å; E318-R343 PolarHBondContact OE1-NH1 2.66Å; E318-R343 IonicContact OE1-NH2 3.71Å; E318-R343 IonicContact OE2-CZ 3.59Å; E318-R343 IonicContact OE2-NH1 3.92Å; E318-R343 PolarHBondContact OE2-NH1 3.26Å
319	L	98.1	Very high	96.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.			trans	-70.7	113.8	-175.2	-171.8	73.3	0	0	0	109.7	L294 L297 L313 L316 L341 R343 L344	L294-L319 HydrophobicContact CD2-CD1 4.34Å; L294-L319 HydrophobicContact CG-CD1 4.28Å; L294-L319 WeakPolarHBondContact O-CA 3.42Å; L294-L319 PolarHBondContact O-N 3.4Å; L297-L319 HydrophobicContact CB-CD1 4.14Å; L313-L319 HydrophobicContact CD2-CD2 4.33Å; L316-L319 HydrophobicContact CB-CB 3.85Å; L316-L319 HydrophobicContact CB-CD2 4.35Å; L316-L319 HydrophobicContact CD1-CD2 3.83Å; L316-L319 PolarHBondContact O-N 3.36Å; L319-L341 HydrophobicContact CD2-CD1 4.39Å; L319-L341 HydrophobicContact CD2-CD2 4.43Å; L319-R343 CarbonylContact O-C 3.52Å; L319-L344 HydrophobicContact CD2-CD1 4.03Å; L319-L344 HydrophobicContact CG-CD1 3.96Å; L319-L344 WeakPolarHBondContact O-CA 3.19Å; L319-L344 PolarHBondContact O-N 3Å; L319-L344 VanDerWaalsContact O-N 3.08Å
320	T	97.7	Very high	96.8	Very high	49 Å²	49	34.9 Å²	34.9	30%	0.301	18%	0.178	S	C	.	.			trans	-102.5	-30.1	-179.6	57.4	0	0	0	0	112.4	K295 E318 R343 E345 S346	K295-T320 PolarHBondContact O-N 3.01Å; K295-T320 PolarHBondContact O-OG1 3.24Å; E318-T320 PolarHBondContact O-N 3.38Å; T320-R343 WeakPolarHBondContact CA-O 3.44Å; T320-R343 HydrophobicContact CG2-CB 4.49Å; T320-E345 PolarHBondContact O-N 3.09Å; T320-S346 PolarHBondContact O-N 3.47Å; T320-S346 VanDerWaalsContact O-N 3.07Å
321	K	97	Very high	96.8	Very high	60 Å²	60	30.6 Å²	30.6	26%	0.261	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.1	-175.3	-172.4	176.4	173.4	-136.2	0	111.7	K295 E296 L297 E323	K295-K321 PolarHBondContact O-N 2.97Å; E296-K321 HydrophobicContact CG-CB 4.35Å; E296-K321 HydrophobicContact CG-CD 4.47Å; E296-K321 IonicContact OE1-NZ 3.68Å; E296-K321 PolarHBondContact OE1-NZ 3.1Å; L297-K321 PolarHBondContact N-O 2.84Å; K321-E323 WeakPolarHBondContact CE-OE1 3.25Å; K321-E323 HydrophobicContact CG-CG 4.21Å; K321-E323 VanDerWaalsContact NZ-CD 3.3Å; K321-E323 IonicContact NZ-OE1 2.8Å; K321-E323 PolarHBondContact NZ-OE1 3.49Å; K321-E323 IonicContact NZ-OE2 2.67Å
322	L	97.7	Very high	96.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	115.1	175.9	178.7	57.7	0	0	0	109.8	L297 L313 I324 F338 L344 S346 L347 M348	L297-L322 HydrophobicContact CB-CD1 4.04Å; L297-L322 HydrophobicContact CD2-CD1 4Å; L297-L322 HydrophobicContact CG-CD1 4.08Å; L313-L322 HydrophobicContact CD2-CD1 3.92Å; L313-L322 HydrophobicContact CD2-CD2 3.62Å; L313-L322 HydrophobicContact CD2-CG 4.44Å; L322-I324 HydrophobicContact CD1-CD1 4.06Å; L322-I324 HydrophobicContact CD1-CG1 4.03Å; L322-I324 HydrophobicContact CD2-CD1 3.83Å; L322-I324 HydrophobicContact CG-CD1 3.8Å; L322-I324 HydrophobicContact CG-CG1 4.07Å; L322-F338 HydrophobicContact CD2-CD1 4.35Å; L322-F338 HydrophobicContact CD2-CE1 3.8Å; L322-F338 HydrophobicContact CD2-CZ 3.93Å; L322-L344 HydrophobicContact CB-CD1 3.79Å; L322-L344 HydrophobicContact CB-CD2 4.49Å; L322-S346 PolarHBondContact N-O 3.46Å; L322-L347 HydrophobicContact CB-CD1 4.19Å; L322-L347 HydrophobicContact CD2-CD1 3.88Å; L322-L347 HydrophobicContact CG-CD1 4.08Å; L322-M348 PolarHBondContact O-N 3.08Å
323	E	97.2	Very high	96.7	Very high	46 Å²	46	29.7 Å²	29.7	22%	0.215	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115	179.7	-60	-172.1	145.8	0	0	111.4	L297 L299 N300 K321 M348	L297-E323 PolarHBondContact O-N 3.32Å; L299-E323 CarbonylContact C-O 3.5Å; L299-E323 WeakPolarHBondContact CA-O 3.47Å; L299-E323 PolarHBondContact N-O 2.83Å; N300-E323 WeakPolarHBondContact ND2-CB 3.42Å; N300-E323 PolarHBondContact ND2-OE2 2.96Å; N300-E323 VanDerWaalsContact ND2-OE2 3.09Å; N300-E323 VanDerWaalsContact OD1-C 3.29Å; N300-E323 WeakPolarHBondContact OD1-CB 3.35Å; N300-E323 PolarHBondContact OD1-O 3.29Å; K321-E323 WeakPolarHBondContact CE-OE1 3.25Å; K321-E323 HydrophobicContact CG-CG 4.21Å; K321-E323 VanDerWaalsContact NZ-CD 3.3Å; K321-E323 IonicContact NZ-OE1 2.8Å; K321-E323 PolarHBondContact NZ-OE1 3.49Å; K321-E323 IonicContact NZ-OE2 2.67Å; E323-M348 HydrophobicContact CG-CB 4.43Å; E323-M348 HydrophobicContact CG-CG 4.2Å
324	I	98.1	Very high	96.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.			trans	-130.6	66.6	177.1	-53.7	158.8	0	0	0	107.1	L299 L305 I308 L322 N327 L330 F338 M348 L349 N352	L299-I324 HydrophobicContact CB-CG1 3.95Å; L299-I324 HydrophobicContact CD1-CG1 4.2Å; L305-I324 HydrophobicContact CD2-CG2 4.24Å; I308-I324 HydrophobicContact CD1-CD1 3.69Å; I308-I324 HydrophobicContact CD1-CG2 4.27Å; L322-I324 HydrophobicContact CD1-CD1 4.06Å; L322-I324 HydrophobicContact CD1-CG1 4.03Å; L322-I324 HydrophobicContact CD2-CD1 3.83Å; L322-I324 HydrophobicContact CG-CD1 3.8Å; L322-I324 HydrophobicContact CG-CG1 4.07Å; I324-N327 VanDerWaalsContact CG2-ND2 3.26Å; I324-N327 WeakPolarHBondContact CG2-ND2 3.27Å; I324-L330 HydrophobicContact CG2-CD2 3.31Å; I324-F338 HydrophobicContact CD1-CZ 4.2Å; I324-M348 CarbonylContact C-O 3.5Å; I324-M348 WeakPolarHBondContact CA-O 3.4Å; I324-M348 PolarHBondContact N-O 3.18Å; I324-L349 HydrophobicContact CB-CD2 3.9Å; I324-L349 HydrophobicContact CD1-CD2 4Å; I324-L349 HydrophobicContact CG2-CD2 4.24Å; I324-N352 PolarHBondContact O-ND2 2.92Å
325	T	98.1	Very high	96.4	Very high	26 Å²	26	30.1 Å²	30.1	16%	0.16	15%	0.154	C	C	.	.			trans	-110.8	152.7	-172.7	69.8	0	0	0	0	112.6	N300 N301 N327 M348 N350	N300-T325 CarbonylContact C-O 3.26Å; N300-T325 WeakPolarHBondContact CA-O 3.46Å; N300-T325 WeakPolarHBondContact OD1-CB 3.34Å; N300-T325 PolarHBondContact OD1-N 2.94Å; N300-T325 PolarHBondContact OD1-OG1 3.4Å; N301-T325 PolarHBondContact N-O 2.7Å; T325-N327 VanDerWaalsContact C-N 3.32Å; T325-N327 PolarHBondContact O-N 3.1Å; T325-M348 HydrophobicContact CG2-CB 3.48Å; T325-M348 VanDerWaalsContact CG2-CB 3.48Å; T325-N350 WeakPolarHBondContact CA-O 3.33Å; T325-N350 VanDerWaalsContact CG2-OD1 3.25Å; T325-N350 WeakPolarHBondContact CG2-OD1 3.33Å
326	N	98.1	Very high	96.2	Very high	81 Å²	81	32.3 Å²	32.3	43%	0.433	16%	0.163	S	C	.	.	S	Bend	trans	57.1	42.2	176.2	-163.9	38.2	0	0	0	113.6	N301 P328 N350 S351	N301-N326 WeakPolarHBondContact CA-O 3.43Å; N301-N326 WeakPolarHBondContact OD1-CB 3.32Å; N301-N326 PolarHBondContact OD1-ND2 3.12Å; N326-P328 VanDerWaalsContact O-CD 3.3Å; N326-P328 WeakPolarHBondContact O-CD 3.26Å; N326-N350 PolarHBondContact N-O 3.23Å; N326-N350 VanDerWaalsContact N-O 3.09Å; N326-S351 CarbonylContact C-O 3.56Å; N326-S351 WeakPolarHBondContact CA-O 3.44Å; N326-S351 PolarHBondContact N-O 3.23Å
327	N	98.1	Very high	96.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.			trans	-106.4	89.3	172.7	-53.8	-58.8	0	0	0	108.7	L299 N301 M302 L305 I324 T325 R329 L330 S351 N352	L299-N327 PolarHBondContact O-ND2 3.26Å; L299-N327 PolarHBondContact O-OD1 3.4Å; N301-N327 PolarHBondContact N-OD1 2.83Å; M302-N327 WeakPolarHBondContact CA-OD1 3.24Å; M302-N327 VanDerWaalsContact CB-OD1 3.31Å; M302-N327 WeakPolarHBondContact CB-OD1 3.4Å; M302-N327 PolarHBondContact N-OD1 3.23Å; L305-N327 HydrophobicContact CB-CB 4.41Å; L305-N327 HydrophobicContact CD2-CB 4.33Å; I324-N327 VanDerWaalsContact CG2-ND2 3.26Å; I324-N327 WeakPolarHBondContact CG2-ND2 3.27Å; T325-N327 VanDerWaalsContact C-N 3.32Å; T325-N327 PolarHBondContact O-N 3.1Å; N327-R329 PolarHBondContact O-N 2.97Å; N327-L330 HydrophobicContact CB-CB 3.72Å; N327-L330 HydrophobicContact CB-CD2 4.39Å; N327-L330 WeakPolarHBondContact O-CB 3.25Å; N327-L330 PolarHBondContact O-N 3.06Å; N327-S351 PolarHBondContact N-O 3.39Å; N327-N352 VanDerWaalsContact CA-OD1 3.31Å; N327-N352 WeakPolarHBondContact CA-OD1 3.36Å; N327-N352 WeakPolarHBondContact CB-OD1 3.16Å; N327-N352 PolarHBondContact N-OD1 3.09Å; N327-N352 WeakPolarHBondContact O-CA 3.42Å; N327-N352 PolarHBondContact O-OD1 2.92Å
328	P	95.6	Very high	96.1	Very high	75 Å²	75	30.6 Å²	30.6	49%	0.487	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-13.3	-166	26	-36.6	0	0	0	114.8	N326 S353	N326-P328 VanDerWaalsContact O-CD 3.3Å; N326-P328 WeakPolarHBondContact O-CD 3.26Å; P328-S353 WeakPolarHBondContact O-CB 3.45Å
329	R	94.5	Very high	96	Very high	134 Å²	134	29.8 Å²	29.8	51%	0.506	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-7.9	176.5	-65.6	-172.5	179.7	174	1.6	113.6	E303 L305 V306 N327 S331 S434	E303-R329 VanDerWaalsContact O-CD 3.27Å; E303-R329 WeakPolarHBondContact O-CD 3.49Å; E303-R329 WeakPolarHBondContact O-CG 3.34Å; L305-R329 CarbonylContact O-C 3.56Å; L305-R329 WeakPolarHBondContact O-CB 3.14Å; V306-R329 WeakPolarHBondContact CA-O 3.14Å; V306-R329 HydrophobicContact CG2-CB 4.12Å; N327-R329 PolarHBondContact O-N 2.97Å; R329-S331 PolarHBondContact O-N 3.38Å; R329-S434 PolarHBondContact O-OG 3.16Å
330	L	96.3	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.173	C	C	.	.			trans	-71.1	106.3	-176.3	173.4	62.5	0	0	0	108.7	L305 V306 I308 I324 N327 N352 S353 L354	L305-L330 HydrophobicContact CD2-CB 4.39Å; L305-L330 HydrophobicContact CD2-CD1 4.12Å; L305-L330 HydrophobicContact CD2-CD2 4.02Å; L305-L330 HydrophobicContact CD2-CG 4.4Å; L305-L330 HydrophobicContact CG-CB 4.44Å; L305-L330 HydrophobicContact CG-CD1 4.19Å; L305-L330 VanDerWaalsContact O-CA 3.28Å; L305-L330 WeakPolarHBondContact O-CA 3.29Å; L305-L330 PolarHBondContact O-N 3.35Å; V306-L330 WeakPolarHBondContact O-CA 2.93Å; I308-L330 HydrophobicContact CD1-CD1 4.44Å; I308-L330 HydrophobicContact CG1-CD1 4.14Å; I324-L330 HydrophobicContact CG2-CD2 3.31Å; N327-L330 HydrophobicContact CB-CB 3.72Å; N327-L330 HydrophobicContact CB-CD2 4.39Å; N327-L330 WeakPolarHBondContact O-CB 3.25Å; N327-L330 PolarHBondContact O-N 3.06Å; L330-N352 HydrophobicContact CB-CB 4.21Å; L330-N352 HydrophobicContact CD2-CB 4.44Å; L330-S353 CarbonylContact O-C 3.51Å; L330-S353 VanDerWaalsContact O-CA 3.26Å; L330-S353 WeakPolarHBondContact O-CA 3.35Å; L330-S353 WeakPolarHBondContact O-CB 3.45Å; L330-S353 PolarHBondContact O-N 3.14Å; L330-L354 HydrophobicContact CG-CD2 4.14Å; L330-L354 PolarHBondContact O-N 3.2Å
331	S	93.9	Very high	95.7	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.021	16%	0.159	C	C	.	.			trans	-124.6	-5.2	-170.4	65	0	0	0	0	113.6	V306 R329 S353 P432 S434	V306-S331 PolarHBondContact O-N 3.05Å; R329-S331 PolarHBondContact O-N 3.38Å; S331-S353 WeakPolarHBondContact CA-O 3.33Å; S331-P432 VanDerWaalsContact OG-CB 3.22Å; S331-P432 WeakPolarHBondContact OG-CB 3.34Å; S331-S434 WeakPolarHBondContact CB-OG 3.4Å; S331-S434 PolarHBondContact OG-OG 2.62Å
332	Y	94.1	Very high	95.6	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	131.1	-179.2	-178.3	-93.5	0	0	0	112.4	S307 I308 H334 R453 L455	S307-Y332 VanDerWaalsContact CA-O 3.23Å; S307-Y332 WeakPolarHBondContact CA-O 3.34Å; I308-Y332 PolarHBondContact N-O 3.03Å; Y332-H334 HydrophobicContact CE1-CB 3.86Å; Y332-H334 PolarHBondContact OH-CD2 2.96Å; Y332-H334 VanDerWaalsContact OH-CD2 3.31Å; Y332-R453 HydrophobicContact CD1-CB 3.69Å; Y332-R453 HydrophobicContact CD1-CG 3.65Å; Y332-R453 HydrophobicContact CD2-CB 3.55Å; Y332-R453 HydrophobicContact CD2-CG 4.45Å; Y332-R453 HydrophobicContact CE1-CB 3.85Å; Y332-R453 HydrophobicContact CE1-CG 3.8Å; Y332-R453 HydrophobicContact CE2-CB 3.71Å; Y332-R453 HydrophobicContact CG-CB 3.52Å; Y332-R453 HydrophobicContact CG-CG 3.99Å; Y332-L455 HydrophobicContact CD2-CD1 4.4Å; Y332-L455 HydrophobicContact CD2-CD2 4.42Å; Y332-L455 HydrophobicContact CD2-CG 4.08Å; Y332-L455 HydrophobicContact CE2-CD1 4.44Å; Y332-L455 HydrophobicContact CE2-CD2 3.68Å; Y332-L455 HydrophobicContact CE2-CG 3.77Å
333	V	95.1	Very high	95.5	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.8	167.4	-178.5	0	0	0	0	107.5	I308 A337 F338 L354 L357 I361	I308-V333 HydrophobicContact CB-CG1 4.39Å; I308-V333 HydrophobicContact CD1-CG2 4.3Å; V333-A337 HydrophobicContact CG1-CB 3.76Å; V333-F338 HydrophobicContact CG1-CE2 4.37Å; V333-F338 HydrophobicContact CG1-CZ 4.05Å; V333-L354 HydrophobicContact CG2-CD2 3.98Å; V333-L357 HydrophobicContact CB-CD1 4.34Å; V333-I361 HydrophobicContact CB-CD1 4.17Å; V333-I361 HydrophobicContact CG1-CD1 3.77Å
334	H	93.6	Very high	95.5	Very high	15 Å²	15	37.2 Å²	37.2	7%	0.069	18%	0.178	C	C	.	.			trans	-61	140.9	-179.3	-171.5	-88.7	0	0	0	111	I308 Y332 Q336 A337	I308-H334 WeakPolarHBondContact O-CB 3.46Å; I308-H334 PolarHBondContact O-N 3.42Å; Y332-H334 HydrophobicContact CE1-CB 3.86Å; Y332-H334 PolarHBondContact OH-CD2 2.96Å; Y332-H334 VanDerWaalsContact OH-CD2 3.31Å; H334-Q336 PolarHBondContact ND1-N 3.45Å; H334-Q336 PolarHBondContact O-N 3.29Å; H334-A337 HydrophobicContact CB-CB 4.23Å; H334-A337 VanDerWaalsContact O-CB 3.23Å; H334-A337 WeakPolarHBondContact O-CB 3.29Å; H334-A337 PolarHBondContact O-N 3.33Å
335	P	92.5	Very high	95.5	Very high	7 Å²	7	41.2 Å²	41.2	5%	0.045	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.7	-179.9	-29.2	36.4	0	0	0	116.1	H358 N360 L455 Y459	P335-H358 HydrophobicContact CB-CB 4.11Å; P335-H358 HydrophobicContact CG-CB 3.93Å; P335-N360 HydrophobicContact CB-CB 4.15Å; P335-N360 WeakPolarHBondContact O-CB 3.46Å; P335-L455 HydrophobicContact CG-CD2 4.16Å; P335-Y459 HydrophobicContact CG-CE2 4.33Å
336	Q	93.6	Very high	95.4	Very high	89 Å²	89	40.5 Å²	40.5	42%	0.416	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	28.5	176.6	-60	177.5	-33.1	0	0	111.4	K310 A311 H334 F338 V339	K310-Q336 HydrophobicContact CG-CB 4.2Å; A311-Q336 PolarHBondContact N-O 3.09Å; H334-Q336 PolarHBondContact ND1-N 3.45Å; H334-Q336 PolarHBondContact O-N 3.29Å; Q336-F338 VanDerWaalsContact C-N 3.31Å; Q336-V339 HydrophobicContact CB-CG2 4.4Å; Q336-V339 VanDerWaalsContact O-CG2 3.22Å; Q336-V339 WeakPolarHBondContact O-CG2 3.43Å
337	A	96.2	Very high	95.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-65.7	-38.8	176	0	0	0	0	0	111.6	I308 D309 S312 L313 V333 H334	I308-A337 HydrophobicContact CG2-CB 3.84Å; D309-A337 WeakPolarHBondContact O-CA 3.02Å; D309-A337 WeakPolarHBondContact O-CB 3.4Å; S312-A337 PolarHBondContact N-O 3.45Å; L313-A337 PolarHBondContact N-O 3.22Å; V333-A337 HydrophobicContact CG1-CB 3.76Å; H334-A337 HydrophobicContact CB-CB 4.23Å; H334-A337 VanDerWaalsContact O-CB 3.23Å; H334-A337 WeakPolarHBondContact O-CB 3.29Å; H334-A337 PolarHBondContact O-N 3.33Å
338	F	95.9	Very high	95.4	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	108.4	-177.8	-55.4	-25.5	0	0	0	109.3	L313 L322 I324 V333 Q336 L341 L347 I361 L365	L313-F338 HydrophobicContact CB-CD1 4.17Å; L313-F338 HydrophobicContact CD1-CD1 4.1Å; L313-F338 HydrophobicContact CD1-CE1 3.95Å; L313-F338 HydrophobicContact CD2-CD1 4.37Å; L313-F338 HydrophobicContact CD2-CE1 4.37Å; L313-F338 HydrophobicContact CG-CD1 4.45Å; L322-F338 HydrophobicContact CD2-CD1 4.35Å; L322-F338 HydrophobicContact CD2-CE1 3.8Å; L322-F338 HydrophobicContact CD2-CZ 3.93Å; I324-F338 HydrophobicContact CD1-CZ 4.2Å; V333-F338 HydrophobicContact CG1-CE2 4.37Å; V333-F338 HydrophobicContact CG1-CZ 4.05Å; Q336-F338 VanDerWaalsContact C-N 3.31Å; F338-L341 HydrophobicContact CB-CD1 3.6Å; F338-L341 HydrophobicContact CB-CG 4.27Å; F338-L341 HydrophobicContact CD1-CD1 4.25Å; F338-L341 HydrophobicContact CG-CD1 4Å; F338-L347 HydrophobicContact CE2-CD1 4.12Å; F338-L347 HydrophobicContact CE2-CD2 4.02Å; F338-L347 HydrophobicContact CZ-CD1 4.36Å; F338-I361 HydrophobicContact CD2-CG2 3.43Å; F338-I361 VanDerWaalsContact CD2-CG2 3.43Å; F338-I361 HydrophobicContact CE2-CG2 3.73Å; F338-L365 HydrophobicContact CB-CD2 4.28Å; F338-L365 HydrophobicContact CD2-CD1 4.26Å
339	V	94.4	Very high	95.5	Very high	38 Å²	38	34 Å²	34	23%	0.23	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.5	-174.5	-176.3	0	0	0	0	109.3	A311 L313 D314 N315 Q336 L341	A311-V339 HydrophobicContact CB-CG2 4.49Å; L313-V339 PolarHBondContact O-N 3.12Å; D314-V339 WeakPolarHBondContact CA-O 3.44Å; D314-V339 HydrophobicContact CB-CB 4.42Å; D314-V339 WeakPolarHBondContact OD1-CB 3.23Å; D314-V339 VanDerWaalsContact OD1-CG1 3.26Å; D314-V339 WeakPolarHBondContact OD1-CG1 3.41Å; N315-V339 PolarHBondContact N-O 3.35Å; Q336-V339 HydrophobicContact CB-CG2 4.4Å; Q336-V339 VanDerWaalsContact O-CG2 3.22Å; Q336-V339 WeakPolarHBondContact O-CG2 3.43Å; V339-L341 PolarHBondContact O-N 2.95Å
340	R	94	Very high	95.6	Very high	128 Å²	128	28.8 Å²	28.8	48%	0.483	14%	0.136	S	C	.	.	S	Bend	trans	53.6	49.4	-178	-62.2	-173	-59.6	-74.2	6.9	113	D314 L316	D314-R340 IonicContact OD1-CZ 2.78Å; D314-R340 IonicContact OD1-NE 3.53Å; D314-R340 IonicContact OD1-NH1 3.34Å; D314-R340 PolarHBondContact OD1-NH1 2.88Å; D314-R340 IonicContact OD1-NH2 2.92Å; D314-R340 PolarHBondContact OD1-NH2 2.99Å; D314-R340 IonicContact OD2-CZ 2.92Å; D314-R340 IonicContact OD2-NH1 3.61Å; D314-R340 IonicContact OD2-NH2 3.09Å; D314-R340 PolarHBondContact OD2-NH2 3.31Å; L316-R340 PolarHBondContact N-O 3.18Å
341	L	96.2	Very high	95.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.148	C	C	.	.			trans	-101.8	71.1	172.8	-52.7	-169.4	0	0	0	110	L313 L316 L319 F338 V339 R343 L344 L365	L313-L341 HydrophobicContact CB-CD1 4.47Å; L313-L341 HydrophobicContact CB-CD2 4.49Å; L316-L341 HydrophobicContact CB-CD2 3.61Å; L316-L341 HydrophobicContact CD1-CD2 3.97Å; L316-L341 HydrophobicContact CG-CD2 4Å; L319-L341 HydrophobicContact CD2-CD1 4.39Å; L319-L341 HydrophobicContact CD2-CD2 4.43Å; F338-L341 HydrophobicContact CB-CD1 3.6Å; F338-L341 HydrophobicContact CB-CG 4.27Å; F338-L341 HydrophobicContact CD1-CD1 4.25Å; F338-L341 HydrophobicContact CG-CD1 4Å; V339-L341 PolarHBondContact O-N 2.95Å; L341-R343 VanDerWaalsContact C-N 3.31Å; L341-R343 PolarHBondContact O-N 3.08Å; L341-L344 HydrophobicContact CB-CB 4.18Å; L341-L344 HydrophobicContact CD1-CD2 4.15Å; L341-L365 HydrophobicContact CB-CD2 3.79Å; L341-L365 HydrophobicContact CD1-CD2 4.06Å; L341-L365 HydrophobicContact CG-CD2 4.34Å
342	S	93.7	Very high	95.9	Very high	58 Å²	58	31 Å²	31	41%	0.406	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.1	-168	48.4	0	0	0	0	115.3	S367	S342-S367 WeakPolarHBondContact O-CB 3.49Å; S342-S367 PolarHBondContact O-OG 3Å
343	R	96.9	Very high	96	Very high	124 Å²	124	32.9 Å²	32.9	47%	0.468	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	10.2	-177	-68.1	-171.5	178.2	162.7	8.8	113.8	P317 E318 L319 T320 L341 E345	P317-R343 WeakPolarHBondContact O-CB 3.47Å; P317-R343 WeakPolarHBondContact O-CD 3.44Å; P317-R343 WeakPolarHBondContact O-CG 3.46Å; E318-R343 IonicContact OE1-CZ 3.74Å; E318-R343 IonicContact OE1-NH1 3.79Å; E318-R343 PolarHBondContact OE1-NH1 2.66Å; E318-R343 IonicContact OE1-NH2 3.71Å; E318-R343 IonicContact OE2-CZ 3.59Å; E318-R343 IonicContact OE2-NH1 3.92Å; E318-R343 PolarHBondContact OE2-NH1 3.26Å; L319-R343 CarbonylContact O-C 3.52Å; T320-R343 WeakPolarHBondContact CA-O 3.44Å; T320-R343 HydrophobicContact CG2-CB 4.49Å; L341-R343 VanDerWaalsContact C-N 3.31Å; L341-R343 PolarHBondContact O-N 3.08Å; R343-E345 PolarHBondContact O-N 2.99Å; R343-E345 VanDerWaalsContact O-N 3.15Å
344	L	97.6	Very high	96	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.			trans	-70.4	114.7	-177.6	-169.8	74.8	0	0	0	110	L319 L322 L341 L347 L365 S367 L368	L319-L344 HydrophobicContact CD2-CD1 4.03Å; L319-L344 HydrophobicContact CG-CD1 3.96Å; L319-L344 WeakPolarHBondContact O-CA 3.19Å; L319-L344 PolarHBondContact O-N 3Å; L319-L344 VanDerWaalsContact O-N 3.08Å; L322-L344 HydrophobicContact CB-CD1 3.79Å; L322-L344 HydrophobicContact CB-CD2 4.49Å; L341-L344 HydrophobicContact CB-CB 4.18Å; L341-L344 HydrophobicContact CD1-CD2 4.15Å; L344-L347 HydrophobicContact CD2-CB 4.47Å; L344-L365 HydrophobicContact CB-CD2 4.31Å; L344-L365 HydrophobicContact CD2-CD1 4.04Å; L344-L365 HydrophobicContact CD2-CD2 3.74Å; L344-L365 HydrophobicContact CD2-CG 4.49Å; L344-S367 CarbonylContact O-C 3.3Å; L344-L368 HydrophobicContact CD2-CD1 4.47Å; L344-L368 HydrophobicContact CG-CD1 4.5Å; L344-L368 VanDerWaalsContact O-CA 3.27Å; L344-L368 WeakPolarHBondContact O-CA 3.32Å; L344-L368 PolarHBondContact O-N 3.3Å
345	E	96.7	Very high	95.9	Very high	84 Å²	84	33.4 Å²	33.4	39%	0.393	17%	0.169	S	C	.	.			trans	-101.2	-36.1	-177.2	-67.5	176.3	168.5	0	0	111.6	T320 R343 Q369 E370	T320-E345 PolarHBondContact O-N 3.09Å; R343-E345 PolarHBondContact O-N 2.99Å; R343-E345 VanDerWaalsContact O-N 3.15Å; E345-Q369 HydrophobicContact CB-CG 4.23Å; E345-Q369 HydrophobicContact CG-CG 4.36Å; E345-Q369 PolarHBondContact O-N 3.05Å; E345-Q369 PolarHBondContact OE1-NE2 2.93Å; E345-E370 PolarHBondContact O-N 3.19Å
