Z4YL84_MOUSE Loading...

Histone lysine demethylase PHF8

AlphaFold DB , UniProt , Accession Z4YL84, Species MOUSE (Mus musculus, Mouse), Gene Phf8, Length 820 aa.

						>Z4YL84_MOUSE|Z4YL84|Phf8
MASVPVYCLCRLPYDVTRFMIECDMCQDWFHGSCVGVEEEKAADIDLYHCPNCEVLHGPSIMKKRRGSSKGHDNHKGKPLKTGSSMFIRELRGRTFDSSDEVILKPTGSQLTVEFLEENSFSVPILVLKKDGLGMTLPSPSFTVRDVEHYVGSDKEIDVIDVARQADCKMKLGDFVKYYYSGKREKVLNVISLEFSDTRLSNLVETPRIVRKLSWVENLWPEECVFERPNVQKYCLMSVRDSYTDFHIDFGGTSVWYHVLKGEKIFYLIRPTNANLTLFECWSSSSNQNEMFFGDQVEKCYKCSVKQGQTLFIPTGWIHAVLTPVDCLAFGGNFLHSLNIEMQLKAYEIEKRLSTADLFKFPNFETICWYVGKHILDIFRGLRENRRHPASYLVHGGKALNLAFRAWTKKEALPDHEDEIPETVRTVQLIKDLAREIRLVEDIFQQNVGKTSNIFGLQRIFPAGSIPLTKPAHSTSVSMSKLSLPSKNGSKKKGLKPKDIFKKAERKGKQSSALGPAGQLSYNLMDPYSHQALKTGPSQKAKFNMSGTSLNDSDDDSADMDLDGSENPLALLMANGSTKRMKSVSKSRRAKIAKKVDSARLVAEQVMGDEFDLDSDDELQIDERLGKEKANLLIRSKFPRKLPRAKPCSDPNRIREPGEVEFDIEEDYTTDEDMVEGVESKLGNGSGAGGILDLLKASRQVGGPDYAALTEAPASPSTQEAIQGMLCMANLQSSSSSPATSSLQAWWTGGQERSSGSSSSGLGTVSSSPASQRTPGKRPIKRPAYWKNESEEEENASLDEQDSLGACFKDAEYSKNMLEY
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	78.2	Confident	247 Å²	247	94.5 Å²	94.5	100%	1.217	54%	0.536	S	S	*	.				0	125.5	0	-69.9	171.1	171.4	0	0	107.6
2	A	48.3	Very low	79.1	Confident	100 Å²	100	93.4 Å²	93.4	83%	0.826	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-81.2	135.5	169.9	0	0	0	0	0	109
3	S	64.7	Low	79.8	Confident	114 Å²	114	91.3 Å²	91.3	80%	0.797	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-74.4	123.4	171	50.8	0	0	0	0	109.5
4	V	72.8	Confident	80.3	Confident	104 Å²	104	95 Å²	95	63%	0.63	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-56.8	130.5	173.9	-176.7	0	0	0	0	108.9	P13	V4-P13 HydrophobicContact CG1-CB 3.87Å
5	P	80.9	Confident	80.5	Confident	74 Å²	74	92.4 Å²	92.4	48%	0.481	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-65.5	141	-179.6	27.3	-34.9	0	0	0	111	Y7	P5-Y7 HydrophobicContact CB-CE2 3.94Å; P5-Y7 HydrophobicContact CG-CE2 4.06Å
6	V	90.9	Very high	80.6	Confident	69 Å²	69	94.1 Å²	94.1	42%	0.418	52%	0.521	S	S	.	.			trans	-125.1	131.1	-177.7	-66.2	0	0	0	0	112.3	R11 L12	V6-R11 HydrophobicContact CG2-CB 4.38Å; V6-R11 PolarHBondContact O-NH1 2.9Å; V6-L12 CarbonylContact C-O 3.52Å; V6-L12 WeakPolarHBondContact CA-O 3.43Å
7	Y	91.8	Very high	80.6	Confident	71 Å²	71	95.9 Å²	95.9	28%	0.278	54%	0.536	S	S	.	.	B	Isolated β-bridge	trans	-116.5	170.7	-167.6	-56	-87.1	0	0	0	111.3	P5 R11 L12 W29	P5-Y7 HydrophobicContact CB-CE2 3.94Å; P5-Y7 HydrophobicContact CG-CE2 4.06Å; Y7-R11 VanDerWaalsContact O-CA 3.26Å; Y7-R11 WeakPolarHBondContact O-CA 3.4Å; Y7-R11 PolarHBondContact O-N 3.13Å; Y7-R11 VanDerWaalsContact O-N 3.14Å; Y7-L12 PolarHBondContact N-O 2.89Å; Y7-L12 PolarHBondContact O-N 3.33Å; Y7-W29 HydrophobicContact CD1-CB 4Å; Y7-W29 HydrophobicContact CG-CB 4.44Å
8	C	92.8	Very high	80.9	Confident	0 Å²	0	95.3 Å²	95.3	0%	0	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	173	170.9	-168.5	0	0	0	0	114.1	C10 R11 M20 D28 W29 F30 H31	C8-C10 PolarHBondContact O-N 2.86Å; C8-R11 PolarHBondContact O-N 3.08Å; C8-R11 PolarHBondContact O-NE 3.21Å; C8-M20 HydrophobicContact CB-CE 4.33Å; C8-D28 PolarHBondContact N-OD1 3.49Å; C8-W29 WeakPolarHBondContact CA-O 3.48Å; C8-W29 VanDerWaalsContact CB-O 3.27Å; C8-W29 WeakPolarHBondContact CB-O 2.98Å; C8-W29 PolarHBondContact N-O 3.28Å; C8-F30 HydrophobicContact CB-CD1 4.41Å; C8-H31 PolarHBondContact SG-N 3.17Å; C8-H31 VanDerWaalsContact SG-N 3.44Å
9	L	91.6	Very high	81.4	Confident	82 Å²	82	93.6 Å²	93.6	43%	0.429	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-25.7	173.7	-59.6	176.9	0	0	0	112.7	F30 V35	L9-F30 HydrophobicContact CD2-CE1 3.88Å; L9-F30 HydrophobicContact CG-CD1 4.05Å; L9-F30 HydrophobicContact CG-CE1 3.87Å; L9-V35 HydrophobicContact CD1-CG1 4.23Å
10	C	94	Very high	81.9	Confident	50 Å²	50	89.8 Å²	89.8	34%	0.338	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.3	179.6	59.6	0	0	0	0	114.7	C8 L12 H31	C8-C10 PolarHBondContact O-N 2.86Å; C10-L12 VanDerWaalsContact C-N 3.31Å; C10-L12 HydrophobicContact CB-CD1 4.33Å; C10-L12 HydrophobicContact CB-CG 4.22Å; C10-L12 PolarHBondContact O-N 2.7Å; C10-H31 PolarHBondContact SG-ND1 2.81Å; C10-H31 VanDerWaalsContact SG-ND1 3.41Å
11	R	91.9	Very high	82.4	Confident	128 Å²	128	86.6 Å²	86.6	48%	0.483	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	50.2	-179.1	-62.4	-66.1	170.1	-147.3	-9.5	113.7	V6 Y7 C8 D28	V6-R11 HydrophobicContact CG2-CB 4.38Å; V6-R11 PolarHBondContact O-NH1 2.9Å; Y7-R11 VanDerWaalsContact O-CA 3.26Å; Y7-R11 WeakPolarHBondContact O-CA 3.4Å; Y7-R11 PolarHBondContact O-N 3.13Å; Y7-R11 VanDerWaalsContact O-N 3.14Å; C8-R11 PolarHBondContact O-N 3.08Å; C8-R11 PolarHBondContact O-NE 3.21Å; R11-D28 IonicContact CZ-OD2 2.78Å; R11-D28 VanDerWaalsContact CZ-OD2 3.25Å; R11-D28 IonicContact NH1-OD1 2.87Å; R11-D28 IonicContact NH1-OD2 2.67Å; R11-D28 PolarHBondContact NH1-OD2 3.06Å; R11-D28 IonicContact NH2-OD2 3.56Å; R11-D28 PolarHBondContact NH2-OD2 3.33Å
12	L	88.6	Confident	84.9	Confident	82 Å²	82	78.4 Å²	78.4	43%	0.429	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-101.7	157.4	172.2	-65.8	179	0	0	0	110	V6 Y7 C10	V6-L12 CarbonylContact C-O 3.52Å; V6-L12 WeakPolarHBondContact CA-O 3.43Å; Y7-L12 PolarHBondContact N-O 2.89Å; Y7-L12 PolarHBondContact O-N 3.33Å; C10-L12 VanDerWaalsContact C-N 3.31Å; C10-L12 HydrophobicContact CB-CD1 4.33Å; C10-L12 HydrophobicContact CB-CG 4.22Å; C10-L12 PolarHBondContact O-N 2.7Å
13	P	88.6	Confident	87	Confident	66 Å²	66	73.6 Å²	73.6	43%	0.429	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-62.2	167.5	167.7	29.8	-36.8	0	0	0	111.5	V4	V4-P13 HydrophobicContact CG1-CB 3.87Å
14	Y	86	Confident	88.3	Confident	143 Å²	143	71.4 Å²	71.4	56%	0.561	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-63.7	143.3	176.3	178.8	-114	0	0	0	112.1	V16 M20	Y14-V16 HydrophobicContact CD1-CG2 4.36Å; Y14-V16 HydrophobicContact CE1-CG2 3.6Å; Y14-M20 HydrophobicContact CD2-SD 3.63Å; Y14-M20 HydrophobicContact CE2-SD 3.85Å
15	D	84.5	Confident	89.2	Confident	56 Å²	56	70.4 Å²	70.4	30%	0.299	36%	0.36	S	S	.	.			trans	-137.4	111.9	-176.9	179.1	-8.1	0	0	0	109.2	T17 R18	D15-T17 PolarHBondContact O-N 3.28Å; D15-T17 WeakPolarHBondContact OD1-CB 3.44Å; D15-T17 PolarHBondContact OD1-N 2.92Å; D15-T17 PolarHBondContact OD1-OG1 3.37Å; D15-T17 PolarHBondContact OD2-OG1 3.08Å; D15-R18 HydrophobicContact CB-CG 4.4Å; D15-R18 PolarHBondContact O-N 3.48Å; D15-R18 WeakPolarHBondContact OD2-CD 3.33Å; D15-R18 WeakPolarHBondContact OD2-CG 3.5Å
16	V	81.9	Confident	89.7	Confident	120 Å²	120	69.5 Å²	69.5	73%	0.727	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.9	-177.9	173.5	0	0	0	0	112.2	Y14 R18	Y14-V16 HydrophobicContact CD1-CG2 4.36Å; Y14-V16 HydrophobicContact CE1-CG2 3.6Å; V16-R18 PolarHBondContact O-N 2.91Å
17	T	80	Confident	89.7	Confident	124 Å²	124	72.1 Å²	72.1	76%	0.761	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-3.7	-176.5	69.9	0	0	0	0	113.6	D15	D15-T17 PolarHBondContact O-N 3.28Å; D15-T17 WeakPolarHBondContact OD1-CB 3.44Å; D15-T17 PolarHBondContact OD1-N 2.92Å; D15-T17 PolarHBondContact OD1-OG1 3.37Å; D15-T17 PolarHBondContact OD2-OG1 3.08Å
18	R	86.3	Confident	89.6	Confident	85 Å²	85	70 Å²	70	32%	0.321	36%	0.356	S	S	.	.	S	Bend	trans	-125.7	119.1	-169.5	-61.7	-177.5	68.3	-179.8	-0.2	111.7	D15 V16 M20 S33	D15-R18 HydrophobicContact CB-CG 4.4Å; D15-R18 PolarHBondContact O-N 3.48Å; D15-R18 WeakPolarHBondContact OD2-CD 3.33Å; D15-R18 WeakPolarHBondContact OD2-CG 3.5Å; V16-R18 PolarHBondContact O-N 2.91Å; R18-M20 WeakPolarHBondContact O-CG 3.21Å; R18-M20 PolarHBondContact O-N 3.46Å; R18-S33 PolarHBondContact NH2-OG 3.38Å
19	F	89.6	Confident	89.7	Confident	63 Å²	63	74.6 Å²	74.6	28%	0.276	37%	0.373	S	S	.	.			trans	-50.6	125.8	171.8	167.8	-106.6	0	0	0	112	I21 H31 G32 V37 E39 A42	F19-I21 HydrophobicContact CZ-CB 3.97Å; F19-H31 WeakPolarHBondContact O-CA 3.32Å; F19-G32 PolarHBondContact O-N 3.16Å; F19-V37 HydrophobicContact CE1-CG1 4.14Å; F19-E39 HydrophobicContact CB-CB 4.35Å; F19-E39 HydrophobicContact CD1-CB 4.04Å; F19-E39 HydrophobicContact CD2-CB 4.06Å; F19-E39 HydrophobicContact CD2-CG 3.83Å; F19-E39 HydrophobicContact CE1-CB 4.49Å; F19-E39 HydrophobicContact CE2-CG 4.3Å; F19-E39 HydrophobicContact CG-CB 3.84Å; F19-E39 HydrophobicContact CG-CG 4.09Å; F19-A42 HydrophobicContact CE1-CB 4.1Å; F19-A42 HydrophobicContact CE2-CB 4.05Å; F19-A42 HydrophobicContact CZ-CB 3.36Å
20	M	92.3	Very high	89.8	Confident	18 Å²	18	70.9 Å²	70.9	9%	0.089	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152	176.2	-58.9	-166.7	81.2	0	0	111.5	C8 Y14 R18 W29 F30	C8-M20 HydrophobicContact CB-CE 4.33Å; Y14-M20 HydrophobicContact CD2-SD 3.63Å; Y14-M20 HydrophobicContact CE2-SD 3.85Å; R18-M20 WeakPolarHBondContact O-CG 3.21Å; R18-M20 PolarHBondContact O-N 3.46Å; M20-W29 HydrophobicContact CB-CE3 3.9Å; M20-W29 HydrophobicContact CE-CB 3.84Å; M20-W29 WeakPolarHBondContact CE-O 3.31Å; M20-F30 CarbonylContact C-O 3.54Å; M20-F30 VanDerWaalsContact CA-O 3.28Å; M20-F30 WeakPolarHBondContact CA-O 3.38Å
21	I	91.6	Very high	89.8	Confident	23 Å²	23	68.5 Å²	68.5	12%	0.118	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.3	176	-171.6	168.6	0	0	0	110.8	F19 F30 V35 V37 A42 I45 Y48	F19-I21 HydrophobicContact CZ-CB 3.97Å; I21-F30 HydrophobicContact CG2-CB 4.47Å; I21-F30 PolarHBondContact N-O 3.25Å; I21-F30 PolarHBondContact O-N 2.97Å; I21-V35 HydrophobicContact CG2-CG2 4.45Å; I21-V37 HydrophobicContact CD1-CG1 4.37Å; I21-A42 HydrophobicContact CD1-CB 4.11Å; I21-I45 HydrophobicContact CD1-CD1 3.96Å; I21-Y48 HydrophobicContact CB-CD1 4.36Å; I21-Y48 HydrophobicContact CD1-CD1 4.13Å; I21-Y48 HydrophobicContact CD1-CD2 4.04Å; I21-Y48 HydrophobicContact CD1-CG 3.67Å; I21-Y48 HydrophobicContact CG1-CD1 3.84Å; I21-Y48 HydrophobicContact CG1-CG 3.88Å; I21-Y48 HydrophobicContact CG2-CD1 3.82Å; I21-Y48 HydrophobicContact CG2-CE1 3.67Å; I21-Y48 HydrophobicContact CG2-CE2 4.5Å; I21-Y48 HydrophobicContact CG2-CG 4.3Å
22	E	94.1	Very high	89.7	Confident	74 Å²	74	62.5 Å²	62.5	35%	0.346	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.3	178.4	-173.9	164.3	-128.5	0	0	111.7	W29 Y48	E22-W29 HydrophobicContact CB-CD2 3.96Å; E22-W29 HydrophobicContact CB-CE3 4.38Å; E22-W29 HydrophobicContact CB-CG 4.43Å; E22-W29 HydrophobicContact CB-CH2 4.18Å; E22-W29 HydrophobicContact CB-CZ2 3.72Å; E22-W29 HydrophobicContact CB-CZ3 4.48Å; E22-W29 HydrophobicContact CG-CD2 4.48Å; E22-W29 HydrophobicContact CG-CZ2 4.21Å; E22-W29 PolarHBondContact OE1-NE1 3.42Å; E22-Y48 WeakPolarHBondContact O-CD1 3.4Å
23	C	92.6	Very high	89.9	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.325	C	S	.	.			trans	-89.1	112.3	174.4	176.7	0	0	0	0	111.4	M25 C26 Q27 D28 F30 Y48 C50	C23-M25 PolarHBondContact O-N 2.8Å; C23-C26 PolarHBondContact O-N 3.49Å; C23-C26 VanDerWaalsContact O-N 3.13Å; C23-Q27 WeakPolarHBondContact O-CA 3.46Å; C23-Q27 PolarHBondContact O-N 3.24Å; C23-D28 PolarHBondContact N-O 3.1Å; C23-F30 HydrophobicContact CB-CD2 3.99Å; C23-F30 HydrophobicContact CB-CE2 3.61Å; C23-Y48 CarbonylContact C-O 3.58Å; C23-Y48 WeakPolarHBondContact CA-O 3.35Å; C23-Y48 HydrophobicContact CB-CD1 4.14Å; C23-Y48 HydrophobicContact CB-CE1 4.26Å; C23-C50 HydrophobicContact CB-CB 3.96Å; C23-C50 PolarHBondContact SG-N 2.6Å; C23-C50 VanDerWaalsContact SG-SG 3.68Å
24	D	92.3	Very high	90.1	Very high	68 Å²	68	62.1 Å²	62.1	36%	0.364	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-35.1	179.5	-69.3	-89.6	0	0	0	113.3	Q27 L47 Y48	D24-Q27 PolarHBondContact O-NE2 3.07Å; D24-L47 VanDerWaalsContact OD1-CD2 3.24Å; D24-L47 WeakPolarHBondContact OD1-CD2 3.43Å; D24-L47 WeakPolarHBondContact OD2-CA 3.49Å; D24-L47 WeakPolarHBondContact OD2-CB 3.47Å; D24-Y48 PolarHBondContact N-O 3.32Å; D24-Y48 PolarHBondContact OD2-N 2.8Å
25	M	91.7	Very high	90.5	Very high	82 Å²	82	56.7 Å²	56.7	40%	0.404	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-23.7	-175	-66.3	-56.6	-36.3	0	0	115.2	C23 C53 H57	C23-M25 PolarHBondContact O-N 2.8Å; M25-C53 HydrophobicContact CB-CB 3.77Å; M25-C53 HydrophobicContact CG-CB 4.35Å; M25-H57 HydrophobicContact CG-CB 4.01Å; M25-H57 HydrophobicContact SD-CB 4.19Å
26	C	90.9	Very high	90.8	Very high	55 Å²	55	57.1 Å²	57.1	37%	0.372	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-4.2	-178.9	70.3	0	0	0	0	115.3	C23 D28	C23-C26 PolarHBondContact O-N 3.49Å; C23-C26 VanDerWaalsContact O-N 3.13Å; C26-D28 PolarHBondContact O-N 3.22Å
27	Q	90.2	Very high	91.2	Very high	125 Å²	125	52.3 Å²	52.3	58%	0.584	29%	0.291	S	S	*	.			trans	53.6	37.1	177.5	-49.5	-76.6	-71.5	0	0	111.9	C23 D24	C23-Q27 WeakPolarHBondContact O-CA 3.46Å; C23-Q27 PolarHBondContact O-N 3.24Å; D24-Q27 PolarHBondContact O-NE2 3.07Å
28	D	90.8	Very high	91.5	Very high	26 Å²	26	51.5 Å²	51.5	14%	0.139	28%	0.278	C	S	.	.			trans	-117.2	149.6	174.5	-168.1	-7.1	0	0	0	107.4	C8 R11 C23 C26 F30	C8-D28 PolarHBondContact N-OD1 3.49Å; R11-D28 IonicContact CZ-OD2 2.78Å; R11-D28 VanDerWaalsContact CZ-OD2 3.25Å; R11-D28 IonicContact NH1-OD1 2.87Å; R11-D28 IonicContact NH1-OD2 2.67Å; R11-D28 PolarHBondContact NH1-OD2 3.06Å; R11-D28 IonicContact NH2-OD2 3.56Å; R11-D28 PolarHBondContact NH2-OD2 3.33Å; C23-D28 PolarHBondContact N-O 3.1Å; C26-D28 PolarHBondContact O-N 3.22Å; D28-F30 HydrophobicContact CB-CE2 3.91Å; D28-F30 HydrophobicContact CB-CZ 4.1Å; D28-F30 VanDerWaalsContact O-CD2 3.26Å; D28-F30 WeakPolarHBondContact O-CD2 3.23Å; D28-F30 WeakPolarHBondContact O-CE2 3.48Å
29	W	94.3	Very high	91.4	Very high	97 Å²	97	54 Å²	54	37%	0.367	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.4	-169.9	-78.1	67.9	0	0	0	110.9	Y7 C8 M20 E22	Y7-W29 HydrophobicContact CD1-CB 4Å; Y7-W29 HydrophobicContact CG-CB 4.44Å; C8-W29 WeakPolarHBondContact CA-O 3.48Å; C8-W29 VanDerWaalsContact CB-O 3.27Å; C8-W29 WeakPolarHBondContact CB-O 2.98Å; C8-W29 PolarHBondContact N-O 3.28Å; M20-W29 HydrophobicContact CB-CE3 3.9Å; M20-W29 HydrophobicContact CE-CB 3.84Å; M20-W29 WeakPolarHBondContact CE-O 3.31Å; E22-W29 HydrophobicContact CB-CD2 3.96Å; E22-W29 HydrophobicContact CB-CE3 4.38Å; E22-W29 HydrophobicContact CB-CG 4.43Å; E22-W29 HydrophobicContact CB-CH2 4.18Å; E22-W29 HydrophobicContact CB-CZ2 3.72Å; E22-W29 HydrophobicContact CB-CZ3 4.48Å; E22-W29 HydrophobicContact CG-CD2 4.48Å; E22-W29 HydrophobicContact CG-CZ2 4.21Å; E22-W29 PolarHBondContact OE1-NE1 3.42Å
30	F	94.3	Very high	90.8	Very high	3 Å²	3	56 Å²	56	1%	0.013	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119.5	-172.1	-64.6	-90.5	0	0	0	111.5	C8 L9 M20 I21 C23 D28 G32 V35 Y48 C50	C8-F30 HydrophobicContact CB-CD1 4.41Å; L9-F30 HydrophobicContact CD2-CE1 3.88Å; L9-F30 HydrophobicContact CG-CD1 4.05Å; L9-F30 HydrophobicContact CG-CE1 3.87Å; M20-F30 CarbonylContact C-O 3.54Å; M20-F30 VanDerWaalsContact CA-O 3.28Å; M20-F30 WeakPolarHBondContact CA-O 3.38Å; I21-F30 HydrophobicContact CG2-CB 4.47Å; I21-F30 PolarHBondContact N-O 3.25Å; I21-F30 PolarHBondContact O-N 2.97Å; C23-F30 HydrophobicContact CB-CD2 3.99Å; C23-F30 HydrophobicContact CB-CE2 3.61Å; D28-F30 HydrophobicContact CB-CE2 3.91Å; D28-F30 HydrophobicContact CB-CZ 4.1Å; D28-F30 VanDerWaalsContact O-CD2 3.26Å; D28-F30 WeakPolarHBondContact O-CD2 3.23Å; D28-F30 WeakPolarHBondContact O-CE2 3.48Å; F30-G32 PolarHBondContact O-N 2.88Å; F30-V35 HydrophobicContact CB-CG1 3.82Å; F30-V35 HydrophobicContact CB-CG2 4.18Å; F30-V35 HydrophobicContact CD1-CG1 3.83Å; F30-V35 HydrophobicContact CG-CG1 4.1Å; F30-Y48 HydrophobicContact CB-CE1 4.35Å; F30-Y48 HydrophobicContact CD2-CE1 4.07Å; F30-Y48 HydrophobicContact CG-CE1 4.4Å; F30-C50 HydrophobicContact CD1-CB 4.25Å; F30-C50 HydrophobicContact CD2-CB 3.84Å; F30-C50 HydrophobicContact CE1-CB 3.94Å; F30-C50 HydrophobicContact CE2-CB 3.5Å; F30-C50 HydrophobicContact CG-CB 4.22Å; F30-C50 HydrophobicContact CZ-CB 3.57Å; F30-C50 VanDerWaalsContact CZ-SG 3.53Å
31	H	93.4	Very high	90	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	125.2	166.8	-59.4	119.9	0	0	0	109.7	C8 C10 F19 S33 C34 V35	C8-H31 PolarHBondContact SG-N 3.17Å; C8-H31 VanDerWaalsContact SG-N 3.44Å; C10-H31 PolarHBondContact SG-ND1 2.81Å; C10-H31 VanDerWaalsContact SG-ND1 3.41Å; F19-H31 WeakPolarHBondContact O-CA 3.32Å; H31-S33 PolarHBondContact O-N 3.45Å; H31-C34 HydrophobicContact CB-CB 4.14Å; H31-C34 WeakPolarHBondContact O-CA 3.33Å; H31-C34 WeakPolarHBondContact O-CB 3.47Å; H31-C34 PolarHBondContact O-N 2.9Å; H31-V35 PolarHBondContact O-N 2.88Å
32	G	89.8	Confident	89.5	Confident	1 Å²	1	60 Å²	60	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-55	-39.5	-177.4	0	0	0	0	0	112.9	F19 F30 C34 V35 G36 V37	F19-G32 PolarHBondContact O-N 3.16Å; F30-G32 PolarHBondContact O-N 2.88Å; G32-C34 PolarHBondContact O-N 3.37Å; G32-V35 PolarHBondContact O-N 3.04Å; G32-V35 VanDerWaalsContact O-N 3.12Å; G32-G36 PolarHBondContact O-N 3.18Å; G32-V37 CarbonylContact C-O 3.52Å; G32-V37 VanDerWaalsContact C-O 3.26Å; G32-V37 WeakPolarHBondContact CA-O 3.32Å; G32-V37 PolarHBondContact O-N 2.95Å
33	S	93.4	Very high	88.8	Confident	91 Å²	91	58.4 Å²	58.4	64%	0.636	32%	0.322	S	S	*	.	H	α-helix	trans	-57.3	-27.9	173.5	65.3	0	0	0	0	114.7	R18 H31	R18-S33 PolarHBondContact NH2-OG 3.38Å; H31-S33 PolarHBondContact O-N 3.45Å
34	C	92.3	Very high	88.3	Confident	50 Å²	50	60.9 Å²	60.9	34%	0.338	34%	0.335	S	S	.	.	H	α-helix	trans	-90.7	-8.9	-178.1	-65.1	0	0	0	0	113.3	H31 G32	H31-C34 HydrophobicContact CB-CB 4.14Å; H31-C34 WeakPolarHBondContact O-CA 3.33Å; H31-C34 WeakPolarHBondContact O-CB 3.47Å; H31-C34 PolarHBondContact O-N 2.9Å; G32-C34 PolarHBondContact O-N 3.37Å
35	V	94	Very high	88.1	Confident	28 Å²	28	58.5 Å²	58.5	17%	0.17	32%	0.322	C	S	.	.	H	α-helix	trans	-127.9	2.9	-178.3	-65	0	0	0	0	113.6	L9 I21 F30 H31 G32 V37 Y48 P51	L9-V35 HydrophobicContact CD1-CG1 4.23Å; I21-V35 HydrophobicContact CG2-CG2 4.45Å; F30-V35 HydrophobicContact CB-CG1 3.82Å; F30-V35 HydrophobicContact CB-CG2 4.18Å; F30-V35 HydrophobicContact CD1-CG1 3.83Å; F30-V35 HydrophobicContact CG-CG1 4.1Å; H31-V35 PolarHBondContact O-N 2.88Å; G32-V35 PolarHBondContact O-N 3.04Å; G32-V35 VanDerWaalsContact O-N 3.12Å; V35-V37 HydrophobicContact CG2-CB 4.19Å; V35-V37 HydrophobicContact CG2-CG2 3.97Å; V35-Y48 VanDerWaalsContact CB-OH 3.24Å; V35-Y48 WeakPolarHBondContact CB-OH 3.31Å; V35-Y48 WeakPolarHBondContact CG1-OH 3.48Å; V35-Y48 VanDerWaalsContact CG2-OH 3.3Å; V35-Y48 WeakPolarHBondContact CG2-OH 3.46Å; V35-P51 HydrophobicContact CG1-CG 4.41Å
36	G	90.6	Very high	87.7	Confident	65 Å²	65	59 Å²	59	67%	0.67	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	18.4	178.5	0	0	0	0	0	114.6	G32	G32-G36 PolarHBondContact O-N 3.18Å
37	V	90.7	Very high	87.6	Confident	20 Å²	20	59.8 Å²	59.8	12%	0.121	33%	0.327	C	S	.	.			trans	-102.1	109.6	177.7	-179.1	0	0	0	0	109.1	F19 I21 G32 V35 A42 I45 Y48	F19-V37 HydrophobicContact CE1-CG1 4.14Å; I21-V37 HydrophobicContact CD1-CG1 4.37Å; G32-V37 CarbonylContact C-O 3.52Å; G32-V37 VanDerWaalsContact C-O 3.26Å; G32-V37 WeakPolarHBondContact CA-O 3.32Å; G32-V37 PolarHBondContact O-N 2.95Å; V35-V37 HydrophobicContact CG2-CB 4.19Å; V35-V37 HydrophobicContact CG2-CG2 3.97Å; V37-A42 HydrophobicContact CG1-CB 3.88Å; V37-I45 HydrophobicContact CG1-CD1 3.97Å; V37-I45 HydrophobicContact CG2-CD1 4.35Å; V37-Y48 HydrophobicContact CG2-CE2 3.95Å
38	E	87.1	Confident	87.8	Confident	107 Å²	107	54.4 Å²	54.4	50%	0.5	30%	0.301	S	S	.	.			trans	-72.9	148.3	166.3	-68.5	144.4	-134.4	0	0	110.3	E40 K41 A42	E38-E40 VanDerWaalsContact C-N 3.31Å; E38-E40 PolarHBondContact O-N 3.21Å; E38-K41 HydrophobicContact CB-CB 4.44Å; E38-K41 HydrophobicContact CB-CD 4.16Å; E38-K41 HydrophobicContact CB-CG 4.31Å; E38-K41 WeakPolarHBondContact O-CA 3.41Å; E38-K41 WeakPolarHBondContact O-CB 3.39Å; E38-K41 PolarHBondContact O-N 3.33Å; E38-K41 IonicContact OE1-NZ 3.29Å; E38-K41 PolarHBondContact OE1-NZ 2.68Å; E38-K41 WeakPolarHBondContact OE2-CD 3.49Å; E38-K41 WeakPolarHBondContact OE2-CE 3.41Å; E38-K41 IonicContact OE2-NZ 2.66Å; E38-K41 PolarHBondContact OE2-NZ 2.78Å; E38-A42 PolarHBondContact O-N 3.39Å
39	E	83.3	Confident	88	Confident	138 Å²	138	53.8 Å²	53.8	65%	0.645	30%	0.297	S	S	*	.	H	α-helix	trans	-56.4	-41.3	179.7	-175.9	171.5	-169	0	0	112.9	F19 K41 A42	F19-E39 HydrophobicContact CB-CB 4.35Å; F19-E39 HydrophobicContact CD1-CB 4.04Å; F19-E39 HydrophobicContact CD2-CB 4.06Å; F19-E39 HydrophobicContact CD2-CG 3.83Å; F19-E39 HydrophobicContact CE1-CB 4.49Å; F19-E39 HydrophobicContact CE2-CG 4.3Å; F19-E39 HydrophobicContact CG-CB 3.84Å; F19-E39 HydrophobicContact CG-CG 4.09Å; E39-K41 PolarHBondContact O-N 3.21Å; E39-A42 WeakPolarHBondContact O-CB 3.34Å; E39-A42 PolarHBondContact O-N 3.43Å
40	E	77.9	Confident	88	Confident	104 Å²	104	49.2 Å²	49.2	49%	0.486	28%	0.28	S	S	.	.	H	α-helix	trans	-57.5	-36.4	172.4	-78.8	-149.7	-131.3	0	0	113.2	E38 K186	E38-E40 VanDerWaalsContact C-N 3.31Å; E38-E40 PolarHBondContact O-N 3.21Å; E40-K186 IonicContact OE1-NZ 3.01Å; E40-K186 IonicContact OE2-NZ 2.71Å; E40-K186 PolarHBondContact OE2-NZ 3.23Å
41	K	74.9	Confident	88	Confident	110 Å²	110	51.7 Å²	51.7	48%	0.478	30%	0.297	S	S	.	.	H	α-helix	trans	-82	-30.9	-177.1	-68.1	173.3	178.8	156.6	0	111.9	E38 E39 A43 D44	E38-K41 HydrophobicContact CB-CB 4.44Å; E38-K41 HydrophobicContact CB-CD 4.16Å; E38-K41 HydrophobicContact CB-CG 4.31Å; E38-K41 WeakPolarHBondContact O-CA 3.41Å; E38-K41 WeakPolarHBondContact O-CB 3.39Å; E38-K41 PolarHBondContact O-N 3.33Å; E38-K41 IonicContact OE1-NZ 3.29Å; E38-K41 PolarHBondContact OE1-NZ 2.68Å; E38-K41 WeakPolarHBondContact OE2-CD 3.49Å; E38-K41 WeakPolarHBondContact OE2-CE 3.41Å; E38-K41 IonicContact OE2-NZ 2.66Å; E38-K41 PolarHBondContact OE2-NZ 2.78Å; E39-K41 PolarHBondContact O-N 3.21Å; K41-A43 PolarHBondContact O-N 3.08Å; K41-D44 PolarHBondContact O-N 2.87Å
42	A	81.8	Confident	88.1	Confident	16 Å²	16	56.7 Å²	56.7	13%	0.132	32%	0.324	C	S	.	.	H	α-helix	trans	-56.7	-36.3	174.2	0	0	0	0	0	112.4	F19 I21 V37 E38 E39 D44 I45	F19-A42 HydrophobicContact CE1-CB 4.1Å; F19-A42 HydrophobicContact CE2-CB 4.05Å; F19-A42 HydrophobicContact CZ-CB 3.36Å; I21-A42 HydrophobicContact CD1-CB 4.11Å; V37-A42 HydrophobicContact CG1-CB 3.88Å; E38-A42 PolarHBondContact O-N 3.39Å; E39-A42 WeakPolarHBondContact O-CB 3.34Å; E39-A42 PolarHBondContact O-N 3.43Å; A42-D44 PolarHBondContact O-N 2.72Å; A42-I45 WeakPolarHBondContact O-CB 3.48Å; A42-I45 PolarHBondContact O-N 3.17Å
43	A	77.9	Confident	88.3	Confident	39 Å²	39	57.3 Å²	57.3	32%	0.322	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-27	176.4	0	0	0	0	0	113.9	K41 K63	K41-A43 PolarHBondContact O-N 3.08Å; A43-K63 VanDerWaalsContact O-CD 3.26Å; A43-K63 WeakPolarHBondContact O-CD 3.19Å; A43-K63 PolarHBondContact O-NZ 3.08Å