346	S	97	Very high	95.8	Very high	10 Å²	10	33.2 Å²	33.2	7%	0.07	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	120.1	-173.4	-174	0	0	0	0	111.5	T320 L322 M348 E370	T320-S346 PolarHBondContact O-N 3.47Å; T320-S346 VanDerWaalsContact O-N 3.07Å; L322-S346 PolarHBondContact N-O 3.46Å; S346-M348 WeakPolarHBondContact OG-CE 3.34Å; S346-E370 WeakPolarHBondContact CB-OE1 3.38Å; S346-E370 WeakPolarHBondContact OG-CG 3.34Å; S346-E370 PolarHBondContact OG-OE1 3.39Å
347	L	97.4	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	105.6	177.4	176.9	59.9	0	0	0	111.2	L322 F338 L344 L349 M362 L365 L368 E370 V371 S372	L322-L347 HydrophobicContact CB-CD1 4.19Å; L322-L347 HydrophobicContact CD2-CD1 3.88Å; L322-L347 HydrophobicContact CG-CD1 4.08Å; F338-L347 HydrophobicContact CE2-CD1 4.12Å; F338-L347 HydrophobicContact CE2-CD2 4.02Å; F338-L347 HydrophobicContact CZ-CD1 4.36Å; L344-L347 HydrophobicContact CD2-CB 4.47Å; L347-L349 HydrophobicContact CD1-CD1 4.09Å; L347-L349 HydrophobicContact CD1-CG 4.06Å; L347-L349 HydrophobicContact CD2-CD1 3.81Å; L347-L349 HydrophobicContact CG-CD1 3.83Å; L347-L349 HydrophobicContact CG-CG 4.1Å; L347-M362 HydrophobicContact CD2-CE 4.19Å; L347-L365 HydrophobicContact CD2-CD1 4Å; L347-L368 HydrophobicContact CB-CD1 3.77Å; L347-E370 PolarHBondContact N-O 2.98Å; L347-V371 HydrophobicContact CB-CG2 4.4Å; L347-V371 HydrophobicContact CD2-CG2 4.41Å; L347-V371 HydrophobicContact CG-CG2 4.42Å; L347-V371 WeakPolarHBondContact O-CA 3.24Å; L347-S372 PolarHBondContact O-N 3.2Å
348	M	97.8	Very high	95.5	Very high	19 Å²	19	29.6 Å²	29.6	9%	0.094	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	114.1	-178.8	-52.2	-65.9	98	0	0	110.6	L322 E323 I324 T325 S346 E370 I397	L322-M348 PolarHBondContact O-N 3.08Å; E323-M348 HydrophobicContact CG-CB 4.43Å; E323-M348 HydrophobicContact CG-CG 4.2Å; I324-M348 CarbonylContact C-O 3.5Å; I324-M348 WeakPolarHBondContact CA-O 3.4Å; I324-M348 PolarHBondContact N-O 3.18Å; T325-M348 HydrophobicContact CG2-CB 3.48Å; T325-M348 VanDerWaalsContact CG2-CB 3.48Å; S346-M348 WeakPolarHBondContact OG-CE 3.34Å; M348-E370 HydrophobicContact CE-CG 4.17Å; M348-I397 HydrophobicContact CE-CD1 3.46Å; M348-I397 VanDerWaalsContact CE-CD1 3.46Å; M348-I397 HydrophobicContact CE-CG1 4.41Å; M348-I397 HydrophobicContact SD-CD1 3.56Å; M348-I397 VanDerWaalsContact SD-CD1 3.56Å
349	L	97.6	Very high	95.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.			trans	-128.8	20.8	-178.3	-74.5	166.9	0	0	0	112.2	I324 L347 N352 L354 L357 S372 L373 N376	I324-L349 HydrophobicContact CB-CD2 3.9Å; I324-L349 HydrophobicContact CD1-CD2 4Å; I324-L349 HydrophobicContact CG2-CD2 4.24Å; L347-L349 HydrophobicContact CD1-CD1 4.09Å; L347-L349 HydrophobicContact CD1-CG 4.06Å; L347-L349 HydrophobicContact CD2-CD1 3.81Å; L347-L349 HydrophobicContact CG-CD1 3.83Å; L347-L349 HydrophobicContact CG-CG 4.1Å; L349-N352 PolarHBondContact O-ND2 2.86Å; L349-L354 HydrophobicContact CB-CD1 4.13Å; L349-L354 HydrophobicContact CD1-CD1 4.49Å; L349-L354 HydrophobicContact CD2-CD1 4.1Å; L349-L354 HydrophobicContact CG-CD1 4.49Å; L349-L357 HydrophobicContact CD1-CD1 4.02Å; L349-L357 HydrophobicContact CD1-CD2 3.82Å; L349-S372 CarbonylContact C-O 3.27Å; L349-S372 VanDerWaalsContact CA-O 3.27Å; L349-S372 WeakPolarHBondContact CA-O 3.32Å; L349-S372 WeakPolarHBondContact CB-O 3.38Å; L349-S372 PolarHBondContact N-O 3.33Å; L349-L373 HydrophobicContact CB-CD2 3.86Å; L349-L373 HydrophobicContact CD1-CD2 4.16Å; L349-N376 PolarHBondContact O-ND2 3.04Å
350	N	97.7	Very high	94.9	Very high	26 Å²	26	32.7 Å²	32.7	14%	0.139	17%	0.165	C	C	.	.			trans	-76.9	158.2	-178.8	59.5	-82.3	0	0	0	113.6	T325 N326 N352 S372 H374	T325-N350 WeakPolarHBondContact CA-O 3.33Å; T325-N350 VanDerWaalsContact CG2-OD1 3.25Å; T325-N350 WeakPolarHBondContact CG2-OD1 3.33Å; N326-N350 PolarHBondContact N-O 3.23Å; N326-N350 VanDerWaalsContact N-O 3.09Å; N350-N352 VanDerWaalsContact C-N 3.32Å; N350-N352 PolarHBondContact O-N 3.02Å; N350-S372 WeakPolarHBondContact CB-OG 3.5Å; N350-S372 PolarHBondContact N-O 3.11Å; N350-S372 PolarHBondContact OD1-OG 3.08Å; N350-S372 VanDerWaalsContact OD1-OG 3.08Å; N350-H374 VanDerWaalsContact CA-O 3.26Å; N350-H374 WeakPolarHBondContact CA-O 3.2Å; N350-H374 VanDerWaalsContact CB-CE1 3.42Å; N350-H374 WeakPolarHBondContact CB-CE1 3.43Å; N350-H374 WeakPolarHBondContact CB-NE2 3.31Å; N350-H374 WeakPolarHBondContact CB-O 3.4Å
351	S	97.7	Very high	94.8	Very high	37 Å²	37	26.6 Å²	26.6	26%	0.259	14%	0.142	S	C	.	.	S	Bend	trans	58.5	42.9	178.4	-53.4	0	0	0	0	112.6	N326 N327 H374 S375	N326-S351 CarbonylContact C-O 3.56Å; N326-S351 WeakPolarHBondContact CA-O 3.44Å; N326-S351 PolarHBondContact N-O 3.23Å; N327-S351 PolarHBondContact N-O 3.39Å; S351-H374 PolarHBondContact N-O 3.1Å; S351-S375 WeakPolarHBondContact CA-O 3.13Å
352	N	97.9	Very high	94.5	Very high	11 Å²	11	27.3 Å²	27.3	6%	0.059	15%	0.145	C	C	.	.	S	Bend	trans	-114.8	-165.5	172.8	-61.1	-51.1	0	0	0	110.2	I324 N327 L330 L349 N350 L354 N376	I324-N352 PolarHBondContact O-ND2 2.92Å; N327-N352 VanDerWaalsContact CA-OD1 3.31Å; N327-N352 WeakPolarHBondContact CA-OD1 3.36Å; N327-N352 WeakPolarHBondContact CB-OD1 3.16Å; N327-N352 PolarHBondContact N-OD1 3.09Å; N327-N352 WeakPolarHBondContact O-CA 3.42Å; N327-N352 PolarHBondContact O-OD1 2.92Å; L330-N352 HydrophobicContact CB-CB 4.21Å; L330-N352 HydrophobicContact CD2-CB 4.44Å; L349-N352 PolarHBondContact O-ND2 2.86Å; N350-N352 VanDerWaalsContact C-N 3.32Å; N350-N352 PolarHBondContact O-N 3.02Å; N352-L354 HydrophobicContact CB-CD1 4.42Å; N352-L354 HydrophobicContact CB-CG 4.12Å; N352-N376 VanDerWaalsContact CA-OD1 3.31Å; N352-N376 WeakPolarHBondContact CA-OD1 3.48Å; N352-N376 WeakPolarHBondContact CB-OD1 3.33Å; N352-N376 PolarHBondContact N-OD1 3.41Å; N352-N376 PolarHBondContact O-OD1 3.43Å
353	S	95.8	Very high	94.1	Very high	42 Å²	42	30.1 Å²	30.1	29%	0.294	16%	0.155	S	C	.	.			trans	-112.8	27.9	176.2	-148.8	0	0	0	0	112.1	P328 L330 S331 S355 N376	P328-S353 WeakPolarHBondContact O-CB 3.45Å; L330-S353 CarbonylContact O-C 3.51Å; L330-S353 VanDerWaalsContact O-CA 3.26Å; L330-S353 WeakPolarHBondContact O-CA 3.35Å; L330-S353 WeakPolarHBondContact O-CB 3.45Å; L330-S353 PolarHBondContact O-N 3.14Å; S331-S353 WeakPolarHBondContact CA-O 3.33Å; S353-S355 PolarHBondContact O-N 3.02Å; S353-N376 PolarHBondContact N-OD1 3.17Å
354	L	94.9	Very high	93.8	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.148	C	C	.	.			trans	-71.5	121.3	-176.7	-62.2	172.4	0	0	0	109.9	L330 V333 L349 N352 N376 P377 L378	L330-L354 HydrophobicContact CG-CD2 4.14Å; L330-L354 PolarHBondContact O-N 3.2Å; V333-L354 HydrophobicContact CG2-CD2 3.98Å; L349-L354 HydrophobicContact CB-CD1 4.13Å; L349-L354 HydrophobicContact CD1-CD1 4.49Å; L349-L354 HydrophobicContact CD2-CD1 4.1Å; L349-L354 HydrophobicContact CG-CD1 4.49Å; N352-L354 HydrophobicContact CB-CD1 4.42Å; N352-L354 HydrophobicContact CB-CG 4.12Å; L354-N376 HydrophobicContact CB-CB 4.47Å; L354-N376 WeakPolarHBondContact CB-OD1 3.47Å; L354-N376 PolarHBondContact N-OD1 3.49Å; L354-P377 WeakPolarHBondContact O-CD 3.49Å; L354-L378 WeakPolarHBondContact O-CD2 3.34Å
355	S	92.4	Very high	93.6	Very high	26 Å²	26	26.8 Å²	26.8	18%	0.182	15%	0.15	C	C	.	.	S	Bend	trans	-80.8	-29	169.5	59.5	0	0	0	0	111.8	S353 P377 L378 R379	S353-S355 PolarHBondContact O-N 3.02Å; S355-P377 WeakPolarHBondContact CA-O 3.5Å; S355-L378 CarbonylContact O-C 3.57Å; S355-L378 WeakPolarHBondContact O-CA 3.36Å; S355-R379 PolarHBondContact O-N 3.06Å
356	A	90.3	Very high	93.4	Very high	2 Å²	2	27.8 Å²	27.8	2%	0.017	16%	0.164	C	C	.	.			trans	-152.5	155.4	-177.1	0	0	0	0	0	112.1	L383 F384 L455	A356-L383 HydrophobicContact CB-CB 3.65Å; A356-L383 HydrophobicContact CB-CD1 3.31Å; A356-L383 HydrophobicContact CB-CG 4.1Å; A356-F384 HydrophobicContact CB-CD2 4.45Å; A356-F384 HydrophobicContact CB-CE2 4.35Å; A356-L455 HydrophobicContact CB-CD1 3.95Å
357	L	91.4	Very high	93.3	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	18%	0.178	C	C	.	.			trans	-126.5	116.8	165.8	-169.2	69.1	0	0	0	108	V333 L349 I361 M362 L373 F384 W386	V333-L357 HydrophobicContact CB-CD1 4.34Å; L349-L357 HydrophobicContact CD1-CD1 4.02Å; L349-L357 HydrophobicContact CD1-CD2 3.82Å; L357-I361 HydrophobicContact CD1-CD1 3.45Å; L357-I361 VanDerWaalsContact CD1-CD1 3.45Å; L357-I361 HydrophobicContact CD1-CG2 4.37Å; L357-I361 HydrophobicContact CG-CD1 4.08Å; L357-M362 HydrophobicContact CD2-CE 3.24Å; L357-M362 HydrophobicContact CD2-SD 4.37Å; L357-M362 HydrophobicContact CG-CE 4.01Å; L357-L373 HydrophobicContact CD2-CD2 3.98Å; L357-F384 HydrophobicContact CB-CZ 4.41Å; L357-W386 HydrophobicContact CB-CZ2 4.21Å; L357-W386 HydrophobicContact CD2-CZ2 4.42Å; L357-W386 PolarHBondContact O-NE1 2.92Å
358	H	91.1	Very high	93.2	Very high	11 Å²	11	30.4 Å²	30.4	5%	0.051	18%	0.181	C	C	.	.			trans	-69	143.9	-170.4	-169.2	-82.5	0	0	0	112.2	P335 N360 I361	P335-H358 HydrophobicContact CB-CB 4.11Å; P335-H358 HydrophobicContact CG-CB 3.93Å; H358-N360 VanDerWaalsContact C-N 3.25Å; H358-N360 VanDerWaalsContact CE1-CG 3.42Å; H358-N360 PolarHBondContact CE1-ND2 3Å; H358-N360 PolarHBondContact CE1-OD1 3.38Å; H358-N360 PolarHBondContact ND1-N 3.33Å; H358-N360 VanDerWaalsContact ND1-N 3.17Å; H358-N360 PolarHBondContact O-N 3.27Å; H358-N360 VanDerWaalsContact O-N 3.14Å; H358-I361 HydrophobicContact CB-CD1 4.48Å; H358-I361 WeakPolarHBondContact O-CB 3.47Å; H358-I361 PolarHBondContact O-N 3.35Å
359	Q	88.6	Confident	93.1	Very high	44 Å²	44	34.8 Å²	34.8	21%	0.206	20%	0.202	C	C	.	.	H	α-helix	trans	-55.3	-36.3	-176.8	63.1	177	-8.8	0	0	114.2	I361 M362 L363 H385 W386	Q359-I361 PolarHBondContact O-N 3.44Å; Q359-I361 VanDerWaalsContact O-N 3.16Å; Q359-M362 WeakPolarHBondContact O-CB 3.37Å; Q359-M362 PolarHBondContact O-N 3.31Å; Q359-L363 WeakPolarHBondContact O-CG 2.94Å; Q359-L363 PolarHBondContact O-N 3.35Å; Q359-H385 PolarHBondContact OE1-CE1 3.07Å; Q359-W386 HydrophobicContact CB-CB 4.02Å; Q359-W386 HydrophobicContact CB-CG 3.96Å
360	N	90.1	Very high	93	Very high	60 Å²	60	37.2 Å²	37.2	32%	0.321	21%	0.213	S	C	.	.	H	α-helix	trans	-57.8	-29.5	178.6	-66.1	2	0	0	0	112.9	P335 H358 L363 S364	P335-N360 HydrophobicContact CB-CB 4.15Å; P335-N360 WeakPolarHBondContact O-CB 3.46Å; H358-N360 VanDerWaalsContact C-N 3.25Å; H358-N360 VanDerWaalsContact CE1-CG 3.42Å; H358-N360 PolarHBondContact CE1-ND2 3Å; H358-N360 PolarHBondContact CE1-OD1 3.38Å; H358-N360 PolarHBondContact ND1-N 3.33Å; H358-N360 VanDerWaalsContact ND1-N 3.17Å; H358-N360 PolarHBondContact O-N 3.27Å; H358-N360 VanDerWaalsContact O-N 3.14Å; N360-L363 PolarHBondContact O-N 3.2Å; N360-S364 WeakPolarHBondContact O-CB 3.47Å; N360-S364 PolarHBondContact O-N 2.88Å; N360-S364 PolarHBondContact O-OG 3.07Å
361	I	92.4	Very high	92.9	Very high	1 Å²	1	36 Å²	36	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-64.8	-48	176.3	-62	174.8	0	0	0	109	V333 F338 L357 H358 Q359 L363 S364 L365	V333-I361 HydrophobicContact CB-CD1 4.17Å; V333-I361 HydrophobicContact CG1-CD1 3.77Å; F338-I361 HydrophobicContact CD2-CG2 3.43Å; F338-I361 VanDerWaalsContact CD2-CG2 3.43Å; F338-I361 HydrophobicContact CE2-CG2 3.73Å; L357-I361 HydrophobicContact CD1-CD1 3.45Å; L357-I361 VanDerWaalsContact CD1-CD1 3.45Å; L357-I361 HydrophobicContact CD1-CG2 4.37Å; L357-I361 HydrophobicContact CG-CD1 4.08Å; H358-I361 HydrophobicContact CB-CD1 4.48Å; H358-I361 WeakPolarHBondContact O-CB 3.47Å; H358-I361 PolarHBondContact O-N 3.35Å; Q359-I361 PolarHBondContact O-N 3.44Å; Q359-I361 VanDerWaalsContact O-N 3.16Å; I361-L363 PolarHBondContact O-N 2.87Å; I361-S364 PolarHBondContact O-N 3.28Å; I361-L365 HydrophobicContact CG2-CD1 4.4Å; I361-L365 WeakPolarHBondContact O-CG 3.36Å
362	M	88.8	Confident	92.8	Very high	16 Å²	16	34.2 Å²	34.2	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-65.1	-39.9	178.7	-57.1	-66.1	102.1	0	0	112	L347 L357 Q359 S364 L365 L368 W386 V390	L347-M362 HydrophobicContact CD2-CE 4.19Å; L357-M362 HydrophobicContact CD2-CE 3.24Å; L357-M362 HydrophobicContact CD2-SD 4.37Å; L357-M362 HydrophobicContact CG-CE 4.01Å; Q359-M362 WeakPolarHBondContact O-CB 3.37Å; Q359-M362 PolarHBondContact O-N 3.31Å; M362-S364 PolarHBondContact O-N 2.91Å; M362-L365 PolarHBondContact O-N 3.08Å; M362-L368 HydrophobicContact SD-CD2 4.29Å; M362-W386 HydrophobicContact CB-CE3 4.43Å; M362-W386 HydrophobicContact CE-CH2 4.44Å; M362-W386 HydrophobicContact CG-CD2 3.82Å; M362-W386 HydrophobicContact CG-CE3 3.64Å; M362-W386 HydrophobicContact CG-CH2 3.57Å; M362-W386 HydrophobicContact CG-CZ2 3.75Å; M362-W386 HydrophobicContact CG-CZ3 3.52Å; M362-W386 HydrophobicContact SD-CE3 4.33Å; M362-W386 HydrophobicContact SD-CH2 3.44Å; M362-W386 WeakPolarHBondContact SD-CH2 3.2Å; M362-W386 HydrophobicContact SD-CZ2 4.07Å; M362-W386 HydrophobicContact SD-CZ3 3.6Å; M362-W386 VanDerWaalsContact SD-CZ3 3.6Å; M362-V390 HydrophobicContact CB-CG2 4.44Å
363	L	86.4	Confident	92.7	Very high	116 Å²	116	33.8 Å²	33.8	61%	0.607	19%	0.192	S	C	*	.	H	α-helix	trans	-67.1	-23.5	177.7	-65.8	173.7	0	0	0	113.1	Q359 N360 I361 L365	Q359-L363 WeakPolarHBondContact O-CG 2.94Å; Q359-L363 PolarHBondContact O-N 3.35Å; N360-L363 PolarHBondContact O-N 3.2Å; I361-L363 PolarHBondContact O-N 2.87Å; L363-L365 VanDerWaalsContact C-N 3.3Å
364	S	89.3	Confident	92.8	Very high	47 Å²	47	32.5 Å²	32.5	33%	0.329	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.7	-179.9	-58.4	0	0	0	0	113.3	N360 I361 M362 P366	N360-S364 WeakPolarHBondContact O-CB 3.47Å; N360-S364 PolarHBondContact O-N 2.88Å; N360-S364 PolarHBondContact O-OG 3.07Å; I361-S364 PolarHBondContact O-N 3.28Å; M362-S364 PolarHBondContact O-N 2.91Å; S364-P366 WeakPolarHBondContact O-CD 3.33Å
365	L	93.9	Very high	92.9	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.042	21%	0.205	C	C	.	.			trans	-118.8	83.1	-174.3	-60.4	175.2	0	0	0	110.6	F338 L341 L344 L347 I361 M362 L363 S367 L368	F338-L365 HydrophobicContact CB-CD2 4.28Å; F338-L365 HydrophobicContact CD2-CD1 4.26Å; L341-L365 HydrophobicContact CB-CD2 3.79Å; L341-L365 HydrophobicContact CD1-CD2 4.06Å; L341-L365 HydrophobicContact CG-CD2 4.34Å; L344-L365 HydrophobicContact CB-CD2 4.31Å; L344-L365 HydrophobicContact CD2-CD1 4.04Å; L344-L365 HydrophobicContact CD2-CD2 3.74Å; L344-L365 HydrophobicContact CD2-CG 4.49Å; L347-L365 HydrophobicContact CD2-CD1 4Å; I361-L365 HydrophobicContact CG2-CD1 4.4Å; I361-L365 WeakPolarHBondContact O-CG 3.36Å; M362-L365 PolarHBondContact O-N 3.08Å; L363-L365 VanDerWaalsContact C-N 3.3Å; L365-S367 VanDerWaalsContact C-N 3.34Å; L365-S367 PolarHBondContact O-N 2.89Å; L365-L368 HydrophobicContact CB-CB 4.01Å; L365-L368 HydrophobicContact CB-CD2 4.47Å; L365-L368 HydrophobicContact CD1-CD1 4.37Å; L365-L368 HydrophobicContact CD1-CD2 4.11Å
366	P	91.9	Very high	93.1	Very high	104 Å²	104	35.3 Å²	35.3	68%	0.675	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-26.3	-171	28.1	-35.8	0	0	0	114.3	S364	S364-P366 WeakPolarHBondContact O-CD 3.33Å
367	S	95.2	Very high	93.3	Very high	53 Å²	53	37.9 Å²	37.9	37%	0.371	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	9.4	-176.5	-66.5	0	0	0	0	113.8	S342 L344 L365 Q369	S342-S367 WeakPolarHBondContact O-CB 3.49Å; S342-S367 PolarHBondContact O-OG 3Å; L344-S367 CarbonylContact O-C 3.3Å; L365-S367 VanDerWaalsContact C-N 3.34Å; L365-S367 PolarHBondContact O-N 2.89Å; S367-Q369 WeakPolarHBondContact O-CG 3.49Å; S367-Q369 PolarHBondContact O-N 2.83Å
368	L	95.9	Very high	93.4	Very high	13 Å²	13	37.9 Å²	37.9	7%	0.068	22%	0.216	C	C	.	.			trans	-65.2	123.9	-175.8	-166.2	70	0	0	0	110.5	L344 L347 M362 L365 V394	L344-L368 HydrophobicContact CD2-CD1 4.47Å; L344-L368 HydrophobicContact CG-CD1 4.5Å; L344-L368 VanDerWaalsContact O-CA 3.27Å; L344-L368 WeakPolarHBondContact O-CA 3.32Å; L344-L368 PolarHBondContact O-N 3.3Å; L347-L368 HydrophobicContact CB-CD1 3.77Å; M362-L368 HydrophobicContact SD-CD2 4.29Å; L365-L368 HydrophobicContact CB-CB 4.01Å; L365-L368 HydrophobicContact CB-CD2 4.47Å; L365-L368 HydrophobicContact CD1-CD1 4.37Å; L365-L368 HydrophobicContact CD1-CD2 4.11Å; L368-V394 HydrophobicContact CD2-CG1 4.12Å; L368-V394 HydrophobicContact CG-CG1 4.17Å
369	Q	95.8	Very high	93.5	Very high	111 Å²	111	38.8 Å²	38.8	52%	0.519	22%	0.219	S	C	.	.			trans	-104.9	-36.5	-179.6	-58.8	-177.6	17.8	0	0	111.2	E345 S367 R395	E345-Q369 HydrophobicContact CB-CG 4.23Å; E345-Q369 HydrophobicContact CG-CG 4.36Å; E345-Q369 PolarHBondContact O-N 3.05Å; E345-Q369 PolarHBondContact OE1-NE2 2.93Å; S367-Q369 WeakPolarHBondContact O-CG 3.49Å; S367-Q369 PolarHBondContact O-N 2.83Å; Q369-R395 WeakPolarHBondContact O-CB 3.18Å; Q369-R395 PolarHBondContact O-N 3.15Å
370	E	95.8	Very high	93.7	Very high	50 Å²	50	36.8 Å²	36.8	23%	0.234	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	146.6	-177.6	61.5	178.6	-153.9	0	0	114	E345 S346 L347 M348 R395 I397	E345-E370 PolarHBondContact O-N 3.19Å; S346-E370 WeakPolarHBondContact CB-OE1 3.38Å; S346-E370 WeakPolarHBondContact OG-CG 3.34Å; S346-E370 PolarHBondContact OG-OE1 3.39Å; L347-E370 PolarHBondContact N-O 2.98Å; M348-E370 HydrophobicContact CE-CG 4.17Å; E370-R395 CarbonylContact C-O 3.3Å; E370-R395 VanDerWaalsContact CA-O 3.23Å; E370-R395 WeakPolarHBondContact CA-O 3.32Å; E370-R395 HydrophobicContact CB-CB 4.18Å; E370-R395 IonicContact OE2-CZ 3.86Å; E370-R395 IonicContact OE2-NE 2.7Å; E370-R395 PolarHBondContact OE2-NE 3.35Å; E370-R395 IonicContact OE2-NH2 3.25Å; E370-R395 PolarHBondContact OE2-NH2 3.33Å; E370-I397 HydrophobicContact CB-CD1 4.37Å; E370-I397 HydrophobicContact CB-CG1 4.37Å; E370-I397 HydrophobicContact CG-CD1 4.37Å
371	V	95.5	Very high	93.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	136.9	178.3	70.5	0	0	0	0	110.6	L347 L373 V394 R395 F396 I397	L347-V371 HydrophobicContact CB-CG2 4.4Å; L347-V371 HydrophobicContact CD2-CG2 4.41Å; L347-V371 HydrophobicContact CG-CG2 4.42Å; L347-V371 WeakPolarHBondContact O-CA 3.24Å; V371-L373 HydrophobicContact CG2-CD1 4.36Å; V371-L373 HydrophobicContact CG2-CD2 4.39Å; V371-L373 HydrophobicContact CG2-CG 4.05Å; V371-V394 HydrophobicContact CB-CG1 4.16Å; V371-V394 HydrophobicContact CG1-CG1 3.91Å; V371-R395 PolarHBondContact N-O 2.8Å; V371-F396 HydrophobicContact CG1-CD1 4.35Å; V371-F396 HydrophobicContact CG1-CD2 4.06Å; V371-F396 HydrophobicContact CG1-CE1 4.32Å; V371-F396 HydrophobicContact CG1-CE2 4.01Å; V371-F396 HydrophobicContact CG1-CG 4.23Å; V371-F396 HydrophobicContact CG1-CZ 4.15Å; V371-F396 WeakPolarHBondContact O-CA 3.18Å; V371-I397 PolarHBondContact O-N 3.14Å
372	S	96.4	Very high	93.6	Very high	1 Å²	1	35 Å²	35	1%	0.007	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118.1	175.1	-166.7	0	0	0	0	110.2	L347 L349 N350 H374	L347-S372 PolarHBondContact O-N 3.2Å; L349-S372 CarbonylContact C-O 3.27Å; L349-S372 VanDerWaalsContact CA-O 3.27Å; L349-S372 WeakPolarHBondContact CA-O 3.32Å; L349-S372 WeakPolarHBondContact CB-O 3.38Å; L349-S372 PolarHBondContact N-O 3.33Å; N350-S372 WeakPolarHBondContact CB-OG 3.5Å; N350-S372 PolarHBondContact N-O 3.11Å; N350-S372 PolarHBondContact OD1-OG 3.08Å; N350-S372 VanDerWaalsContact OD1-OG 3.08Å; S372-H374 PolarHBondContact OG-CD2 3.33Å; S372-H374 PolarHBondContact OG-NE2 3.5Å
373	L	95.9	Very high	93.6	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	20%	0.198	C	C	.	.			trans	-127.9	0.6	-178.8	-65.9	172.4	0	0	0	113.5	L349 L357 V371 N376 L378 F384 W386 F396 T402	L349-L373 HydrophobicContact CB-CD2 3.86Å; L349-L373 HydrophobicContact CD1-CD2 4.16Å; L357-L373 HydrophobicContact CD2-CD2 3.98Å; V371-L373 HydrophobicContact CG2-CD1 4.36Å; V371-L373 HydrophobicContact CG2-CD2 4.39Å; V371-L373 HydrophobicContact CG2-CG 4.05Å; L373-N376 PolarHBondContact O-ND2 2.78Å; L373-L378 HydrophobicContact CB-CD1 4.23Å; L373-F384 HydrophobicContact CD1-CE1 4.09Å; L373-F384 HydrophobicContact CD1-CZ 4.39Å; L373-W386 HydrophobicContact CD1-CH2 4.26Å; L373-F396 HydrophobicContact CD1-CE1 4.07Å; L373-T402 HydrophobicContact CB-CG2 4.2Å