44	D	82.8	Confident	88.3	Confident	53 Å²	53	57.2 Å²	57.2	28%	0.283	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-6.6	176.9	-106	-10.4	0	0	0	113.3	K41 A42 M62 K63 R65	K41-D44 PolarHBondContact O-N 2.87Å; A42-D44 PolarHBondContact O-N 2.72Å; D44-M62 HydrophobicContact CB-CE 3.94Å; D44-M62 WeakPolarHBondContact O-CE 3.34Å; D44-K63 WeakPolarHBondContact O-CB 3.33Å; D44-K63 PolarHBondContact O-N 3.29Å; D44-R65 IonicContact OD1-NE 2.78Å; D44-R65 IonicContact OD2-CZ 3.79Å; D44-R65 VanDerWaalsContact OD2-CZ 3.29Å; D44-R65 IonicContact OD2-NE 3.25Å; D44-R65 PolarHBondContact OD2-NE 3.36Å; D44-R65 VanDerWaalsContact OD2-NE 3.14Å; D44-R65 IonicContact OD2-NH2 3.47Å; D44-R65 PolarHBondContact OD2-NH2 3.41Å
45	I	87.4	Confident	88.4	Confident	18 Å²	18	60.8 Å²	60.8	9%	0.092	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136.4	174	-54.3	176.7	0	0	0	109.4	I21 V37 A42 L47 Y48 M62 K63	I21-I45 HydrophobicContact CD1-CD1 3.96Å; V37-I45 HydrophobicContact CG1-CD1 3.97Å; V37-I45 HydrophobicContact CG2-CD1 4.35Å; A42-I45 WeakPolarHBondContact O-CB 3.48Å; A42-I45 PolarHBondContact O-N 3.17Å; I45-L47 WeakPolarHBondContact CG2-O 3.32Å; I45-Y48 HydrophobicContact CD1-CD2 4.16Å; I45-M62 HydrophobicContact CG1-CE 3.99Å; I45-M62 HydrophobicContact CG1-SD 3.87Å; I45-K63 WeakPolarHBondContact O-CE 3.23Å; I45-K63 PolarHBondContact O-NZ 3.16Å
46	D	84.5	Confident	88.2	Confident	93 Å²	93	65.9 Å²	65.9	50%	0.497	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-43.4	179	-139.9	20.5	0	0	0	111.3	I61 K63	D46-I61 WeakPolarHBondContact CA-O 3.46Å; D46-I61 HydrophobicContact CB-CG2 4.3Å; D46-I61 VanDerWaalsContact CB-O 3.24Å; D46-I61 WeakPolarHBondContact CB-O 3.48Å; D46-I61 PolarHBondContact N-O 3.03Å; D46-K63 HydrophobicContact CB-CG 3.69Å; D46-K63 WeakPolarHBondContact OD1-CG 3.34Å
47	L	89.5	Confident	88.1	Confident	71 Å²	71	67.4 Å²	67.4	37%	0.372	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	127.2	170.5	-58	168	0	0	0	108	D24 I45 I61	D24-L47 VanDerWaalsContact OD1-CD2 3.24Å; D24-L47 WeakPolarHBondContact OD1-CD2 3.43Å; D24-L47 WeakPolarHBondContact OD2-CA 3.49Å; D24-L47 WeakPolarHBondContact OD2-CB 3.47Å; I45-L47 WeakPolarHBondContact CG2-O 3.32Å; L47-I61 HydrophobicContact CB-CB 4.21Å; L47-I61 HydrophobicContact CB-CD1 4.42Å; L47-I61 HydrophobicContact CD1-CD1 3.9Å; L47-I61 PolarHBondContact N-O 3.31Å; L47-I61 VanDerWaalsContact N-O 3.15Å; L47-I61 PolarHBondContact O-N 3.13Å
48	Y	94	Very high	88.1	Confident	11 Å²	11	67.8 Å²	67.8	4%	0.043	36%	0.36	C	S	.	.			trans	-97.7	128.1	-176.6	174.4	-112.4	0	0	0	111.6	I21 E22 C23 D24 F30 V35 V37 I45 C50 S60	I21-Y48 HydrophobicContact CB-CD1 4.36Å; I21-Y48 HydrophobicContact CD1-CD1 4.13Å; I21-Y48 HydrophobicContact CD1-CD2 4.04Å; I21-Y48 HydrophobicContact CD1-CG 3.67Å; I21-Y48 HydrophobicContact CG1-CD1 3.84Å; I21-Y48 HydrophobicContact CG1-CG 3.88Å; I21-Y48 HydrophobicContact CG2-CD1 3.82Å; I21-Y48 HydrophobicContact CG2-CE1 3.67Å; I21-Y48 HydrophobicContact CG2-CE2 4.5Å; I21-Y48 HydrophobicContact CG2-CG 4.3Å; E22-Y48 WeakPolarHBondContact O-CD1 3.4Å; C23-Y48 CarbonylContact C-O 3.58Å; C23-Y48 WeakPolarHBondContact CA-O 3.35Å; C23-Y48 HydrophobicContact CB-CD1 4.14Å; C23-Y48 HydrophobicContact CB-CE1 4.26Å; D24-Y48 PolarHBondContact N-O 3.32Å; D24-Y48 PolarHBondContact OD2-N 2.8Å; F30-Y48 HydrophobicContact CB-CE1 4.35Å; F30-Y48 HydrophobicContact CD2-CE1 4.07Å; F30-Y48 HydrophobicContact CG-CE1 4.4Å; V35-Y48 VanDerWaalsContact CB-OH 3.24Å; V35-Y48 WeakPolarHBondContact CB-OH 3.31Å; V35-Y48 WeakPolarHBondContact CG1-OH 3.48Å; V35-Y48 VanDerWaalsContact CG2-OH 3.3Å; V35-Y48 WeakPolarHBondContact CG2-OH 3.46Å; V37-Y48 HydrophobicContact CG2-CE2 3.95Å; I45-Y48 HydrophobicContact CD1-CD2 4.16Å; Y48-C50 HydrophobicContact CE1-CB 3.97Å; Y48-C50 WeakPolarHBondContact OH-CA 3.46Å; Y48-S60 WeakPolarHBondContact CD2-OG 3.46Å
49	H	94.3	Very high	88.3	Confident	13 Å²	13	66.8 Å²	66.8	6%	0.06	36%	0.363	C	S	.	.			trans	-112.5	119.1	171.7	-61.1	172.3	0	0	0	108.7	G58 P59 S60	H49-G58 PolarHBondContact ND1-O 3.43Å; H49-P59 PolarHBondContact ND1-O 3.22Å; H49-S60 PolarHBondContact N-OG 3.29Å; H49-S60 PolarHBondContact O-OG 3.13Å
50	C	94.6	Very high	88.7	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.007	34%	0.342	C	S	.	.			trans	-68.3	162	175.7	77.4	0	0	0	0	111.8	C23 F30 Y48 N52 C53 E54	C23-C50 HydrophobicContact CB-CB 3.96Å; C23-C50 PolarHBondContact SG-N 2.6Å; C23-C50 VanDerWaalsContact SG-SG 3.68Å; F30-C50 HydrophobicContact CD1-CB 4.25Å; F30-C50 HydrophobicContact CD2-CB 3.84Å; F30-C50 HydrophobicContact CE1-CB 3.94Å; F30-C50 HydrophobicContact CE2-CB 3.5Å; F30-C50 HydrophobicContact CG-CB 4.22Å; F30-C50 HydrophobicContact CZ-CB 3.57Å; F30-C50 VanDerWaalsContact CZ-SG 3.53Å; Y48-C50 HydrophobicContact CE1-CB 3.97Å; Y48-C50 WeakPolarHBondContact OH-CA 3.46Å; C50-N52 PolarHBondContact O-N 3.16Å; C50-C53 WeakPolarHBondContact O-CA 3.4Å; C50-C53 PolarHBondContact O-N 3.47Å; C50-E54 PolarHBondContact O-N 3.42Å
51	P	95.1	Very high	89.2	Confident	56 Å²	56	60.5 Å²	60.5	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-55.1	-27.8	-173.9	-29.7	36.4	0	0	0	115.5	V35	V35-P51 HydrophobicContact CG1-CG 4.41Å
52	N	94.3	Very high	89.7	Confident	106 Å²	106	60 Å²	60	57%	0.567	34%	0.339	S	S	*	.	H	α-helix	trans	-75.9	-37.6	175.3	-65.9	-32.3	0	0	0	112.5	C50	C50-N52 PolarHBondContact O-N 3.16Å
53	C	94.2	Very high	89.7	Confident	13 Å²	13	63.5 Å²	63.5	9%	0.088	35%	0.351	C	S	.	.	H	α-helix	trans	-79.4	-31.4	178.8	-70.1	0	0	0	0	112.1	M25 C50 V55 L56 H57	M25-C53 HydrophobicContact CB-CB 3.77Å; M25-C53 HydrophobicContact CG-CB 4.35Å; C50-C53 WeakPolarHBondContact O-CA 3.4Å; C50-C53 PolarHBondContact O-N 3.47Å; C53-V55 VanDerWaalsContact C-N 3.25Å; C53-V55 PolarHBondContact O-N 3.32Å; C53-L56 PolarHBondContact O-N 3.33Å; C53-H57 PolarHBondContact O-CD2 2.94Å; C53-H57 PolarHBondContact O-N 2.95Å
54	E	93.2	Very high	89.4	Confident	89 Å²	89	70.9 Å²	70.9	42%	0.416	38%	0.376	S	S	.	.	H	α-helix	trans	-54.9	-40.6	177	170.9	166.1	-155.6	0	0	112.4	C50 L56 G58 P59	C50-E54 PolarHBondContact O-N 3.42Å; E54-L56 PolarHBondContact O-N 3.04Å; E54-G58 WeakPolarHBondContact CA-O 3.46Å; E54-G58 CarbonylContact O-C 3.52Å; E54-G58 VanDerWaalsContact O-CA 3.27Å; E54-G58 WeakPolarHBondContact O-CA 3.49Å; E54-G58 PolarHBondContact O-N 3.44Å; E54-P59 WeakPolarHBondContact OE1-CB 3.46Å
55	V	93.6	Very high	88.1	Confident	125 Å²	125	77.9 Å²	77.9	76%	0.758	40%	0.398	S	S	*	.	H	α-helix	trans	-62.8	-25.5	178.1	178.5	0	0	0	0	112.8	C53	C53-V55 VanDerWaalsContact C-N 3.25Å; C53-V55 PolarHBondContact O-N 3.32Å
56	L	90.6	Very high	86.2	Confident	135 Å²	135	87.7 Å²	87.7	71%	0.707	43%	0.434	S	S	*	.	H	α-helix	trans	-105	-29.6	-175.6	-62.7	177	0	0	0	113.6	C53 E54	C53-L56 PolarHBondContact O-N 3.33Å; E54-L56 PolarHBondContact O-N 3.04Å
57	H	89	Confident	84.1	Confident	97 Å²	97	86.2 Å²	86.2	45%	0.449	44%	0.441	S	S	.	.	H	α-helix	trans	-122.2	-2.8	-170	-56.3	-67.7	0	0	0	113.8	M25 C53	M25-H57 HydrophobicContact CG-CB 4.01Å; M25-H57 HydrophobicContact SD-CB 4.19Å; C53-H57 PolarHBondContact O-CD2 2.94Å; C53-H57 PolarHBondContact O-N 2.95Å
58	G	89.8	Confident	81.9	Confident	28 Å²	28	89 Å²	89	29%	0.289	47%	0.467	S	S	.	.			trans	87.5	171.1	-175.2	0	0	0	0	0	113	H49 E54	H49-G58 PolarHBondContact ND1-O 3.43Å; E54-G58 WeakPolarHBondContact CA-O 3.46Å; E54-G58 CarbonylContact O-C 3.52Å; E54-G58 VanDerWaalsContact O-CA 3.27Å; E54-G58 WeakPolarHBondContact O-CA 3.49Å; E54-G58 PolarHBondContact O-N 3.44Å
59	P	92.4	Very high	79.2	Confident	87 Å²	87	93.8 Å²	93.8	57%	0.565	50%	0.501	S	S	*	.	S	Bend	trans	-61.8	161.3	-177.9	26.5	-36.2	0	0	0	112.9	H49 E54	H49-P59 PolarHBondContact ND1-O 3.22Å; E54-P59 WeakPolarHBondContact OE1-CB 3.46Å
60	S	90.2	Very high	76.8	Confident	29 Å²	29	103.5 Å²	103.5	20%	0.203	54%	0.543	C	S	.	.			trans	-51.1	138.9	172	-66.3	0	0	0	0	111.9	Y48 H49 M62	Y48-S60 WeakPolarHBondContact CD2-OG 3.46Å; H49-S60 PolarHBondContact N-OG 3.29Å; H49-S60 PolarHBondContact O-OG 3.13Å; S60-M62 PolarHBondContact O-N 3.4Å
61	I	88.6	Confident	73.8	Confident	80 Å²	80	106.9 Å²	106.9	41%	0.41	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.7	112.7	-176.9	-64.1	167.3	0	0	0	108.2	D46 L47	D46-I61 WeakPolarHBondContact CA-O 3.46Å; D46-I61 HydrophobicContact CB-CG2 4.3Å; D46-I61 VanDerWaalsContact CB-O 3.24Å; D46-I61 WeakPolarHBondContact CB-O 3.48Å; D46-I61 PolarHBondContact N-O 3.03Å; L47-I61 HydrophobicContact CB-CB 4.21Å; L47-I61 HydrophobicContact CB-CD1 4.42Å; L47-I61 HydrophobicContact CD1-CD1 3.9Å; L47-I61 PolarHBondContact N-O 3.31Å; L47-I61 VanDerWaalsContact N-O 3.15Å; L47-I61 PolarHBondContact O-N 3.13Å
62	M	85.4	Confident	71.2	Confident	99 Å²	99	113.3 Å²	113.3	49%	0.488	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.5	144.2	178.6	-56.4	-56.2	-67.5	0	0	112.1	D44 I45 S60 K64	D44-M62 HydrophobicContact CB-CE 3.94Å; D44-M62 WeakPolarHBondContact O-CE 3.34Å; I45-M62 HydrophobicContact CG1-CE 3.99Å; I45-M62 HydrophobicContact CG1-SD 3.87Å; S60-M62 PolarHBondContact O-N 3.4Å; M62-K64 PolarHBondContact O-N 2.95Å
63	K	82.2	Confident	68.7	Low	91 Å²	91	113 Å²	113	40%	0.396	60%	0.601	S	S	.	*			trans	-57.7	130.4	172.3	-79.5	163.4	178.2	134.8	0	109.7	A43 D44 I45 D46 R65	A43-K63 VanDerWaalsContact O-CD 3.26Å; A43-K63 WeakPolarHBondContact O-CD 3.19Å; A43-K63 PolarHBondContact O-NZ 3.08Å; D44-K63 WeakPolarHBondContact O-CB 3.33Å; D44-K63 PolarHBondContact O-N 3.29Å; I45-K63 WeakPolarHBondContact O-CE 3.23Å; I45-K63 PolarHBondContact O-NZ 3.16Å; D46-K63 HydrophobicContact CB-CG 3.69Å; D46-K63 WeakPolarHBondContact OD1-CG 3.34Å; K63-R65 PolarHBondContact O-N 3.37Å
64	K	72.3	Confident	66.1	Low	194 Å²	194	119.7 Å²	119.7	84%	0.843	64%	0.636	S	S	*	*			trans	-70.2	86.7	-176.1	-71.7	177.1	-179.1	167.4	0	111.6	M62 R66	M62-K64 PolarHBondContact O-N 2.95Å; K64-R66 PolarHBondContact O-N 3.41Å
65	R	54.2	Low	63.7	Low	199 Å²	199	123 Å²	123	75%	0.751	65%	0.652	S	S	*	*			trans	-50.6	106.6	165.6	-74.6	-172.4	175.7	-157.6	0.8	109.1	D44 K63 G67	D44-R65 IonicContact OD1-NE 2.78Å; D44-R65 IonicContact OD2-CZ 3.79Å; D44-R65 VanDerWaalsContact OD2-CZ 3.29Å; D44-R65 IonicContact OD2-NE 3.25Å; D44-R65 PolarHBondContact OD2-NE 3.36Å; D44-R65 VanDerWaalsContact OD2-NE 3.14Å; D44-R65 IonicContact OD2-NH2 3.47Å; D44-R65 PolarHBondContact OD2-NH2 3.41Å; K63-R65 PolarHBondContact O-N 3.37Å; R65-G67 VanDerWaalsContact C-N 3.26Å; R65-G67 PolarHBondContact O-N 2.91Å
66	R	48.3	Very low	61.3	Low	225 Å²	225	125.2 Å²	125.2	85%	0.849	65%	0.651	S	S	*	*			trans	-73.8	81.6	175.7	-70.1	-171.3	179.6	-161.6	-0.5	109.4	K64	K64-R66 PolarHBondContact O-N 3.41Å
67	G	39.8	Very low	59.6	Low	62 Å²	62	122.2 Å²	122.2	64%	0.639	65%	0.653	S	S	*	*			trans	-55.9	140.1	176.2	0	0	0	0	0	111.8	R65 S69	R65-G67 VanDerWaalsContact C-N 3.26Å; R65-G67 PolarHBondContact O-N 2.91Å; G67-S69 PolarHBondContact O-N 3.44Å
68	S	44.1	Very low	58.4	Low	130 Å²	130	126 Å²	126	91%	0.909	67%	0.668	S	S	*	*			trans	-58.4	128.4	-177.3	-172.2	0	0	0	0	111.4
69	S	36.9	Very low	57.8	Low	110 Å²	110	128 Å²	128	77%	0.769	68%	0.676	S	S	*	*			trans	-146.2	134.7	174.1	-77.7	0	0	0	0	109.1	G67 G71	G67-S69 PolarHBondContact O-N 3.44Å; S69-G71 PolarHBondContact O-N 3.04Å; S69-G71 VanDerWaalsContact O-N 3.16Å
70	K	43.6	Very low	57.6	Low	218 Å²	218	127 Å²	127	95%	0.948	67%	0.666	S	S	*	*			trans	-64.8	114.3	-174.3	-65.4	176.8	179.9	176.6	0	110.4
71	G	31.7	Very low	57.6	Low	72 Å²	72	131 Å²	131	74%	0.742	68%	0.679	S	S	*	*			trans	-161.6	138.3	175.2	0	0	0	0	0	110.5	S69	S69-G71 PolarHBondContact O-N 3.04Å; S69-G71 VanDerWaalsContact O-N 3.16Å
72	H	40.2	Very low	57.9	Low	190 Å²	190	127.4 Å²	127.4	88%	0.88	66%	0.661	S	S	*	*			trans	-78.9	143.3	-176.5	-129.1	-96.1	0	0	0	111.6
73	D	43.3	Very low	58.2	Low	99 Å²	99	122.9 Å²	122.9	53%	0.529	64%	0.64	S	S	.	*	S	Bend	trans	45.4	78.2	154	-162.2	13.3	0	0	0	118.3	K76	D73-K76 WeakPolarHBondContact OD1-CE 3.4Å; D73-K76 IonicContact OD1-NZ 3.36Å; D73-K76 PolarHBondContact OD1-NZ 2.79Å; D73-K76 IonicContact OD2-NZ 2.73Å; D73-K76 PolarHBondContact OD2-NZ 3.44Å
74	N	38.5	Very low	58.9	Low	154 Å²	154	119.7 Å²	119.7	82%	0.824	63%	0.629	S	S	*	*			trans	-151.8	50.9	159.8	-148.9	-9.9	0	0	0	114.5
75	H	43.6	Very low	59.9	Low	160 Å²	160	115.4 Å²	115.4	74%	0.741	62%	0.623	S	S	*	*			trans	-125.7	25.1	178.2	-98.9	-86.7	0	0	0	113.5	G77	H75-G77 VanDerWaalsContact C-N 3.31Å; H75-G77 PolarHBondContact O-N 3.21Å
76	K	42.4	Very low	61.8	Low	171 Å²	171	110 Å²	110	74%	0.743	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	41.2	-177.1	-69.4	169.8	172.7	153.2	0	113.7	D73	D73-K76 WeakPolarHBondContact OD1-CE 3.4Å; D73-K76 IonicContact OD1-NZ 3.36Å; D73-K76 PolarHBondContact OD1-NZ 2.79Å; D73-K76 IonicContact OD2-NZ 2.73Å; D73-K76 PolarHBondContact OD2-NZ 3.44Å
77	G	55.2	Low	64.1	Low	72 Å²	72	99.8 Å²	99.8	74%	0.742	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170.1	19.7	-170.1	0	0	0	0	0	117.5	H75	H75-G77 VanDerWaalsContact C-N 3.31Å; H75-G77 PolarHBondContact O-N 3.21Å
78	K	64.3	Low	66.9	Low	175 Å²	175	97.1 Å²	97.1	76%	0.761	54%	0.541	S	S	*	.	S	Bend	trans	-133.7	135.3	161.5	-72.9	-157.6	170.7	-147.2	0	108.3
79	P	77.3	Confident	69.4	Low	71 Å²	71	99 Å²	99	46%	0.461	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-65.2	162.7	175.7	29.8	-36	0	0	0	111.1	E290	P79-E290 HydrophobicContact CB-CB 4.06Å; P79-E290 HydrophobicContact CG-CB 3.72Å; P79-E290 HydrophobicContact CG-CG 4.01Å; P79-E290 WeakPolarHBondContact CG-OE2 3.42Å
80	L	88	Confident	72.2	Confident	67 Å²	67	97.8 Å²	97.8	35%	0.351	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-78.2	131.1	176.2	-71.3	172.7	0	0	0	109.6	M86 E90	L80-M86 HydrophobicContact CD2-CB 3.73Å; L80-M86 HydrophobicContact CD2-CE 4.48Å; L80-E90 WeakPolarHBondContact CD1-OE2 3.39Å
81	K	90.9	Very high	74.8	Confident	112 Å²	112	87.5 Å²	87.5	49%	0.487	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-80.1	136.4	174.4	-73.5	-172.9	172.7	-65.4	0	111.5	S84 F87 N289 E290	K81-S84 VanDerWaalsContact O-CB 3.29Å; K81-S84 WeakPolarHBondContact O-CB 3.32Å; K81-S84 PolarHBondContact O-N 3.39Å; K81-S84 PolarHBondContact O-OG 2.97Å; K81-F87 VanDerWaalsContact O-CB 3.22Å; K81-F87 WeakPolarHBondContact O-CB 3.46Å; K81-N289 VanDerWaalsContact CA-O 3.28Å; K81-N289 WeakPolarHBondContact CA-O 3.36Å; K81-E290 WeakPolarHBondContact CE-OE1 3.46Å; K81-E290 HydrophobicContact CG-CG 4.3Å; K81-E290 IonicContact NZ-OE1 3.14Å; K81-E290 PolarHBondContact NZ-OE1 2.95Å
82	T	93.4	Very high	77.9	Confident	4 Å²	4	88.2 Å²	88.2	3%	0.025	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	143.4	169.6	-61.6	0	0	0	0	111.1	S84 F87 Q165 Y243 D245 N289	T82-S84 PolarHBondContact O-N 2.78Å; T82-F87 HydrophobicContact CG2-CE1 4.37Å; T82-F87 HydrophobicContact CG2-CZ 4.23Å; T82-Q165 HydrophobicContact CG2-CG 3.74Å; T82-Y243 HydrophobicContact CG2-CD1 4.07Å; T82-Y243 HydrophobicContact CG2-CE1 3.62Å; T82-D245 HydrophobicContact CG2-CB 3.88Å; T82-D245 WeakPolarHBondContact CG2-OD2 3.3Å; T82-D245 PolarHBondContact OG1-OD2 3.11Å; T82-N289 PolarHBondContact N-O 2.99Å; T82-N289 PolarHBondContact OG1-O 2.72Å
83	G	93.1	Very high	80.5	Confident	5 Å²	5	82.2 Å²	82.2	5%	0.052	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	-13.8	177	0	0	0	0	0	116	V162	G83-V162 CarbonylContact C-O 3.56Å; G83-V162 WeakPolarHBondContact CA-O 3.3Å
84	S	95	Very high	83	Confident	24 Å²	24	80.5 Å²	80.5	17%	0.168	42%	0.421	C	S	.	.	S	Bend	trans	-64	149.8	176	72.5	0	0	0	0	112.3	K81 T82 M86 F87 I88	K81-S84 VanDerWaalsContact O-CB 3.29Å; K81-S84 WeakPolarHBondContact O-CB 3.32Å; K81-S84 PolarHBondContact O-N 3.39Å; K81-S84 PolarHBondContact O-OG 2.97Å; T82-S84 PolarHBondContact O-N 2.78Å; S84-M86 PolarHBondContact O-N 3.5Å; S84-F87 WeakPolarHBondContact O-CA 3.25Å; S84-F87 WeakPolarHBondContact O-CB 3.44Å; S84-F87 PolarHBondContact O-N 2.73Å; S84-F87 WeakPolarHBondContact OG-CB 3.48Å; S84-F87 PolarHBondContact OG-N 3.13Å; S84-I88 WeakPolarHBondContact O-CG1 3.18Å; S84-I88 PolarHBondContact O-N 3.24Å
85	S	94.3	Very high	85.8	Confident	103 Å²	103	79.8 Å²	79.8	72%	0.72	42%	0.423	S	S	*	.	H	α-helix	trans	-59.4	-23.5	-179.1	59.7	0	0	0	0	114.3	R89	S85-R89 PolarHBondContact O-N 3.39Å
86	M	94.5	Very high	88.3	Confident	85 Å²	85	74.5 Å²	74.5	42%	0.419	40%	0.397	S	S	.	.	H	α-helix	trans	-73.5	-45.4	171	-72.7	-73.5	-64.9	0	0	111.9	L80 S84 R89 E90	L80-M86 HydrophobicContact CD2-CB 3.73Å; L80-M86 HydrophobicContact CD2-CE 4.48Å; S84-M86 PolarHBondContact O-N 3.5Å; M86-R89 VanDerWaalsContact CE-NH2 3.34Å; M86-R89 PolarHBondContact O-N 3.47Å; M86-R89 PolarHBondContact SD-NH1 2.98Å; M86-R89 PolarHBondContact SD-NH2 3.2Å; M86-E90 PolarHBondContact O-N 2.86Å; M86-E90 VanDerWaalsContact O-N 3.09Å
87	F	96.6	Very high	91	Very high	12 Å²	12	68.4 Å²	68.4	5%	0.053	37%	0.373	C	S	.	.	H	α-helix	trans	-59.7	-47.1	173.5	165.5	-88.9	0	0	0	111.5	K81 T82 S84 R89 E90 L91 Y243 F292	K81-F87 VanDerWaalsContact O-CB 3.22Å; K81-F87 WeakPolarHBondContact O-CB 3.46Å; T82-F87 HydrophobicContact CG2-CE1 4.37Å; T82-F87 HydrophobicContact CG2-CZ 4.23Å; S84-F87 WeakPolarHBondContact O-CA 3.25Å; S84-F87 WeakPolarHBondContact O-CB 3.44Å; S84-F87 PolarHBondContact O-N 2.73Å; S84-F87 WeakPolarHBondContact OG-CB 3.48Å; S84-F87 PolarHBondContact OG-N 3.13Å; F87-R89 VanDerWaalsContact C-N 3.27Å; F87-R89 PolarHBondContact O-N 3.38Å; F87-E90 PolarHBondContact O-N 3.29Å; F87-E90 VanDerWaalsContact O-N 3.08Å; F87-L91 HydrophobicContact CE1-CD2 3.94Å; F87-L91 HydrophobicContact CZ-CD2 4.29Å; F87-L91 WeakPolarHBondContact O-CB 3.43Å; F87-L91 PolarHBondContact O-N 2.94Å; F87-Y243 AromaticContact CE1-CD1 3.81Å; F87-Y243 HydrophobicContact CE1-CD1 3.81Å; F87-Y243 HydrophobicContact CE1-CD2 4.25Å; F87-Y243 AromaticContact CE1-CE1 3.61Å; F87-Y243 HydrophobicContact CE1-CE1 3.61Å; F87-Y243 HydrophobicContact CE1-CE2 4.07Å; F87-Y243 HydrophobicContact CE1-CG 4.12Å; F87-Y243 AromaticContact CE1-CZ 3.75Å; F87-Y243 HydrophobicContact CZ-CD1 4.42Å; F87-Y243 AromaticContact CZ-CE1 3.75Å; F87-Y243 HydrophobicContact CZ-CE1 3.75Å; F87-Y243 HydrophobicContact CZ-CE2 4.28Å; F87-Y243 AromaticContact CZ-CZ 3.67Å; F87-F292 AromaticContact CE2-CD2 3.87Å; F87-F292 HydrophobicContact CE2-CD2 3.87Å; F87-F292 AromaticContact CZ-CD2 3.92Å; F87-F292 HydrophobicContact CZ-CD2 3.92Å; F87-F292 HydrophobicContact CZ-CE2 4.37Å
88	I	97.6	Very high	93	Very high	6 Å²	6	67.5 Å²	67.5	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-36.9	178	-57.2	-63.6	0	0	0	111.7	S84 R92 D241 Y243 L322	S84-I88 WeakPolarHBondContact O-CG1 3.18Å; S84-I88 PolarHBondContact O-N 3.24Å; I88-R92 WeakPolarHBondContact O-CB 3.49Å; I88-R92 VanDerWaalsContact O-CG 3.3Å; I88-R92 WeakPolarHBondContact O-CG 3.35Å; I88-R92 PolarHBondContact O-N 3.28Å; I88-D241 HydrophobicContact CG2-CB 4.06Å; I88-D241 WeakPolarHBondContact CG2-OD1 3.41Å; I88-Y243 VanDerWaalsContact CD1-CB 3.48Å; I88-Y243 HydrophobicContact CD1-CD2 4.32Å; I88-Y243 HydrophobicContact CD1-CG 3.96Å; I88-L322 HydrophobicContact CD1-CD1 4.11Å; I88-L322 HydrophobicContact CG2-CD1 3.92Å
89	R	96.5	Very high	94.6	Very high	169 Å²	169	59.4 Å²	59.4	64%	0.638	32%	0.321	S	S	*	.	H	α-helix	trans	-67.2	-37.3	175.9	-167.3	-179.6	71.3	-142.4	-1.4	112.4	S85 M86 F87	S85-R89 PolarHBondContact O-N 3.39Å; M86-R89 VanDerWaalsContact CE-NH2 3.34Å; M86-R89 PolarHBondContact O-N 3.47Å; M86-R89 PolarHBondContact SD-NH1 2.98Å; M86-R89 PolarHBondContact SD-NH2 3.2Å; F87-R89 VanDerWaalsContact C-N 3.27Å; F87-R89 PolarHBondContact O-N 3.38Å
90	E	96.4	Very high	95.5	Very high	84 Å²	84	60.8 Å²	60.8	39%	0.393	32%	0.324	S	S	.	.	H	α-helix	trans	-69.4	-47.7	173.6	-169.5	-177.6	114	0	0	111.4	L80 M86 F87 R92 G93 R94	L80-E90 WeakPolarHBondContact CD1-OE2 3.39Å; M86-E90 PolarHBondContact O-N 2.86Å; M86-E90 VanDerWaalsContact O-N 3.09Å; F87-E90 PolarHBondContact O-N 3.29Å; F87-E90 VanDerWaalsContact O-N 3.08Å; E90-R92 VanDerWaalsContact C-N 3.26Å; E90-R92 PolarHBondContact O-N 3.41Å; E90-G93 CarbonylContact O-C 3.54Å; E90-G93 WeakPolarHBondContact O-CA 3.49Å; E90-G93 PolarHBondContact O-N 2.97Å; E90-R94 HydrophobicContact CG-CG 4.33Å; E90-R94 WeakPolarHBondContact O-CG 3.46Å; E90-R94 PolarHBondContact O-N 3.44Å; E90-R94 IonicContact OE1-CZ 2.71Å; E90-R94 VanDerWaalsContact OE1-CZ 3.27Å; E90-R94 IonicContact OE1-NE 3.33Å; E90-R94 PolarHBondContact OE1-NE 3.39Å; E90-R94 IonicContact OE1-NH2 2.71Å; E90-R94 PolarHBondContact OE1-NH2 2.57Å
91	L	97.4	Very high	95.9	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-54.7	-38.2	177.4	-179.3	60.4	0	0	0	113.3	F87 G93 F96 Y243 Y267 F292 L322	F87-L91 HydrophobicContact CE1-CD2 3.94Å; F87-L91 HydrophobicContact CZ-CD2 4.29Å; F87-L91 WeakPolarHBondContact O-CB 3.43Å; F87-L91 PolarHBondContact O-N 2.94Å; L91-G93 VanDerWaalsContact C-N 3.31Å; L91-F96 HydrophobicContact CD1-CE2 4.34Å; L91-F96 HydrophobicContact CD1-CZ 3.85Å; L91-Y243 HydrophobicContact CD2-CD2 3.57Å; L91-Y243 HydrophobicContact CD2-CE2 3.35Å; L91-Y267 HydrophobicContact CD1-CE1 4.03Å; L91-Y267 HydrophobicContact CD1-CE2 3.99Å; L91-Y267 HydrophobicContact CD2-CE2 4.07Å; L91-Y267 HydrophobicContact CG-CE2 4.22Å; L91-Y267 WeakPolarHBondContact CG-OH 3.36Å; L91-F292 HydrophobicContact CD1-CD2 4.48Å; L91-F292 HydrophobicContact CD1-CE2 3.54Å; L91-F292 HydrophobicContact CD1-CZ 3.73Å; L91-L322 HydrophobicContact CD2-CB 4.36Å; L91-L322 HydrophobicContact CD2-CD2 4.3Å; L91-L322 HydrophobicContact CG-CD2 4.46Å
92	R	96.3	Very high	96.1	Very high	88 Å²	88	58.6 Å²	58.6	33%	0.332	32%	0.316	S	S	.	.	H	α-helix	trans	-69.3	-26	173.6	-75.2	174.8	173.5	-87.8	18.2	113.6	I88 E90 D241 L322 P324	I88-R92 WeakPolarHBondContact O-CB 3.49Å; I88-R92 VanDerWaalsContact O-CG 3.3Å; I88-R92 WeakPolarHBondContact O-CG 3.35Å; I88-R92 PolarHBondContact O-N 3.28Å; E90-R92 VanDerWaalsContact C-N 3.26Å; E90-R92 PolarHBondContact O-N 3.41Å; R92-D241 IonicContact CZ-OD1 3.05Å; R92-D241 IonicContact NE-OD1 2.99Å; R92-D241 PolarHBondContact NE-OD1 3.02Å; R92-D241 IonicContact NH2-OD1 2.75Å; R92-D241 PolarHBondContact NH2-OD1 3.46Å; R92-D241 IonicContact NH2-OD2 2.97Å; R92-L322 HydrophobicContact CG-CD2 3.9Å; R92-P324 PolarHBondContact NH2-O 2.97Å
93	G	94.8	Very high	96.3	Very high	64 Å²	64	59 Å²	59	66%	0.66	32%	0.318	S	S	*	.	H	α-helix	trans	-94.1	-14.8	178.4	0	0	0	0	0	115.1	E90 L91	E90-G93 CarbonylContact O-C 3.54Å; E90-G93 WeakPolarHBondContact O-CA 3.49Å; E90-G93 PolarHBondContact O-N 2.97Å; L91-G93 VanDerWaalsContact C-N 3.31Å