374	H	96.4	Very high	93.7	Very high	15 Å²	15	29 Å²	29	7%	0.069	17%	0.17	C	C	.	.			trans	-59.5	160.3	-179.6	70.1	83.6	0	0	0	111.8	N350 S351 S372 N376 Q398 A401	N350-H374 VanDerWaalsContact CA-O 3.26Å; N350-H374 WeakPolarHBondContact CA-O 3.2Å; N350-H374 VanDerWaalsContact CB-CE1 3.42Å; N350-H374 WeakPolarHBondContact CB-CE1 3.43Å; N350-H374 WeakPolarHBondContact CB-NE2 3.31Å; N350-H374 WeakPolarHBondContact CB-O 3.4Å; S351-H374 PolarHBondContact N-O 3.1Å; S372-H374 PolarHBondContact OG-CD2 3.33Å; S372-H374 PolarHBondContact OG-NE2 3.5Å; H374-N376 VanDerWaalsContact C-N 3.27Å; H374-N376 PolarHBondContact O-N 3.41Å; H374-N376 PolarHBondContact O-ND2 3.14Å; H374-Q398 HydrophobicContact CB-CB 4.36Å; H374-Q398 PolarHBondContact CD2-OE1 3.05Å; H374-Q398 PolarHBondContact CE1-OE1 3.08Å; H374-Q398 PolarHBondContact ND1-OE1 2.96Å; H374-Q398 PolarHBondContact NE2-OE1 3.07Å; H374-Q398 VanDerWaalsContact NE2-OE1 3.14Å; H374-A401 HydrophobicContact CB-CB 3.88Å
375	S	96.9	Very high	93.4	Very high	72 Å²	72	29.9 Å²	29.9	50%	0.503	17%	0.168	S	C	.	.	S	Bend	trans	58.8	38.2	179.2	-49.9	0	0	0	0	113.3	S351	S351-S375 WeakPolarHBondContact CA-O 3.13Å
376	N	96.7	Very high	93	Very high	15 Å²	15	29.7 Å²	29.7	8%	0.08	17%	0.167	C	C	.	.	S	Bend	trans	-124	151.3	170.1	-79.2	-83	0	0	0	110.1	L349 N352 S353 L354 L373 H374 L378	L349-N376 PolarHBondContact O-ND2 3.04Å; N352-N376 VanDerWaalsContact CA-OD1 3.31Å; N352-N376 WeakPolarHBondContact CA-OD1 3.48Å; N352-N376 WeakPolarHBondContact CB-OD1 3.33Å; N352-N376 PolarHBondContact N-OD1 3.41Å; N352-N376 PolarHBondContact O-OD1 3.43Å; S353-N376 PolarHBondContact N-OD1 3.17Å; L354-N376 HydrophobicContact CB-CB 4.47Å; L354-N376 WeakPolarHBondContact CB-OD1 3.47Å; L354-N376 PolarHBondContact N-OD1 3.49Å; L373-N376 PolarHBondContact O-ND2 2.78Å; H374-N376 VanDerWaalsContact C-N 3.27Å; H374-N376 PolarHBondContact O-N 3.41Å; H374-N376 PolarHBondContact O-ND2 3.14Å; N376-L378 HydrophobicContact CB-CD2 3.45Å; N376-L378 VanDerWaalsContact CB-CD2 3.45Å; N376-L378 HydrophobicContact CB-CG 3.91Å; N376-L378 PolarHBondContact O-N 3.09Å
377	P	94.8	Very high	92.7	Very high	55 Å²	55	24.8 Å²	24.8	36%	0.357	14%	0.135	S	C	.	.			trans	-78	59	176.9	34	-37.1	0	0	0	112.5	L354 S355 R379	L354-P377 WeakPolarHBondContact O-CD 3.49Å; S355-P377 WeakPolarHBondContact CA-O 3.5Å; P377-R379 PolarHBondContact O-N 3.44Å
378	L	94.3	Very high	92	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.7	-170.4	-54.6	-178.1	0	0	0	113	L354 S355 L373 N376 F384 T402 C404 S405 A406 V415	L354-L378 WeakPolarHBondContact O-CD2 3.34Å; S355-L378 CarbonylContact O-C 3.57Å; S355-L378 WeakPolarHBondContact O-CA 3.36Å; L373-L378 HydrophobicContact CB-CD1 4.23Å; N376-L378 HydrophobicContact CB-CD2 3.45Å; N376-L378 VanDerWaalsContact CB-CD2 3.45Å; N376-L378 HydrophobicContact CB-CG 3.91Å; N376-L378 PolarHBondContact O-N 3.09Å; L378-F384 HydrophobicContact CB-CE2 3.92Å; L378-F384 HydrophobicContact CB-CZ 4.27Å; L378-F384 HydrophobicContact CD1-CE1 4.49Å; L378-F384 HydrophobicContact CD1-CE2 4.49Å; L378-F384 HydrophobicContact CD1-CZ 4Å; L378-F384 HydrophobicContact CD2-CE2 3.77Å; L378-F384 HydrophobicContact CD2-CZ 3.61Å; L378-F384 HydrophobicContact CG-CE2 4.26Å; L378-F384 HydrophobicContact CG-CZ 4.16Å; L378-T402 HydrophobicContact CD1-CG2 3.73Å; L378-C404 CarbonylContact O-C 3.57Å; L378-S405 PolarHBondContact O-N 3.13Å; L378-A406 PolarHBondContact O-N 3.4Å; L378-V415 HydrophobicContact CD1-CG2 3.9Å
379	R	92.3	Very high	91.4	Very high	31 Å²	31	29.6 Å²	29.6	12%	0.117	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	106.9	174.6	-171.6	179.3	73.3	163.9	19.3	109.5	S355 P377 D381 L383 F384 A406 C427 L428 T430	S355-R379 PolarHBondContact O-N 3.06Å; P377-R379 PolarHBondContact O-N 3.44Å; R379-D381 VanDerWaalsContact C-N 3.27Å; R379-D381 WeakPolarHBondContact CD-OD2 3.35Å; R379-D381 HydrophobicContact CG-CB 4.37Å; R379-D381 IonicContact CZ-OD1 3.78Å; R379-D381 IonicContact CZ-OD2 3.95Å; R379-D381 IonicContact NE-OD1 2.67Å; R379-D381 PolarHBondContact NE-OD1 3.3Å; R379-D381 IonicContact NE-OD2 3.6Å; R379-D381 PolarHBondContact NE-OD2 3.35Å; R379-D381 IonicContact NH1-OD2 3.71Å; R379-D381 IonicContact NH2-OD1 2.82Å; R379-D381 PolarHBondContact NH2-OD1 3.18Å; R379-D381 IonicContact NH2-OD2 2.78Å; R379-D381 PolarHBondContact NH2-OD2 3.2Å; R379-D381 PolarHBondContact O-N 3.28Å; R379-L383 VanDerWaalsContact NH2-CD1 3.3Å; R379-F384 VanDerWaalsContact O-CD2 3.23Å; R379-F384 WeakPolarHBondContact O-CD2 3.37Å; R379-A406 CarbonylContact C-O 3.54Å; R379-A406 WeakPolarHBondContact CA-O 3.34Å; R379-A406 HydrophobicContact CB-CB 4.38Å; R379-A406 HydrophobicContact CG-CB 3.97Å; R379-C427 PolarHBondContact NH2-SG 2.82Å; R379-C427 VanDerWaalsContact NH2-SG 3.42Å; R379-L428 PolarHBondContact NH1-O 2.88Å; R379-L428 VanDerWaalsContact NH1-O 3.17Å; R379-T430 PolarHBondContact NH1-OG1 3.46Å
380	C	92.8	Very high	90.8	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	13%	0.133	C	C	.	.			trans	-83.3	68.2	-177.5	-68.2	0	0	0	0	111.8	C404 A406 L410 M423	C380-C404 HydrophobicContact CB-CB 3.75Å; C380-C404 WeakPolarHBondContact CB-SG 3.41Å; C380-C404 VanDerWaalsContact SG-CA 3.57Å; C380-C404 WeakPolarHBondContact SG-CB 3.38Å; C380-C404 CovalentContact SG-SG 2.02Å; C380-C404 PolarHBondContact SG-SG 2.97Å; C380-A406 PolarHBondContact N-O 2.96Å; C380-L410 HydrophobicContact CB-CD1 4.21Å; C380-L410 WeakPolarHBondContact O-CD1 3.37Å; C380-M423 HydrophobicContact CB-CE 4.18Å
381	D	91.3	Very high	89.9	Confident	18 Å²	18	23.6 Å²	23.6	10%	0.096	13%	0.127	C	C	.	.	S	Bend	trans	-130.2	-149.3	176.7	71.7	-9.5	0	0	0	111.2	R379 L383 F384 H385 C427	R379-D381 VanDerWaalsContact C-N 3.27Å; R379-D381 WeakPolarHBondContact CD-OD2 3.35Å; R379-D381 HydrophobicContact CG-CB 4.37Å; R379-D381 IonicContact CZ-OD1 3.78Å; R379-D381 IonicContact CZ-OD2 3.95Å; R379-D381 IonicContact NE-OD1 2.67Å; R379-D381 PolarHBondContact NE-OD1 3.3Å; R379-D381 IonicContact NE-OD2 3.6Å; R379-D381 PolarHBondContact NE-OD2 3.35Å; R379-D381 IonicContact NH1-OD2 3.71Å; R379-D381 IonicContact NH2-OD1 2.82Å; R379-D381 PolarHBondContact NH2-OD1 3.18Å; R379-D381 IonicContact NH2-OD2 2.78Å; R379-D381 PolarHBondContact NH2-OD2 3.2Å; R379-D381 PolarHBondContact O-N 3.28Å; D381-L383 PolarHBondContact O-N 3.24Å; D381-L383 PolarHBondContact OD1-N 3.41Å; D381-F384 PolarHBondContact O-N 3.26Å; D381-H385 PolarHBondContact O-N 3.3Å; D381-C427 WeakPolarHBondContact OD2-CB 3.38Å
382	C	89.6	Confident	89.2	Confident	5 Å²	5	34 Å²	34	3%	0.034	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-42.1	-36.9	177.4	65.1	0	0	0	0	114.4	F384 S424 C427 E457	C382-F384 VanDerWaalsContact C-N 3.3Å; C382-F384 PolarHBondContact O-N 3.24Å; C382-S424 WeakPolarHBondContact CA-O 3.33Å; C382-S424 WeakPolarHBondContact CB-O 3.2Å; C382-S424 PolarHBondContact N-O 2.67Å; C382-C427 HydrophobicContact CB-CB 3.72Å; C382-C427 WeakPolarHBondContact CB-SG 3.42Å; C382-C427 WeakPolarHBondContact SG-CB 3.19Å; C382-C427 CovalentContact SG-SG 1.98Å; C382-C427 PolarHBondContact SG-SG 2.84Å; C382-E457 HydrophobicContact CB-CB 3.83Å
383	L	89.3	Confident	88.8	Confident	7 Å²	7	39.9 Å²	39.9	4%	0.037	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-81.2	-16.1	-172.4	-64.8	178.7	0	0	0	112	A356 R379 D381 W386 L455	A356-L383 HydrophobicContact CB-CB 3.65Å; A356-L383 HydrophobicContact CB-CD1 3.31Å; A356-L383 HydrophobicContact CB-CG 4.1Å; R379-L383 VanDerWaalsContact NH2-CD1 3.3Å; D381-L383 PolarHBondContact O-N 3.24Å; D381-L383 PolarHBondContact OD1-N 3.41Å; L383-W386 PolarHBondContact O-NE1 3.34Å; L383-L455 HydrophobicContact CD1-CB 3.47Å; L383-L455 VanDerWaalsContact CD1-CB 3.47Å; L383-L455 HydrophobicContact CD1-CD1 4.34Å; L383-L455 HydrophobicContact CD2-CB 4.22Å
384	F	87.2	Confident	88.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-114.1	6.4	-179.4	-98	-74.3	0	0	0	113.3	A356 L357 L373 L378 R379 D381 C382 W386 A387 V415 M423	A356-F384 HydrophobicContact CB-CD2 4.45Å; A356-F384 HydrophobicContact CB-CE2 4.35Å; L357-F384 HydrophobicContact CB-CZ 4.41Å; L373-F384 HydrophobicContact CD1-CE1 4.09Å; L373-F384 HydrophobicContact CD1-CZ 4.39Å; L378-F384 HydrophobicContact CB-CE2 3.92Å; L378-F384 HydrophobicContact CB-CZ 4.27Å; L378-F384 HydrophobicContact CD1-CE1 4.49Å; L378-F384 HydrophobicContact CD1-CE2 4.49Å; L378-F384 HydrophobicContact CD1-CZ 4Å; L378-F384 HydrophobicContact CD2-CE2 3.77Å; L378-F384 HydrophobicContact CD2-CZ 3.61Å; L378-F384 HydrophobicContact CG-CE2 4.26Å; L378-F384 HydrophobicContact CG-CZ 4.16Å; R379-F384 VanDerWaalsContact O-CD2 3.23Å; R379-F384 WeakPolarHBondContact O-CD2 3.37Å; D381-F384 PolarHBondContact O-N 3.26Å; C382-F384 VanDerWaalsContact C-N 3.3Å; C382-F384 PolarHBondContact O-N 3.24Å; F384-W386 HydrophobicContact CD1-CZ2 4.1Å; F384-W386 HydrophobicContact CE1-CH2 4.42Å; F384-W386 AromaticContact CE1-CZ2 3.84Å; F384-W386 HydrophobicContact CE1-CZ2 3.84Å; F384-W386 PolarHBondContact O-N 2.93Å; F384-A387 HydrophobicContact CD1-CB 4.07Å; F384-A387 WeakPolarHBondContact O-CB 3.49Å; F384-A387 PolarHBondContact O-N 3.28Å; F384-V415 HydrophobicContact CD1-CG1 4.33Å; F384-M423 HydrophobicContact CB-SD 4.42Å
385	H	82.9	Confident	88.5	Confident	66 Å²	66	46.2 Å²	46.2	31%	0.306	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-31.8	178.5	96.1	-135.2	0	0	0	112	Q359 D381 A387	Q359-H385 PolarHBondContact OE1-CE1 3.07Å; D381-H385 PolarHBondContact O-N 3.3Å; H385-A387 VanDerWaalsContact C-N 3.25Å; H385-A387 PolarHBondContact O-N 3.06Å
386	W	85.6	Confident	88.4	Confident	3 Å²	3	43.5 Å²	43.5	1%	0.011	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-23	-176.9	63.6	-97.1	0	0	0	113	L357 Q359 M362 L373 L383 F384 A388 R389 V390 F396	L357-W386 HydrophobicContact CB-CZ2 4.21Å; L357-W386 HydrophobicContact CD2-CZ2 4.42Å; L357-W386 PolarHBondContact O-NE1 2.92Å; Q359-W386 HydrophobicContact CB-CB 4.02Å; Q359-W386 HydrophobicContact CB-CG 3.96Å; M362-W386 HydrophobicContact CB-CE3 4.43Å; M362-W386 HydrophobicContact CE-CH2 4.44Å; M362-W386 HydrophobicContact CG-CD2 3.82Å; M362-W386 HydrophobicContact CG-CE3 3.64Å; M362-W386 HydrophobicContact CG-CH2 3.57Å; M362-W386 HydrophobicContact CG-CZ2 3.75Å; M362-W386 HydrophobicContact CG-CZ3 3.52Å; M362-W386 HydrophobicContact SD-CE3 4.33Å; M362-W386 HydrophobicContact SD-CH2 3.44Å; M362-W386 WeakPolarHBondContact SD-CH2 3.2Å; M362-W386 HydrophobicContact SD-CZ2 4.07Å; M362-W386 HydrophobicContact SD-CZ3 3.6Å; M362-W386 VanDerWaalsContact SD-CZ3 3.6Å; L373-W386 HydrophobicContact CD1-CH2 4.26Å; L383-W386 PolarHBondContact O-NE1 3.34Å; F384-W386 HydrophobicContact CD1-CZ2 4.1Å; F384-W386 HydrophobicContact CE1-CH2 4.42Å; F384-W386 AromaticContact CE1-CZ2 3.84Å; F384-W386 HydrophobicContact CE1-CZ2 3.84Å; F384-W386 PolarHBondContact O-N 2.93Å; W386-A388 PolarHBondContact O-N 3.36Å; W386-R389 WeakPolarHBondContact O-CB 3.33Å; W386-R389 PolarHBondContact O-N 3.06Å; W386-R389 VanDerWaalsContact O-N 3.07Å; W386-V390 HydrophobicContact CD2-CG2 4.46Å; W386-V390 HydrophobicContact CE3-CB 3.56Å; W386-V390 HydrophobicContact CE3-CG1 4.07Å; W386-V390 HydrophobicContact CE3-CG2 3.49Å; W386-V390 VanDerWaalsContact CE3-CG2 3.49Å; W386-V390 HydrophobicContact CZ3-CB 3.77Å; W386-V390 HydrophobicContact CZ3-CG1 3.8Å; W386-V390 HydrophobicContact CZ3-CG2 4.11Å; W386-V390 WeakPolarHBondContact O-CG2 3.14Å; W386-V390 PolarHBondContact O-N 2.98Å; W386-F396 HydrophobicContact CH2-CZ 4.42Å; W386-F396 HydrophobicContact CZ3-CZ 4.18Å
387	A	85.8	Confident	88.3	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-43.5	-170.6	0	0	0	0	0	112.6	F384 H385 R389 V390 A391 F396 V415	F384-A387 HydrophobicContact CD1-CB 4.07Å; F384-A387 WeakPolarHBondContact O-CB 3.49Å; F384-A387 PolarHBondContact O-N 3.28Å; H385-A387 VanDerWaalsContact C-N 3.25Å; H385-A387 PolarHBondContact O-N 3.06Å; A387-R389 VanDerWaalsContact C-N 3.26Å; A387-R389 PolarHBondContact O-N 3.3Å; A387-V390 PolarHBondContact O-N 2.95Å; A387-A391 WeakPolarHBondContact O-CB 3.21Å; A387-A391 PolarHBondContact O-N 3.24Å; A387-F396 HydrophobicContact CB-CZ 4.44Å; A387-V415 HydrophobicContact CB-CG1 3.84Å
388	A	80.7	Confident	88.3	Confident	31 Å²	31	46.7 Å²	46.7	26%	0.256	22%	0.216	S	C	.	.	H	α-helix	trans	-61.8	-34.2	178.2	0	0	0	0	0	112.6	W386	W386-A388 PolarHBondContact O-N 3.36Å
389	R	83.3	Confident	88.2	Confident	136 Å²	136	47.8 Å²	47.8	51%	0.513	22%	0.223	S	C	.	.	H	α-helix	trans	-74.9	-47	176.8	-177.8	175.3	64.6	-170	-4.2	111.4	W386 A387 R392	W386-R389 WeakPolarHBondContact O-CB 3.33Å; W386-R389 PolarHBondContact O-N 3.06Å; W386-R389 VanDerWaalsContact O-N 3.07Å; A387-R389 VanDerWaalsContact C-N 3.26Å; A387-R389 PolarHBondContact O-N 3.3Å; R389-R392 PolarHBondContact O-N 2.8Å
390	V	83.3	Confident	88.2	Confident	25 Å²	25	52 Å²	52	15%	0.152	24%	0.244	C	C	.	.	H	α-helix	trans	-72.6	-33.2	-176	172.1	0	0	0	0	112.1	M362 W386 A387 R392 V393 V394	M362-V390 HydrophobicContact CB-CG2 4.44Å; W386-V390 HydrophobicContact CD2-CG2 4.46Å; W386-V390 HydrophobicContact CE3-CB 3.56Å; W386-V390 HydrophobicContact CE3-CG1 4.07Å; W386-V390 HydrophobicContact CE3-CG2 3.49Å; W386-V390 VanDerWaalsContact CE3-CG2 3.49Å; W386-V390 HydrophobicContact CZ3-CB 3.77Å; W386-V390 HydrophobicContact CZ3-CG1 3.8Å; W386-V390 HydrophobicContact CZ3-CG2 4.11Å; W386-V390 WeakPolarHBondContact O-CG2 3.14Å; W386-V390 PolarHBondContact O-N 2.98Å; A387-V390 PolarHBondContact O-N 2.95Å; V390-R392 PolarHBondContact O-N 2.86Å; V390-V393 PolarHBondContact O-N 2.91Å; V390-V394 HydrophobicContact CG1-CB 3.76Å; V390-V394 HydrophobicContact CG1-CG2 3.55Å; V390-V394 PolarHBondContact O-N 2.88Å
391	A	77.5	Confident	88.3	Confident	11 Å²	11	53.9 Å²	53.9	9%	0.091	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-5	177	0	0	0	0	0	114.6	A387 F396 R416	A387-A391 WeakPolarHBondContact O-CB 3.21Å; A387-A391 PolarHBondContact O-N 3.24Å; A391-F396 HydrophobicContact CB-CD2 4Å; A391-F396 HydrophobicContact CB-CE2 3.71Å; A391-F396 HydrophobicContact CB-CZ 4.47Å; A391-R416 HydrophobicContact CB-CG 3.98Å
392	R	81.1	Confident	88.4	Confident	218 Å²	218	53.1 Å²	53.1	82%	0.823	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-25.7	169.5	-63.4	-176.7	178.3	177.5	-1.3	113	R389 V390	R389-R392 PolarHBondContact O-N 2.8Å; V390-R392 PolarHBondContact O-N 2.86Å
393	V	87.7	Confident	88.7	Confident	125 Å²	125	56.1 Å²	56.1	76%	0.758	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-38.5	-173.2	-174.3	0	0	0	0	111	V390	V390-V393 PolarHBondContact O-N 2.91Å
394	V	92.1	Very high	89	Confident	14 Å²	14	55.9 Å²	55.9	9%	0.085	27%	0.27	C	S	.	.	S	Bend	trans	-104.9	132	-177.3	-176.2	0	0	0	0	110.1	L368 V371 V390	L368-V394 HydrophobicContact CD2-CG1 4.12Å; L368-V394 HydrophobicContact CG-CG1 4.17Å; V371-V394 HydrophobicContact CB-CG1 4.16Å; V371-V394 HydrophobicContact CG1-CG1 3.91Å; V390-V394 HydrophobicContact CG1-CB 3.76Å; V390-V394 HydrophobicContact CG1-CG2 3.55Å; V390-V394 PolarHBondContact O-N 2.88Å
395	R	94.2	Very high	89.4	Confident	135 Å²	135	58.4 Å²	58.4	51%	0.509	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123	177.7	-171.1	-177.4	80.5	91.4	-8.4	110.8	Q369 E370 V371	Q369-R395 WeakPolarHBondContact O-CB 3.18Å; Q369-R395 PolarHBondContact O-N 3.15Å; E370-R395 CarbonylContact C-O 3.3Å; E370-R395 VanDerWaalsContact CA-O 3.23Å; E370-R395 WeakPolarHBondContact CA-O 3.32Å; E370-R395 HydrophobicContact CB-CB 4.18Å; E370-R395 IonicContact OE2-CZ 3.86Å; E370-R395 IonicContact OE2-NE 2.7Å; E370-R395 PolarHBondContact OE2-NE 3.35Å; E370-R395 IonicContact OE2-NH2 3.25Å; E370-R395 PolarHBondContact OE2-NH2 3.33Å; V371-R395 PolarHBondContact N-O 2.8Å
396	F	93.8	Very high	89.8	Confident	14 Å²	14	56.7 Å²	56.7	6%	0.061	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.4	170.8	-80.2	-118.8	0	0	0	109.4	V371 L373 W386 A387 A391 P399 T402	V371-F396 HydrophobicContact CG1-CD1 4.35Å; V371-F396 HydrophobicContact CG1-CD2 4.06Å; V371-F396 HydrophobicContact CG1-CE1 4.32Å; V371-F396 HydrophobicContact CG1-CE2 4.01Å; V371-F396 HydrophobicContact CG1-CG 4.23Å; V371-F396 HydrophobicContact CG1-CZ 4.15Å; V371-F396 WeakPolarHBondContact O-CA 3.18Å; L373-F396 HydrophobicContact CD1-CE1 4.07Å; W386-F396 HydrophobicContact CH2-CZ 4.42Å; W386-F396 HydrophobicContact CZ3-CZ 4.18Å; A387-F396 HydrophobicContact CB-CZ 4.44Å; A391-F396 HydrophobicContact CB-CD2 4Å; A391-F396 HydrophobicContact CB-CE2 3.71Å; A391-F396 HydrophobicContact CB-CZ 4.47Å; F396-P399 HydrophobicContact CB-CB 4.11Å; F396-P399 WeakPolarHBondContact O-CD 3.32Å; F396-T402 HydrophobicContact CD1-CG2 4.43Å
397	I	95.1	Very high	90	Very high	30 Å²	30	58.5 Å²	58.5	15%	0.154	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	131.1	174.4	-57.5	-166.7	0	0	0	109.1	M348 E370 V371	M348-I397 HydrophobicContact CE-CD1 3.46Å; M348-I397 VanDerWaalsContact CE-CD1 3.46Å; M348-I397 HydrophobicContact CE-CG1 4.41Å; M348-I397 HydrophobicContact SD-CD1 3.56Å; M348-I397 VanDerWaalsContact SD-CD1 3.56Å; E370-I397 HydrophobicContact CB-CD1 4.37Å; E370-I397 HydrophobicContact CB-CG1 4.37Å; E370-I397 HydrophobicContact CG-CD1 4.37Å; V371-I397 PolarHBondContact O-N 3.14Å
398	Q	94.2	Very high	90.3	Very high	107 Å²	107	63.5 Å²	63.5	50%	0.5	33%	0.329	S	S	.	.	S	Bend	trans	47.7	60.4	-172	-59.7	-176.7	-6	0	0	112.3	H374 E400 A401 T402	H374-Q398 HydrophobicContact CB-CB 4.36Å; H374-Q398 PolarHBondContact CD2-OE1 3.05Å; H374-Q398 PolarHBondContact CE1-OE1 3.08Å; H374-Q398 PolarHBondContact ND1-OE1 2.96Å; H374-Q398 PolarHBondContact NE2-OE1 3.07Å; H374-Q398 VanDerWaalsContact NE2-OE1 3.14Å; Q398-E400 PolarHBondContact O-N 2.76Å; Q398-E400 VanDerWaalsContact O-N 3.09Å; Q398-A401 HydrophobicContact CB-CB 4.16Å; Q398-A401 PolarHBondContact O-N 3.17Å; Q398-A401 VanDerWaalsContact O-N 3.07Å; Q398-T402 PolarHBondContact O-N 3.08Å; Q398-T402 PolarHBondContact O-OG1 2.97Å; Q398-T402 VanDerWaalsContact O-OG1 3.05Å
399	P	91.8	Very high	90.8	Very high	25 Å²	25	69 Å²	69	16%	0.162	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-60.5	-26.5	-177	16	-15.7	0	0	0	111.9	F396 A401 T402	F396-P399 HydrophobicContact CB-CB 4.11Å; F396-P399 WeakPolarHBondContact O-CD 3.32Å; P399-A401 VanDerWaalsContact C-N 3.28Å; P399-A401 PolarHBondContact O-N 2.98Å; P399-T402 WeakPolarHBondContact O-CB 3.41Å; P399-T402 PolarHBondContact O-N 3.33Å; P399-T402 VanDerWaalsContact O-N 3.12Å
400	E	92.5	Very high	91.3	Very high	119 Å²	119	63 Å²	63	56%	0.556	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-75.9	-23.2	-175.9	-75.6	55.8	101.2	0	0	111.4	Q398	Q398-E400 PolarHBondContact O-N 2.76Å; Q398-E400 VanDerWaalsContact O-N 3.09Å
401	A	94.8	Very high	91.8	Very high	42 Å²	42	70.3 Å²	70.3	35%	0.347	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-95.8	-1.2	173.4	0	0	0	0	0	112.7	H374 Q398 P399 L403	H374-A401 HydrophobicContact CB-CB 3.88Å; Q398-A401 HydrophobicContact CB-CB 4.16Å; Q398-A401 PolarHBondContact O-N 3.17Å; Q398-A401 VanDerWaalsContact O-N 3.07Å; P399-A401 VanDerWaalsContact C-N 3.28Å; P399-A401 PolarHBondContact O-N 2.98Å; A401-L403 PolarHBondContact O-N 3.18Å
402	T	94.9	Very high	92.6	Very high	2 Å²	2	73.1 Å²	73.1	1%	0.012	38%	0.376	C	S	.	.			trans	-92.3	90.5	178	-54.5	0	0	0	0	109.4	L373 L378 F396 Q398 P399 V415	L373-T402 HydrophobicContact CB-CG2 4.2Å; L378-T402 HydrophobicContact CD1-CG2 3.73Å; F396-T402 HydrophobicContact CD1-CG2 4.43Å; Q398-T402 PolarHBondContact O-N 3.08Å; Q398-T402 PolarHBondContact O-OG1 2.97Å; Q398-T402 VanDerWaalsContact O-OG1 3.05Å; P399-T402 WeakPolarHBondContact O-CB 3.41Å; P399-T402 PolarHBondContact O-N 3.33Å; P399-T402 VanDerWaalsContact O-N 3.12Å; T402-V415 HydrophobicContact CG2-CB 4.22Å; T402-V415 HydrophobicContact CG2-CG2 3.86Å; T402-V415 PolarHBondContact O-N 3.17Å
403	L	95.1	Very high	93.2	Very high	67 Å²	67	66.8 Å²	66.8	35%	0.351	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-113.2	149.6	-171.3	-54	178.4	0	0	0	112.1	A401 R413 R414	A401-L403 PolarHBondContact O-N 3.18Å; L403-R413 CarbonylContact C-O 3.19Å; L403-R413 WeakPolarHBondContact CA-O 3.43Å; L403-R414 HydrophobicContact CD2-CB 4.41Å; L403-R414 HydrophobicContact CD2-CG 3.76Å
404	C	95.1	Very high	93.5	Very high	3 Å²	3	65.7 Å²	65.7	2%	0.02	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	132.9	170	-57.6	0	0	0	0	110.5	L378 C380 L410 R411 A412 R413	L378-C404 CarbonylContact O-C 3.57Å; C380-C404 HydrophobicContact CB-CB 3.75Å; C380-C404 WeakPolarHBondContact CB-SG 3.41Å; C380-C404 VanDerWaalsContact SG-CA 3.57Å; C380-C404 WeakPolarHBondContact SG-CB 3.38Å; C380-C404 CovalentContact SG-SG 2.02Å; C380-C404 PolarHBondContact SG-SG 2.97Å; C404-L410 HydrophobicContact CB-CB 4.46Å; C404-L410 WeakPolarHBondContact CB-O 3.45Å; C404-R411 CarbonylContact O-C 3.47Å; C404-R411 WeakPolarHBondContact O-CA 3.49Å; C404-A412 PolarHBondContact O-N 2.87Å; C404-R413 PolarHBondContact N-O 3.26Å
405	S	95	Very high	93.5	Very high	52 Å²	52	65 Å²	65	36%	0.364	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-27.3	169.8	-174.7	0	0	0	0	112.6	L378	L378-S405 PolarHBondContact O-N 3.13Å
406	A	91.4	Very high	93.1	Very high	31 Å²	31	65.8 Å²	65.8	26%	0.256	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	161.8	-179.6	0	0	0	0	0	109.6	L378 R379 C380	L378-A406 PolarHBondContact O-N 3.4Å; R379-A406 CarbonylContact C-O 3.54Å; R379-A406 WeakPolarHBondContact CA-O 3.34Å; R379-A406 HydrophobicContact CB-CB 4.38Å; R379-A406 HydrophobicContact CG-CB 3.97Å; C380-A406 PolarHBondContact N-O 2.96Å
407	P	91.1	Very high	92.8	Very high	41 Å²	41	70.1 Å²	70.1	27%	0.266	35%	0.354	S	S	.	.	S	Bend	cis	-67.9	169.4	-9.2	35.6	-40.1	0	0	0	111.8	E409 L410 R411	P407-E409 VanDerWaalsContact CB-OE2 3.27Å; P407-E409 WeakPolarHBondContact CB-OE2 3.37Å; P407-E409 PolarHBondContact O-N 2.96Å; P407-E409 VanDerWaalsContact O-N 3.1Å; P407-L410 HydrophobicContact CG-CB 4.43Å; P407-L410 HydrophobicContact CG-CD1 4.21Å; P407-L410 HydrophobicContact CG-CG 4.29Å; P407-L410 PolarHBondContact O-N 2.98Å; P407-R411 PolarHBondContact O-N 3.29Å
408	P	91.3	Very high	92.5	Very high	105 Å²	105	68.8 Å²	68.8	68%	0.682	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-53.2	-32.7	-173.5	-27.8	36.3	0	0	0	114.6	L410 R411	P408-L410 VanDerWaalsContact C-N 3.27Å; P408-L410 PolarHBondContact O-N 3.32Å; P408-R411 WeakPolarHBondContact O-CB 3.47Å; P408-R411 PolarHBondContact O-N 3.15Å
409	E	92.3	Very high	92.1	Very high	147 Å²	147	66.4 Å²	66.4	69%	0.687	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-69.3	-26.1	-179	-53.9	72.3	-153.5	0	0	112.4	P407	P407-E409 VanDerWaalsContact CB-OE2 3.27Å; P407-E409 WeakPolarHBondContact CB-OE2 3.37Å; P407-E409 PolarHBondContact O-N 2.96Å; P407-E409 VanDerWaalsContact O-N 3.1Å
410	L	92.7	Very high	91.6	Very high	11 Å²	11	69.1 Å²	69.1	6%	0.058	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-106.6	2.3	-179.1	-61.4	-179.3	0	0	0	112.7	C380 C404 P407 P408 A412 R413 V418	C380-L410 HydrophobicContact CB-CD1 4.21Å; C380-L410 WeakPolarHBondContact O-CD1 3.37Å; C404-L410 HydrophobicContact CB-CB 4.46Å; C404-L410 WeakPolarHBondContact CB-O 3.45Å; P407-L410 HydrophobicContact CG-CB 4.43Å; P407-L410 HydrophobicContact CG-CD1 4.21Å; P407-L410 HydrophobicContact CG-CG 4.29Å; P407-L410 PolarHBondContact O-N 2.98Å; P408-L410 VanDerWaalsContact C-N 3.27Å; P408-L410 PolarHBondContact O-N 3.32Å; L410-A412 PolarHBondContact O-N 3.07Å; L410-R413 VanDerWaalsContact O-CB 3.29Å; L410-R413 WeakPolarHBondContact O-CB 3.14Å; L410-R413 PolarHBondContact O-N 2.95Å; L410-R413 VanDerWaalsContact O-N 3.09Å; L410-V418 HydrophobicContact CD1-CG1 3.76Å; L410-V418 HydrophobicContact CD2-CG1 4.28Å; L410-V418 HydrophobicContact CD2-CG2 4.43Å
411	R	94.8	Very high	91.1	Very high	178 Å²	178	66.9 Å²	66.9	67%	0.672	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	137.8	-176.7	-174.3	174.7	178.1	154.3	1.7	111.7	C404 P407 P408 R413	C404-R411 CarbonylContact O-C 3.47Å; C404-R411 WeakPolarHBondContact O-CA 3.49Å; P407-R411 PolarHBondContact O-N 3.29Å; P408-R411 WeakPolarHBondContact O-CB 3.47Å; P408-R411 PolarHBondContact O-N 3.15Å; R411-R413 PolarHBondContact O-N 3.2Å; R411-R413 VanDerWaalsContact O-N 3.12Å
412	A	94.1	Very high	90.7	Very high	69 Å²	69	69 Å²	69	57%	0.57	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	5.7	-176.3	0	0	0	0	0	115.6	C404 L410	C404-A412 PolarHBondContact O-N 2.87Å; L410-A412 PolarHBondContact O-N 3.07Å
413	R	94.1	Very high	90.4	Very high	85 Å²	85	69.4 Å²	69.4	32%	0.321	38%	0.375	S	S	.	.			trans	-76.1	149.4	168.4	-64.9	-169.9	62.5	-167.5	-7.3	110.7	L403 C404 L410 R411 E417 V418 E422	L403-R413 CarbonylContact C-O 3.19Å; L403-R413 WeakPolarHBondContact CA-O 3.43Å; C404-R413 PolarHBondContact N-O 3.26Å; L410-R413 VanDerWaalsContact O-CB 3.29Å; L410-R413 WeakPolarHBondContact O-CB 3.14Å; L410-R413 PolarHBondContact O-N 2.95Å; L410-R413 VanDerWaalsContact O-N 3.09Å; R411-R413 PolarHBondContact O-N 3.2Å; R411-R413 VanDerWaalsContact O-N 3.12Å; R413-E417 PolarHBondContact NH2-O 3.39Å; R413-V418 HydrophobicContact CB-CG2 4.13Å; R413-E422 IonicContact CZ-OE1 3.05Å; R413-E422 IonicContact NH1-OE1 3.55Å; R413-E422 PolarHBondContact NH1-OE1 3.27Å; R413-E422 IonicContact NH2-OE1 3.59Å
414	R	92.9	Very high	89.9	Confident	102 Å²	102	69.3 Å²	69.3	39%	0.385	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-72.3	131.2	176.8	-57.3	-176.2	-166.9	150.5	-7.9	109.3	L403 R416 E417 V418	L403-R414 HydrophobicContact CD2-CB 4.41Å; L403-R414 HydrophobicContact CD2-CG 3.76Å; R414-R416 PolarHBondContact O-N 3.36Å; R414-R416 VanDerWaalsContact O-N 3.08Å; R414-E417 HydrophobicContact CB-CB 4.34Å; R414-E417 HydrophobicContact CB-CG 4.05Å; R414-E417 WeakPolarHBondContact CD-OE1 3.17Å; R414-E417 IonicContact CZ-OE1 3.35Å; R414-E417 IonicContact NE-OE1 3.95Å; R414-E417 IonicContact NH1-OE1 3.41Å; R414-E417 PolarHBondContact NH1-OE1 2.77Å; R414-E417 PolarHBondContact O-N 3.19Å; R414-V418 PolarHBondContact O-N 3.39Å
415	V	91.4	Very high	89.5	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.006	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-54.9	-36	-176.4	177.6	0	0	0	0	111.6	L378 F384 A387 T402 E417 V418	L378-V415 HydrophobicContact CD1-CG2 3.9Å; F384-V415 HydrophobicContact CD1-CG1 4.33Å; A387-V415 HydrophobicContact CB-CG1 3.84Å; T402-V415 HydrophobicContact CG2-CB 4.22Å; T402-V415 HydrophobicContact CG2-CG2 3.86Å; T402-V415 PolarHBondContact O-N 3.17Å; V415-E417 VanDerWaalsContact C-N 3.3Å; V415-E417 PolarHBondContact O-N 2.8Å; V415-V418 PolarHBondContact O-N 3.01Å
416	R	85.9	Confident	89.3	Confident	151 Å²	151	72.9 Å²	72.9	57%	0.57	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-73.4	-19	-177.9	-156.8	177.7	168.9	-160.8	-2.4	114.2	A391 R414	A391-R416 HydrophobicContact CB-CG 3.98Å; R414-R416 PolarHBondContact O-N 3.36Å; R414-R416 VanDerWaalsContact O-N 3.08Å
417	E	88.1	Confident	89.3	Confident	104 Å²	104	71.7 Å²	71.7	49%	0.486	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-95	-10.7	-179.9	-66.1	175	-179.9	0	0	112.7	R413 R414 V415	R413-E417 PolarHBondContact NH2-O 3.39Å; R414-E417 HydrophobicContact CB-CB 4.34Å; R414-E417 HydrophobicContact CB-CG 4.05Å; R414-E417 WeakPolarHBondContact CD-OE1 3.17Å; R414-E417 IonicContact CZ-OE1 3.35Å; R414-E417 IonicContact NE-OE1 3.95Å; R414-E417 IonicContact NH1-OE1 3.41Å; R414-E417 PolarHBondContact NH1-OE1 2.77Å; R414-E417 PolarHBondContact O-N 3.19Å; V415-E417 VanDerWaalsContact C-N 3.3Å; V415-E417 PolarHBondContact O-N 2.8Å
418	V	89	Confident	89.3	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.012	41%	0.41	C	S	.	.	S	Bend	trans	-81.2	120.7	176	-179.4	0	0	0	0	108.4	L410 R413 R414 V415 E422 M423	L410-V418 HydrophobicContact CD1-CG1 3.76Å; L410-V418 HydrophobicContact CD2-CG1 4.28Å; L410-V418 HydrophobicContact CD2-CG2 4.43Å; R413-V418 HydrophobicContact CB-CG2 4.13Å; R414-V418 PolarHBondContact O-N 3.39Å; V415-V418 PolarHBondContact O-N 3.01Å; V418-E422 HydrophobicContact CG1-CB 4.01Å; V418-M423 HydrophobicContact CB-CE 3.61Å; V418-M423 HydrophobicContact CG1-CE 3.45Å; V418-M423 VanDerWaalsContact CG1-CE 3.45Å; V418-M423 HydrophobicContact CG1-CG 3.72Å; V418-M423 HydrophobicContact CG1-SD 4.44Å
419	S	85.4	Confident	89.3	Confident	58 Å²	58	69.3 Å²	69.3	41%	0.406	38%	0.379	S	S	.	.			trans	-72.8	153.8	177.5	69.8	0	0	0	0	111.3	G421 E422 M423	S419-G421 PolarHBondContact O-N 3.25Å; S419-G421 VanDerWaalsContact O-N 3.14Å; S419-E422 WeakPolarHBondContact CB-OE2 3.46Å; S419-E422 PolarHBondContact N-OE2 2.85Å; S419-E422 PolarHBondContact O-N 3.11Å; S419-E422 VanDerWaalsContact O-N 3.09Å; S419-E422 WeakPolarHBondContact OG-CG 3.18Å; S419-E422 PolarHBondContact OG-OE2 3.15Å; S419-M423 PolarHBondContact O-N 2.82Å
420	S	81.6	Confident	89.2	Confident	81 Å²	81	64.4 Å²	64.4	57%	0.566	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-20.3	178.2	58	0	0	0	0	113.6
421	G	82.6	Confident	89.1	Confident	72 Å²	72	64.2 Å²	64.2	74%	0.742	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-21.9	176.1	0	0	0	0	0	113.9	S419	S419-G421 PolarHBondContact O-N 3.25Å; S419-G421 VanDerWaalsContact O-N 3.14Å
422	E	86.1	Confident	88.7	Confident	87 Å²	87	56.3 Å²	56.3	41%	0.407	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-21.2	173.4	-69.2	167.3	98.4	0	0	112	R413 V418 S419	R413-E422 IonicContact CZ-OE1 3.05Å; R413-E422 IonicContact NH1-OE1 3.55Å; R413-E422 PolarHBondContact NH1-OE1 3.27Å; R413-E422 IonicContact NH2-OE1 3.59Å; V418-E422 HydrophobicContact CG1-CB 4.01Å; S419-E422 WeakPolarHBondContact CB-OE2 3.46Å; S419-E422 PolarHBondContact N-OE2 2.85Å; S419-E422 PolarHBondContact O-N 3.11Å; S419-E422 VanDerWaalsContact O-N 3.09Å; S419-E422 WeakPolarHBondContact OG-CG 3.18Å; S419-E422 PolarHBondContact OG-OE2 3.15Å
423	M	87.9	Confident	87.9	Confident	10 Å²	10	58.4 Å²	58.4	5%	0.049	34%	0.336	C	S	.	.	S	Bend	trans	-86.2	129.4	174.8	-60.3	-174.8	-177.2	0	0	109.9	C380 F384 V418 S419	C380-M423 HydrophobicContact CB-CE 4.18Å; F384-M423 HydrophobicContact CB-SD 4.42Å; V418-M423 HydrophobicContact CB-CE 3.61Å; V418-M423 HydrophobicContact CG1-CE 3.45Å; V418-M423 VanDerWaalsContact CG1-CE 3.45Å; V418-M423 HydrophobicContact CG1-CG 3.72Å; V418-M423 HydrophobicContact CG1-SD 4.44Å; S419-M423 PolarHBondContact O-N 2.82Å
424	S	86	Confident	87.2	Confident	65 Å²	65	56 Å²	56	46%	0.455	33%	0.332	S	S	.	.			trans	-62.1	139.6	175.3	-175.6	0	0	0	0	111.3	C382 S426	C382-S424 WeakPolarHBondContact CA-O 3.33Å; C382-S424 WeakPolarHBondContact CB-O 3.2Å; C382-S424 PolarHBondContact N-O 2.67Å; S424-S426 VanDerWaalsContact C-N 3.27Å; S424-S426 WeakPolarHBondContact CB-O 3.47Å; S424-S426 PolarHBondContact O-N 2.68Å; S424-S426 PolarHBondContact OG-N 3Å; S424-S426 PolarHBondContact OG-O 2.8Å
425	A	86.3	Confident	86.4	Confident	84 Å²	84	51.8 Å²	51.8	69%	0.694	32%	0.318	S	S	*	.	S	Bend	trans	-72	-22	176.3	0	0	0	0	0	113.4
426	S	90.4	Very high	86.1	Confident	46 Å²	46	52 Å²	52	32%	0.322	32%	0.319	S	S	.	.	S	Bend	trans	-137.1	157.1	179.4	59.7	0	0	0	0	110.6	S424 E457	S424-S426 VanDerWaalsContact C-N 3.27Å; S424-S426 WeakPolarHBondContact CB-O 3.47Å; S424-S426 PolarHBondContact O-N 2.68Å; S424-S426 PolarHBondContact OG-N 3Å; S424-S426 PolarHBondContact OG-O 2.8Å; S426-E457 CarbonylContact C-O 3.57Å; S426-E457 VanDerWaalsContact CA-O 3.23Å; S426-E457 WeakPolarHBondContact CA-O 3.35Å; S426-E457 VanDerWaalsContact CB-O 3.32Å; S426-E457 WeakPolarHBondContact CB-O 3.27Å
427	C	91.1	Very high	86	Confident	7 Å²	7	48 Å²	48	5%	0.047	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	158	-169.3	55.3	0	0	0	0	112.3	R379 D381 C382 E457 N508	R379-C427 PolarHBondContact NH2-SG 2.82Å; R379-C427 VanDerWaalsContact NH2-SG 3.42Å; D381-C427 WeakPolarHBondContact OD2-CB 3.38Å; C382-C427 HydrophobicContact CB-CB 3.72Å; C382-C427 WeakPolarHBondContact CB-SG 3.42Å; C382-C427 WeakPolarHBondContact SG-CB 3.19Å; C382-C427 CovalentContact SG-SG 1.98Å; C382-C427 PolarHBondContact SG-SG 2.84Å; C427-E457 PolarHBondContact N-O 2.86Å; C427-E457 PolarHBondContact SG-N 3.33Å; C427-N508 PolarHBondContact O-ND2 3.23Å
428	L	91.2	Very high	85.7	Confident	92 Å²	92	47.8 Å²	47.8	48%	0.482	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	147	175.3	-70.4	166.6	0	0	0	111.3	R379 L510	R379-L428 PolarHBondContact NH1-O 2.88Å; R379-L428 VanDerWaalsContact NH1-O 3.17Å; L428-L510 VanDerWaalsContact CD2-C 3.47Å; L428-L510 HydrophobicContact CD2-CB 3.84Å; L428-L510 WeakPolarHBondContact CD2-O 3.49Å; L428-L510 HydrophobicContact CG-CB 4.46Å
429	P	91.9	Very high	85.5	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.019	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	150.3	170.1	-19.9	34.2	0	0	0	111.2	A456 P460 A506 N508 D513	P429-A456 VanDerWaalsContact CA-CB 3.48Å; P429-A456 HydrophobicContact CB-CB 3.96Å; P429-A456 HydrophobicContact CG-CB 3.91Å; P429-P460 HydrophobicContact CB-CB 3.91Å; P429-P460 HydrophobicContact CB-CG 4.28Å; P429-P460 HydrophobicContact CG-CB 3.82Å; P429-A506 HydrophobicContact CB-CB 3.77Å; P429-A506 WeakPolarHBondContact CB-O 3.39Å; P429-A506 WeakPolarHBondContact CG-O 2.91Å; P429-N508 WeakPolarHBondContact CD-OD1 3.27Å; P429-N508 HydrophobicContact CG-CB 4.02Å; P429-D513 WeakPolarHBondContact O-CB 3.42Å
430	T	89.4	Confident	85.6	Confident	45 Å²	45	52 Å²	52	28%	0.276	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	121.4	173.2	-61.6	0	0	0	0	109.7	R379 A454 L455 D513	R379-T430 PolarHBondContact NH1-OG1 3.46Å; T430-A454 VanDerWaalsContact O-CA 3.28Å; T430-A454 WeakPolarHBondContact O-CA 3.23Å; T430-A454 WeakPolarHBondContact O-CB 3.45Å; T430-L455 PolarHBondContact N-O 2.95Å; T430-L455 PolarHBondContact O-N 3.38Å; T430-D513 WeakPolarHBondContact CA-OD2 3.48Å
431	I	90.6	Very high	85.9	Confident	6 Å²	6	50.2 Å²	50.2	3%	0.031	33%	0.328	C	S	.	.			trans	-90.7	116.4	171.3	-59.7	168.6	0	0	0	106.9	T433 S435 A454 C504 A506 D513 H515	I431-T433 PolarHBondContact O-N 3.2Å; I431-S435 WeakPolarHBondContact CG2-OG 3.4Å; I431-A454 HydrophobicContact CG1-CB 4.01Å; I431-C504 HydrophobicContact CD1-CB 4.41Å; I431-A506 HydrophobicContact CD1-CB 3.96Å; I431-A506 HydrophobicContact CG1-CB 3.85Å; I431-D513 WeakPolarHBondContact CD1-O 3.5Å; I431-D513 PolarHBondContact N-OD2 2.81Å; I431-H515 HydrophobicContact CB-CB 4.3Å; I431-H515 HydrophobicContact CD1-CB 4.2Å; I431-H515 HydrophobicContact CG2-CB 3.77Å
432	P	86.3	Confident	86.3	Confident	13 Å²	13	47.7 Å²	47.7	8%	0.084	30%	0.298	C	S	.	.			trans	-61.8	134.9	178	-21.7	33.4	0	0	0	111.3	S331 S434 S435 R453	S331-P432 VanDerWaalsContact OG-CB 3.22Å; S331-P432 WeakPolarHBondContact OG-CB 3.34Å; P432-S434 PolarHBondContact O-N 3.01Å; P432-S435 VanDerWaalsContact O-CB 3.23Å; P432-S435 WeakPolarHBondContact O-CB 3.29Å; P432-S435 PolarHBondContact O-N 3.24Å; P432-S435 PolarHBondContact O-OG 2.67Å; P432-R453 WeakPolarHBondContact CD-O 3.38Å
433	T	78.3	Confident	86.5	Confident	113 Å²	113	49.5 Å²	49.5	69%	0.693	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-26.8	-176.9	52.7	0	0	0	0	113.5	I431 S435	I431-T433 PolarHBondContact O-N 3.2Å; T433-S435 VanDerWaalsContact C-N 3.33Å
434	S	77.8	Confident	86.6	Confident	34 Å²	34	53.5 Å²	53.5	24%	0.238	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.7	174.7	47.9	0	0	0	0	113.9	V306 R329 S331 P432 L436	V306-S434 VanDerWaalsContact CG1-O 3.23Å; V306-S434 WeakPolarHBondContact CG1-O 3.01Å; R329-S434 PolarHBondContact O-OG 3.16Å; S331-S434 WeakPolarHBondContact CB-OG 3.4Å; S331-S434 PolarHBondContact OG-OG 2.62Å; P432-S434 PolarHBondContact O-N 3.01Å; S434-L436 VanDerWaalsContact C-N 3.35Å; S434-L436 PolarHBondContact O-N 3.35Å
435	S	77.6	Confident	86.8	Confident	13 Å²	13	52.7 Å²	52.7	9%	0.091	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-34.6	-178.5	69	0	0	0	0	112.9	I431 P432 T433	I431-S435 WeakPolarHBondContact CG2-OG 3.4Å; P432-S435 VanDerWaalsContact O-CB 3.23Å; P432-S435 WeakPolarHBondContact O-CB 3.29Å; P432-S435 PolarHBondContact O-N 3.24Å; P432-S435 PolarHBondContact O-OG 2.67Å; T433-S435 VanDerWaalsContact C-N 3.33Å
436	L	84.3	Confident	87	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.026	31%	0.306	C	S	.	.	S	Bend	trans	-125	123.7	-178	-76.7	167.6	0	0	0	110.7	S434 L450 H451 C452 W464 C504 H515 V517	S434-L436 VanDerWaalsContact C-N 3.35Å; S434-L436 PolarHBondContact O-N 3.35Å; L436-L450 HydrophobicContact CD2-CB 4.45Å; L436-H451 WeakPolarHBondContact CD2-O 3.12Å; L436-H451 WeakPolarHBondContact CG-O 3.5Å; L436-C452 HydrophobicContact CD1-CB 4.22Å; L436-W464 HydrophobicContact CD1-CH2 3.7Å; L436-W464 HydrophobicContact CD1-CZ2 4.22Å; L436-W464 HydrophobicContact CD2-CH2 3.67Å; L436-W464 HydrophobicContact CD2-CZ2 4.1Å; L436-W464 HydrophobicContact CG-CH2 4.36Å; L436-C504 HydrophobicContact CD1-CB 3.98Å; L436-H515 HydrophobicContact CD1-CB 4.11Å; L436-H515 PolarHBondContact O-CE1 3.49Å; L436-V517 HydrophobicContact CD2-CG1 4.39Å
437	P	83.3	Confident	87	Confident	67 Å²	67	53.2 Å²	53.2	44%	0.435	32%	0.315	S	S	.	.			trans	-68.1	159.1	172.4	31.2	-35.7	0	0	0	110.8	Y439 V440 V517	P437-Y439 VanDerWaalsContact C-N 3.3Å; P437-Y439 PolarHBondContact O-N 2.89Å; P437-V440 HydrophobicContact CG-CG2 3.48Å; P437-V440 VanDerWaalsContact CG-CG2 3.48Å; P437-V517 HydrophobicContact CG-CG2 4.49Å; P437-V517 WeakPolarHBondContact O-CB 3.38Å; P437-V517 WeakPolarHBondContact O-CG2 3.42Å
438	S	82.4	Confident	87	Confident	100 Å²	100	53.1 Å²	53.1	70%	0.699	31%	0.314	S	S	*	.	S	Bend	trans	-68.3	-29.5	175.8	53.7	0	0	0	0	113.1	T518	S438-T518 PolarHBondContact O-N 3.1Å
439	Y	85.6	Confident	87	Confident	115 Å²	115	51.2 Å²	51.2	45%	0.451	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	138.9	-178	-180	-93	0	0	0	112.3	P437 T518 H522	P437-Y439 VanDerWaalsContact C-N 3.3Å; P437-Y439 PolarHBondContact O-N 2.89Å; Y439-T518 CarbonylContact C-O 3.59Å; Y439-T518 VanDerWaalsContact CA-O 3.28Å; Y439-T518 WeakPolarHBondContact CA-O 3.42Å; Y439-T518 HydrophobicContact CD2-CG2 4.11Å; Y439-T518 HydrophobicContact CE2-CG2 4.47Å; Y439-H522 PolarHBondContact OH-CE1 3.29Å
440	V	86.6	Confident	86.9	Confident	33 Å²	33	51.1 Å²	51.1	20%	0.2	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.5	171.4	-177.2	0	0	0	0	109.7	P437 V442 L448 L450 V517 T518 V519 G520	P437-V440 HydrophobicContact CG-CG2 3.48Å; P437-V440 VanDerWaalsContact CG-CG2 3.48Å; V440-V442 HydrophobicContact CG1-CG2 3.94Å; V440-L448 HydrophobicContact CB-CD1 4.36Å; V440-L448 HydrophobicContact CG1-CD1 3.67Å; V440-L450 HydrophobicContact CG2-CD2 4.03Å; V440-V517 HydrophobicContact CB-CG2 4.48Å; V440-V517 HydrophobicContact CG2-CG2 3.8Å; V440-T518 PolarHBondContact N-O 2.96Å; V440-V519 WeakPolarHBondContact O-CA 3.32Å; V440-G520 PolarHBondContact O-N 3.34Å
441	G	88.1	Confident	86.9	Confident	44 Å²	44	51.6 Å²	51.6	45%	0.454	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126.9	172.7	0	0	0	0	0	111.1	G520	G441-G520 WeakPolarHBondContact CA-O 3.05Å
442	V	90.6	Very high	86.9	Confident	19 Å²	19	51.3 Å²	51.3	12%	0.115	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	148.3	176.3	-168.1	0	0	0	0	109.8	V440 L448 I494 G520 V521 H522	V440-V442 HydrophobicContact CG1-CG2 3.94Å; V442-L448 HydrophobicContact CG2-CB 4.14Å; V442-L448 HydrophobicContact CG2-CD1 3.46Å; V442-L448 VanDerWaalsContact CG2-CD1 3.46Å; V442-L448 HydrophobicContact CG2-CG 4.34Å; V442-I494 HydrophobicContact CB-CD1 4.47Å; V442-I494 HydrophobicContact CB-CG2 4.13Å; V442-I494 HydrophobicContact CG1-CG2 3.68Å; V442-G520 PolarHBondContact N-O 2.69Å; V442-V521 WeakPolarHBondContact O-CA 3.45Å; V442-H522 PolarHBondContact O-N 3.38Å; V442-H522 PolarHBondContact O-ND1 2.97Å
443	Q	90.4	Very high	87.2	Confident	126 Å²	126	50.7 Å²	50.7	59%	0.589	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	142.3	172.4	-68.2	-174.2	-11.7	0	0	110.2	G445 G446 I494	Q443-G445 PolarHBondContact O-N 2.83Å; Q443-G446 WeakPolarHBondContact O-CA 3.32Å; Q443-G446 PolarHBondContact O-N 3.39Å; Q443-I494 WeakPolarHBondContact O-CG2 3.28Å
444	E	91	Very high	87.8	Confident	94 Å²	94	45.3 Å²	45.3	44%	0.439	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	134.1	172.5	-177.1	-179.8	-145.4	0	0	110.9	G446 P496 V521 H522 N523	E444-G446 PolarHBondContact O-N 2.99Å; E444-P496 WeakPolarHBondContact OE1-CD 3.33Å; E444-V521 HydrophobicContact CB-CG1 4.02Å; E444-H522 PolarHBondContact N-O 2.92Å; E444-N523 PolarHBondContact OE2-ND2 3.29Å; E444-N523 PolarHBondContact OE2-OD1 2.84Å
445	G	89.3	Confident	88.5	Confident	47 Å²	47	44.1 Å²	44.1	49%	0.485	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-3.2	-174.4	0	0	0	0	0	114.7	Q443 R493 I494	Q443-G445 PolarHBondContact O-N 2.83Å; G445-R493 WeakPolarHBondContact O-CA 3.35Å; G445-I494 PolarHBondContact N-O 3.03Å
446	G	90.4	Very high	89.2	Confident	24 Å²	24	43.5 Å²	43.5	25%	0.247	25%	0.252	C	S	.	.			trans	-72.8	177.5	175.8	0	0	0	0	0	114	Q443 E444 R493 I494	Q443-G446 WeakPolarHBondContact O-CA 3.32Å; Q443-G446 PolarHBondContact O-N 3.39Å; E444-G446 PolarHBondContact O-N 2.99Å; G446-R493 WeakPolarHBondContact O-CA 3.3Å; G446-R493 PolarHBondContact O-N 2.97Å; G446-I494 PolarHBondContact O-N 2.97Å
447	K	91.2	Very high	89.5	Confident	118 Å²	118	46.3 Å²	46.3	51%	0.513	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.4	171.4	-174.7	179.7	-179.9	178.9	0	109.2	V449 E490 I491	K447-V449 HydrophobicContact CD-CG2 4.26Å; K447-V449 HydrophobicContact CG-CG2 4.18Å; K447-E490 WeakPolarHBondContact CE-OE2 3.34Å; K447-E490 IonicContact NZ-OE1 3.63Å; K447-E490 IonicContact NZ-OE2 3.59Å; K447-E490 PolarHBondContact NZ-OE2 2.97Å; K447-I491 WeakPolarHBondContact CA-O 3.45Å