94	R	96.3	Very high	96.5	Very high	63 Å²	63	61.4 Å²	61.4	24%	0.238	33%	0.329	C	S	.	.			trans	-67	142.7	176.9	-80.6	164.8	167.8	-111.2	3.7	112.1	E90 F96 D295	E90-R94 HydrophobicContact CG-CG 4.33Å; E90-R94 WeakPolarHBondContact O-CG 3.46Å; E90-R94 PolarHBondContact O-N 3.44Å; E90-R94 IonicContact OE1-CZ 2.71Å; E90-R94 VanDerWaalsContact OE1-CZ 3.27Å; E90-R94 IonicContact OE1-NE 3.33Å; E90-R94 PolarHBondContact OE1-NE 3.39Å; E90-R94 IonicContact OE1-NH2 2.71Å; E90-R94 PolarHBondContact OE1-NH2 2.57Å; R94-F96 HydrophobicContact CB-CD2 4.3Å; R94-F96 HydrophobicContact CB-CE2 3.46Å; R94-F96 VanDerWaalsContact CB-CE2 3.46Å; R94-F96 HydrophobicContact CB-CZ 3.9Å; R94-F96 WeakPolarHBondContact O-CD2 3.41Å; R94-F96 WeakPolarHBondContact O-CE2 3.3Å; R94-D295 IonicContact CZ-OD1 3.72Å; R94-D295 IonicContact CZ-OD2 3.51Å; R94-D295 IonicContact NH1-OD1 2.68Å; R94-D295 PolarHBondContact NH1-OD1 2.88Å; R94-D295 IonicContact NH1-OD2 3.79Å; R94-D295 PolarHBondContact NH1-OD2 3.03Å; R94-D295 IonicContact NH2-OD2 3.21Å; R94-D295 PolarHBondContact NH2-OD2 3.04Å
95	T	97	Very high	96.6	Very high	139 Å²	139	64.8 Å²	64.8	85%	0.853	34%	0.34	S	S	*	.			trans	-88	145.8	172.2	48	0	0	0	0	110.8
96	F	97.9	Very high	96.8	Very high	48 Å²	48	60.5 Å²	60.5	21%	0.211	31%	0.311	C	S	.	.			trans	-145.4	159.6	-175.2	-69.3	-89	0	0	0	109.8	L91 R94 Y267 F292 C300 K302	L91-F96 HydrophobicContact CD1-CE2 4.34Å; L91-F96 HydrophobicContact CD1-CZ 3.85Å; R94-F96 HydrophobicContact CB-CD2 4.3Å; R94-F96 HydrophobicContact CB-CE2 3.46Å; R94-F96 VanDerWaalsContact CB-CE2 3.46Å; R94-F96 HydrophobicContact CB-CZ 3.9Å; R94-F96 WeakPolarHBondContact O-CD2 3.41Å; R94-F96 WeakPolarHBondContact O-CE2 3.3Å; F96-Y267 AromaticContact CD1-CD1 3.81Å; F96-Y267 HydrophobicContact CD1-CD1 3.81Å; F96-Y267 HydrophobicContact CD1-CE1 4.17Å; F96-Y267 HydrophobicContact CD2-CD1 4.32Å; F96-Y267 AromaticContact CD2-CE1 3.85Å; F96-Y267 HydrophobicContact CD2-CE1 3.85Å; F96-Y267 AromaticContact CE1-CD1 3.5Å; F96-Y267 HydrophobicContact CE1-CD1 3.5Å; F96-Y267 VanDerWaalsContact CE1-CD1 3.5Å; F96-Y267 AromaticContact CE1-CE1 3.79Å; F96-Y267 HydrophobicContact CE1-CE1 3.79Å; F96-Y267 HydrophobicContact CE1-CG 4.5Å; F96-Y267 HydrophobicContact CE2-CD1 4.04Å; F96-Y267 AromaticContact CE2-CE1 3.44Å; F96-Y267 HydrophobicContact CE2-CE1 3.44Å; F96-Y267 VanDerWaalsContact CE2-CE1 3.44Å; F96-Y267 HydrophobicContact CG-CD1 4.22Å; F96-Y267 HydrophobicContact CG-CE1 4.2Å; F96-Y267 AromaticContact CZ-CD1 3.63Å; F96-Y267 HydrophobicContact CZ-CD1 3.63Å; F96-Y267 AromaticContact CZ-CE1 3.41Å; F96-Y267 HydrophobicContact CZ-CE1 3.41Å; F96-Y267 VanDerWaalsContact CZ-CE1 3.41Å; F96-F292 AromaticContact CE1-CE1 3.77Å; F96-F292 HydrophobicContact CE1-CE1 3.77Å; F96-F292 AromaticContact CE1-CZ 3.73Å; F96-F292 HydrophobicContact CE1-CZ 3.73Å; F96-F292 AromaticContact CZ-CE1 3.97Å; F96-F292 HydrophobicContact CZ-CE1 3.97Å; F96-F292 AromaticContact CZ-CZ 3.73Å; F96-F292 HydrophobicContact CZ-CZ 3.73Å; F96-C300 HydrophobicContact CD1-CB 4.27Å; F96-K302 HydrophobicContact CB-CB 3.6Å; F96-K302 HydrophobicContact CB-CD 4.27Å; F96-K302 HydrophobicContact CD2-CB 4.48Å; F96-K302 HydrophobicContact CD2-CD 3.95Å; F96-K302 HydrophobicContact CG-CB 4.08Å; F96-K302 HydrophobicContact CG-CD 4.36Å
97	D	97.5	Very high	97	Very high	43 Å²	43	60.2 Å²	60.2	23%	0.23	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	150.4	167.8	-56.2	-82.8	0	0	0	110.7	K299 C300 Y301 K302	D97-K299 IonicContact OD1-NZ 2.69Å; D97-K299 PolarHBondContact OD1-NZ 3.05Å; D97-K299 VanDerWaalsContact OD2-CA 3.29Å; D97-K299 WeakPolarHBondContact OD2-CA 3.37Å; D97-K299 WeakPolarHBondContact OD2-CB 3.42Å; D97-C300 PolarHBondContact N-O 3.27Å; D97-C300 PolarHBondContact OD2-N 2.92Å; D97-Y301 HydrophobicContact CB-CD1 3.61Å; D97-Y301 HydrophobicContact CB-CE1 4.04Å; D97-Y301 HydrophobicContact CB-CG 4.31Å; D97-K302 PolarHBondContact O-N 3.34Å
98	S	97.6	Very high	97	Very high	54 Å²	54	59.7 Å²	59.7	38%	0.378	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	129.6	175.8	-172	0	0	0	0	109.7	D100 E101	S98-D100 PolarHBondContact O-N 2.87Å; S98-D100 WeakPolarHBondContact OG-CB 3.28Å; S98-D100 PolarHBondContact OG-N 3.24Å; S98-E101 PolarHBondContact N-OE1 3.42Å; S98-E101 VanDerWaalsContact N-OE1 3.1Å; S98-E101 WeakPolarHBondContact O-CB 3.23Å; S98-E101 WeakPolarHBondContact O-CG 3.29Å; S98-E101 PolarHBondContact O-N 3.4Å
99	S	97.4	Very high	97	Very high	5 Å²	5	63.2 Å²	63.2	4%	0.035	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-57	-23.7	171	60.2	0	0	0	0	113.1	E101 V102 I103 K302 C303	S99-E101 PolarHBondContact O-N 2.89Å; S99-E101 VanDerWaalsContact O-N 3.11Å; S99-V102 WeakPolarHBondContact O-CG2 3.4Å; S99-V102 PolarHBondContact O-N 3.26Å; S99-I103 WeakPolarHBondContact O-CG1 3.42Å; S99-I103 WeakPolarHBondContact O-CG2 3.35Å; S99-I103 PolarHBondContact O-N 2.85Å; S99-K302 WeakPolarHBondContact CB-O 3.49Å; S99-K302 PolarHBondContact N-O 3.18Å; S99-K302 PolarHBondContact OG-O 3.38Å; S99-C303 WeakPolarHBondContact OG-CA 3.24Å
100	D	96.7	Very high	97.1	Very high	99 Å²	99	60.4 Å²	60.4	53%	0.529	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-62.8	-13.9	177	-66.5	-5.9	0	0	0	113.7	S98 V102 K105	S98-D100 PolarHBondContact O-N 2.87Å; S98-D100 WeakPolarHBondContact OG-CB 3.28Å; S98-D100 PolarHBondContact OG-N 3.24Å; D100-V102 VanDerWaalsContact C-N 3.3Å; D100-K105 WeakPolarHBondContact OD1-CE 3.18Å; D100-K105 IonicContact OD1-NZ 2.72Å; D100-K105 PolarHBondContact OD1-NZ 3.34Å; D100-K105 IonicContact OD2-NZ 3.46Å; D100-K105 PolarHBondContact OD2-NZ 3.44Å
101	E	96.2	Very high	97.1	Very high	109 Å²	109	56.9 Å²	56.9	51%	0.509	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-72.3	-20.5	170.7	-65.7	168.1	-134.6	0	0	113.3	S98 S99 K299 Y301	S98-E101 PolarHBondContact N-OE1 3.42Å; S98-E101 VanDerWaalsContact N-OE1 3.1Å; S98-E101 WeakPolarHBondContact O-CB 3.23Å; S98-E101 WeakPolarHBondContact O-CG 3.29Å; S98-E101 PolarHBondContact O-N 3.4Å; S99-E101 PolarHBondContact O-N 2.89Å; S99-E101 VanDerWaalsContact O-N 3.11Å; E101-K299 IonicContact OE2-NZ 2.87Å; E101-K299 PolarHBondContact OE2-NZ 3.04Å; E101-Y301 HydrophobicContact CB-CE1 4.28Å
102	V	96.3	Very high	97.1	Very high	24 Å²	24	59.1 Å²	59.1	15%	0.145	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.1	-20.9	-169.3	-66.5	0	0	0	0	116.2	S99 D100 V123 Y301	S99-V102 WeakPolarHBondContact O-CG2 3.4Å; S99-V102 PolarHBondContact O-N 3.26Å; D100-V102 VanDerWaalsContact C-N 3.3Å; V102-V123 WeakPolarHBondContact O-CB 3.43Å; V102-Y301 HydrophobicContact CB-CE1 4.4Å; V102-Y301 HydrophobicContact CG1-CD1 4.31Å; V102-Y301 HydrophobicContact CG1-CE1 3.58Å; V102-Y301 HydrophobicContact CG1-CE2 4.22Å; V102-Y301 HydrophobicContact CG2-CD1 3.74Å; V102-Y301 HydrophobicContact CG2-CD2 4.05Å; V102-Y301 HydrophobicContact CG2-CE1 3.88Å; V102-Y301 HydrophobicContact CG2-CE2 4.22Å; V102-Y301 HydrophobicContact CG2-CG 3.83Å
103	I	97.1	Very high	97.1	Very high	13 Å²	13	56.1 Å²	56.1	7%	0.067	32%	0.32	C	S	.	.			trans	-85.6	137.7	-176.1	70.6	-174.8	0	0	0	112.7	S99 K105 P124 L126	S99-I103 WeakPolarHBondContact O-CG1 3.42Å; S99-I103 WeakPolarHBondContact O-CG2 3.35Å; S99-I103 PolarHBondContact O-N 2.85Å; I103-K105 HydrophobicContact CG1-CG 4.4Å; I103-P124 VanDerWaalsContact CA-O 3.26Å; I103-P124 WeakPolarHBondContact CA-O 3.11Å; I103-P124 WeakPolarHBondContact CB-O 3.22Å; I103-P124 HydrophobicContact CG2-CB 4Å; I103-P124 HydrophobicContact CG2-CG 4.5Å; I103-L126 HydrophobicContact CD1-CB 3.89Å; I103-L126 HydrophobicContact CD1-CD2 3.94Å
104	L	97.6	Very high	97.1	Very high	55 Å²	55	57.9 Å²	57.9	29%	0.288	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-83.3	144.8	172.9	-56.6	177.2	0	0	0	110.1	F115 V123 P124 I125 L126	L104-F115 HydrophobicContact CD1-CE1 4.37Å; L104-F115 HydrophobicContact CD1-CZ 3.96Å; L104-V123 HydrophobicContact CD1-CG2 3.87Å; L104-V123 HydrophobicContact CG-CG2 3.77Å; L104-P124 PolarHBondContact N-O 3.36Å; L104-P124 VanDerWaalsContact N-O 3.1Å; L104-I125 HydrophobicContact CB-CG1 4.33Å; L104-I125 HydrophobicContact CB-CG2 4.47Å; L104-I125 CarbonylContact O-C 3.46Å; L104-I125 WeakPolarHBondContact O-CA 3.47Å; L104-L126 PolarHBondContact O-N 2.84Å
105	K	97.7	Very high	97.1	Very high	95 Å²	95	57.1 Å²	57.1	41%	0.413	31%	0.31	S	S	.	.			trans	-127.5	57.5	-178.3	-60.1	-178.2	-176	176.4	0	112.9	D100 I103 L126	D100-K105 WeakPolarHBondContact OD1-CE 3.18Å; D100-K105 IonicContact OD1-NZ 2.72Å; D100-K105 PolarHBondContact OD1-NZ 3.34Å; D100-K105 IonicContact OD2-NZ 3.46Å; D100-K105 PolarHBondContact OD2-NZ 3.44Å; I103-K105 HydrophobicContact CG1-CG 4.4Å; K105-L126 WeakPolarHBondContact CA-O 3.3Å
106	P	97.6	Very high	97	Very high	14 Å²	14	50.7 Å²	50.7	9%	0.091	27%	0.27	C	S	.	.			trans	-66.5	159.3	174	31.9	-35.1	0	0	0	111.1	Q110 L111 F115 I125 V127	P106-Q110 HydrophobicContact CB-CB 3.88Å; P106-L111 HydrophobicContact CG-CB 4.45Å; P106-L111 HydrophobicContact CG-CD1 4.48Å; P106-F115 HydrophobicContact CB-CE1 4.45Å; P106-F115 HydrophobicContact CB-CZ 4.16Å; P106-F115 HydrophobicContact CG-CE1 4.09Å; P106-F115 HydrophobicContact CG-CZ 4.1Å; P106-I125 VanDerWaalsContact CD-CG2 3.42Å; P106-I125 HydrophobicContact CG-CG2 3.53Å; P106-V127 HydrophobicContact CG-CG2 4.35Å
107	T	98.2	Very high	96.7	Very high	78 Å²	78	51.8 Å²	51.8	48%	0.479	28%	0.276	S	S	.	.			trans	-72.2	160.5	160.4	62.5	0	0	0	0	110.3	S109 Q110 L111	T107-S109 PolarHBondContact O-N 3.37Å; T107-Q110 PolarHBondContact O-N 2.82Å; T107-Q110 WeakPolarHBondContact OG1-CG 3.47Å; T107-Q110 PolarHBondContact OG1-OE1 3.14Å; T107-L111 PolarHBondContact O-N 2.69Å
108	G	97.6	Very high	96.3	Very high	2 Å²	2	57.4 Å²	57.4	2%	0.021	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-30.3	-179	0	0	0	0	0	114.1	Q110 L111 D131 G132	G108-Q110 VanDerWaalsContact C-N 3.34Å; G108-L111 PolarHBondContact O-N 3.41Å; G108-D131 VanDerWaalsContact CA-O 3.32Å; G108-D131 WeakPolarHBondContact CA-O 3.31Å; G108-D131 PolarHBondContact N-O 2.79Å; G108-G132 VanDerWaalsContact C-C 3.47Å; G108-G132 CarbonylContact O-C 3.6Å
109	S	97.8	Very high	95.4	Very high	80 Å²	80	57.7 Å²	57.7	56%	0.559	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-21.8	175.3	-54.1	0	0	0	0	113.9	T107	T107-S109 PolarHBondContact O-N 3.37Å
110	Q	97.3	Very high	94.4	Very high	110 Å²	110	60 Å²	60	51%	0.514	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-14.9	176.1	-71.6	167.3	-61.1	0	0	112.8	P106 T107 G108 T112 F115	P106-Q110 HydrophobicContact CB-CB 3.88Å; T107-Q110 PolarHBondContact O-N 2.82Å; T107-Q110 WeakPolarHBondContact OG1-CG 3.47Å; T107-Q110 PolarHBondContact OG1-OE1 3.14Å; G108-Q110 VanDerWaalsContact C-N 3.34Å; Q110-T112 VanDerWaalsContact C-N 3.27Å; Q110-T112 PolarHBondContact O-N 3.45Å; Q110-F115 WeakPolarHBondContact O-CB 3.46Å
111	L	97.4	Very high	94.4	Very high	10 Å²	10	55.6 Å²	55.6	5%	0.052	29%	0.29	C	S	.	.			trans	-81.7	75.2	178	-171.8	57	0	0	0	110.4	P106 T107 G108 F115 L116 I125 V127 L133 I209 F312	P106-L111 HydrophobicContact CG-CB 4.45Å; P106-L111 HydrophobicContact CG-CD1 4.48Å; T107-L111 PolarHBondContact O-N 2.69Å; G108-L111 PolarHBondContact O-N 3.41Å; L111-F115 HydrophobicContact CD1-CD1 3.86Å; L111-F115 HydrophobicContact CD1-CE1 4Å; L111-L116 HydrophobicContact CD1-CD1 4.2Å; L111-L116 HydrophobicContact CD1-CD2 3.8Å; L111-L116 HydrophobicContact CD1-CG 4.06Å; L111-I125 HydrophobicContact CD1-CD1 3.89Å; L111-I125 HydrophobicContact CD1-CG2 4.37Å; L111-V127 HydrophobicContact CD2-CG2 4.02Å; L111-L133 HydrophobicContact CB-CD2 4.1Å; L111-L133 HydrophobicContact CD2-CD2 3.71Å; L111-L133 HydrophobicContact CG-CD2 4.42Å; L111-I209 HydrophobicContact CD2-CG2 3.99Å; L111-I209 HydrophobicContact CG-CB 4.47Å; L111-I209 HydrophobicContact CG-CG1 4.34Å; L111-I209 HydrophobicContact CG-CG2 4.14Å; L111-F312 HydrophobicContact CD2-CD2 3.79Å; L111-F312 HydrophobicContact CD2-CE1 4.43Å; L111-F312 HydrophobicContact CD2-CE2 3.47Å; L111-F312 VanDerWaalsContact CD2-CE2 3.47Å; L111-F312 HydrophobicContact CD2-CG 4.41Å; L111-F312 HydrophobicContact CD2-CZ 3.83Å
112	T	97.1	Very high	94.3	Very high	48 Å²	48	53.1 Å²	53.1	29%	0.294	29%	0.285	S	S	.	.			trans	-101.8	179.9	179.1	78.7	0	0	0	0	111.5	Q110 E114 F115 L116 I209	Q110-T112 VanDerWaalsContact C-N 3.27Å; Q110-T112 PolarHBondContact O-N 3.45Å; T112-E114 WeakPolarHBondContact CB-OE2 3.25Å; T112-E114 PolarHBondContact OG1-OE2 3.49Å; T112-F115 PolarHBondContact OG1-N 3.31Å; T112-L116 WeakPolarHBondContact O-CG 3.23Å; T112-I209 VanDerWaalsContact C-CD1 3.49Å; T112-I209 WeakPolarHBondContact O-CD1 3.36Å
113	V	96.4	Very high	94.4	Very high	25 Å²	25	52.8 Å²	52.8	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-71.2	-43.4	177.5	173.3	0	0	0	0	109.7	F115 L116 E117 I209 K212 L213	V113-F115 PolarHBondContact O-N 2.85Å; V113-L116 CarbonylContact O-C 3.5Å; V113-L116 WeakPolarHBondContact O-CA 3.46Å; V113-L116 WeakPolarHBondContact O-CB 3.37Å; V113-L116 PolarHBondContact O-N 3.21Å; V113-E117 HydrophobicContact CG1-CG 4.15Å; V113-E117 WeakPolarHBondContact O-CG 3.35Å; V113-E117 PolarHBondContact O-N 3.38Å; V113-I209 HydrophobicContact CB-CD1 4.48Å; V113-I209 HydrophobicContact CG2-CD1 3.73Å; V113-K212 HydrophobicContact CG2-CB 4.05Å; V113-K212 HydrophobicContact CG2-CD 3.75Å; V113-L213 HydrophobicContact CG1-CD2 4.33Å; V113-L213 HydrophobicContact CG2-CD2 4.32Å
114	E	95	Very high	94.5	Very high	101 Å²	101	52.1 Å²	52.1	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-43.9	-177	-51.8	73.1	-159.5	0	0	110.5	T112 L116 E117 E118	T112-E114 WeakPolarHBondContact CB-OE2 3.25Å; T112-E114 PolarHBondContact OG1-OE2 3.49Å; E114-L116 PolarHBondContact O-N 3.05Å; E114-E117 PolarHBondContact O-N 2.9Å; E114-E118 PolarHBondContact O-N 3.12Å
115	F	95.8	Very high	94.5	Very high	48 Å²	48	49.6 Å²	49.6	21%	0.211	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-34.9	172.1	173.6	-95.3	0	0	0	113.2	L104 P106 Q110 L111 T112 V113 N119 I125	L104-F115 HydrophobicContact CD1-CE1 4.37Å; L104-F115 HydrophobicContact CD1-CZ 3.96Å; P106-F115 HydrophobicContact CB-CE1 4.45Å; P106-F115 HydrophobicContact CB-CZ 4.16Å; P106-F115 HydrophobicContact CG-CE1 4.09Å; P106-F115 HydrophobicContact CG-CZ 4.1Å; Q110-F115 WeakPolarHBondContact O-CB 3.46Å; L111-F115 HydrophobicContact CD1-CD1 3.86Å; L111-F115 HydrophobicContact CD1-CE1 4Å; T112-F115 PolarHBondContact OG1-N 3.31Å; V113-F115 PolarHBondContact O-N 2.85Å; F115-N119 PolarHBondContact O-ND2 3.08Å; F115-I125 HydrophobicContact CE1-CD1 4.24Å
116	L	96.1	Very high	94.6	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-82.5	-29.3	178	-66.7	-177.9	0	0	0	112.9	L111 T112 V113 E114 N119 S120 F121 I125 I209 L213 L338	L111-L116 HydrophobicContact CD1-CD1 4.2Å; L111-L116 HydrophobicContact CD1-CD2 3.8Å; L111-L116 HydrophobicContact CD1-CG 4.06Å; T112-L116 WeakPolarHBondContact O-CG 3.23Å; V113-L116 CarbonylContact O-C 3.5Å; V113-L116 WeakPolarHBondContact O-CA 3.46Å; V113-L116 WeakPolarHBondContact O-CB 3.37Å; V113-L116 PolarHBondContact O-N 3.21Å; E114-L116 PolarHBondContact O-N 3.05Å; L116-N119 CarbonylContact O-C 3.51Å; L116-N119 PolarHBondContact O-N 3.25Å; L116-S120 CarbonylContact O-C 3.54Å; L116-S120 VanDerWaalsContact O-CA 3.23Å; L116-S120 WeakPolarHBondContact O-CA 3.3Å; L116-S120 PolarHBondContact O-N 3.48Å; L116-F121 HydrophobicContact CB-CB 4.31Å; L116-F121 HydrophobicContact CD1-CD1 4.43Å; L116-F121 HydrophobicContact CD1-CG 4.43Å; L116-F121 HydrophobicContact CD2-CB 3.96Å; L116-F121 HydrophobicContact CD2-CD2 3.93Å; L116-F121 HydrophobicContact CD2-CG 3.93Å; L116-F121 PolarHBondContact O-N 2.95Å; L116-I125 HydrophobicContact CD2-CD1 3.4Å; L116-I209 HydrophobicContact CD1-CD1 3.96Å; L116-I209 HydrophobicContact CD1-CG1 3.62Å; L116-L213 HydrophobicContact CD1-CD1 3.73Å; L116-L338 HydrophobicContact CB-CD1 3.85Å
117	E	91.3	Very high	94.7	Very high	70 Å²	70	44.8 Å²	44.8	33%	0.327	24%	0.244	S	C	.	.	H	α-helix	trans	-66.8	-41.8	171.7	-69	-174.7	130	0	0	111.9	V113 E114 N119 S120 L338 Y392	V113-E117 HydrophobicContact CG1-CG 4.15Å; V113-E117 WeakPolarHBondContact O-CG 3.35Å; V113-E117 PolarHBondContact O-N 3.38Å; E114-E117 PolarHBondContact O-N 2.9Å; E117-N119 PolarHBondContact O-N 2.76Å; E117-S120 PolarHBondContact O-N 3.11Å; E117-L338 HydrophobicContact CG-CD2 4.07Å; E117-Y392 HydrophobicContact CB-CE1 4.11Å; E117-Y392 HydrophobicContact CG-CE1 3.76Å; E117-Y392 PolarHBondContact OE1-OH 2.66Å
118	E	87.5	Confident	94.7	Very high	161 Å²	161	45.4 Å²	45.4	75%	0.752	24%	0.244	S	C	*	.	H	α-helix	trans	-59.4	-31.4	175.7	-75.1	-176.7	167.9	0	0	113.1	E114	E114-E118 PolarHBondContact O-N 3.12Å
119	N	78.9	Confident	94.7	Very high	60 Å²	60	52.1 Å²	52.1	32%	0.321	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	6	-172.7	-64.8	-85.8	0	0	0	113.3	F115 L116 E117 F121 S122	F115-N119 PolarHBondContact O-ND2 3.08Å; L116-N119 CarbonylContact O-C 3.51Å; L116-N119 PolarHBondContact O-N 3.25Å; E117-N119 PolarHBondContact O-N 2.76Å; N119-F121 PolarHBondContact O-N 3.07Å; N119-S122 WeakPolarHBondContact O-CB 3.21Å; N119-S122 PolarHBondContact O-N 3.32Å; N119-S122 PolarHBondContact O-OG 3Å
120	S	77.8	Confident	94.6	Very high	53 Å²	53	52.9 Å²	52.9	37%	0.371	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.5	28.7	-170.9	-56.6	0	0	0	0	115	L116 E117 S122	L116-S120 CarbonylContact O-C 3.54Å; L116-S120 VanDerWaalsContact O-CA 3.23Å; L116-S120 WeakPolarHBondContact O-CA 3.3Å; L116-S120 PolarHBondContact O-N 3.48Å; E117-S120 PolarHBondContact O-N 3.11Å; S120-S122 PolarHBondContact O-N 2.87Å; S120-S122 VanDerWaalsContact O-N 3.09Å
121	F	95.8	Very high	94.7	Very high	7 Å²	7	52.1 Å²	52.1	3%	0.031	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	37.1	46.9	-166.7	-171.7	-163	0	0	0	113	L116 N119 V123 I125 F312 P314 F334 H336 L338	L116-F121 HydrophobicContact CB-CB 4.31Å; L116-F121 HydrophobicContact CD1-CD1 4.43Å; L116-F121 HydrophobicContact CD1-CG 4.43Å; L116-F121 HydrophobicContact CD2-CB 3.96Å; L116-F121 HydrophobicContact CD2-CD2 3.93Å; L116-F121 HydrophobicContact CD2-CG 3.93Å; L116-F121 PolarHBondContact O-N 2.95Å; N119-F121 PolarHBondContact O-N 3.07Å; F121-V123 PolarHBondContact O-N 3.14Å; F121-I125 HydrophobicContact CD2-CD1 3.61Å; F121-I125 HydrophobicContact CD2-CG1 4.19Å; F121-I125 HydrophobicContact CE2-CD1 3.64Å; F121-I125 HydrophobicContact CE2-CG1 3.92Å; F121-F312 HydrophobicContact CE2-CB 4.25Å; F121-F312 HydrophobicContact CZ-CB 3.9Å; F121-P314 HydrophobicContact CD1-CB 4.01Å; F121-P314 HydrophobicContact CD2-CB 3.73Å; F121-P314 HydrophobicContact CD2-CG 4.07Å; F121-P314 HydrophobicContact CE1-CB 3.92Å; F121-P314 HydrophobicContact CE2-CB 3.63Å; F121-P314 HydrophobicContact CE2-CG 3.87Å; F121-P314 HydrophobicContact CG-CB 3.89Å; F121-P314 HydrophobicContact CZ-CB 3.71Å; F121-P314 HydrophobicContact CZ-CG 4.32Å; F121-P314 WeakPolarHBondContact O-CB 3.4Å; F121-P314 VanDerWaalsContact O-CG 3.28Å; F121-P314 WeakPolarHBondContact O-CG 3.18Å; F121-F334 HydrophobicContact CE1-CZ 4.17Å; F121-H336 AromaticContact CD1-CD2 3.98Å; F121-H336 AromaticContact CD1-NE2 3.34Å; F121-H336 VanDerWaalsContact CD1-NE2 3.34Å; F121-H336 WeakPolarHBondContact CD1-NE2 3.19Å; F121-H336 AromaticContact CE1-NE2 3.8Å; F121-L338 HydrophobicContact CB-CD1 3.77Å; F121-L338 HydrophobicContact CD1-CD1 4.49Å
122	S	95.4	Very high	94.7	Very high	57 Å²	57	53 Å²	53	40%	0.399	28%	0.277	S	S	.	.			trans	-87.5	-2.1	-166	59.2	0	0	0	0	116.1	N119 S120 R270 W317	N119-S122 WeakPolarHBondContact O-CB 3.21Å; N119-S122 PolarHBondContact O-N 3.32Å; N119-S122 PolarHBondContact O-OG 3Å; S120-S122 PolarHBondContact O-N 2.87Å; S120-S122 VanDerWaalsContact O-N 3.09Å; S122-R270 PolarHBondContact O-NH1 3.41Å; S122-W317 PolarHBondContact O-NE1 3.21Å
123	V	97.6	Very high	94.7	Very high	17 Å²	17	50.9 Å²	50.9	10%	0.103	26%	0.264	C	S	.	.	S	Bend	trans	-141.8	154	-179.5	-70.9	0	0	0	0	111.5	V102 L104 F121 R270 W317	V102-V123 WeakPolarHBondContact O-CB 3.43Å; L104-V123 HydrophobicContact CD1-CG2 3.87Å; L104-V123 HydrophobicContact CG-CG2 3.77Å; F121-V123 PolarHBondContact O-N 3.14Å; V123-R270 VanDerWaalsContact CG1-NH2 3.35Å; V123-W317 HydrophobicContact CB-CZ2 4.46Å; V123-W317 HydrophobicContact CG1-CZ2 4.14Å
124	P	98.6	Very high	94.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.			trans	-63.2	149.6	177.9	-20.2	32.5	0	0	0	112.9	I103 L104 L268 L311 F312 W317	I103-P124 VanDerWaalsContact CA-O 3.26Å; I103-P124 WeakPolarHBondContact CA-O 3.11Å; I103-P124 WeakPolarHBondContact CB-O 3.22Å; I103-P124 HydrophobicContact CG2-CB 4Å; I103-P124 HydrophobicContact CG2-CG 4.5Å; L104-P124 PolarHBondContact N-O 3.36Å; L104-P124 VanDerWaalsContact N-O 3.1Å; P124-L268 HydrophobicContact CB-CD1 4.38Å; P124-L268 HydrophobicContact CG-CD1 4.18Å; P124-L311 HydrophobicContact CB-CD1 4.15Å; P124-F312 CarbonylContact C-O 3.55Å; P124-F312 VanDerWaalsContact CA-O 3.28Å; P124-F312 WeakPolarHBondContact CA-O 3.27Å; P124-W317 HydrophobicContact CG-CD2 3.99Å; P124-W317 HydrophobicContact CG-CE3 3.85Å; P124-W317 HydrophobicContact CG-CH2 4.25Å; P124-W317 HydrophobicContact CG-CZ2 4.39Å; P124-W317 HydrophobicContact CG-CZ3 3.98Å
125	I	98.8	Very high	95	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.8	-172.6	-53.7	178.5	0	0	0	109.1	L104 P106 L111 F115 L116 F121 V127 L311 F312	L104-I125 HydrophobicContact CB-CG1 4.33Å; L104-I125 HydrophobicContact CB-CG2 4.47Å; L104-I125 CarbonylContact O-C 3.46Å; L104-I125 WeakPolarHBondContact O-CA 3.47Å; P106-I125 VanDerWaalsContact CD-CG2 3.42Å; P106-I125 HydrophobicContact CG-CG2 3.53Å; L111-I125 HydrophobicContact CD1-CD1 3.89Å; L111-I125 HydrophobicContact CD1-CG2 4.37Å; F115-I125 HydrophobicContact CE1-CD1 4.24Å; L116-I125 HydrophobicContact CD2-CD1 3.4Å; F121-I125 HydrophobicContact CD2-CD1 3.61Å; F121-I125 HydrophobicContact CD2-CG1 4.19Å; F121-I125 HydrophobicContact CE2-CD1 3.64Å; F121-I125 HydrophobicContact CE2-CG1 3.92Å; I125-V127 HydrophobicContact CG2-CG2 4.16Å; I125-L311 CarbonylContact O-C 3.59Å; I125-L311 WeakPolarHBondContact O-CA 3.36Å; I125-F312 HydrophobicContact CB-CB 4.29Å; I125-F312 PolarHBondContact N-O 3.38Å; I125-F312 PolarHBondContact O-N 3.06Å
126	L	98.8	Very high	95.1	Very high	7 Å²	7	49.1 Å²	49.1	4%	0.037	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	103.7	-179.8	-179.1	65.6	0	0	0	110.7	I103 L104 K105 L128 V305 Q309 L311	I103-L126 HydrophobicContact CD1-CB 3.89Å; I103-L126 HydrophobicContact CD1-CD2 3.94Å; L104-L126 PolarHBondContact O-N 2.84Å; K105-L126 WeakPolarHBondContact CA-O 3.3Å; L126-L128 HydrophobicContact CD2-CD2 4.19Å; L126-L128 HydrophobicContact CG-CD2 4.18Å; L126-V305 HydrophobicContact CD1-CG1 4.26Å; L126-V305 HydrophobicContact CD1-CG2 4.22Å; L126-Q309 HydrophobicContact CD1-CB 4.21Å; L126-L311 HydrophobicContact CB-CD1 4.38Å; L126-L311 HydrophobicContact CD1-CB 4.34Å; L126-L311 HydrophobicContact CD1-CD1 4.5Å
127	V	98.8	Very high	95.2	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.1	178.1	-170.4	0	0	0	0	109.2	P106 L111 I125 K129 L133 T310 F312	P106-V127 HydrophobicContact CG-CG2 4.35Å; L111-V127 HydrophobicContact CD2-CG2 4.02Å; I125-V127 HydrophobicContact CG2-CG2 4.16Å; V127-K129 VanDerWaalsContact C-N 3.28Å; V127-K129 VanDerWaalsContact CG1-O 3.3Å; V127-K129 WeakPolarHBondContact CG1-O 3.31Å; V127-K129 PolarHBondContact O-N 2.92Å; V127-L133 HydrophobicContact CB-CD1 4.01Å; V127-L133 HydrophobicContact CG1-CD1 3.88Å; V127-L133 HydrophobicContact CG1-CD2 4.39Å; V127-L133 HydrophobicContact CG1-CG 4.17Å; V127-L133 HydrophobicContact CG2-CD1 4.35Å; V127-L133 HydrophobicContact CG2-CD2 4.32Å; V127-T310 PolarHBondContact N-O 3.35Å; V127-T310 PolarHBondContact O-N 2.88Å; V127-F312 HydrophobicContact CG2-CD2 4.24Å; V127-F312 HydrophobicContact CG2-CE2 3.9Å