448	L	91.4	Very high	90	Very high	4 Å²	4	46 Å²	46	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	136.5	169.4	175.7	70.6	0	0	0	109.2	V440 V442 L450 E490 I491 I494 V519	V440-L448 HydrophobicContact CB-CD1 4.36Å; V440-L448 HydrophobicContact CG1-CD1 3.67Å; V442-L448 HydrophobicContact CG2-CB 4.14Å; V442-L448 HydrophobicContact CG2-CD1 3.46Å; V442-L448 VanDerWaalsContact CG2-CD1 3.46Å; V442-L448 HydrophobicContact CG2-CG 4.34Å; L448-L450 HydrophobicContact CD1-CD2 3.88Å; L448-L450 HydrophobicContact CD1-CG 4.09Å; L448-L450 HydrophobicContact CD2-CD1 3.89Å; L448-L450 HydrophobicContact CD2-CD2 4.47Å; L448-L450 HydrophobicContact CD2-CG 3.97Å; L448-L450 HydrophobicContact CG-CD1 4.46Å; L448-L450 HydrophobicContact CG-CD2 4.35Å; L448-L450 HydrophobicContact CG-CG 3.99Å; L448-E490 WeakPolarHBondContact O-CA 3.26Å; L448-I491 HydrophobicContact CB-CB 4.26Å; L448-I491 HydrophobicContact CD2-CD1 3.87Å; L448-I491 HydrophobicContact CD2-CG1 4.4Å; L448-I491 PolarHBondContact N-O 3.04Å; L448-I491 PolarHBondContact O-N 2.92Å; L448-I494 HydrophobicContact CB-CD1 3.93Å; L448-I494 HydrophobicContact CD2-CD1 3.93Å; L448-I494 HydrophobicContact CG-CD1 4.48Å; L448-V519 HydrophobicContact CD2-CB 4.46Å; L448-V519 HydrophobicContact CD2-CG1 3.84Å; L448-V519 HydrophobicContact CD2-CG2 3.78Å
449	V	89.8	Confident	90.3	Very high	52 Å²	52	45.9 Å²	45.9	32%	0.315	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.2	173	-175.5	0	0	0	0	107.9	K447 H451 T488 L489 E490	K447-V449 HydrophobicContact CD-CG2 4.26Å; K447-V449 HydrophobicContact CG-CG2 4.18Å; V449-H451 WeakPolarHBondContact CG1-CE1 3.14Å; V449-H451 WeakPolarHBondContact CG1-NE2 2.93Å; V449-T488 HydrophobicContact CG1-CG2 3.54Å; V449-L489 WeakPolarHBondContact CA-O 3.49Å; V449-E490 HydrophobicContact CG1-CG 4.27Å; V449-E490 HydrophobicContact CG2-CG 4.26Å
450	L	91.1	Very high	90.7	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.9	178.3	-63.6	176.4	0	0	0	109	L436 V440 L448 W464 T488 L489 Y502 V517 V519	L436-L450 HydrophobicContact CD2-CB 4.45Å; V440-L450 HydrophobicContact CG2-CD2 4.03Å; L448-L450 HydrophobicContact CD1-CD2 3.88Å; L448-L450 HydrophobicContact CD1-CG 4.09Å; L448-L450 HydrophobicContact CD2-CD1 3.89Å; L448-L450 HydrophobicContact CD2-CD2 4.47Å; L448-L450 HydrophobicContact CD2-CG 3.97Å; L448-L450 HydrophobicContact CG-CD1 4.46Å; L448-L450 HydrophobicContact CG-CD2 4.35Å; L448-L450 HydrophobicContact CG-CG 3.99Å; L450-W464 HydrophobicContact CB-CH2 3.86Å; L450-W464 HydrophobicContact CB-CZ2 3.79Å; L450-W464 HydrophobicContact CD1-CH2 4.08Å; L450-W464 HydrophobicContact CD1-CZ3 4.17Å; L450-T488 CarbonylContact O-C 3.37Å; L450-T488 WeakPolarHBondContact O-CA 3.28Å; L450-L489 HydrophobicContact CB-CB 4.4Å; L450-L489 HydrophobicContact CD1-CD2 4.48Å; L450-L489 PolarHBondContact N-O 3.16Å; L450-L489 PolarHBondContact O-N 3.47Å; L450-Y502 HydrophobicContact CD1-CG 4.22Å; L450-V517 HydrophobicContact CD1-CG1 3.73Å; L450-V517 HydrophobicContact CD2-CG1 4.02Å; L450-V517 HydrophobicContact CD2-CG2 4.27Å; L450-V517 HydrophobicContact CG-CG1 4.44Å; L450-V519 HydrophobicContact CD1-CG2 4.17Å
451	H	88.8	Confident	90.9	Very high	54 Å²	54	43.7 Å²	43.7	25%	0.25	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.4	-179.6	-57.7	-71.8	0	0	0	109.9	L436 V449 T488	L436-H451 WeakPolarHBondContact CD2-O 3.12Å; L436-H451 WeakPolarHBondContact CG-O 3.5Å; V449-H451 WeakPolarHBondContact CG1-CE1 3.14Å; V449-H451 WeakPolarHBondContact CG1-NE2 2.93Å; H451-T488 WeakPolarHBondContact ND1-CG2 3.44Å; H451-T488 PolarHBondContact ND1-OG1 2.97Å
452	C	91.2	Very high	91.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.			trans	-112.8	130.7	167.4	-173.2	0	0	0	0	109.8	L436 W464 E486 G487 C504	L436-C452 HydrophobicContact CD1-CB 4.22Å; C452-W464 HydrophobicContact CB-CH2 4.48Å; C452-W464 HydrophobicContact CB-CZ2 3.58Å; C452-E486 VanDerWaalsContact O-O 3.07Å; C452-G487 PolarHBondContact N-O 2.76Å; C452-C504 HydrophobicContact CB-CB 3.59Å; C452-C504 WeakPolarHBondContact CB-SG 3.5Å; C452-C504 WeakPolarHBondContact SG-CB 3.41Å; C452-C504 CovalentContact SG-SG 2Å; C452-C504 PolarHBondContact SG-SG 2.87Å
453	R	91.1	Very high	91.2	Very high	1 Å²	1	42.3 Å²	42.3	0%	0.004	22%	0.22	C	C	.	.			trans	-133.5	134.1	-177.3	-57.4	-63.7	-175.9	-127.9	2.9	108.5	D309 Y332 P432 E486 T488	D309-R453 IonicContact OD1-CZ 3.77Å; D309-R453 VanDerWaalsContact OD1-CZ 3.31Å; D309-R453 IonicContact OD1-NE 3.65Å; D309-R453 PolarHBondContact OD1-NE 3.47Å; D309-R453 VanDerWaalsContact OD1-NE 3.09Å; D309-R453 IonicContact OD1-NH2 2.8Å; D309-R453 PolarHBondContact OD1-NH2 3.47Å; D309-R453 IonicContact OD2-NH2 3.81Å; D309-R453 PolarHBondContact OD2-NH2 3.3Å; D309-R453 VanDerWaalsContact OD2-NH2 3.08Å; Y332-R453 HydrophobicContact CD1-CB 3.69Å; Y332-R453 HydrophobicContact CD1-CG 3.65Å; Y332-R453 HydrophobicContact CD2-CB 3.55Å; Y332-R453 HydrophobicContact CD2-CG 4.45Å; Y332-R453 HydrophobicContact CE1-CB 3.85Å; Y332-R453 HydrophobicContact CE1-CG 3.8Å; Y332-R453 HydrophobicContact CE2-CB 3.71Å; Y332-R453 HydrophobicContact CG-CB 3.52Å; Y332-R453 HydrophobicContact CG-CG 3.99Å; P432-R453 WeakPolarHBondContact CD-O 3.38Å; R453-E486 VanDerWaalsContact NH1-C 3.29Å; R453-E486 PolarHBondContact NH1-O 2.79Å; R453-T488 VanDerWaalsContact CZ-OG1 3.28Å; R453-T488 PolarHBondContact NH1-OG1 2.97Å; R453-T488 PolarHBondContact NH2-OG1 2.95Å
454	A	92.1	Very high	91.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.			trans	-140.4	155.2	175.8	0	0	0	0	0	111.3	T430 I431 P460 L462 A506	T430-A454 VanDerWaalsContact O-CA 3.28Å; T430-A454 WeakPolarHBondContact O-CA 3.23Å; T430-A454 WeakPolarHBondContact O-CB 3.45Å; I431-A454 HydrophobicContact CG1-CB 4.01Å; A454-P460 HydrophobicContact CB-CG 4.02Å; A454-L462 HydrophobicContact CB-CD2 3.99Å; A454-A506 HydrophobicContact CB-CB 3.54Å
455	L	91.8	Very high	91.3	Very high	8 Å²	8	33.9 Å²	33.9	4%	0.042	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.2	171.1	-63.3	174.1	0	0	0	109.5	Y332 P335 A356 L383 T430	Y332-L455 HydrophobicContact CD2-CD1 4.4Å; Y332-L455 HydrophobicContact CD2-CD2 4.42Å; Y332-L455 HydrophobicContact CD2-CG 4.08Å; Y332-L455 HydrophobicContact CE2-CD1 4.44Å; Y332-L455 HydrophobicContact CE2-CD2 3.68Å; Y332-L455 HydrophobicContact CE2-CG 3.77Å; P335-L455 HydrophobicContact CG-CD2 4.16Å; A356-L455 HydrophobicContact CB-CD1 3.95Å; L383-L455 HydrophobicContact CD1-CB 3.47Å; L383-L455 VanDerWaalsContact CD1-CB 3.47Å; L383-L455 HydrophobicContact CD1-CD1 4.34Å; L383-L455 HydrophobicContact CD2-CB 4.22Å; T430-L455 PolarHBondContact N-O 2.95Å; T430-L455 PolarHBondContact O-N 3.38Å
456	A	92.5	Very high	91.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	169.5	176.3	0	0	0	0	0	110.1	P429 P458 P460 N508	P429-A456 VanDerWaalsContact CA-CB 3.48Å; P429-A456 HydrophobicContact CB-CB 3.96Å; P429-A456 HydrophobicContact CG-CB 3.91Å; A456-P458 CarbonylContact C-O 3.55Å; A456-P458 WeakPolarHBondContact CB-O 3.49Å; A456-P460 HydrophobicContact CB-CB 4.35Å; A456-P460 HydrophobicContact CB-CG 4.08Å; A456-N508 WeakPolarHBondContact CB-ND2 3.49Å
457	E	91.3	Very high	91.1	Very high	65 Å²	65	33.3 Å²	33.3	30%	0.304	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	116.3	169.1	-173.4	63.7	-111.5	0	0	108.4	C382 S426 C427	C382-E457 HydrophobicContact CB-CB 3.83Å; S426-E457 CarbonylContact C-O 3.57Å; S426-E457 VanDerWaalsContact CA-O 3.23Å; S426-E457 WeakPolarHBondContact CA-O 3.35Å; S426-E457 VanDerWaalsContact CB-O 3.32Å; S426-E457 WeakPolarHBondContact CB-O 3.27Å; C427-E457 PolarHBondContact N-O 2.86Å; C427-E457 PolarHBondContact SG-N 3.33Å
458	P	92.9	Very high	90.7	Very high	61 Å²	61	32.6 Å²	32.6	40%	0.396	18%	0.177	S	C	.	.	S	Bend	cis	-59.6	153	-5.2	-22.2	34.5	0	0	0	113.5	A456 N508	A456-P458 CarbonylContact C-O 3.55Å; A456-P458 WeakPolarHBondContact CB-O 3.49Å; P458-N508 PolarHBondContact O-ND2 3.06Å
459	Y	90.3	Very high	90.4	Very high	96 Å²	96	35 Å²	35	38%	0.376	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-54.7	134	-179.7	-166.3	-91.6	0	0	0	111.3	P335	P335-Y459 HydrophobicContact CG-CE2 4.33Å
460	P	92.8	Very high	90.2	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.032	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-78.3	147.5	-171.8	30.6	-32.9	0	0	0	112.9	P429 A454 A456 A506 E507	P429-P460 HydrophobicContact CB-CB 3.91Å; P429-P460 HydrophobicContact CB-CG 4.28Å; P429-P460 HydrophobicContact CG-CB 3.82Å; A454-P460 HydrophobicContact CB-CG 4.02Å; A456-P460 HydrophobicContact CB-CB 4.35Å; A456-P460 HydrophobicContact CB-CG 4.08Å; P460-A506 HydrophobicContact CB-CB 4.23Å; P460-E507 CarbonylContact C-O 3.58Å; P460-E507 VanDerWaalsContact CA-O 3.28Å; P460-E507 WeakPolarHBondContact CA-O 3.26Å
461	E	91	Very high	90.1	Very high	98 Å²	98	41.1 Å²	41.1	46%	0.458	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.8	161	-170.6	-173.3	146.6	0	0	108.9	R471 A506 E507	E461-R471 IonicContact OE1-NH2 2.96Å; E461-R471 PolarHBondContact OE1-NH2 3.3Å; E461-R471 VanDerWaalsContact OE1-NH2 3.11Å; E461-A506 WeakPolarHBondContact O-CA 3.38Å; E461-E507 PolarHBondContact N-O 3.06Å; E461-E507 PolarHBondContact O-N 3.36Å
462	L	92.4	Very high	90.2	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.037	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	130.1	177.3	-69.7	169	0	0	0	110.2	A454 V505 A506	A454-L462 HydrophobicContact CB-CD2 3.99Å; L462-V505 WeakPolarHBondContact CA-O 3.13Å; L462-A506 HydrophobicContact CD2-CB 3.52Å
463	Y	92.1	Very high	89.8	Confident	27 Å²	27	39.3 Å²	39.3	11%	0.106	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	162.7	172.1	61.5	-90.4	0	0	0	111.3	V465 R471 L472 V505 E507	Y463-V465 HydrophobicContact CD2-CG2 4.29Å; Y463-V465 HydrophobicContact CE2-CG2 4.16Å; Y463-R471 HydrophobicContact CD2-CG 3.75Å; Y463-R471 HydrophobicContact CE2-CG 4.27Å; Y463-R471 HydrophobicContact CG-CG 4.3Å; Y463-L472 WeakPolarHBondContact CA-O 3.32Å; Y463-L472 WeakPolarHBondContact CB-O 3.28Å; Y463-V505 HydrophobicContact CD1-CB 4.3Å; Y463-V505 HydrophobicContact CD2-CB 3.95Å; Y463-V505 HydrophobicContact CD2-CG2 4.15Å; Y463-V505 HydrophobicContact CE1-CB 3.88Å; Y463-V505 HydrophobicContact CE1-CG1 3.79Å; Y463-V505 HydrophobicContact CE2-CB 3.49Å; Y463-V505 VanDerWaalsContact CE2-CB 3.49Å; Y463-V505 HydrophobicContact CE2-CG1 3.96Å; Y463-V505 HydrophobicContact CE2-CG2 3.57Å; Y463-V505 HydrophobicContact CG-CB 4.35Å; Y463-V505 VanDerWaalsContact CZ-CB 3.46Å; Y463-V505 VanDerWaalsContact CZ-CG1 3.41Å; Y463-V505 PolarHBondContact N-O 3.03Å; Y463-V505 PolarHBondContact O-N 3.36Å; Y463-V505 WeakPolarHBondContact OH-CG1 3.25Å; Y463-E507 HydrophobicContact CE1-CB 4.15Å; Y463-E507 WeakPolarHBondContact CE1-OE2 3.39Å; Y463-E507 PolarHBondContact OH-OE2 2.79Å
464	W	93.7	Very high	89	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.8	178	-79	87.7	0	0	0	111.2	L436 L450 C452 R471 L472 G487 L489 T503 C504 V517	L436-W464 HydrophobicContact CD1-CH2 3.7Å; L436-W464 HydrophobicContact CD1-CZ2 4.22Å; L436-W464 HydrophobicContact CD2-CH2 3.67Å; L436-W464 HydrophobicContact CD2-CZ2 4.1Å; L436-W464 HydrophobicContact CG-CH2 4.36Å; L450-W464 HydrophobicContact CB-CH2 3.86Å; L450-W464 HydrophobicContact CB-CZ2 3.79Å; L450-W464 HydrophobicContact CD1-CH2 4.08Å; L450-W464 HydrophobicContact CD1-CZ3 4.17Å; C452-W464 HydrophobicContact CB-CH2 4.48Å; C452-W464 HydrophobicContact CB-CZ2 3.58Å; W464-R471 CarbonylContact O-C 3.35Å; W464-R471 WeakPolarHBondContact O-CA 3.27Å; W464-L472 HydrophobicContact CB-CB 4.28Å; W464-L472 PolarHBondContact N-O 3.17Å; W464-L472 PolarHBondContact O-N 3.39Å; W464-G487 PolarHBondContact NE1-O 3Å; W464-L489 HydrophobicContact CB-CD2 4.08Å; W464-L489 HydrophobicContact CD2-CB 4.21Å; W464-L489 HydrophobicContact CD2-CD2 4.03Å; W464-L489 HydrophobicContact CE3-CD2 4.38Å; W464-L489 HydrophobicContact CG-CB 4.07Å; W464-L489 HydrophobicContact CG-CD2 3.93Å; W464-T503 CarbonylContact C-O 3.53Å; W464-T503 WeakPolarHBondContact CA-O 3.21Å; W464-T503 VanDerWaalsContact CE3-C 3.46Å; W464-C504 HydrophobicContact CD2-CB 4.01Å; W464-C504 HydrophobicContact CE3-CB 4Å; W464-C504 HydrophobicContact CH2-CB 3.8Å; W464-C504 HydrophobicContact CZ2-CB 3.81Å; W464-C504 HydrophobicContact CZ3-CB 3.88Å; W464-V517 HydrophobicContact CH2-CG1 4Å; W464-V517 HydrophobicContact CZ3-CG1 3.92Å
465	V	90.9	Very high	87.9	Confident	43 Å²	43	47.7 Å²	47.7	26%	0.261	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.9	168.8	-174.9	0	0	0	0	107.7	Y463 L470 Y502 T503 V505	Y463-V465 HydrophobicContact CD2-CG2 4.29Å; Y463-V465 HydrophobicContact CE2-CG2 4.16Å; V465-L470 WeakPolarHBondContact CA-O 3.37Å; V465-Y502 WeakPolarHBondContact O-CA 3.32Å; V465-T503 PolarHBondContact N-O 3.28Å; V465-T503 PolarHBondContact O-N 2.93Å; V465-V505 HydrophobicContact CG2-CG2 4.24Å
466	T	89.5	Confident	86.7	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.025	29%	0.29	C	S	.	.			trans	-76.8	167.7	177.7	65.8	0	0	0	0	111.6	S468 G469 L470 L472 Y481 Y502	T466-S468 PolarHBondContact O-N 3.46Å; T466-S468 VanDerWaalsContact O-N 3.11Å; T466-S468 PolarHBondContact OG1-OG 2.68Å; T466-G469 PolarHBondContact O-N 3.17Å; T466-L470 HydrophobicContact CG2-CB 4.19Å; T466-L470 PolarHBondContact N-O 3.33Å; T466-L470 VanDerWaalsContact OG1-CB 3.24Å; T466-L470 WeakPolarHBondContact OG1-CB 3.17Å; T466-L470 PolarHBondContact OG1-N 2.85Å; T466-L470 PolarHBondContact OG1-O 3.3Å; T466-L472 HydrophobicContact CG2-CD1 3.52Å; T466-L472 HydrophobicContact CG2-CG 3.89Å; T466-Y481 HydrophobicContact CG2-CE1 4.26Å; T466-Y502 HydrophobicContact CG2-CE1 4.09Å
467	P	86.1	Confident	85.3	Confident	55 Å²	55	59 Å²	59	36%	0.357	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.7	176.2	-24.7	32.9	0	0	0	114.3	G469 L501 Y502	P467-G469 VanDerWaalsContact C-N 3.28Å; P467-L501 WeakPolarHBondContact CA-O 3.39Å; P467-L501 WeakPolarHBondContact CG-O 3.25Å; P467-Y502 VanDerWaalsContact CD-CZ 3.42Å; P467-Y502 HydrophobicContact CG-CD2 3.89Å; P467-Y502 HydrophobicContact CG-CE2 3.53Å
468	S	82.8	Confident	84.5	Confident	103 Å²	103	59.9 Å²	59.9	72%	0.72	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	1.7	176.6	71.3	0	0	0	0	113.6	T466	T466-S468 PolarHBondContact O-N 3.46Å; T466-S468 VanDerWaalsContact O-N 3.11Å; T466-S468 PolarHBondContact OG1-OG 2.68Å
469	G	83.5	Confident	83.4	Confident	55 Å²	55	67.9 Å²	67.9	57%	0.567	36%	0.364	S	S	*	.			trans	82.8	5.2	-176.3	0	0	0	0	0	114.9	T466 P467 R471	T466-G469 PolarHBondContact O-N 3.17Å; P467-G469 VanDerWaalsContact C-N 3.28Å; G469-R471 PolarHBondContact O-N 3.44Å
470	L	85.7	Confident	83.1	Confident	59 Å²	59	66.1 Å²	66.1	31%	0.309	36%	0.359	S	S	.	.			trans	-68.6	125.6	176.3	-179.1	67.9	0	0	0	110.2	V465 T466 L472 F478	V465-L470 WeakPolarHBondContact CA-O 3.37Å; T466-L470 HydrophobicContact CG2-CB 4.19Å; T466-L470 PolarHBondContact N-O 3.33Å; T466-L470 VanDerWaalsContact OG1-CB 3.24Å; T466-L470 WeakPolarHBondContact OG1-CB 3.17Å; T466-L470 PolarHBondContact OG1-N 2.85Å; T466-L470 PolarHBondContact OG1-O 3.3Å; L470-L472 HydrophobicContact CD2-CD2 3.72Å; L470-L472 HydrophobicContact CG-CD2 4.03Å; L470-F478 HydrophobicContact CD1-CE1 4.43Å; L470-F478 HydrophobicContact CD1-CE2 4.49Å; L470-F478 HydrophobicContact CD1-CZ 3.87Å; L470-F478 HydrophobicContact CD2-CE1 4.16Å; L470-F478 HydrophobicContact CD2-CE2 4.2Å; L470-F478 HydrophobicContact CD2-CZ 3.98Å; L470-F478 HydrophobicContact CG-CZ 4.29Å
471	R	89.8	Confident	82.9	Confident	123 Å²	123	67.9 Å²	67.9	46%	0.464	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	118.6	171.2	-179.7	175.6	173.6	173.2	-3.3	110.2	E461 Y463 W464 G469	E461-R471 IonicContact OE1-NH2 2.96Å; E461-R471 PolarHBondContact OE1-NH2 3.3Å; E461-R471 VanDerWaalsContact OE1-NH2 3.11Å; Y463-R471 HydrophobicContact CD2-CG 3.75Å; Y463-R471 HydrophobicContact CE2-CG 4.27Å; Y463-R471 HydrophobicContact CG-CG 4.3Å; W464-R471 CarbonylContact O-C 3.35Å; W464-R471 WeakPolarHBondContact O-CA 3.27Å; G469-R471 PolarHBondContact O-N 3.44Å
472	L	90	Very high	82.7	Confident	4 Å²	4	69 Å²	69	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	100.5	175	-58.2	177	0	0	0	108.2	Y463 W464 T466 L470 F478 Y481 L483 L489	Y463-L472 WeakPolarHBondContact CA-O 3.32Å; Y463-L472 WeakPolarHBondContact CB-O 3.28Å; W464-L472 HydrophobicContact CB-CB 4.28Å; W464-L472 PolarHBondContact N-O 3.17Å; W464-L472 PolarHBondContact O-N 3.39Å; T466-L472 HydrophobicContact CG2-CD1 3.52Å; T466-L472 HydrophobicContact CG2-CG 3.89Å; L470-L472 HydrophobicContact CD2-CD2 3.72Å; L470-L472 HydrophobicContact CG-CD2 4.03Å; L472-F478 HydrophobicContact CD2-CD2 3.41Å; L472-F478 VanDerWaalsContact CD2-CD2 3.41Å; L472-F478 HydrophobicContact CD2-CE2 3.53Å; L472-F478 HydrophobicContact CD2-CG 4.31Å; L472-Y481 HydrophobicContact CD1-CD1 3.59Å; L472-Y481 HydrophobicContact CD1-CE1 4.21Å; L472-Y481 HydrophobicContact CD1-CG 3.78Å; L472-Y481 HydrophobicContact CD2-CD2 4.26Å; L472-Y481 HydrophobicContact CD2-CG 4.16Å; L472-L483 WeakPolarHBondContact O-CD2 3.3Å; L472-L489 HydrophobicContact CD1-CD1 3.7Å; L472-L489 HydrophobicContact CD1-CD2 4.23Å
473	G	84.2	Confident	82.5	Confident	12 Å²	12	69.8 Å²	69.8	12%	0.124	38%	0.375	C	S	.	.			trans	-98	167.8	172	0	0	0	0	0	112.1	S475 A476	G473-S475 PolarHBondContact O-N 2.91Å; G473-S475 VanDerWaalsContact O-N 3.15Å; G473-A476 WeakPolarHBondContact O-CB 3.28Å; G473-A476 PolarHBondContact O-N 2.7Å
474	P	72.9	Confident	82.1	Confident	61 Å²	61	71.4 Å²	71.4	40%	0.396	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.9	-177.5	-22.9	32.2	0	0	0	113.7
475	S	70.9	Confident	81.4	Confident	115 Å²	115	76.4 Å²	76.4	80%	0.804	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-2.7	-179.1	-50.5	0	0	0	0	113.9	G473 F477	G473-S475 PolarHBondContact O-N 2.91Å; G473-S475 VanDerWaalsContact O-N 3.15Å; S475-F477 PolarHBondContact O-N 2.66Å
476	A	66.3	Low	80.9	Confident	40 Å²	40	75.8 Å²	75.8	33%	0.331	41%	0.41	S	S	.	.			trans	-88.9	108	-175.7	0	0	0	0	0	110.7	G473 F478	G473-A476 WeakPolarHBondContact O-CB 3.28Å; G473-A476 PolarHBondContact O-N 2.7Å; A476-F478 HydrophobicContact CB-CD2 4.04Å; A476-F478 HydrophobicContact CB-CE2 3.6Å; A476-F478 PolarHBondContact O-N 3.02Å
477	F	62.3	Low	80.8	Confident	205 Å²	205	75.6 Å²	75.6	90%	0.899	41%	0.409	S	S	*	.			trans	-84.4	101.8	177.6	-90.8	-89.2	0	0	0	111.5	S475	S475-F477 PolarHBondContact O-N 2.66Å
478	F	73.9	Confident	80.9	Confident	84 Å²	84	73 Å²	73	37%	0.368	39%	0.392	S	S	.	.			trans	-114	128.3	166.6	-62.5	-78.8	0	0	0	109	L470 L472 A476 H480 Y481	L470-F478 HydrophobicContact CD1-CE1 4.43Å; L470-F478 HydrophobicContact CD1-CE2 4.49Å; L470-F478 HydrophobicContact CD1-CZ 3.87Å; L470-F478 HydrophobicContact CD2-CE1 4.16Å; L470-F478 HydrophobicContact CD2-CE2 4.2Å; L470-F478 HydrophobicContact CD2-CZ 3.98Å; L470-F478 HydrophobicContact CG-CZ 4.29Å; L472-F478 HydrophobicContact CD2-CD2 3.41Å; L472-F478 VanDerWaalsContact CD2-CD2 3.41Å; L472-F478 HydrophobicContact CD2-CE2 3.53Å; L472-F478 HydrophobicContact CD2-CG 4.31Å; A476-F478 HydrophobicContact CB-CD2 4.04Å; A476-F478 HydrophobicContact CB-CE2 3.6Å; A476-F478 PolarHBondContact O-N 3.02Å; F478-H480 PolarHBondContact O-N 3Å; F478-Y481 HydrophobicContact CB-CD2 3.95Å; F478-Y481 HydrophobicContact CG-CD2 4.47Å; F478-Y481 PolarHBondContact O-N 3.47Å
479	K	71	Confident	81.3	Confident	229 Å²	229	68.1 Å²	68.1	100%	0.996	36%	0.358	S	S	*	.	S	Bend	trans	-57.4	-21.8	-178.1	-77.3	-175.7	176.9	178.8	0	114.3
480	H	84.1	Confident	81.7	Confident	59 Å²	59	66.7 Å²	66.7	27%	0.273	34%	0.337	S	S	.	.	S	Bend	trans	-99.8	-26.8	-174.6	-169	66	0	0	0	114.1	F478 I491 S492 E498	F478-H480 PolarHBondContact O-N 3Å; H480-I491 WeakPolarHBondContact NE2-CG2 3.34Å; H480-S492 PolarHBondContact CE1-O 2.82Å; H480-S492 PolarHBondContact ND1-O 2.8Å; H480-E498 IonicContact CD2-OE1 2.83Å; H480-E498 IonicContact CD2-OE2 2.84Å; H480-E498 IonicContact CE1-OE1 2.76Å; H480-E498 IonicContact CE1-OE2 3.59Å; H480-E498 IonicContact NE2-OE1 3.41Å; H480-E498 PolarHBondContact NE2-OE1 3.47Å; H480-E498 IonicContact NE2-OE2 2.86Å; H480-E498 PolarHBondContact NE2-OE2 3.16Å
481	Y	87.6	Confident	82	Confident	43 Å²	43	63.9 Å²	63.9	17%	0.169	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.1	-176.8	-58.4	-87.1	0	0	0	109.4	T466 L472 F478 L489 I491	T466-Y481 HydrophobicContact CG2-CE1 4.26Å; L472-Y481 HydrophobicContact CD1-CD1 3.59Å; L472-Y481 HydrophobicContact CD1-CE1 4.21Å; L472-Y481 HydrophobicContact CD1-CG 3.78Å; L472-Y481 HydrophobicContact CD2-CD2 4.26Å; L472-Y481 HydrophobicContact CD2-CG 4.16Å; F478-Y481 HydrophobicContact CB-CD2 3.95Å; F478-Y481 HydrophobicContact CG-CD2 4.47Å; F478-Y481 PolarHBondContact O-N 3.47Å; Y481-L489 HydrophobicContact CD1-CD1 4.32Å; Y481-I491 HydrophobicContact CD1-CD1 3.9Å; Y481-I491 HydrophobicContact CD1-CG1 3.86Å; Y481-I491 HydrophobicContact CD1-CG2 4.37Å; Y481-I491 HydrophobicContact CE1-CD1 3.73Å; Y481-I491 HydrophobicContact CE1-CG1 4.16Å; Y481-I491 HydrophobicContact CE1-CG2 4.32Å
482	Q	87.8	Confident	82.1	Confident	121 Å²	121	60.8 Å²	60.8	57%	0.565	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	111.6	174.4	-177.1	173.5	1.1	0	0	108.8	E490	Q482-E490 HydrophobicContact CB-CB 4.32Å; Q482-E490 PolarHBondContact N-O 2.9Å; Q482-E490 PolarHBondContact O-N 3.19Å
483	L	87.4	Confident	82	Confident	24 Å²	24	70 Å²	70	13%	0.126	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119.3	172.4	-178.7	58.3	0	0	0	109.1	L472 T488 L489	L472-L483 WeakPolarHBondContact O-CD2 3.3Å; L483-T488 WeakPolarHBondContact CA-O 3.43Å; L483-T488 WeakPolarHBondContact CD1-O 3.23Å; L483-L489 HydrophobicContact CD1-CB 4.4Å
484	Q	83.6	Confident	82.3	Confident	60 Å²	60	69.5 Å²	69.5	28%	0.28	35%	0.348	S	S	.	.			trans	-76.8	147.3	172.5	-51.3	-157.8	47.5	0	0	110	E486 G487 T488 E490	Q484-E486 HydrophobicContact CB-CG 4.17Å; Q484-E486 VanDerWaalsContact CB-OE1 3.27Å; Q484-E486 WeakPolarHBondContact CB-OE1 3.38Å; Q484-E486 WeakPolarHBondContact CB-OE2 3.44Å; Q484-E486 VanDerWaalsContact CD-OE1 3.28Å; Q484-E486 PolarHBondContact O-N 3.15Å; Q484-E486 PolarHBondContact OE1-OE1 3.33Å; Q484-G487 PolarHBondContact O-N 3.25Å; Q484-T488 PolarHBondContact N-O 3.25Å; Q484-E490 PolarHBondContact NE2-OE1 3.28Å
485	P	79.8	Confident	83.1	Confident	106 Å²	106	68.2 Å²	68.2	69%	0.688	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-29.3	-178.7	-27.4	35.2	0	0	0	114.5	G487	P485-G487 PolarHBondContact O-N 2.8Å
486	E	79.4	Confident	83.9	Confident	29 Å²	29	65.5 Å²	65.5	14%	0.136	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	0.1	177	64.2	-92	-158.7	0	0	114.6	C452 R453 Q484	C452-E486 VanDerWaalsContact O-O 3.07Å; R453-E486 VanDerWaalsContact NH1-C 3.29Å; R453-E486 PolarHBondContact NH1-O 2.79Å; Q484-E486 HydrophobicContact CB-CG 4.17Å; Q484-E486 VanDerWaalsContact CB-OE1 3.27Å; Q484-E486 WeakPolarHBondContact CB-OE1 3.38Å; Q484-E486 WeakPolarHBondContact CB-OE2 3.44Å; Q484-E486 VanDerWaalsContact CD-OE1 3.28Å; Q484-E486 PolarHBondContact O-N 3.15Å; Q484-E486 PolarHBondContact OE1-OE1 3.33Å
487	G	87.1	Confident	84.7	Confident	0 Å²	0	75 Å²	75	0%	0	35%	0.347	C	S	.	.	S	Bend	trans	97.2	9.3	175.7	0	0	0	0	0	116.1	C452 W464 Q484 P485	C452-G487 PolarHBondContact N-O 2.76Å; W464-G487 PolarHBondContact NE1-O 3Å; Q484-G487 PolarHBondContact O-N 3.25Å; P485-G487 PolarHBondContact O-N 2.8Å
488	T	89.1	Confident	85.9	Confident	1 Å²	1	66 Å²	66	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118.7	175.1	-65.8	0	0	0	0	111.1	V449 L450 H451 R453 L483 Q484 E490	V449-T488 HydrophobicContact CG1-CG2 3.54Å; L450-T488 CarbonylContact O-C 3.37Å; L450-T488 WeakPolarHBondContact O-CA 3.28Å; H451-T488 WeakPolarHBondContact ND1-CG2 3.44Å; H451-T488 PolarHBondContact ND1-OG1 2.97Å; R453-T488 VanDerWaalsContact CZ-OG1 3.28Å; R453-T488 PolarHBondContact NH1-OG1 2.97Å; R453-T488 PolarHBondContact NH2-OG1 2.95Å; L483-T488 WeakPolarHBondContact CA-O 3.43Å; L483-T488 WeakPolarHBondContact CD1-O 3.23Å; Q484-T488 PolarHBondContact N-O 3.25Å; T488-E490 HydrophobicContact CG2-CG 4.13Å
489	L	91.6	Very high	86.5	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	120.7	173.6	176.7	63	0	0	0	110.1	V449 L450 W464 L472 Y481 L483 I491 Y502	V449-L489 WeakPolarHBondContact CA-O 3.49Å; L450-L489 HydrophobicContact CB-CB 4.4Å; L450-L489 HydrophobicContact CD1-CD2 4.48Å; L450-L489 PolarHBondContact N-O 3.16Å; L450-L489 PolarHBondContact O-N 3.47Å; W464-L489 HydrophobicContact CB-CD2 4.08Å; W464-L489 HydrophobicContact CD2-CB 4.21Å; W464-L489 HydrophobicContact CD2-CD2 4.03Å; W464-L489 HydrophobicContact CE3-CD2 4.38Å; W464-L489 HydrophobicContact CG-CB 4.07Å; W464-L489 HydrophobicContact CG-CD2 3.93Å; L472-L489 HydrophobicContact CD1-CD1 3.7Å; L472-L489 HydrophobicContact CD1-CD2 4.23Å; Y481-L489 HydrophobicContact CD1-CD1 4.32Å; L483-L489 HydrophobicContact CD1-CB 4.4Å; L489-I491 HydrophobicContact CD1-CG1 4.48Å; L489-I491 HydrophobicContact CD2-CD1 4.31Å; L489-I491 HydrophobicContact CD2-CG1 4.49Å; L489-I491 HydrophobicContact CG-CG1 4.17Å; L489-Y502 HydrophobicContact CD2-CD1 3.88Å; L489-Y502 HydrophobicContact CD2-CE1 4.13Å
490	E	91.6	Very high	87.1	Confident	25 Å²	25	54.1 Å²	54.1	12%	0.117	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.9	172.7	-57.2	-168.2	-177.8	0	0	110.8	K447 L448 V449 Q482 Q484 T488	K447-E490 WeakPolarHBondContact CE-OE2 3.34Å; K447-E490 IonicContact NZ-OE1 3.63Å; K447-E490 IonicContact NZ-OE2 3.59Å; K447-E490 PolarHBondContact NZ-OE2 2.97Å; L448-E490 WeakPolarHBondContact O-CA 3.26Å; V449-E490 HydrophobicContact CG1-CG 4.27Å; V449-E490 HydrophobicContact CG2-CG 4.26Å; Q482-E490 HydrophobicContact CB-CB 4.32Å; Q482-E490 PolarHBondContact N-O 2.9Å; Q482-E490 PolarHBondContact O-N 3.19Å; Q484-E490 PolarHBondContact NE2-OE1 3.28Å; T488-E490 HydrophobicContact CG2-CG 4.13Å
491	I	91.9	Very high	87.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	120.1	175.6	-44.9	-176.8	0	0	0	107.7	K447 L448 H480 Y481 L489 E498 Y502	K447-I491 WeakPolarHBondContact CA-O 3.45Å; L448-I491 HydrophobicContact CB-CB 4.26Å; L448-I491 HydrophobicContact CD2-CD1 3.87Å; L448-I491 HydrophobicContact CD2-CG1 4.4Å; L448-I491 PolarHBondContact N-O 3.04Å; L448-I491 PolarHBondContact O-N 2.92Å; H480-I491 WeakPolarHBondContact NE2-CG2 3.34Å; Y481-I491 HydrophobicContact CD1-CD1 3.9Å; Y481-I491 HydrophobicContact CD1-CG1 3.86Å; Y481-I491 HydrophobicContact CD1-CG2 4.37Å; Y481-I491 HydrophobicContact CE1-CD1 3.73Å; Y481-I491 HydrophobicContact CE1-CG1 4.16Å; Y481-I491 HydrophobicContact CE1-CG2 4.32Å; L489-I491 HydrophobicContact CD1-CG1 4.48Å; L489-I491 HydrophobicContact CD2-CD1 4.31Å; L489-I491 HydrophobicContact CD2-CG1 4.49Å; L489-I491 HydrophobicContact CG-CG1 4.17Å; I491-E498 WeakPolarHBondContact CG2-OE2 3.49Å; I491-Y502 HydrophobicContact CD1-CE1 3.82Å
492	S	90.9	Very high	87.4	Confident	57 Å²	57	52.2 Å²	52.2	40%	0.399	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.8	-178.1	-67	0	0	0	0	110.8	H480	H480-S492 PolarHBondContact CE1-O 2.82Å; H480-S492 PolarHBondContact ND1-O 2.8Å
493	R	89.4	Confident	87.6	Confident	199 Å²	199	47.9 Å²	47.9	75%	0.751	25%	0.247	S	C	*	.	S	Bend	trans	60.2	57.4	-177.5	-59	-178.7	-71.3	-155.5	-4.1	112.2	G445 G446 S495	G445-R493 WeakPolarHBondContact O-CA 3.35Å; G446-R493 WeakPolarHBondContact O-CA 3.3Å; G446-R493 PolarHBondContact O-N 2.97Å; R493-S495 PolarHBondContact O-N 2.64Å
494	I	90.4	Very high	87.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.241	C	C	.	.			trans	-59.6	133.2	-176.4	-163.9	170.9	0	0	0	111.8	V442 Q443 G445 G446 L448 E498 V519 V521	V442-I494 HydrophobicContact CB-CD1 4.47Å; V442-I494 HydrophobicContact CB-CG2 4.13Å; V442-I494 HydrophobicContact CG1-CG2 3.68Å; Q443-I494 WeakPolarHBondContact O-CG2 3.28Å; G445-I494 PolarHBondContact N-O 3.03Å; G446-I494 PolarHBondContact O-N 2.97Å; L448-I494 HydrophobicContact CB-CD1 3.93Å; L448-I494 HydrophobicContact CD2-CD1 3.93Å; L448-I494 HydrophobicContact CG-CD1 4.48Å; I494-E498 VanDerWaalsContact CA-OE2 3.27Å; I494-E498 WeakPolarHBondContact CA-OE2 3.29Å; I494-E498 HydrophobicContact CD1-CB 4.42Å; I494-E498 HydrophobicContact CG1-CB 3.87Å; I494-E498 VanDerWaalsContact CG1-OE2 3.27Å; I494-E498 WeakPolarHBondContact CG1-OE2 3.38Å; I494-V519 HydrophobicContact CD1-CG1 3.79Å; I494-V521 HydrophobicContact CD1-CG2 3.69Å; I494-V521 HydrophobicContact CG1-CG2 3.8Å; I494-V521 HydrophobicContact CG2-CG1 4.37Å; I494-V521 HydrophobicContact CG2-CG2 4.43Å
495	S	88.8	Confident	88.3	Confident	33 Å²	33	44.4 Å²	44.4	23%	0.231	23%	0.23	C	C	.	.			trans	-107.6	161	177.9	74.8	0	0	0	0	112	R493 R497 E498	R493-S495 PolarHBondContact O-N 2.64Å; S495-R497 PolarHBondContact O-N 3.32Å; S495-E498 PolarHBondContact N-OE1 3.05Å; S495-E498 PolarHBondContact N-OE2 3.31Å; S495-E498 WeakPolarHBondContact O-CB 3.42Å; S495-E498 PolarHBondContact O-N 3.48Å; S495-E498 PolarHBondContact OG-OE1 3.25Å
496	P	87.1	Confident	89	Confident	59 Å²	59	39.3 Å²	39.3	38%	0.383	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-57.6	-21	175.8	-26.6	36.1	0	0	0	114.4	E444 E498 A499 V521	E444-P496 WeakPolarHBondContact OE1-CD 3.33Å; P496-E498 PolarHBondContact O-N 3.02Å; P496-A499 WeakPolarHBondContact O-CB 2.93Å; P496-A499 PolarHBondContact O-N 2.92Å; P496-V521 HydrophobicContact CG-CG1 4.36Å
497	R	84.9	Confident	89.5	Confident	238 Å²	238	41.7 Å²	41.7	90%	0.898	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-70.5	-19.4	176	-60.9	-177.1	178.3	-140.3	-0.8	113.3	S495 A499	S495-R497 PolarHBondContact O-N 3.32Å; R497-A499 VanDerWaalsContact C-N 3.35Å
498	E	86.6	Confident	89.8	Confident	18 Å²	18	42.5 Å²	42.5	8%	0.084	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-91.6	-0.3	178.4	-72.8	144.6	-126.2	0	0	112.5	H480 I491 I494 S495 P496 Y502	H480-E498 IonicContact CD2-OE1 2.83Å; H480-E498 IonicContact CD2-OE2 2.84Å; H480-E498 IonicContact CE1-OE1 2.76Å; H480-E498 IonicContact CE1-OE2 3.59Å; H480-E498 IonicContact NE2-OE1 3.41Å; H480-E498 PolarHBondContact NE2-OE1 3.47Å; H480-E498 IonicContact NE2-OE2 2.86Å; H480-E498 PolarHBondContact NE2-OE2 3.16Å; I491-E498 WeakPolarHBondContact CG2-OE2 3.49Å; I494-E498 VanDerWaalsContact CA-OE2 3.27Å; I494-E498 WeakPolarHBondContact CA-OE2 3.29Å; I494-E498 HydrophobicContact CD1-CB 4.42Å; I494-E498 HydrophobicContact CG1-CB 3.87Å; I494-E498 VanDerWaalsContact CG1-OE2 3.27Å; I494-E498 WeakPolarHBondContact CG1-OE2 3.38Å; S495-E498 PolarHBondContact N-OE1 3.05Å; S495-E498 PolarHBondContact N-OE2 3.31Å; S495-E498 WeakPolarHBondContact O-CB 3.42Å; S495-E498 PolarHBondContact O-N 3.48Å; S495-E498 PolarHBondContact OG-OE1 3.25Å; P496-E498 PolarHBondContact O-N 3.02Å; E498-Y502 WeakPolarHBondContact CB-OH 3.37Å; E498-Y502 WeakPolarHBondContact O-CE2 3.33Å; E498-Y502 PolarHBondContact O-OH 2.7Å
499	A	85.9	Confident	89.8	Confident	39 Å²	39	47.3 Å²	47.3	32%	0.322	25%	0.253	S	S	.	.			trans	-67	145.3	171.9	0	0	0	0	0	110.8	P496 R497 V519 V521	P496-A499 WeakPolarHBondContact O-CB 2.93Å; P496-A499 PolarHBondContact O-N 2.92Å; R497-A499 VanDerWaalsContact C-N 3.35Å; A499-V519 WeakPolarHBondContact CA-O 3.49Å; A499-V521 HydrophobicContact CB-CB 4.46Å; A499-V521 HydrophobicContact CB-CG2 4.14Å
500	G	84.6	Confident	89.7	Confident	24 Å²	24	51.1 Å²	51.1	25%	0.247	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.6	-164	177.5	0	0	0	0	0	113.4	V519	G500-V519 PolarHBondContact N-O 3.37Å; G500-V519 PolarHBondContact O-N 2.99Å
501	L	87.4	Confident	89.6	Confident	61 Å²	61	51.2 Å²	51.2	32%	0.319	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	120.2	-176.1	-169.1	69	0	0	0	111.1	P467	P467-L501 WeakPolarHBondContact CA-O 3.39Å; P467-L501 WeakPolarHBondContact CG-O 3.25Å
502	Y	90.7	Very high	89.4	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.7	168.9	-70.9	-103.3	0	0	0	108.9	L450 V465 T466 P467 L489 I491 E498 S516 V517 V519	L450-Y502 HydrophobicContact CD1-CG 4.22Å; V465-Y502 WeakPolarHBondContact O-CA 3.32Å; T466-Y502 HydrophobicContact CG2-CE1 4.09Å; P467-Y502 VanDerWaalsContact CD-CZ 3.42Å; P467-Y502 HydrophobicContact CG-CD2 3.89Å; P467-Y502 HydrophobicContact CG-CE2 3.53Å; L489-Y502 HydrophobicContact CD2-CD1 3.88Å; L489-Y502 HydrophobicContact CD2-CE1 4.13Å; I491-Y502 HydrophobicContact CD1-CE1 3.82Å; E498-Y502 WeakPolarHBondContact CB-OH 3.37Å; E498-Y502 WeakPolarHBondContact O-CE2 3.33Å; E498-Y502 PolarHBondContact O-OH 2.7Å; Y502-S516 CarbonylContact O-C 3.53Å; Y502-S516 WeakPolarHBondContact O-CA 3.36Å; Y502-S516 WeakPolarHBondContact O-CB 3.36Å; Y502-V517 PolarHBondContact N-O 3.34Å; Y502-V517 PolarHBondContact O-N 3.33Å; Y502-V519 HydrophobicContact CD2-CB 3.98Å; Y502-V519 HydrophobicContact CD2-CG2 3.48Å; Y502-V519 VanDerWaalsContact CD2-CG2 3.48Å; Y502-V519 HydrophobicContact CE2-CB 3.84Å; Y502-V519 HydrophobicContact CE2-CG1 4.48Å; Y502-V519 HydrophobicContact CE2-CG2 3.72Å; Y502-V519 HydrophobicContact CG-CG2 4.41Å
503	T	91.8	Very high	89.3	Confident	29 Å²	29	53.6 Å²	53.6	18%	0.178	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.1	178.1	-56.5	0	0	0	0	109.5	W464 V465 V505 S516	W464-T503 CarbonylContact C-O 3.53Å; W464-T503 WeakPolarHBondContact CA-O 3.21Å; W464-T503 VanDerWaalsContact CE3-C 3.46Å; V465-T503 PolarHBondContact N-O 3.28Å; V465-T503 PolarHBondContact O-N 2.93Å; T503-V505 HydrophobicContact CG2-CG2 4.2Å; T503-S516 WeakPolarHBondContact CB-OG 3.31Å; T503-S516 WeakPolarHBondContact CG2-OG 3.41Å; T503-S516 PolarHBondContact OG1-OG 3.29Å
504	C	94.3	Very high	89.3	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.7	165	179.6	0	0	0	0	109.2	I431 L436 C452 W464 T514 H515	I431-C504 HydrophobicContact CD1-CB 4.41Å; L436-C504 HydrophobicContact CD1-CB 3.98Å; C452-C504 HydrophobicContact CB-CB 3.59Å; C452-C504 WeakPolarHBondContact CB-SG 3.5Å; C452-C504 WeakPolarHBondContact SG-CB 3.41Å; C452-C504 CovalentContact SG-SG 2Å; C452-C504 PolarHBondContact SG-SG 2.87Å; W464-C504 HydrophobicContact CD2-CB 4.01Å; W464-C504 HydrophobicContact CE3-CB 4Å; W464-C504 HydrophobicContact CH2-CB 3.8Å; W464-C504 HydrophobicContact CZ2-CB 3.81Å; W464-C504 HydrophobicContact CZ3-CB 3.88Å; C504-T514 CarbonylContact O-C 3.52Å; C504-T514 VanDerWaalsContact O-CA 3.26Å; C504-T514 WeakPolarHBondContact O-CA 3.4Å; C504-H515 PolarHBondContact N-O 3.14Å; C504-H515 PolarHBondContact O-N 3.3Å
505	V	92.1	Very high	89.2	Confident	11 Å²	11	50 Å²	50	7%	0.067	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.8	173.6	-172.6	0	0	0	0	108.8	L462 Y463 V465 T503 A512 T514	L462-V505 WeakPolarHBondContact CA-O 3.13Å; Y463-V505 HydrophobicContact CD1-CB 4.3Å; Y463-V505 HydrophobicContact CD2-CB 3.95Å; Y463-V505 HydrophobicContact CD2-CG2 4.15Å; Y463-V505 HydrophobicContact CE1-CB 3.88Å; Y463-V505 HydrophobicContact CE1-CG1 3.79Å; Y463-V505 HydrophobicContact CE2-CB 3.49Å; Y463-V505 VanDerWaalsContact CE2-CB 3.49Å; Y463-V505 HydrophobicContact CE2-CG1 3.96Å; Y463-V505 HydrophobicContact CE2-CG2 3.57Å; Y463-V505 HydrophobicContact CG-CB 4.35Å; Y463-V505 VanDerWaalsContact CZ-CB 3.46Å; Y463-V505 VanDerWaalsContact CZ-CG1 3.41Å; Y463-V505 PolarHBondContact N-O 3.03Å; Y463-V505 PolarHBondContact O-N 3.36Å; Y463-V505 WeakPolarHBondContact OH-CG1 3.25Å; V465-V505 HydrophobicContact CG2-CG2 4.24Å; T503-V505 HydrophobicContact CG2-CG2 4.2Å; V505-A512 HydrophobicContact CG1-CB 4.08Å; V505-T514 HydrophobicContact CB-CG2 4.3Å; V505-T514 HydrophobicContact CG1-CG2 3.96Å; V505-T514 HydrophobicContact CG2-CG2 3.92Å
506	A	93.6	Very high	89.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.8	171.1	0	0	0	0	0	108.3	P429 I431 A454 P460 E461 L462 A512 D513	P429-A506 HydrophobicContact CB-CB 3.77Å; P429-A506 WeakPolarHBondContact CB-O 3.39Å; P429-A506 WeakPolarHBondContact CG-O 2.91Å; I431-A506 HydrophobicContact CD1-CB 3.96Å; I431-A506 HydrophobicContact CG1-CB 3.85Å; A454-A506 HydrophobicContact CB-CB 3.54Å; P460-A506 HydrophobicContact CB-CB 4.23Å; E461-A506 WeakPolarHBondContact O-CA 3.38Å; L462-A506 HydrophobicContact CD2-CB 3.52Å; A506-A512 CarbonylContact O-C 3.13Å; A506-A512 WeakPolarHBondContact O-CA 3.36Å; A506-A512 WeakPolarHBondContact O-CB 3.28Å; A506-D513 PolarHBondContact N-O 3.4Å; A506-D513 PolarHBondContact O-N 2.86Å
507	E	90.7	Very high	89.3	Confident	78 Å²	78	47.6 Å²	47.6	36%	0.364	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.5	-171.3	-177	173.3	-179.8	0	0	111	P460 E461 Y463 A512	P460-E507 CarbonylContact C-O 3.58Å; P460-E507 VanDerWaalsContact CA-O 3.28Å; P460-E507 WeakPolarHBondContact CA-O 3.26Å; E461-E507 PolarHBondContact N-O 3.06Å; E461-E507 PolarHBondContact O-N 3.36Å; Y463-E507 HydrophobicContact CE1-CB 4.15Å; Y463-E507 WeakPolarHBondContact CE1-OE2 3.39Å; Y463-E507 PolarHBondContact OH-OE2 2.79Å; E507-A512 HydrophobicContact CB-CB 3.96Å; E507-A512 HydrophobicContact CG-CB 4.1Å
508	N	91.9	Very high	89.4	Confident	18 Å²	18	38.3 Å²	38.3	10%	0.096	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	-176.7	168.2	76.8	2.8	0	0	0	110.3	C427 P429 A456 P458 L510 G511	C427-N508 PolarHBondContact O-ND2 3.23Å; P429-N508 WeakPolarHBondContact CD-OD1 3.27Å; P429-N508 HydrophobicContact CG-CB 4.02Å; A456-N508 WeakPolarHBondContact CB-ND2 3.49Å; P458-N508 PolarHBondContact O-ND2 3.06Å; N508-L510 PolarHBondContact O-N 2.78Å; N508-L510 WeakPolarHBondContact OD1-CB 3.06Å; N508-L510 PolarHBondContact OD1-N 3.26Å; N508-G511 PolarHBondContact N-O 2.77Å; N508-G511 PolarHBondContact O-N 3.49Å; N508-G511 VanDerWaalsContact O-N 3.09Å; N508-G511 PolarHBondContact OD1-N 3.23Å; N508-G511 PolarHBondContact OD1-O 3.25Å
509	A	89.6	Confident	89.6	Confident	101 Å²	101	37.6 Å²	37.6	84%	0.835	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.5	-177.4	0	0	0	0	0	115
510	L	89.1	Confident	89.6	Confident	82 Å²	82	36.3 Å²	36.3	43%	0.429	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-22.2	178.8	-64.1	103.9	0	0	0	113	L428 N508	L428-L510 VanDerWaalsContact CD2-C 3.47Å; L428-L510 HydrophobicContact CD2-CB 3.84Å; L428-L510 WeakPolarHBondContact CD2-O 3.49Å; L428-L510 HydrophobicContact CG-CB 4.46Å; N508-L510 PolarHBondContact O-N 2.78Å; N508-L510 WeakPolarHBondContact OD1-CB 3.06Å; N508-L510 PolarHBondContact OD1-N 3.26Å
511	G	90.2	Very high	89.9	Confident	27 Å²	27	36.3 Å²	36.3	28%	0.278	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	152.2	-163.3	-177.4	0	0	0	0	0	112.4	N508	N508-G511 PolarHBondContact N-O 2.77Å; N508-G511 PolarHBondContact O-N 3.49Å; N508-G511 VanDerWaalsContact O-N 3.09Å; N508-G511 PolarHBondContact OD1-N 3.23Å; N508-G511 PolarHBondContact OD1-O 3.25Å
512	A	87.7	Confident	89.9	Confident	55 Å²	55	38 Å²	38	46%	0.455	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	152	-175.9	0	0	0	0	0	112.5	V505 A506 E507	V505-A512 HydrophobicContact CG1-CB 4.08Å; A506-A512 CarbonylContact O-C 3.13Å; A506-A512 WeakPolarHBondContact O-CA 3.36Å; A506-A512 WeakPolarHBondContact O-CB 3.28Å; E507-A512 HydrophobicContact CB-CB 3.96Å; E507-A512 HydrophobicContact CG-CB 4.1Å
513	D	88.7	Confident	89.5	Confident	51 Å²	51	42.7 Å²	42.7	27%	0.273	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	148.7	166.5	-171.8	23.6	0	0	0	109.6	P429 T430 I431 A506	P429-D513 WeakPolarHBondContact O-CB 3.42Å; T430-D513 WeakPolarHBondContact CA-OD2 3.48Å; I431-D513 WeakPolarHBondContact CD1-O 3.5Å; I431-D513 PolarHBondContact N-OD2 2.81Å; A506-D513 PolarHBondContact N-O 3.4Å; A506-D513 PolarHBondContact O-N 2.86Å
514	T	90.2	Very high	88	Confident	81 Å²	81	52.5 Å²	52.5	50%	0.497	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.3	-173.8	64.3	0	0	0	0	111.4	C504 V505	C504-T514 CarbonylContact O-C 3.52Å; C504-T514 VanDerWaalsContact O-CA 3.26Å; C504-T514 WeakPolarHBondContact O-CA 3.4Å; V505-T514 HydrophobicContact CB-CG2 4.3Å; V505-T514 HydrophobicContact CG1-CG2 3.96Å; V505-T514 HydrophobicContact CG2-CG2 3.92Å
515	H	88.6	Confident	85.7	Confident	44 Å²	44	55.5 Å²	55.5	20%	0.204	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	135.9	173.2	-158.5	-75.9	0	0	0	110.3	I431 L436 C504	I431-H515 HydrophobicContact CB-CB 4.3Å; I431-H515 HydrophobicContact CD1-CB 4.2Å; I431-H515 HydrophobicContact CG2-CB 3.77Å; L436-H515 HydrophobicContact CD1-CB 4.11Å; L436-H515 PolarHBondContact O-CE1 3.49Å; C504-H515 PolarHBondContact N-O 3.14Å; C504-H515 PolarHBondContact O-N 3.3Å
516	S	88.3	Confident	83.2	Confident	41 Å²	41	64.7 Å²	64.7	29%	0.287	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.1	-175.1	-55.6	0	0	0	0	112.5	Y502 T503	Y502-S516 CarbonylContact O-C 3.53Å; Y502-S516 WeakPolarHBondContact O-CA 3.36Å; Y502-S516 WeakPolarHBondContact O-CB 3.36Å; T503-S516 WeakPolarHBondContact CB-OG 3.31Å; T503-S516 WeakPolarHBondContact CG2-OG 3.41Å; T503-S516 PolarHBondContact OG1-OG 3.29Å