128	L	98.4	Very high	95.5	Very high	91 Å²	91	47.4 Å²	47.4	48%	0.476	26%	0.264	S	S	.	.	S	Bend	trans	-73.3	-13.9	-167.2	-56.8	177.8	0	0	0	114.9	L126	L126-L128 HydrophobicContact CD2-CD2 4.19Å; L126-L128 HydrophobicContact CG-CD2 4.18Å
129	K	97.5	Very high	96	Very high	143 Å²	143	43 Å²	43	62%	0.622	25%	0.251	S	S	*	.	S	Bend	trans	-145.8	147.4	175.7	-60.7	-174.3	-179.1	-177.2	0	109.2	V127 D131	V127-K129 VanDerWaalsContact C-N 3.28Å; V127-K129 VanDerWaalsContact CG1-O 3.3Å; V127-K129 WeakPolarHBondContact CG1-O 3.31Å; V127-K129 PolarHBondContact O-N 2.92Å; K129-D131 WeakPolarHBondContact CB-OD2 3.25Å; K129-D131 WeakPolarHBondContact CD-OD2 3.36Å; K129-D131 PolarHBondContact O-N 3.39Å
130	K	97	Very high	96.8	Very high	97 Å²	97	44 Å²	44	42%	0.422	26%	0.261	S	S	.	.	S	Bend	trans	-68.2	-11.6	177.1	74	-176.8	-166.4	-53	0	114.9	G132 L133 M135	K130-G132 PolarHBondContact O-N 3.18Å; K130-L133 WeakPolarHBondContact O-CB 3.48Å; K130-L133 PolarHBondContact O-N 3.3Å; K130-L133 VanDerWaalsContact O-N 3.13Å; K130-M135 HydrophobicContact CB-CE 3.95Å; K130-M135 HydrophobicContact CB-CG 4.25Å; K130-M135 HydrophobicContact CB-SD 3.86Å
131	D	98.1	Very high	97.8	Very high	93 Å²	93	45.4 Å²	45.4	50%	0.497	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	127.8	-172.4	-45.4	-39.7	0	0	0	110.8	G108 K129 L133	G108-D131 VanDerWaalsContact CA-O 3.32Å; G108-D131 WeakPolarHBondContact CA-O 3.31Å; G108-D131 PolarHBondContact N-O 2.79Å; K129-D131 WeakPolarHBondContact CB-OD2 3.25Å; K129-D131 WeakPolarHBondContact CD-OD2 3.36Å; K129-D131 PolarHBondContact O-N 3.39Å; D131-L133 VanDerWaalsContact C-N 3.35Å; D131-L133 PolarHBondContact O-N 3.18Å
132	G	97.8	Very high	97.9	Very high	30 Å²	30	45.8 Å²	45.8	31%	0.309	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-18	-175.3	0	0	0	0	0	115.8	G108 K130 G134 R208	G108-G132 VanDerWaalsContact C-C 3.47Å; G108-G132 CarbonylContact O-C 3.6Å; K130-G132 PolarHBondContact O-N 3.18Å; G132-G134 PolarHBondContact O-N 2.98Å; G132-R208 PolarHBondContact O-NH2 3.42Å
133	L	98.4	Very high	98.1	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	26%	0.264	C	S	.	.	S	Bend	trans	-70.9	-13	-178.8	-74.6	179.8	0	0	0	114.6	L111 V127 K130 D131 M135 R208 T310 F312	L111-L133 HydrophobicContact CB-CD2 4.1Å; L111-L133 HydrophobicContact CD2-CD2 3.71Å; L111-L133 HydrophobicContact CG-CD2 4.42Å; V127-L133 HydrophobicContact CB-CD1 4.01Å; V127-L133 HydrophobicContact CG1-CD1 3.88Å; V127-L133 HydrophobicContact CG1-CD2 4.39Å; V127-L133 HydrophobicContact CG1-CG 4.17Å; V127-L133 HydrophobicContact CG2-CD1 4.35Å; V127-L133 HydrophobicContact CG2-CD2 4.32Å; K130-L133 WeakPolarHBondContact O-CB 3.48Å; K130-L133 PolarHBondContact O-N 3.3Å; K130-L133 VanDerWaalsContact O-N 3.13Å; D131-L133 VanDerWaalsContact C-N 3.35Å; D131-L133 PolarHBondContact O-N 3.18Å; L133-M135 VanDerWaalsContact C-N 3.3Å; L133-M135 HydrophobicContact CB-CE 3.79Å; L133-M135 HydrophobicContact CD1-CE 3.35Å; L133-M135 HydrophobicContact CG-CE 4.2Å; L133-M135 PolarHBondContact O-N 2.88Å; L133-R208 WeakPolarHBondContact O-CB 3.39Å; L133-R208 PolarHBondContact O-N 3.27Å; L133-T310 HydrophobicContact CD1-CG2 4.24Å; L133-F312 HydrophobicContact CD1-CE2 4.03Å; L133-F312 HydrophobicContact CD1-CZ 4.09Å; L133-F312 HydrophobicContact CD2-CE2 4.18Å; L133-F312 HydrophobicContact CD2-CZ 4.1Å
134	G	98.2	Very high	98.1	Very high	35 Å²	35	44.1 Å²	44.1	36%	0.361	26%	0.259	S	S	.	.			trans	59.7	39.8	-178.8	0	0	0	0	0	113	G132 R208 R211	G132-G134 PolarHBondContact O-N 2.98Å; G134-R208 PolarHBondContact O-N 3.46Å; G134-R211 PolarHBondContact O-NH2 3.06Å
135	M	98.1	Very high	98.1	Very high	20 Å²	20	51.3 Å²	51.3	10%	0.099	29%	0.287	C	S	.	.			trans	-101.4	151.9	168	75.2	177.1	76.4	0	0	109.8	K130 L133 L137 E205 P207 T310	K130-M135 HydrophobicContact CB-CE 3.95Å; K130-M135 HydrophobicContact CB-CG 4.25Å; K130-M135 HydrophobicContact CB-SD 3.86Å; L133-M135 VanDerWaalsContact C-N 3.3Å; L133-M135 HydrophobicContact CB-CE 3.79Å; L133-M135 HydrophobicContact CD1-CE 3.35Å; L133-M135 HydrophobicContact CG-CE 4.2Å; L133-M135 PolarHBondContact O-N 2.88Å; M135-L137 HydrophobicContact CG-CG 4.48Å; M135-L137 HydrophobicContact SD-CD1 3.56Å; M135-L137 VanDerWaalsContact SD-CD1 3.56Å; M135-L137 HydrophobicContact SD-CG 4.05Å; M135-E205 VanDerWaalsContact CA-O 3.28Å; M135-E205 WeakPolarHBondContact CA-O 3.49Å; M135-E205 WeakPolarHBondContact CB-O 3.21Å; M135-P207 HydrophobicContact CB-CG 4.31Å; M135-P207 HydrophobicContact CE-CG 4.11Å; M135-T310 HydrophobicContact CE-CG2 3.99Å; M135-T310 WeakPolarHBondContact CE-OG1 3.18Å
136	T	98.5	Very high	98.1	Very high	81 Å²	81	54 Å²	54	50%	0.497	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-112.7	137.2	164.4	-55.1	0	0	0	0	107.8	V204 E205	T136-V204 WeakPolarHBondContact O-CA 3.49Å; T136-E205 PolarHBondContact N-O 3.19Å; T136-E205 PolarHBondContact O-N 2.96Å
137	L	98.4	Very high	98.1	Very high	25 Å²	25	53.6 Å²	53.6	13%	0.131	30%	0.299	C	S	.	.			trans	-143.2	154.4	175.6	-73	177.4	0	0	0	108.7	M135 L203 V204 H258 F330	M135-L137 HydrophobicContact CG-CG 4.48Å; M135-L137 HydrophobicContact SD-CD1 3.56Å; M135-L137 VanDerWaalsContact SD-CD1 3.56Å; M135-L137 HydrophobicContact SD-CG 4.05Å; L137-L203 CarbonylContact C-O 3.6Å; L137-L203 WeakPolarHBondContact CA-O 3.39Å; L137-V204 HydrophobicContact CD2-CB 4.43Å; L137-V204 HydrophobicContact CD2-CG1 3.83Å; L137-V204 HydrophobicContact CD2-CG2 4.02Å; L137-H258 HydrophobicContact CD1-CB 3.99Å; L137-H258 WeakPolarHBondContact CD1-CD2 3.44Å; L137-H258 VanDerWaalsContact CD1-CG 3.5Å; L137-F330 HydrophobicContact CD2-CB 3.89Å; L137-F330 HydrophobicContact CD2-CD2 4.12Å; L137-F330 HydrophobicContact CD2-CG 3.96Å
138	P	98.1	Very high	98.1	Very high	14 Å²	14	55.8 Å²	55.8	9%	0.091	31%	0.309	C	S	.	.			trans	-61.5	160.6	171.5	27.1	-34.9	0	0	0	111.7	F142 L203 L260 F330	P138-F142 HydrophobicContact CB-CB 3.9Å; P138-F142 HydrophobicContact CB-CD1 4.16Å; P138-F142 HydrophobicContact CB-CD2 3.53Å; P138-F142 HydrophobicContact CB-CE2 4Å; P138-F142 HydrophobicContact CB-CG 3.63Å; P138-F142 HydrophobicContact CG-CB 4.26Å; P138-F142 HydrophobicContact CG-CD1 3.84Å; P138-F142 HydrophobicContact CG-CD2 4.11Å; P138-F142 HydrophobicContact CG-CE1 4.14Å; P138-F142 HydrophobicContact CG-CE2 4.37Å; P138-F142 HydrophobicContact CG-CG 3.84Å; P138-F142 HydrophobicContact CG-CZ 4.41Å; P138-L203 HydrophobicContact CB-CD1 4.44Å; P138-L260 HydrophobicContact CG-CD2 4.02Å; P138-F330 HydrophobicContact CG-CE2 4.01Å; P138-F330 HydrophobicContact CG-CZ 4.08Å
139	S	96.8	Very high	98.1	Very high	67 Å²	67	58.3 Å²	58.3	47%	0.469	32%	0.318	S	S	.	.			trans	-51	146.6	179.9	172.4	0	0	0	0	112.8	S141 F142	S139-S141 WeakPolarHBondContact CB-OG 3.47Å; S139-S141 PolarHBondContact O-N 3.02Å; S139-S141 PolarHBondContact OG-N 3.38Å; S139-S141 VanDerWaalsContact OG-N 3.12Å; S139-S141 PolarHBondContact OG-OG 3.47Å; S139-F142 WeakPolarHBondContact O-CB 3.26Å; S139-F142 PolarHBondContact O-N 2.9Å
140	P	96.7	Very high	98.2	Very high	83 Å²	83	55.4 Å²	55.4	54%	0.539	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-5.7	167.4	-24.7	35.3	0	0	0	115.3	K261	P140-K261 WeakPolarHBondContact O-CE 3.25Å
141	S	97.4	Very high	98.2	Very high	82 Å²	82	51.7 Å²	51.7	57%	0.573	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-24	167.4	58	0	0	0	0	114.1	S139 T143 K261	S139-S141 WeakPolarHBondContact CB-OG 3.47Å; S139-S141 PolarHBondContact O-N 3.02Å; S139-S141 PolarHBondContact OG-N 3.38Å; S139-S141 VanDerWaalsContact OG-N 3.12Å; S139-S141 PolarHBondContact OG-OG 3.47Å; S141-T143 VanDerWaalsContact O-CG2 3.3Å; S141-T143 WeakPolarHBondContact O-CG2 3.37Å; S141-K261 VanDerWaalsContact C-NZ 3.3Å; S141-K261 PolarHBondContact O-NZ 3.35Å
142	F	98.6	Very high	98.2	Very high	15 Å²	15	48.6 Å²	48.6	7%	0.066	28%	0.28	C	S	.	.			trans	-58.9	145.7	-173.3	-168.9	-91.9	0	0	0	113.8	P138 S139 D146 V147 Y150 L200 L203 L260 K261 L328 F330	P138-F142 HydrophobicContact CB-CB 3.9Å; P138-F142 HydrophobicContact CB-CD1 4.16Å; P138-F142 HydrophobicContact CB-CD2 3.53Å; P138-F142 HydrophobicContact CB-CE2 4Å; P138-F142 HydrophobicContact CB-CG 3.63Å; P138-F142 HydrophobicContact CG-CB 4.26Å; P138-F142 HydrophobicContact CG-CD1 3.84Å; P138-F142 HydrophobicContact CG-CD2 4.11Å; P138-F142 HydrophobicContact CG-CE1 4.14Å; P138-F142 HydrophobicContact CG-CE2 4.37Å; P138-F142 HydrophobicContact CG-CG 3.84Å; P138-F142 HydrophobicContact CG-CZ 4.41Å; S139-F142 WeakPolarHBondContact O-CB 3.26Å; S139-F142 PolarHBondContact O-N 2.9Å; F142-D146 HydrophobicContact CD1-CB 4.17Å; F142-D146 HydrophobicContact CD2-CB 3.51Å; F142-D146 HydrophobicContact CE1-CB 3.96Å; F142-D146 HydrophobicContact CE2-CB 3.29Å; F142-D146 HydrophobicContact CG-CB 3.95Å; F142-D146 HydrophobicContact CZ-CB 3.51Å; F142-V147 HydrophobicContact CE1-CG2 3.74Å; F142-V147 HydrophobicContact CZ-CG2 4.47Å; F142-Y150 HydrophobicContact CE2-CD2 4.01Å; F142-Y150 HydrophobicContact CE2-CE2 4.12Å; F142-Y150 HydrophobicContact CZ-CD2 4.25Å; F142-L200 HydrophobicContact CE1-CD1 4.18Å; F142-L200 HydrophobicContact CE2-CD1 4.41Å; F142-L200 HydrophobicContact CZ-CD1 3.57Å; F142-L203 HydrophobicContact CE2-CD1 3.9Å; F142-L203 HydrophobicContact CZ-CD1 4.47Å; F142-L260 HydrophobicContact CB-CD2 4.22Å; F142-L260 HydrophobicContact CD1-CD2 4.43Å; F142-K261 WeakPolarHBondContact O-CE 3.37Å; F142-K261 PolarHBondContact O-NZ 2.9Å; F142-L328 HydrophobicContact CD1-CD2 4.17Å; F142-F330 HydrophobicContact CE1-CZ 4.22Å
143	T	98.7	Very high	98.3	Very high	36 Å²	36	49.6 Å²	49.6	22%	0.221	28%	0.282	C	S	.	.			trans	-134.2	171.7	-163.8	77	0	0	0	0	113.1	S141 R145 D146 V147 Y180	S141-T143 VanDerWaalsContact O-CG2 3.3Å; S141-T143 WeakPolarHBondContact O-CG2 3.37Å; T143-R145 PolarHBondContact O-N 3.28Å; T143-R145 PolarHBondContact OG1-N 2.79Å; T143-D146 WeakPolarHBondContact CA-OD2 3.28Å; T143-D146 WeakPolarHBondContact CB-OD2 2.91Å; T143-D146 WeakPolarHBondContact CG2-OD2 3.4Å; T143-D146 PolarHBondContact N-OD2 3.4Å; T143-D146 WeakPolarHBondContact O-CB 3.31Å; T143-D146 PolarHBondContact O-N 2.85Å; T143-D146 PolarHBondContact OG1-N 3.13Å; T143-D146 PolarHBondContact OG1-OD2 3.29Å; T143-V147 PolarHBondContact O-N 3.39Å; T143-V147 VanDerWaalsContact O-N 3.08Å; T143-Y180 WeakPolarHBondContact CB-OH 3.3Å
144	V	98.6	Very high	98.2	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.012	31%	0.307	C	S	.	.	H	α-helix	trans	-64.6	-24.4	174.1	171.4	0	0	0	0	112.1	E148 V176 Y179 Y180 M237	V144-E148 PolarHBondContact O-N 2.8Å; V144-E148 VanDerWaalsContact O-N 3.08Å; V144-V176 HydrophobicContact CG1-CB 4.29Å; V144-V176 HydrophobicContact CG1-CG1 4.19Å; V144-V176 HydrophobicContact CG1-CG2 3.72Å; V144-Y179 HydrophobicContact CB-CD1 4.11Å; V144-Y179 HydrophobicContact CB-CE1 4.25Å; V144-Y179 HydrophobicContact CG1-CD1 4.24Å; V144-Y179 HydrophobicContact CG1-CG 4.21Å; V144-Y179 HydrophobicContact CG2-CD1 4.01Å; V144-Y179 HydrophobicContact CG2-CD2 4.4Å; V144-Y179 HydrophobicContact CG2-CE1 3.75Å; V144-Y179 HydrophobicContact CG2-CE2 4.16Å; V144-Y179 HydrophobicContact CG2-CG 4.33Å; V144-Y180 HydrophobicContact CB-CE2 3.89Å; V144-Y180 HydrophobicContact CG1-CE2 4.19Å; V144-Y180 PolarHBondContact N-OH 3.5Å; V144-M237 HydrophobicContact CB-SD 4.34Å; V144-M237 HydrophobicContact CG1-SD 3.81Å; V144-M237 HydrophobicContact CG2-CB 4.43Å; V144-M237 HydrophobicContact CG2-CG 4.1Å; V144-M237 HydrophobicContact CG2-SD 3.98Å