517	V	88	Confident	80.9	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.006	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134.6	176.4	55.1	0	0	0	0	109.3	L436 P437 V440 L450 W464 Y502	L436-V517 HydrophobicContact CD2-CG1 4.39Å; P437-V517 HydrophobicContact CG-CG2 4.49Å; P437-V517 WeakPolarHBondContact O-CB 3.38Å; P437-V517 WeakPolarHBondContact O-CG2 3.42Å; V440-V517 HydrophobicContact CB-CG2 4.48Å; V440-V517 HydrophobicContact CG2-CG2 3.8Å; L450-V517 HydrophobicContact CD1-CG1 3.73Å; L450-V517 HydrophobicContact CD2-CG1 4.02Å; L450-V517 HydrophobicContact CD2-CG2 4.27Å; L450-V517 HydrophobicContact CG-CG1 4.44Å; W464-V517 HydrophobicContact CH2-CG1 4Å; W464-V517 HydrophobicContact CZ3-CG1 3.92Å; Y502-V517 PolarHBondContact N-O 3.34Å; Y502-V517 PolarHBondContact O-N 3.33Å
518	T	88.3	Confident	78.2	Confident	43 Å²	43	80.9 Å²	80.9	26%	0.264	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.6	175.8	-54.4	0	0	0	0	109.6	S438 Y439 V440	S438-T518 PolarHBondContact O-N 3.1Å; Y439-T518 CarbonylContact C-O 3.59Å; Y439-T518 VanDerWaalsContact CA-O 3.28Å; Y439-T518 WeakPolarHBondContact CA-O 3.42Å; Y439-T518 HydrophobicContact CD2-CG2 4.11Å; Y439-T518 HydrophobicContact CE2-CG2 4.47Å; V440-T518 PolarHBondContact N-O 2.96Å
519	V	89.2	Confident	75.4	Confident	2 Å²	2	89.7 Å²	89.7	1%	0.012	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.3	179.1	177.6	0	0	0	0	109.5	V440 L448 L450 I494 A499 G500 Y502	V440-V519 WeakPolarHBondContact O-CA 3.32Å; L448-V519 HydrophobicContact CD2-CB 4.46Å; L448-V519 HydrophobicContact CD2-CG1 3.84Å; L448-V519 HydrophobicContact CD2-CG2 3.78Å; L450-V519 HydrophobicContact CD1-CG2 4.17Å; I494-V519 HydrophobicContact CD1-CG1 3.79Å; A499-V519 WeakPolarHBondContact CA-O 3.49Å; G500-V519 PolarHBondContact N-O 3.37Å; G500-V519 PolarHBondContact O-N 2.99Å; Y502-V519 HydrophobicContact CD2-CB 3.98Å; Y502-V519 HydrophobicContact CD2-CG2 3.48Å; Y502-V519 VanDerWaalsContact CD2-CG2 3.48Å; Y502-V519 HydrophobicContact CE2-CB 3.84Å; Y502-V519 HydrophobicContact CE2-CG1 4.48Å; Y502-V519 HydrophobicContact CE2-CG2 3.72Å; Y502-V519 HydrophobicContact CG-CG2 4.41Å
520	G	87.8	Confident	72.8	Confident	12 Å²	12	97 Å²	97	12%	0.124	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.4	172.8	0	0	0	0	0	111.8	V440 G441 V442	V440-G520 PolarHBondContact O-N 3.34Å; G441-G520 WeakPolarHBondContact CA-O 3.05Å; V442-G520 PolarHBondContact N-O 2.69Å
521	V	90.1	Very high	69.9	Low	25 Å²	25	96.7 Å²	96.7	15%	0.152	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.9	178.8	-176.8	0	0	0	0	109.8	V442 E444 I494 P496 A499	V442-V521 WeakPolarHBondContact O-CA 3.45Å; E444-V521 HydrophobicContact CB-CG1 4.02Å; I494-V521 HydrophobicContact CD1-CG2 3.69Å; I494-V521 HydrophobicContact CG1-CG2 3.8Å; I494-V521 HydrophobicContact CG2-CG1 4.37Å; I494-V521 HydrophobicContact CG2-CG2 4.43Å; P496-V521 HydrophobicContact CG-CG1 4.36Å; A499-V521 HydrophobicContact CB-CB 4.46Å; A499-V521 HydrophobicContact CB-CG2 4.14Å
522	H	87.4	Confident	66.9	Low	96 Å²	96	101.8 Å²	101.8	44%	0.444	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.4	-174.9	-54.4	80.5	0	0	0	111.1	Y439 V442 E444	Y439-H522 PolarHBondContact OH-CE1 3.29Å; V442-H522 PolarHBondContact O-N 3.38Å; V442-H522 PolarHBondContact O-ND1 2.97Å; E444-H522 PolarHBondContact N-O 2.92Å
523	N	81.8	Confident	63.9	Low	99 Å²	99	108.1 Å²	108.1	53%	0.529	54%	0.544	S	S	.	.			trans	-81	142.6	174.2	-77	23.6	0	0	0	111.4	E444 G525	E444-N523 PolarHBondContact OE2-ND2 3.29Å; E444-N523 PolarHBondContact OE2-OD1 2.84Å; N523-G525 PolarHBondContact O-N 2.88Å
524	R	60.1	Low	61	Low	236 Å²	236	111.5 Å²	111.5	89%	0.891	57%	0.566	S	S	*	*			trans	-74.3	92.2	170.1	-119.1	-178.1	173.8	-173.3	-0.7	109.1
525	G	46.8	Very low	58.1	Low	63 Å²	63	117.2 Å²	117.2	65%	0.649	58%	0.584	S	S	*	*			trans	-145.6	96.2	-179.8	0	0	0	0	0	114.4	N523	N523-G525 PolarHBondContact O-N 2.88Å
526	K	38.5	Very low	55.3	Low	203 Å²	203	121.3 Å²	121.3	88%	0.883	62%	0.615	S	S	*	*			trans	48.2	115.5	156.3	-67.8	179.4	178.8	175.5	0	118.5	R528	K526-R528 PolarHBondContact O-N 3.33Å
527	N	45.2	Very low	52.4	Low	171 Å²	171	129.3 Å²	129.3	91%	0.914	64%	0.644	S	S	*	*			trans	-7.5	97.3	155	-79.8	-15.5	0	0	0	114.6
528	R	34.8	Very low	49.6	Very low	247 Å²	247	139 Å²	139	93%	0.932	69%	0.686	S	S	*	*			trans	-103.6	116.5	160.1	-91.9	-176.9	161.2	169.6	-4.6	109.4	K526	K526-R528 PolarHBondContact O-N 3.33Å
529	K	33.2	Very low	46.7	Very low	204 Å²	204	147.3 Å²	147.3	89%	0.887	72%	0.719	S	S	*	*			trans	-53.5	142.9	-177.1	-68.6	173.7	173.5	177.3	0	111.3	G531	K529-G531 PolarHBondContact O-N 3.1Å
530	R	35	Very low	43.8	Very low	255 Å²	255	156.2 Å²	156.2	96%	0.962	76%	0.761	S	S	*	*			trans	-40.2	113.5	167.8	-79.6	174.4	161.8	174.1	-5.7	111.4
531	G	28.1	Very low	40.9	Very low	75 Å²	75	161.2 Å²	161.2	77%	0.773	79%	0.794	S	S	*	*			trans	-100.8	118.4	164.3	0	0	0	0	0	109.6	K529	K529-G531 PolarHBondContact O-N 3.1Å
532	V	28	Very low	38	Very low	133 Å²	133	167.9 Å²	167.9	81%	0.806	83%	0.825	S	S	*	*			trans	-33.8	128.7	177.5	178.2	0	0	0	0	115.1	T534	V532-T534 HydrophobicContact CG1-CG2 4.47Å
533	M	25.1	Very low	35.3	Very low	188 Å²	188	173.5 Å²	173.5	93%	0.926	84%	0.843	S	S	*	*			trans	-85.9	106.9	173	-157	167	84.2	0	0	109.5
534	T	27.6	Very low	33.9	Very low	122 Å²	122	176.4 Å²	176.4	75%	0.748	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-88.3	124.5	170.5	46.7	0	0	0	0	110.3	V532	V532-T534 HydrophobicContact CG1-CG2 4.47Å
535	K	28.6	Very low	33.2	Very low	201 Å²	201	171 Å²	171	87%	0.874	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-60.5	146	-179.9	-65.3	177.9	176.5	178.6	0	112.4
536	P	29.1	Very low	33.5	Very low	130 Å²	130	169.7 Å²	169.7	84%	0.844	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-85.5	137.7	168.7	32.1	-26.6	0	0	0	111.1
537	K	27.6	Very low	34.6	Very low	209 Å²	209	167.7 Å²	167.7	91%	0.909	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-83.5	139.9	169.3	-79.2	-177.7	175.7	178.3	0	110
538	K	29	Very low	35.8	Very low	205 Å²	205	162.3 Å²	162.3	89%	0.891	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-66.1	140.8	169.3	-76	178.8	173.3	180	0	111.1
539	F	27.4	Very low	37.9	Very low	218 Å²	218	154.8 Å²	154.8	96%	0.956	77%	0.765	S	S	*	*			trans	-142.7	137.9	147.5	-120.4	-91.1	0	0	0	108.9
540	Q	28.2	Very low	39.8	Very low	188 Å²	188	150 Å²	150	88%	0.879	75%	0.748	S	S	*	*			trans	-115.4	131.5	-175.3	-150.7	174.7	11.9	0	0	107
541	S	27.3	Very low	41.5	Very low	117 Å²	117	142.1 Å²	142.1	82%	0.818	73%	0.725	S	S	*	*			trans	-160.2	147.1	153.2	-171.7	0	0	0	0	109.1
542	M	28.9	Very low	43.5	Very low	165 Å²	165	142.8 Å²	142.8	81%	0.813	71%	0.708	S	S	*	*			trans	-116.4	113.5	-161.5	-171.3	178.6	-168.2	0	0	108.6
543	R	32.1	Very low	45.6	Very low	215 Å²	215	141.1 Å²	141.1	81%	0.811	70%	0.698	S	S	*	*			trans	-144.8	152.1	155.2	-75.4	-168.4	176.4	174.8	-2	107.6	E545	R543-E545 WeakPolarHBondContact O-CB 3.32Å; R543-E545 WeakPolarHBondContact O-CG 3.49Å; R543-E545 PolarHBondContact O-N 3.4Å
544	V	51	Low	47.5	Very low	160 Å²	160	133.2 Å²	133.2	97%	0.97	66%	0.664	S	S	*	*			trans	-57.5	108.4	-172.9	-179.6	0	0	0	0	109.6
545	E	45.1	Very low	49.2	Very low	122 Å²	122	134.6 Å²	134.6	57%	0.57	66%	0.662	S	S	*	*			trans	-138.8	103.5	-168.5	-81.3	174.1	-175.4	0	0	110.1	R543 R547	R543-E545 WeakPolarHBondContact O-CB 3.32Å; R543-E545 WeakPolarHBondContact O-CG 3.49Å; R543-E545 PolarHBondContact O-N 3.4Å; E545-R547 PolarHBondContact O-N 2.82Å
546	A	54.7	Low	50.7	Low	35 Å²	35	130.3 Å²	130.3	29%	0.289	65%	0.645	S	S	.	*			trans	-70.5	94.5	150.5	0	0	0	0	0	105.8	L548 L615	A546-L548 PolarHBondContact O-N 2.77Å; A546-L615 HydrophobicContact CB-CD1 4.13Å; A546-L615 HydrophobicContact CB-CD2 4.48Å
547	R	60.2	Low	52.5	Low	161 Å²	161	128 Å²	128	61%	0.608	62%	0.62	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.1	113.3	-179.1	-168.4	175.4	-179	161.4	-2.2	108.6	E545 E549 W562	E545-R547 PolarHBondContact O-N 2.82Å; R547-E549 HydrophobicContact CG-CG 4.11Å; R547-E549 IonicContact NE-OE1 3.54Å; R547-E549 PolarHBondContact O-N 3.32Å; R547-W562 WeakPolarHBondContact O-CA 3.4Å
548	L	71.4	Confident	54.6	Low	58 Å²	58	118.4 Å²	118.4	30%	0.304	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.7	112	171.9	-166.7	75.4	0	0	0	108.1	A546 L560 W562 V611 L613	A546-L548 PolarHBondContact O-N 2.77Å; L548-L560 HydrophobicContact CD1-CB 4.14Å; L548-L560 HydrophobicContact CD2-CD2 4.19Å; L548-L560 HydrophobicContact CG-CD2 4.19Å; L548-W562 HydrophobicContact CD1-CE3 3.77Å; L548-W562 HydrophobicContact CD1-CZ3 4.42Å; L548-V611 HydrophobicContact CD2-CB 4.44Å; L548-V611 HydrophobicContact CD2-CG1 4.02Å; L548-L613 HydrophobicContact CD1-CB 4.31Å; L548-L613 HydrophobicContact CD1-CD2 4.38Å
549	E	78.6	Confident	56.5	Low	90 Å²	90	110.3 Å²	110.3	42%	0.421	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.1	178.2	-65.5	-171	168.5	0	0	110	R547 L560 S561	R547-E549 HydrophobicContact CG-CG 4.11Å; R547-E549 IonicContact NE-OE1 3.54Å; R547-E549 PolarHBondContact O-N 3.32Å; E549-L560 CarbonylContact O-C 3.41Å; E549-L560 VanDerWaalsContact O-CA 3.29Å; E549-L560 WeakPolarHBondContact O-CA 3.46Å; E549-S561 PolarHBondContact N-O 3.48Å; E549-S561 PolarHBondContact O-N 3.08Å
550	L	72.3	Confident	59.1	Low	102 Å²	102	100.3 Å²	100.3	53%	0.534	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	107.4	173.2	-173.7	68.2	0	0	0	107.9	V553 A558 L560	L550-V553 HydrophobicContact CD1-CG2 3.95Å; L550-V553 HydrophobicContact CD2-CG2 3.44Å; L550-V553 VanDerWaalsContact CD2-CG2 3.44Å; L550-V553 HydrophobicContact CG-CG2 3.78Å; L550-A558 HydrophobicContact CD1-CB 4Å; L550-L560 HydrophobicContact CB-CD2 4.47Å; L550-L560 HydrophobicContact CD1-CD2 3.67Å
551	N	71.6	Confident	61.3	Low	91 Å²	91	92.2 Å²	92.2	49%	0.487	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-41	-176	-68.7	-1.8	0	0	0	111.2	I559 S561	N551-I559 HydrophobicContact CB-CB 4.47Å; N551-I559 HydrophobicContact CB-CG2 4.27Å; N551-I559 PolarHBondContact N-O 3.17Å; N551-S561 VanDerWaalsContact CG-OG 3.3Å; N551-S561 WeakPolarHBondContact ND2-CB 3.35Å; N551-S561 PolarHBondContact ND2-OG 3.22Å; N551-S561 PolarHBondContact OD1-OG 3.35Å
552	E	70.7	Confident	63.8	Low	88 Å²	88	87 Å²	87	41%	0.411	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	144.3	-173.4	-164.6	-178.5	140	0	0	110.6	Y557 A558 I559	E552-Y557 PolarHBondContact OE1-OH 3.2Å; E552-A558 CarbonylContact O-C 3.56Å; E552-A558 WeakPolarHBondContact O-CA 3.4Å; E552-I559 HydrophobicContact CB-CB 4.31Å; E552-I559 HydrophobicContact CB-CD1 4.42Å; E552-I559 PolarHBondContact N-O 3.2Å; E552-I559 PolarHBondContact O-N 3.27Å
553	V	71.9	Confident	65.4	Low	99 Å²	99	86.7 Å²	86.7	60%	0.6	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	120.1	173.4	-175.5	0	0	0	0	108.2	L550	L550-V553 HydrophobicContact CD1-CG2 3.95Å; L550-V553 HydrophobicContact CD2-CG2 3.44Å; L550-V553 VanDerWaalsContact CD2-CG2 3.44Å; L550-V553 HydrophobicContact CG-CG2 3.78Å
554	G	64.2	Low	66.6	Low	21 Å²	21	78.7 Å²	78.7	22%	0.216	40%	0.403	C	S	.	.			trans	-106.1	176.9	168.6	0	0	0	0	0	111.4	H556 Y557	G554-H556 PolarHBondContact O-N 3.36Å; G554-Y557 PolarHBondContact N-O 3.24Å; G554-Y557 VanDerWaalsContact O-O 3.11Å
555	E	63	Low	66.7	Low	151 Å²	151	82.8 Å²	82.8	71%	0.706	40%	0.401	S	S	*	.	S	Bend	trans	-60	-30.4	-176.2	-68.7	-178.3	167.9	0	0	114
556	H	59.9	Low	67.2	Low	112 Å²	112	84.6 Å²	84.6	52%	0.519	41%	0.409	S	S	.	.	S	Bend	trans	-131.7	8.5	-175.9	-58.7	91.7	0	0	0	113.7	G554 H602 L603	G554-H556 PolarHBondContact O-N 3.36Å; H556-H602 PolarHBondContact O-N 2.89Å; H556-L603 WeakPolarHBondContact CA-O 3.4Å; H556-L603 PolarHBondContact CD2-O 2.97Å; H556-L603 PolarHBondContact O-N 3.41Å; H556-L603 VanDerWaalsContact O-N 3.13Å
557	Y	67.5	Low	67.1	Low	81 Å²	81	89.6 Å²	89.6	32%	0.318	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	158.6	-176.8	75.2	-91.5	0	0	0	112.6	E552 G554 I559 N599 L600	E552-Y557 PolarHBondContact OE1-OH 3.2Å; G554-Y557 PolarHBondContact N-O 3.24Å; G554-Y557 VanDerWaalsContact O-O 3.11Å; Y557-I559 HydrophobicContact CD2-CG1 4.09Å; Y557-I559 HydrophobicContact CE2-CD1 4.2Å; Y557-I559 HydrophobicContact CE2-CG1 4.13Å; Y557-N599 WeakPolarHBondContact CB-OD1 3.5Å; Y557-N599 WeakPolarHBondContact CD2-OD1 3.28Å; Y557-L600 CarbonylContact C-O 3.56Å; Y557-L600 WeakPolarHBondContact CA-O 3.37Å; Y557-L600 VanDerWaalsContact CB-O 3.25Å; Y557-L600 WeakPolarHBondContact CB-O 3.33Å
558	A	72	Confident	66.7	Low	7 Å²	7	83.9 Å²	83.9	6%	0.058	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	126.6	173.2	0	0	0	0	0	110.3	L550 E552 L600 L603	L550-A558 HydrophobicContact CD1-CB 4Å; E552-A558 CarbonylContact O-C 3.56Å; E552-A558 WeakPolarHBondContact O-CA 3.4Å; A558-L600 HydrophobicContact CB-CB 4.3Å; A558-L600 HydrophobicContact CB-CD1 4.39Å; A558-L600 PolarHBondContact N-O 3.28Å; A558-L600 WeakPolarHBondContact O-CB 3.45Å; A558-L600 PolarHBondContact O-N 2.84Å; A558-L603 HydrophobicContact CB-CD1 3.56Å
559	I	68.8	Low	65.6	Low	36 Å²	36	85 Å²	85	19%	0.185	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.7	179.2	-57.9	177.7	0	0	0	108.8	N551 E552 Y557 N599	N551-I559 HydrophobicContact CB-CB 4.47Å; N551-I559 HydrophobicContact CB-CG2 4.27Å; N551-I559 PolarHBondContact N-O 3.17Å; E552-I559 HydrophobicContact CB-CB 4.31Å; E552-I559 HydrophobicContact CB-CD1 4.42Å; E552-I559 PolarHBondContact N-O 3.2Å; E552-I559 PolarHBondContact O-N 3.27Å; Y557-I559 HydrophobicContact CD2-CG1 4.09Å; Y557-I559 HydrophobicContact CE2-CD1 4.2Å; Y557-I559 HydrophobicContact CE2-CG1 4.13Å; I559-N599 HydrophobicContact CG1-CB 4.41Å
560	L	81.4	Confident	64.2	Low	7 Å²	7	85 Å²	85	4%	0.037	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	145.6	175.3	-59.6	160.7	0	0	0	109	L548 E549 L550 L573 S597 F598 L600 V611	L548-L560 HydrophobicContact CD1-CB 4.14Å; L548-L560 HydrophobicContact CD2-CD2 4.19Å; L548-L560 HydrophobicContact CG-CD2 4.19Å; E549-L560 CarbonylContact O-C 3.41Å; E549-L560 VanDerWaalsContact O-CA 3.29Å; E549-L560 WeakPolarHBondContact O-CA 3.46Å; L550-L560 HydrophobicContact CB-CD2 4.47Å; L550-L560 HydrophobicContact CD1-CD2 3.67Å; L560-L573 HydrophobicContact CD1-CD1 4.41Å; L560-L573 HydrophobicContact CD1-CD2 4.14Å; L560-S597 CarbonylContact O-C 3.3Å; L560-S597 WeakPolarHBondContact O-CA 3.14Å; L560-S597 WeakPolarHBondContact O-CB 3.35Å; L560-F598 PolarHBondContact N-O 2.99Å; L560-F598 PolarHBondContact O-N 3.1Å; L560-L600 HydrophobicContact CD1-CD1 3.69Å; L560-L600 HydrophobicContact CD1-CD2 4.02Å; L560-L600 HydrophobicContact CD1-CG 3.65Å; L560-L600 HydrophobicContact CG-CD1 4.5Å; L560-L600 HydrophobicContact CG-CG 4.43Å; L560-V611 HydrophobicContact CD1-CG1 3.69Å
561	S	75.1	Confident	63.8	Low	18 Å²	18	80.6 Å²	80.6	13%	0.126	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	158.1	166.6	69.1	0	0	0	0	111.7	E549 N551 Q596	E549-S561 PolarHBondContact N-O 3.48Å; E549-S561 PolarHBondContact O-N 3.08Å; N551-S561 VanDerWaalsContact CG-OG 3.3Å; N551-S561 WeakPolarHBondContact ND2-CB 3.35Å; N551-S561 PolarHBondContact ND2-OG 3.22Å; N551-S561 PolarHBondContact OD1-OG 3.35Å; S561-Q596 VanDerWaalsContact CA-O 3.28Å; S561-Q596 WeakPolarHBondContact CA-O 3.4Å; S561-Q596 WeakPolarHBondContact CB-O 3Å
562	W	80.2	Confident	63.6	Low	9 Å²	9	82.5 Å²	82.5	3%	0.034	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	141.7	174.1	56.1	85.7	0	0	0	109.7	R547 L548 I591 T595 Q596 F598 L613	R547-W562 WeakPolarHBondContact O-CA 3.4Å; L548-W562 HydrophobicContact CD1-CE3 3.77Å; L548-W562 HydrophobicContact CD1-CZ3 4.42Å; W562-I591 HydrophobicContact CH2-CD1 4.36Å; W562-I591 HydrophobicContact CH2-CG1 4.46Å; W562-I591 HydrophobicContact CH2-CG2 4.1Å; W562-I591 HydrophobicContact CZ2-CG2 3.72Å; W562-T595 VanDerWaalsContact CE2-O 3.27Å; W562-T595 HydrophobicContact CH2-CG2 4.44Å; W562-T595 HydrophobicContact CZ2-CG2 4.18Å; W562-T595 WeakPolarHBondContact CZ2-O 3.41Å; W562-T595 PolarHBondContact NE1-O 2.85Å; W562-Q596 PolarHBondContact N-O 2.8Å; W562-F598 HydrophobicContact CH2-CB 3.62Å; W562-F598 HydrophobicContact CZ3-CB 3.75Å; W562-L613 HydrophobicContact CB-CD2 4.42Å; W562-L613 HydrophobicContact CD2-CD2 4.21Å; W562-L613 HydrophobicContact CG-CD2 4.11Å
563	Q	61.6	Low	63.9	Low	158 Å²	158	78.3 Å²	78.3	74%	0.738	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.9	174.4	-67.2	-173.4	-4.1	0	0	109.3
564	S	58.5	Low	64.3	Low	47 Å²	47	74.2 Å²	74.2	33%	0.329	37%	0.367	S	S	.	.			trans	-119.8	141.7	172.3	178.1	0	0	0	0	109.6	Q566	S564-Q566 VanDerWaalsContact C-N 3.25Å; S564-Q566 WeakPolarHBondContact CB-O 3.35Å; S564-Q566 PolarHBondContact O-N 3.41Å; S564-Q566 PolarHBondContact OG-N 3.3Å; S564-Q566 PolarHBondContact OG-O 2.96Å
565	R	52.3	Low	65.2	Low	245 Å²	245	74 Å²	74	93%	0.925	36%	0.359	S	S	*	.	S	Bend	trans	-77.8	-9.3	174.4	-68.1	-170.9	-178.4	-164.8	0.8	113.3
566	Q	55.9	Low	66.1	Low	161 Å²	161	70 Å²	70	75%	0.752	34%	0.341	S	S	*	.	S	Bend	trans	-133.7	150.1	177.6	-66.4	-175.7	-9.9	0	0	110.8	S564 L568	S564-Q566 VanDerWaalsContact C-N 3.25Å; S564-Q566 WeakPolarHBondContact CB-O 3.35Å; S564-Q566 PolarHBondContact O-N 3.41Å; S564-Q566 PolarHBondContact OG-N 3.3Å; S564-Q566 PolarHBondContact OG-O 2.96Å; Q566-L568 PolarHBondContact O-N 3.1Å; Q566-L568 VanDerWaalsContact O-N 3.11Å
567	N	51.8	Low	67	Low	139 Å²	139	65.3 Å²	65.3	74%	0.743	32%	0.321	S	S	*	.			trans	-61.8	112	170.4	-78	-19.3	0	0	0	108.9	P569	N567-P569 WeakPolarHBondContact O-CD 3.47Å
568	L	52.8	Low	67.2	Low	42 Å²	42	66.8 Å²	66.8	22%	0.22	33%	0.333	C	S	.	.			trans	-79.3	121.5	-179	-69.6	159.9	0	0	0	109.5	Q566 S570 T571 L615	Q566-L568 PolarHBondContact O-N 3.1Å; Q566-L568 VanDerWaalsContact O-N 3.11Å; L568-S570 PolarHBondContact O-N 3.09Å; L568-T571 HydrophobicContact CB-CG2 3.77Å; L568-T571 HydrophobicContact CD1-CG2 4.29Å; L568-L615 HydrophobicContact CD1-CD2 3.79Å; L568-L615 HydrophobicContact CD2-CD2 4.16Å; L568-L615 HydrophobicContact CG-CD2 4.47Å
569	P	47.7	Very low	66.9	Low	81 Å²	81	72 Å²	72	53%	0.526	36%	0.356	S	S	.	.	S	Bend	trans	-70.8	127.1	175.2	27.7	-30.7	0	0	0	109.6	N567	N567-P569 WeakPolarHBondContact O-CD 3.47Å
570	S	49.1	Very low	66	Low	91 Å²	91	78.1 Å²	78.1	64%	0.636	40%	0.395	S	S	*	.	S	Bend	trans	37.5	91.7	175.4	63.1	0	0	0	0	115.6	L568	L568-S570 PolarHBondContact O-N 3.09Å
571	T	62.8	Low	64.7	Low	8 Å²	8	81.4 Å²	81.4	5%	0.049	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	139.4	173.7	52.4	0	0	0	0	110.2	L568 I591 H614 L615	L568-T571 HydrophobicContact CB-CG2 3.77Å; L568-T571 HydrophobicContact CD1-CG2 4.29Å; T571-I591 WeakPolarHBondContact O-CB 3.47Å; T571-I591 PolarHBondContact O-N 3.24Å; T571-I591 VanDerWaalsContact OG1-CB 3.32Å; T571-I591 WeakPolarHBondContact OG1-CB 3.41Å; T571-H614 WeakPolarHBondContact CA-O 3.26Å; T571-L615 HydrophobicContact CG2-CD2 3.69Å
572	R	68.3	Low	63.5	Low	132 Å²	132	85.7 Å²	85.7	50%	0.498	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.3	174.3	-170.4	-174.1	-58.7	166.6	3.7	108	T589 H614	R572-T589 WeakPolarHBondContact CA-O 3.35Å; R572-T589 WeakPolarHBondContact CG-O 3.47Å; R572-H614 HydrophobicContact CB-CB 4.26Å; R572-H614 PolarHBondContact N-O 2.79Å; R572-H614 WeakPolarHBondContact O-CB 3.37Å; R572-H614 PolarHBondContact O-CD2 2.93Å; R572-H614 VanDerWaalsContact O-CD2 3.32Å; R572-H614 PolarHBondContact O-N 2.85Å
573	L	77.8	Confident	62.4	Low	0 Å²	0	93.5 Å²	93.5	0%	0	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136	174.4	-171.8	71.3	0	0	0	108.8	L560 T588 T589 I591 F598 L600 V611 L613	L560-L573 HydrophobicContact CD1-CD1 4.41Å; L560-L573 HydrophobicContact CD1-CD2 4.14Å; L573-T588 CarbonylContact O-C 3.57Å; L573-T588 VanDerWaalsContact O-CA 3.3Å; L573-T588 WeakPolarHBondContact O-CA 3.48Å; L573-T589 HydrophobicContact CB-CG2 4.07Å; L573-T589 PolarHBondContact N-O 3.13Å; L573-T589 PolarHBondContact O-N 3.35Å; L573-I591 HydrophobicContact CB-CD1 4.12Å; L573-I591 HydrophobicContact CB-CG1 3.97Å; L573-F598 HydrophobicContact CD2-CB 4.17Å; L573-F598 HydrophobicContact CD2-CD1 3.35Å; L573-F598 HydrophobicContact CD2-CE1 3.97Å; L573-F598 HydrophobicContact CD2-CG 3.92Å; L573-L600 HydrophobicContact CD2-CD2 3.69Å; L573-L600 HydrophobicContact CG-CD2 4.49Å; L573-V611 HydrophobicContact CD1-CG1 3.95Å; L573-L613 HydrophobicContact CD1-CB 4.16Å; L573-L613 HydrophobicContact CD1-CD1 3.99Å
574	S	78.7	Confident	62.3	Low	13 Å²	13	87.1 Å²	87.1	9%	0.091	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142.7	177.2	62.3	0	0	0	0	111.6	Y587 V611 C612 H614	S574-Y587 CarbonylContact C-O 3.52Å; S574-Y587 WeakPolarHBondContact CA-O 3.46Å; S574-V611 CarbonylContact O-C 3.56Å; S574-V611 WeakPolarHBondContact O-CA 3.49Å; S574-C612 PolarHBondContact N-O 3.25Å; S574-C612 PolarHBondContact O-N 3.36Å; S574-C612 PolarHBondContact OG-O 3.38Å; S574-H614 PolarHBondContact OG-CD2 2.89Å; S574-H614 PolarHBondContact OG-NE2 2.87Å
575	W	83.2	Confident	62.4	Low	15 Å²	15	88.9 Å²	88.9	6%	0.057	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	142.3	173.7	64.9	103.8	0	0	0	111.9	Y587 T589 F598 L600 R610 V611	W575-Y587 HydrophobicContact CZ2-CG 4.2Å; W575-Y587 PolarHBondContact N-O 3.07Å; W575-Y587 AromaticContact NE1-CD2 3.81Å; W575-Y587 AromaticContact NE1-CG 3.89Å; W575-Y587 PolarHBondContact O-N 2.03Å; W575-T589 HydrophobicContact CH2-CG2 4.37Å; W575-T589 HydrophobicContact CZ3-CG2 3.91Å; W575-F598 HydrophobicContact CH2-CE1 4.48Å; W575-F598 HydrophobicContact CZ3-CE1 4.45Å; W575-L600 HydrophobicContact CB-CD1 4.19Å; W575-L600 HydrophobicContact CD2-CD1 4.5Å; W575-L600 HydrophobicContact CD2-CD2 3.55Å; W575-L600 HydrophobicContact CE3-CD2 3.39Å; W575-L600 HydrophobicContact CG-CD1 4.17Å; W575-L600 HydrophobicContact CG-CD2 4.08Å; W575-L600 HydrophobicContact CH2-CD2 4.21Å; W575-L600 HydrophobicContact CZ2-CD2 4.33Å; W575-L600 HydrophobicContact CZ3-CD2 3.75Å; W575-R610 CarbonylContact C-O 3.56Å; W575-R610 VanDerWaalsContact CA-O 3.23Å; W575-R610 WeakPolarHBondContact CA-O 3.28Å; W575-V611 HydrophobicContact CB-CB 4.48Å; W575-V611 HydrophobicContact CB-CG1 4.42Å; W575-V611 HydrophobicContact CB-CG2 3.94Å
576	Q	82	Confident	63.3	Low	69 Å²	69	80.7 Å²	80.7	32%	0.322	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	136.9	-176.6	-172.3	-178.4	15.2	0	0	110.5	M578 T584 T586 Y609 R610	Q576-M578 PolarHBondContact O-N 2.72Å; Q576-T584 WeakPolarHBondContact CG-OG1 3.29Å; Q576-T584 PolarHBondContact NE2-O 3.31Å; Q576-T584 VanDerWaalsContact NE2-O 3.09Å; Q576-T584 PolarHBondContact NE2-OG1 3.26Å; Q576-T586 HydrophobicContact CB-CG2 4.38Å; Q576-T586 VanDerWaalsContact CD-OG1 3.29Å; Q576-T586 PolarHBondContact OE1-OG1 2.62Å; Q576-Y609 CarbonylContact O-C 3.23Å; Q576-Y609 VanDerWaalsContact O-CA 3.3Å; Q576-Y609 WeakPolarHBondContact O-CA 3.49Å; Q576-R610 PolarHBondContact N-O 2.85Å; Q576-R610 PolarHBondContact O-N 2.84Å
577	A	79.3	Confident	63.9	Low	13 Å²	13	77.9 Å²	77.9	11%	0.107	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	128.9	173.4	0	0	0	0	0	110.6	Q579 T584 T607 F608 Y609	A577-Q579 PolarHBondContact O-N 3.25Å; A577-Q579 VanDerWaalsContact O-N 3.17Å; A577-T584 HydrophobicContact CB-CG2 4.37Å; A577-T584 PolarHBondContact O-OG1 3.1Å; A577-T584 VanDerWaalsContact O-OG1 3.05Å; A577-T607 HydrophobicContact CB-CG2 3.77Å; A577-F608 CarbonylContact C-O 3.53Å; A577-F608 WeakPolarHBondContact CA-O 3Å; A577-Y609 HydrophobicContact CB-CD1 4.13Å; A577-Y609 HydrophobicContact CB-CE1 3.76Å
578	M	72.1	Confident	64.7	Low	112 Å²	112	75.5 Å²	75.5	55%	0.552	42%	0.418	S	S	*	.			trans	-85.2	74.6	176.8	-61.6	-174.9	93.8	0	0	109.5	Q576 F608 R610	Q576-M578 PolarHBondContact O-N 2.72Å; M578-F608 HydrophobicContact CB-CB 4.3Å; M578-F608 PolarHBondContact N-O 3.12Å; M578-R610 HydrophobicContact CE-CB 4.38Å; M578-R610 HydrophobicContact CG-CB 3.91Å; M578-R610 HydrophobicContact SD-CB 3.96Å
579	Q	66	Low	65.4	Low	116 Å²	116	75.6 Å²	75.6	54%	0.542	42%	0.421	S	S	.	.			trans	-105.1	152.8	165.5	-86.7	177.7	-5.5	0	0	110.5	A577 S581 T584	A577-Q579 PolarHBondContact O-N 3.25Å; A577-Q579 VanDerWaalsContact O-N 3.17Å; Q579-S581 PolarHBondContact O-N 3.36Å; Q579-T584 HydrophobicContact CB-CG2 4.18Å
580	T	50.4	Low	66.1	Low	165 Å²	165	81.8 Å²	81.8	100%	1.012	43%	0.434	S	S	*	.	S	Bend	trans	-74	2.6	-174.3	42.2	0	0	0	0	115.1
581	S	53.2	Low	66.9	Low	75 Å²	75	77.9 Å²	77.9	52%	0.524	41%	0.406	S	S	.	.	S	Bend	trans	-105.2	139	178	63.3	0	0	0	0	112.6	Q579 H583	Q579-S581 PolarHBondContact O-N 3.36Å; S581-H583 PolarHBondContact O-N 2.98Å
582	S	49.5	Very low	66.5	Low	109 Å²	109	84.3 Å²	84.3	76%	0.762	44%	0.439	S	S	*	.	S	Bend	trans	-67.8	10.5	-162.8	55.8	0	0	0	0	118.5
583	H	56.5	Low	65.9	Low	172 Å²	172	81.8 Å²	81.8	80%	0.796	45%	0.446	S	S	*	.			trans	-143	64.4	-178.4	-70.2	-44.6	0	0	0	114.1	S581	S581-H583 PolarHBondContact O-N 2.98Å
584	T	59.8	Low	64.9	Low	24 Å²	24	84.1 Å²	84.1	15%	0.147	47%	0.47	C	S	.	.			trans	-92.3	132.4	163.3	55.4	0	0	0	0	110.5	Q576 A577 Q579 T586	Q576-T584 WeakPolarHBondContact CG-OG1 3.29Å; Q576-T584 PolarHBondContact NE2-O 3.31Å; Q576-T584 VanDerWaalsContact NE2-O 3.09Å; Q576-T584 PolarHBondContact NE2-OG1 3.26Å; A577-T584 HydrophobicContact CB-CG2 4.37Å; A577-T584 PolarHBondContact O-OG1 3.1Å; A577-T584 VanDerWaalsContact O-OG1 3.05Å; Q579-T584 HydrophobicContact CB-CG2 4.18Å; T584-T586 PolarHBondContact O-N 2.88Å
585	P	61.8	Low	64	Low	84 Å²	84	85.8 Å²	85.8	55%	0.545	48%	0.48	S	S	.	.			trans	-66.6	130.5	180	25.7	-32.1	0	0	0	111	Y587	P585-Y587 HydrophobicContact CB-CE2 4.46Å; P585-Y587 HydrophobicContact CG-CE2 4.08Å
586	T	70.8	Confident	63.4	Low	74 Å²	74	90.9 Å²	90.9	45%	0.454	50%	0.504	S	S	.	.			trans	-87.8	114.2	172.4	-55.9	0	0	0	0	109.1	Q576 T584 T588	Q576-T586 HydrophobicContact CB-CG2 4.38Å; Q576-T586 VanDerWaalsContact CD-OG1 3.29Å; Q576-T586 PolarHBondContact OE1-OG1 2.62Å; T584-T586 PolarHBondContact O-N 2.88Å; T586-T588 HydrophobicContact CG2-CG2 4.06Å
587	Y	67.8	Low	62.9	Low	102 Å²	102	90.9 Å²	90.9	40%	0.4	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.8	174.4	-62.2	-84.8	0	0	0	109	S574 W575 P585	S574-Y587 CarbonylContact C-O 3.52Å; S574-Y587 WeakPolarHBondContact CA-O 3.46Å; W575-Y587 HydrophobicContact CZ2-CG 4.2Å; W575-Y587 PolarHBondContact N-O 3.07Å; W575-Y587 AromaticContact NE1-CD2 3.81Å; W575-Y587 AromaticContact NE1-CG 3.89Å; W575-Y587 PolarHBondContact O-N 2.03Å; P585-Y587 HydrophobicContact CB-CE2 4.46Å; P585-Y587 HydrophobicContact CG-CE2 4.08Å
588	T	69.3	Low	62.5	Low	88 Å²	88	92.8 Å²	92.8	54%	0.54	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	144.2	178	70.7	0	0	0	0	110.7	L573 T586	L573-T588 CarbonylContact O-C 3.57Å; L573-T588 VanDerWaalsContact O-CA 3.3Å; L573-T588 WeakPolarHBondContact O-CA 3.48Å; T586-T588 HydrophobicContact CG2-CG2 4.06Å
589	T	66.9	Low	62.5	Low	45 Å²	45	89.6 Å²	89.6	28%	0.276	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	148.7	175.6	-171.8	0	0	0	0	110.9	R572 L573 W575 I591 F598	R572-T589 WeakPolarHBondContact CA-O 3.35Å; R572-T589 WeakPolarHBondContact CG-O 3.47Å; L573-T589 HydrophobicContact CB-CG2 4.07Å; L573-T589 PolarHBondContact N-O 3.13Å; L573-T589 PolarHBondContact O-N 3.35Å; W575-T589 HydrophobicContact CH2-CG2 4.37Å; W575-T589 HydrophobicContact CZ3-CG2 3.91Å; T589-I591 HydrophobicContact CG2-CD1 3.95Å; T589-F598 HydrophobicContact CG2-CE1 3.84Å; T589-F598 HydrophobicContact CG2-CE2 4.07Å; T589-F598 HydrophobicContact CG2-CZ 3.5Å; T589-F598 VanDerWaalsContact CG2-CZ 3.5Å
590	R	62.5	Low	62.9	Low	211 Å²	211	84.1 Å²	84.1	80%	0.796	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	135	172.5	-71.7	-175.5	-177.8	179.7	-0.4	108.8
591	I	67.3	Low	63.4	Low	9 Å²	9	79.2 Å²	79.2	5%	0.046	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.9	-179.7	-57.3	-64.5	0	0	0	108.2	W562 T571 L573 T589 T595 F598	W562-I591 HydrophobicContact CH2-CD1 4.36Å; W562-I591 HydrophobicContact CH2-CG1 4.46Å; W562-I591 HydrophobicContact CH2-CG2 4.1Å; W562-I591 HydrophobicContact CZ2-CG2 3.72Å; T571-I591 WeakPolarHBondContact O-CB 3.47Å; T571-I591 PolarHBondContact O-N 3.24Å; T571-I591 VanDerWaalsContact OG1-CB 3.32Å; T571-I591 WeakPolarHBondContact OG1-CB 3.41Å; L573-I591 HydrophobicContact CB-CD1 4.12Å; L573-I591 HydrophobicContact CB-CG1 3.97Å; T589-I591 HydrophobicContact CG2-CD1 3.95Å; I591-T595 VanDerWaalsContact CG2-CB 3.49Å; I591-T595 HydrophobicContact CG2-CG2 3.9Å; I591-F598 HydrophobicContact CD1-CB 4.3Å; I591-F598 HydrophobicContact CD1-CD1 4.4Å; I591-F598 HydrophobicContact CD1-CD2 3.25Å; I591-F598 HydrophobicContact CD1-CE2 3.55Å; I591-F598 HydrophobicContact CD1-CG 3.73Å; I591-F598 HydrophobicContact CD1-CZ 4.26Å
592	L	54.3	Low	63.6	Low	143 Å²	143	82.4 Å²	82.4	75%	0.749	45%	0.454	S	S	*	.			trans	-66.4	145.1	178.7	-65.3	172.1	0	0	0	110.7	G594 T595	L592-G594 PolarHBondContact O-N 3.32Å; L592-T595 WeakPolarHBondContact O-CB 3.47Å; L592-T595 PolarHBondContact O-N 2.97Å; L592-T595 VanDerWaalsContact O-N 3.15Å; L592-T595 PolarHBondContact O-OG1 2.91Å
593	A	54.5	Low	64.6	Low	78 Å²	78	78 Å²	78	65%	0.645	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	131.5	178.5	0	0	0	0	0	110.7
594	G	56.8	Low	65.5	Low	49 Å²	49	75.8 Å²	75.8	51%	0.505	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-8.6	-177.2	0	0	0	0	0	115.4	L592 Q596	L592-G594 PolarHBondContact O-N 3.32Å; G594-Q596 PolarHBondContact O-N 3.01Å
595	T	61	Low	66	Low	49 Å²	49	77.5 Å²	77.5	30%	0.301	43%	0.428	S	S	.	.			trans	-68.8	127.3	172.7	-49.3	0	0	0	0	110.2	W562 I591 L592 S597	W562-T595 VanDerWaalsContact CE2-O 3.27Å; W562-T595 HydrophobicContact CH2-CG2 4.44Å; W562-T595 HydrophobicContact CZ2-CG2 4.18Å; W562-T595 WeakPolarHBondContact CZ2-O 3.41Å; W562-T595 PolarHBondContact NE1-O 2.85Å; I591-T595 VanDerWaalsContact CG2-CB 3.49Å; I591-T595 HydrophobicContact CG2-CG2 3.9Å; L592-T595 WeakPolarHBondContact O-CB 3.47Å; L592-T595 PolarHBondContact O-N 2.97Å; L592-T595 VanDerWaalsContact O-N 3.15Å; L592-T595 PolarHBondContact O-OG1 2.91Å; T595-S597 WeakPolarHBondContact CG2-O 3.42Å
596	Q	70.6	Confident	66.4	Low	122 Å²	122	83 Å²	83	57%	0.57	45%	0.446	S	S	*	.			trans	-115.9	-5.9	-178.3	-65.1	-176.8	-4.8	0	0	113.8	S561 W562 G594	S561-Q596 VanDerWaalsContact CA-O 3.28Å; S561-Q596 WeakPolarHBondContact CA-O 3.4Å; S561-Q596 WeakPolarHBondContact CB-O 3Å; W562-Q596 PolarHBondContact N-O 2.8Å; G594-Q596 PolarHBondContact O-N 3.01Å
597	S	70.6	Confident	66.5	Low	69 Å²	69	81.1 Å²	81.1	48%	0.483	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	149.3	174.6	65.7	0	0	0	0	110.6	L560 T595	L560-S597 CarbonylContact O-C 3.3Å; L560-S597 WeakPolarHBondContact O-CA 3.14Å; L560-S597 WeakPolarHBondContact O-CB 3.35Å; T595-S597 WeakPolarHBondContact CG2-O 3.42Å
598	F	71.1	Confident	67	Low	53 Å²	53	84.1 Å²	84.1	23%	0.232	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136.1	-179.6	-168.7	-91.8	0	0	0	111	L560 W562 L573 W575 T589 I591 L600	L560-F598 PolarHBondContact N-O 2.99Å; L560-F598 PolarHBondContact O-N 3.1Å; W562-F598 HydrophobicContact CH2-CB 3.62Å; W562-F598 HydrophobicContact CZ3-CB 3.75Å; L573-F598 HydrophobicContact CD2-CB 4.17Å; L573-F598 HydrophobicContact CD2-CD1 3.35Å; L573-F598 HydrophobicContact CD2-CE1 3.97Å; L573-F598 HydrophobicContact CD2-CG 3.92Å; W575-F598 HydrophobicContact CH2-CE1 4.48Å; W575-F598 HydrophobicContact CZ3-CE1 4.45Å; T589-F598 HydrophobicContact CG2-CE1 3.84Å; T589-F598 HydrophobicContact CG2-CE2 4.07Å; T589-F598 HydrophobicContact CG2-CZ 3.5Å; T589-F598 VanDerWaalsContact CG2-CZ 3.5Å; I591-F598 HydrophobicContact CD1-CB 4.3Å; I591-F598 HydrophobicContact CD1-CD1 4.4Å; I591-F598 HydrophobicContact CD1-CD2 3.25Å; I591-F598 HydrophobicContact CD1-CE2 3.55Å; I591-F598 HydrophobicContact CD1-CG 3.73Å; I591-F598 HydrophobicContact CD1-CZ 4.26Å; F598-L600 HydrophobicContact CD1-CD2 4.11Å; F598-L600 HydrophobicContact CE1-CD2 4.23Å
599	N	72.2	Confident	67.5	Low	44 Å²	44	82.1 Å²	82.1	24%	0.235	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.5	178.2	-170.5	12.1	0	0	0	109.7	Y557 I559 T601	Y557-N599 WeakPolarHBondContact CB-OD1 3.5Å; Y557-N599 WeakPolarHBondContact CD2-OD1 3.28Å; I559-N599 HydrophobicContact CG1-CB 4.41Å; N599-T601 PolarHBondContact O-N 3.08Å
600	L	73.3	Confident	68.1	Low	2 Å²	2	87.4 Å²	87.4	1%	0.01	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	124.8	168.9	-63.8	-172.7	0	0	0	108.9	Y557 A558 L560 L573 W575 F598 L603 V611	Y557-L600 CarbonylContact C-O 3.56Å; Y557-L600 WeakPolarHBondContact CA-O 3.37Å; Y557-L600 VanDerWaalsContact CB-O 3.25Å; Y557-L600 WeakPolarHBondContact CB-O 3.33Å; A558-L600 HydrophobicContact CB-CB 4.3Å; A558-L600 HydrophobicContact CB-CD1 4.39Å; A558-L600 PolarHBondContact N-O 3.28Å; A558-L600 WeakPolarHBondContact O-CB 3.45Å; A558-L600 PolarHBondContact O-N 2.84Å; L560-L600 HydrophobicContact CD1-CD1 3.69Å; L560-L600 HydrophobicContact CD1-CD2 4.02Å; L560-L600 HydrophobicContact CD1-CG 3.65Å; L560-L600 HydrophobicContact CG-CD1 4.5Å; L560-L600 HydrophobicContact CG-CG 4.43Å; L573-L600 HydrophobicContact CD2-CD2 3.69Å; L573-L600 HydrophobicContact CG-CD2 4.49Å; W575-L600 HydrophobicContact CB-CD1 4.19Å; W575-L600 HydrophobicContact CD2-CD1 4.5Å; W575-L600 HydrophobicContact CD2-CD2 3.55Å; W575-L600 HydrophobicContact CE3-CD2 3.39Å; W575-L600 HydrophobicContact CG-CD1 4.17Å; W575-L600 HydrophobicContact CG-CD2 4.08Å; W575-L600 HydrophobicContact CH2-CD2 4.21Å; W575-L600 HydrophobicContact CZ2-CD2 4.33Å; W575-L600 HydrophobicContact CZ3-CD2 3.75Å; F598-L600 HydrophobicContact CD1-CD2 4.11Å; F598-L600 HydrophobicContact CE1-CD2 4.23Å; L600-L603 HydrophobicContact CB-CD1 4.15Å; L600-L603 HydrophobicContact CB-CD2 4.36Å; L600-L603 HydrophobicContact CB-CG 4.38Å; L600-V611 HydrophobicContact CD1-CG1 4.28Å; L600-V611 HydrophobicContact CD1-CG2 3.72Å
601	T	62.4	Low	69	Low	62 Å²	62	79.3 Å²	79.3	38%	0.38	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	164.1	176.2	55.4	0	0	0	0	110.2	N599	N599-T601 PolarHBondContact O-N 3.08Å
602	H	56.2	Low	69.5	Low	142 Å²	142	81.2 Å²	81.2	66%	0.657	44%	0.435	S	S	*	.	S	Bend	trans	67	32.4	-177.5	-47.9	-74.8	0	0	0	114.7	H556	H556-H602 PolarHBondContact O-N 2.89Å
603	L	71.8	Confident	70.6	Confident	17 Å²	17	76 Å²	76	9%	0.089	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-79.8	149.5	170.1	-54	-177.5	0	0	0	110.5	H556 A558 L600 Y609	H556-L603 WeakPolarHBondContact CA-O 3.4Å; H556-L603 PolarHBondContact CD2-O 2.97Å; H556-L603 PolarHBondContact O-N 3.41Å; H556-L603 VanDerWaalsContact O-N 3.13Å; A558-L603 HydrophobicContact CB-CD1 3.56Å; L600-L603 HydrophobicContact CB-CD1 4.15Å; L600-L603 HydrophobicContact CB-CD2 4.36Å; L600-L603 HydrophobicContact CB-CG 4.38Å; L603-Y609 HydrophobicContact CB-CE2 3.99Å; L603-Y609 HydrophobicContact CD2-CD1 3.95Å; L603-Y609 HydrophobicContact CD2-CD2 3.97Å; L603-Y609 HydrophobicContact CD2-CE1 3.85Å; L603-Y609 HydrophobicContact CD2-CE2 3.86Å; L603-Y609 HydrophobicContact CD2-CG 4.02Å; L603-Y609 HydrophobicContact CG-CE2 4.43Å
604	Q	73.8	Confident	71.6	Confident	125 Å²	125	76.8 Å²	76.8	58%	0.584	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-98.4	139.1	171.7	-67.7	-178.7	-25.4	0	0	109.6	T607 Y609	Q604-T607 WeakPolarHBondContact O-CB 3.48Å; Q604-T607 PolarHBondContact O-N 2.93Å; Q604-Y609 PolarHBondContact N-OH 3.31Å
605	A	70.4	Confident	72.1	Confident	59 Å²	59	78.4 Å²	78.4	49%	0.488	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	147.3	176.1	0	0	0	0	0	111.2	T607	A605-T607 PolarHBondContact O-N 2.04Å; A605-T607 PolarHBondContact O-OG1 3.23Å
606	E	70.9	Confident	71.8	Confident	200 Å²	200	77.7 Å²	77.7	94%	0.935	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	16.8	177.5	-55.1	-174.7	172.7	0	0	115.7
607	T	73	Confident	70.3	Confident	35 Å²	35	78.4 Å²	78.4	22%	0.215	41%	0.41	C	S	.	.			trans	-103.6	131.7	-179.5	-56.3	0	0	0	0	110.8	A577 Q604 A605 Y609	A577-T607 HydrophobicContact CB-CG2 3.77Å; Q604-T607 WeakPolarHBondContact O-CB 3.48Å; Q604-T607 PolarHBondContact O-N 2.93Å; A605-T607 PolarHBondContact O-N 2.04Å; A605-T607 PolarHBondContact O-OG1 3.23Å; T607-Y609 HydrophobicContact CG2-CD2 4.3Å; T607-Y609 HydrophobicContact CG2-CE2 3.73Å; T607-Y609 VanDerWaalsContact O-CD2 3.24Å; T607-Y609 WeakPolarHBondContact O-CD2 3.07Å
608	F	78.4	Confident	68.5	Low	164 Å²	164	80 Å²	80	72%	0.719	42%	0.421	S	S	*	.			trans	-80.1	128.9	174.7	-70	-82.7	0	0	0	110.3	A577 M578	A577-F608 CarbonylContact C-O 3.53Å; A577-F608 WeakPolarHBondContact CA-O 3Å; M578-F608 HydrophobicContact CB-CB 4.3Å; M578-F608 PolarHBondContact N-O 3.12Å
609	Y	79.5	Confident	66.4	Low	47 Å²	47	90.2 Å²	90.2	18%	0.184	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.3	177	-71.5	-93.7	0	0	0	110.7	Q576 A577 L603 Q604 T607	Q576-Y609 CarbonylContact O-C 3.23Å; Q576-Y609 VanDerWaalsContact O-CA 3.3Å; Q576-Y609 WeakPolarHBondContact O-CA 3.49Å; A577-Y609 HydrophobicContact CB-CD1 4.13Å; A577-Y609 HydrophobicContact CB-CE1 3.76Å; L603-Y609 HydrophobicContact CB-CE2 3.99Å; L603-Y609 HydrophobicContact CD2-CD1 3.95Å; L603-Y609 HydrophobicContact CD2-CD2 3.97Å; L603-Y609 HydrophobicContact CD2-CE1 3.85Å; L603-Y609 HydrophobicContact CD2-CE2 3.86Å; L603-Y609 HydrophobicContact CD2-CG 4.02Å; L603-Y609 HydrophobicContact CG-CE2 4.43Å; Q604-Y609 PolarHBondContact N-OH 3.31Å; T607-Y609 HydrophobicContact CG2-CD2 4.3Å; T607-Y609 HydrophobicContact CG2-CE2 3.73Å; T607-Y609 VanDerWaalsContact O-CD2 3.24Å; T607-Y609 WeakPolarHBondContact O-CD2 3.07Å
610	R	80.1	Confident	66.1	Low	156 Å²	156	92.5 Å²	92.5	59%	0.589	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.2	163.7	175.2	178.1	-90.1	-176.6	-6.4	107.6	W575 Q576 M578	W575-R610 CarbonylContact C-O 3.56Å; W575-R610 VanDerWaalsContact CA-O 3.23Å; W575-R610 WeakPolarHBondContact CA-O 3.28Å; Q576-R610 PolarHBondContact N-O 2.85Å; Q576-R610 PolarHBondContact O-N 2.84Å; M578-R610 HydrophobicContact CE-CB 4.38Å; M578-R610 HydrophobicContact CG-CB 3.91Å; M578-R610 HydrophobicContact SD-CB 3.96Å
611	V	81.5	Confident	65.7	Low	40 Å²	40	97.3 Å²	97.3	24%	0.242	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.2	177.3	-172.3	0	0	0	0	109.5	L548 L560 L573 S574 W575 L600	L548-V611 HydrophobicContact CD2-CB 4.44Å; L548-V611 HydrophobicContact CD2-CG1 4.02Å; L560-V611 HydrophobicContact CD1-CG1 3.69Å; L573-V611 HydrophobicContact CD1-CG1 3.95Å; S574-V611 CarbonylContact O-C 3.56Å; S574-V611 WeakPolarHBondContact O-CA 3.49Å; W575-V611 HydrophobicContact CB-CB 4.48Å; W575-V611 HydrophobicContact CB-CG1 4.42Å; W575-V611 HydrophobicContact CB-CG2 3.94Å; L600-V611 HydrophobicContact CD1-CG1 4.28Å; L600-V611 HydrophobicContact CD1-CG2 3.72Å
612	C	76.4	Confident	65.9	Low	49 Å²	49	99.2 Å²	99.2	33%	0.331	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	127	178.5	-61.1	0	0	0	0	110.4	S574	S574-C612 PolarHBondContact N-O 3.25Å; S574-C612 PolarHBondContact O-N 3.36Å; S574-C612 PolarHBondContact OG-O 3.38Å
613	L	77.8	Confident	66.5	Low	33 Å²	33	96.7 Å²	96.7	17%	0.173	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.7	169.1	-178.7	69.7	0	0	0	108.4	L548 W562 L573 L615	L548-L613 HydrophobicContact CD1-CB 4.31Å; L548-L613 HydrophobicContact CD1-CD2 4.38Å; W562-L613 HydrophobicContact CB-CD2 4.42Å; W562-L613 HydrophobicContact CD2-CD2 4.21Å; W562-L613 HydrophobicContact CG-CD2 4.11Å; L573-L613 HydrophobicContact CD1-CB 4.16Å; L573-L613 HydrophobicContact CD1-CD1 3.99Å; L613-L615 HydrophobicContact CD2-CD2 4.11Å; L613-L615 HydrophobicContact CG-CD2 4.2Å
614	H	74.9	Confident	66.1	Low	95 Å²	95	101.7 Å²	101.7	44%	0.44	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.3	178.7	-56.7	-85.2	0	0	0	109.2	T571 R572 S574	T571-H614 WeakPolarHBondContact CA-O 3.26Å; R572-H614 HydrophobicContact CB-CB 4.26Å; R572-H614 PolarHBondContact N-O 2.79Å; R572-H614 WeakPolarHBondContact O-CB 3.37Å; R572-H614 PolarHBondContact O-CD2 2.93Å; R572-H614 VanDerWaalsContact O-CD2 3.32Å; R572-H614 PolarHBondContact O-N 2.85Å; S574-H614 PolarHBondContact OG-CD2 2.89Å; S574-H614 PolarHBondContact OG-NE2 2.87Å
615	L	68.3	Low	65.6	Low	83 Å²	83	100.1 Å²	100.1	44%	0.435	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	115	175.8	-56.5	178.6	0	0	0	108.3	A546 L568 T571 L613 V617	A546-L615 HydrophobicContact CB-CD1 4.13Å; A546-L615 HydrophobicContact CB-CD2 4.48Å; L568-L615 HydrophobicContact CD1-CD2 3.79Å; L568-L615 HydrophobicContact CD2-CD2 4.16Å; L568-L615 HydrophobicContact CG-CD2 4.47Å; T571-L615 HydrophobicContact CG2-CD2 3.69Å; L613-L615 HydrophobicContact CD2-CD2 4.11Å; L613-L615 HydrophobicContact CG-CD2 4.2Å; L615-V617 PolarHBondContact O-N 3.34Å
616	G	54.2	Low	65.3	Low	35 Å²	35	103.1 Å²	103.1	36%	0.361	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-71.1	119	176.1	0	0	0	0	0	110.5
617	V	40.2	Very low	64.8	Low	136 Å²	136	95.6 Å²	95.6	82%	0.824	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-86.7	127.2	157.9	-173.1	0	0	0	0	105.6	L615 E619	L615-V617 PolarHBondContact O-N 3.34Å; V617-E619 PolarHBondContact O-N 3.37Å
618	S	31.3	Very low	64.2	Low	102 Å²	102	100.7 Å²	100.7	71%	0.713	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-58.3	121.8	167	54.1	0	0	0	0	109.1
619	E	27.5	Very low	62.9	Low	268 Å²	268	94.9 Å²	94.9	100%	1.252	50%	0.504	S	S	*	.			trans	-95.7	0	139.5	-78.9	-169	162.9	0	0	108.2	V617	V617-E619 PolarHBondContact O-N 3.37Å

Retrieved 619 of 619 residues in 2563.7 ms (Link to these results)

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