145	R	98.6	Very high	98.2	Very high	152 Å²	152	55.3 Å²	55.3	57%	0.574	30%	0.301	S	S	*	.	H	α-helix	trans	-72.9	-30.6	169.9	-62.1	-168.9	-179.8	-169.1	-2.7	112.9	T143 E148 H149 V176 Y180	T143-R145 PolarHBondContact O-N 3.28Å; T143-R145 PolarHBondContact OG1-N 2.79Å; R145-E148 WeakPolarHBondContact O-CB 3.45Å; R145-E148 PolarHBondContact O-N 3.21Å; R145-H149 PolarHBondContact O-N 2.64Å; R145-V176 HydrophobicContact CG-CG1 4.11Å; R145-Y180 HydrophobicContact CG-CD2 4.07Å; R145-Y180 HydrophobicContact CG-CE2 3.5Å
146	D	98.8	Very high	98.2	Very high	56 Å²	56	60.3 Å²	60.3	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-73	-35.5	175	-51.7	-69.8	0	0	0	110	F142 T143 H149 Y150	F142-D146 HydrophobicContact CD1-CB 4.17Å; F142-D146 HydrophobicContact CD2-CB 3.51Å; F142-D146 HydrophobicContact CE1-CB 3.96Å; F142-D146 HydrophobicContact CE2-CB 3.29Å; F142-D146 HydrophobicContact CG-CB 3.95Å; F142-D146 HydrophobicContact CZ-CB 3.51Å; T143-D146 WeakPolarHBondContact CA-OD2 3.28Å; T143-D146 WeakPolarHBondContact CB-OD2 2.91Å; T143-D146 WeakPolarHBondContact CG2-OD2 3.4Å; T143-D146 PolarHBondContact N-OD2 3.4Å; T143-D146 WeakPolarHBondContact O-CB 3.31Å; T143-D146 PolarHBondContact O-N 2.85Å; T143-D146 PolarHBondContact OG1-N 3.13Å; T143-D146 PolarHBondContact OG1-OD2 3.29Å; D146-H149 PolarHBondContact O-N 2.9Å; D146-Y150 VanDerWaalsContact O-CD2 3.32Å; D146-Y150 WeakPolarHBondContact O-CD2 3.34Å; D146-Y150 PolarHBondContact O-N 2.97Å
147	V	98.8	Very high	98.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.6	-50.1	167	-176.9	0	0	0	0	110.5	F142 T143 H149 Y150 V151 L172 L193 L200 M237 L328	F142-V147 HydrophobicContact CE1-CG2 3.74Å; F142-V147 HydrophobicContact CZ-CG2 4.47Å; T143-V147 PolarHBondContact O-N 3.39Å; T143-V147 VanDerWaalsContact O-N 3.08Å; V147-H149 VanDerWaalsContact C-N 3.28Å; V147-H149 PolarHBondContact O-N 2.84Å; V147-Y150 PolarHBondContact O-N 3.28Å; V147-V151 HydrophobicContact CG1-CG2 4.02Å; V147-V151 VanDerWaalsContact O-CB 3.26Å; V147-V151 WeakPolarHBondContact O-CB 3.34Å; V147-V151 WeakPolarHBondContact O-CG2 3.11Å; V147-V151 PolarHBondContact O-N 3.31Å; V147-L172 HydrophobicContact CG1-CD2 4.32Å; V147-L193 HydrophobicContact CG1-CD2 4Å; V147-L200 HydrophobicContact CG1-CD2 4.23Å; V147-M237 HydrophobicContact CB-SD 4.13Å; V147-M237 HydrophobicContact CG1-CE 4.3Å; V147-M237 HydrophobicContact CG1-SD 3.91Å; V147-M237 HydrophobicContact CG2-SD 4.16Å; V147-L328 HydrophobicContact CG2-CD1 4.22Å
148	E	98.7	Very high	98	Very high	47 Å²	47	57.6 Å²	57.6	22%	0.22	31%	0.307	C	S	.	.	H	α-helix	trans	-54.2	-42.3	175.3	-167	-176.2	-167.7	0	0	112.5	V144 R145 G152 G173 V176	V144-E148 PolarHBondContact O-N 2.8Å; V144-E148 VanDerWaalsContact O-N 3.08Å; R145-E148 WeakPolarHBondContact O-CB 3.45Å; R145-E148 PolarHBondContact O-N 3.21Å; E148-G152 CarbonylContact O-C 3.59Å; E148-G152 VanDerWaalsContact O-CA 3.24Å; E148-G152 WeakPolarHBondContact O-CA 3.23Å; E148-G152 PolarHBondContact O-N 3.02Å; E148-G173 WeakPolarHBondContact OE1-CA 3.25Å; E148-V176 HydrophobicContact CB-CG2 3.83Å; E148-V176 HydrophobicContact CG-CG2 4.09Å; E148-V176 WeakPolarHBondContact OE2-CG1 3.16Å
149	H	98.6	Very high	97.9	Very high	143 Å²	143	57 Å²	57	66%	0.662	30%	0.303	S	S	*	.	H	α-helix	trans	-68.9	-40.5	180	-177	72.4	0	0	0	113.8	R145 D146 V147	R145-H149 PolarHBondContact O-N 2.64Å; D146-H149 PolarHBondContact O-N 2.9Å; V147-H149 VanDerWaalsContact C-N 3.28Å; V147-H149 PolarHBondContact O-N 2.84Å
150	Y	98.7	Very high	97.8	Very high	82 Å²	82	54.6 Å²	54.6	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-85.6	-22.9	-177.8	-80.8	-84.9	0	0	0	114.1	F142 D146 V147 R199 L203	F142-Y150 HydrophobicContact CE2-CD2 4.01Å; F142-Y150 HydrophobicContact CE2-CE2 4.12Å; F142-Y150 HydrophobicContact CZ-CD2 4.25Å; D146-Y150 VanDerWaalsContact O-CD2 3.32Å; D146-Y150 WeakPolarHBondContact O-CD2 3.34Å; D146-Y150 PolarHBondContact O-N 2.97Å; V147-Y150 PolarHBondContact O-N 3.28Å; Y150-R199 HydrophobicContact CD1-CB 4.01Å; Y150-R199 PolarHBondContact O-N 3.4Å; Y150-L203 HydrophobicContact CD1-CD1 4.14Å; Y150-L203 HydrophobicContact CD2-CD1 4.1Å; Y150-L203 HydrophobicContact CE1-CD1 3.85Å; Y150-L203 HydrophobicContact CE1-CG 4.3Å; Y150-L203 HydrophobicContact CE2-CD1 3.81Å; Y150-L203 HydrophobicContact CG-CD1 4.27Å
151	V	98.6	Very high	97.8	Very high	19 Å²	19	51.1 Å²	51.1	12%	0.115	26%	0.262	C	S	.	.	H	α-helix	trans	-98.4	-34.2	179	172.8	0	0	0	0	112.4	V147 K155 L172 L193 F195 T198 L200	V147-V151 HydrophobicContact CG1-CG2 4.02Å; V147-V151 VanDerWaalsContact O-CB 3.26Å; V147-V151 WeakPolarHBondContact O-CB 3.34Å; V147-V151 WeakPolarHBondContact O-CG2 3.11Å; V147-V151 PolarHBondContact O-N 3.31Å; V151-K155 HydrophobicContact CG1-CB 3.98Å; V151-K155 HydrophobicContact CG1-CD 3.54Å; V151-K155 HydrophobicContact CG1-CG 4.31Å; V151-L172 HydrophobicContact CB-CD2 3.61Å; V151-L172 HydrophobicContact CG1-CD2 3.5Å; V151-L172 HydrophobicContact CG2-CD2 4.48Å; V151-L193 HydrophobicContact CG1-CD1 4.24Å; V151-F195 HydrophobicContact CG2-CB 4.4Å; V151-T198 HydrophobicContact CB-CG2 4.43Å; V151-T198 HydrophobicContact CG1-CG2 4.18Å; V151-T198 HydrophobicContact CG2-CG2 4.26Å; V151-L200 HydrophobicContact CG2-CB 4.14Å; V151-L200 HydrophobicContact CG2-CD2 3.87Å
152	G	98.3	Very high	97.7	Very high	29 Å²	29	47.3 Å²	47.3	30%	0.299	24%	0.235	S	C	.	.			trans	102.1	130.5	-175.8	0	0	0	0	0	112.8	E148 D154 K155	E148-G152 CarbonylContact O-C 3.59Å; E148-G152 VanDerWaalsContact O-CA 3.24Å; E148-G152 WeakPolarHBondContact O-CA 3.23Å; E148-G152 PolarHBondContact O-N 3.02Å; G152-D154 PolarHBondContact O-N 3.24Å; G152-D154 VanDerWaalsContact O-N 3.11Å; G152-K155 PolarHBondContact O-N 3.06Å
153	S	98.1	Very high	97.3	Very high	51 Å²	51	49.3 Å²	49.3	36%	0.357	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-29.9	-179.1	46.7	0	0	0	0	114.5	G173	S153-G173 PolarHBondContact O-N 2.88Å
154	D	97.7	Very high	96.9	Very high	100 Å²	100	53.7 Å²	53.7	54%	0.535	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-0.6	-171.9	-67.6	-93.7	0	0	0	114.1	G152 E156 K171	G152-D154 PolarHBondContact O-N 3.24Å; G152-D154 VanDerWaalsContact O-N 3.11Å; D154-E156 PolarHBondContact O-N 3.28Å; D154-K171 WeakPolarHBondContact OD1-CE 3.41Å; D154-K171 IonicContact OD1-NZ 2.61Å; D154-K171 PolarHBondContact OD1-NZ 3.22Å
155	K	97.8	Very high	96.4	Very high	57 Å²	57	55.9 Å²	55.9	25%	0.248	28%	0.277	C	S	.	.			trans	-62.4	123.7	170.5	-164.1	175.2	-169.5	178.5	0	108.1	V151 G152 L172 L193 E194 D197 T198	V151-K155 HydrophobicContact CG1-CB 3.98Å; V151-K155 HydrophobicContact CG1-CD 3.54Å; V151-K155 HydrophobicContact CG1-CG 4.31Å; G152-K155 PolarHBondContact O-N 3.06Å; K155-L172 PolarHBondContact O-N 3.43Å; K155-L193 HydrophobicContact CD-CD1 4.35Å; K155-E194 PolarHBondContact NZ-O 2.82Å; K155-D197 IonicContact NZ-OD1 3.27Å; K155-D197 PolarHBondContact NZ-OD1 3.47Å; K155-D197 IonicContact NZ-OD2 2.71Å; K155-D197 PolarHBondContact NZ-OD2 3.09Å; K155-T198 HydrophobicContact CD-CG2 4.5Å
156	E	97.9	Very high	95.9	Very high	125 Å²	125	50.2 Å²	50.2	58%	0.584	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.4	171.7	-173.9	168.5	74.5	0	0	109.3	D154 K169	D154-E156 PolarHBondContact O-N 3.28Å; E156-K169 HydrophobicContact CG-CB 3.94Å; E156-K169 HydrophobicContact CG-CD 4.3Å; E156-K169 HydrophobicContact CG-CG 4.42Å; E156-K169 WeakPolarHBondContact OE1-CD 3.3Å
157	I	97.4	Very high	95.3	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	147.8	-176.6	59.6	166.1	0	0	0	110.6	V159 K169 M170 L172 F175 V190 L193	I157-V159 HydrophobicContact CD1-CG2 3.99Å; I157-V159 HydrophobicContact CG1-CG2 3.87Å; I157-K169 WeakPolarHBondContact O-CA 3.47Å; I157-M170 VanDerWaalsContact CG1-O 3.3Å; I157-M170 WeakPolarHBondContact CG1-O 3.47Å; I157-M170 PolarHBondContact N-O 2.88Å; I157-M170 PolarHBondContact O-N 2.92Å; I157-M170 VanDerWaalsContact O-N 3.09Å; I157-L172 HydrophobicContact CD1-CB 4.35Å; I157-L172 HydrophobicContact CD1-CD1 4.01Å; I157-L172 HydrophobicContact CG2-CB 4.37Å; I157-F175 HydrophobicContact CD1-CB 3.99Å; I157-F175 HydrophobicContact CD1-CG 4.28Å; I157-V190 HydrophobicContact CD1-CG1 4.22Å; I157-V190 HydrophobicContact CD1-CG2 3.78Å; I157-L193 HydrophobicContact CG2-CD1 3.87Å; I157-L193 HydrophobicContact CG2-CD2 4.48Å
158	D	94.8	Very high	94.9	Very high	44 Å²	44	52.9 Å²	52.9	24%	0.235	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	132.4	171.6	-68.8	-72.9	0	0	0	111.1	K169	D158-K169 WeakPolarHBondContact OD1-CE 3.48Å; D158-K169 VanDerWaalsContact OD1-CG 3.3Å; D158-K169 WeakPolarHBondContact OD1-CG 3.44Å; D158-K169 IonicContact OD1-NZ 2.71Å; D158-K169 PolarHBondContact OD1-NZ 3.35Å; D158-K169 IonicContact OD2-NZ 2.62Å; D158-K169 PolarHBondContact OD2-NZ 2.87Å
159	V	96.5	Very high	94.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	123.4	-171.3	-168.6	0	0	0	0	110	I157 D167 C168 M170 F175 L188 V190	I157-V159 HydrophobicContact CD1-CG2 3.99Å; I157-V159 HydrophobicContact CG1-CG2 3.87Å; V159-D167 CarbonylContact O-C 3.55Å; V159-C168 PolarHBondContact N-O 3.36Å; V159-C168 PolarHBondContact O-N 2.98Å; V159-M170 HydrophobicContact CB-CE 3.97Å; V159-M170 HydrophobicContact CB-CG 4.48Å; V159-M170 HydrophobicContact CB-SD 4.39Å; V159-M170 HydrophobicContact CG1-CE 4.12Å; V159-M170 HydrophobicContact CG1-SD 4.4Å; V159-M170 HydrophobicContact CG2-CE 4.08Å; V159-M170 HydrophobicContact CG2-CG 3.59Å; V159-M170 HydrophobicContact CG2-SD 3.92Å; V159-F175 HydrophobicContact CG1-CD2 4.04Å; V159-F175 HydrophobicContact CG1-CE2 4.25Å; V159-L188 HydrophobicContact CG1-CB 3.81Å; V159-V190 HydrophobicContact CG1-CG2 4.2Å; V159-V190 HydrophobicContact CG2-CG2 4.02Å
160	I	95.3	Very high	94.5	Very high	17 Å²	17	51 Å²	51	9%	0.087	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	123.9	-179.4	-60.1	158.4	0	0	0	109.8	V162 D167 L188 N189 I191	I160-V162 HydrophobicContact CG2-CG2 4.25Å; I160-V162 PolarHBondContact O-N 2.99Å; I160-D167 WeakPolarHBondContact CG1-OD1 3.32Å; I160-L188 WeakPolarHBondContact O-CA 3.15Å; I160-N189 HydrophobicContact CB-CB 4.31Å; I160-N189 PolarHBondContact N-O 2.82Å; I160-N189 PolarHBondContact O-N 3.27Å; I160-I191 HydrophobicContact CD1-CD1 3.6Å; I160-I191 HydrophobicContact CD1-CG1 3.93Å
161	D	95.8	Very high	94.5	Very high	11 Å²	11	51.5 Å²	51.5	6%	0.059	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	96.8	159.7	-173.1	-27.8	0	0	0	108.1	A163 R164 Q165 A166 K186 L188	D161-A163 PolarHBondContact O-N 2.81Å; D161-A163 PolarHBondContact OD1-N 2.94Å; D161-R164 HydrophobicContact CB-CB 4.22Å; D161-R164 HydrophobicContact CB-CG 4.36Å; D161-R164 CarbonylContact O-C 3.58Å; D161-R164 WeakPolarHBondContact O-CA 3.05Å; D161-R164 PolarHBondContact O-N 3.37Å; D161-R164 VanDerWaalsContact OD2-CD 3.28Å; D161-R164 WeakPolarHBondContact OD2-CD 3.37Å; D161-Q165 PolarHBondContact O-N 3.33Å; D161-A166 PolarHBondContact N-O 3.22Å; D161-K186 WeakPolarHBondContact OD2-CD 3.38Å; D161-K186 IonicContact OD2-NZ 3.61Å; D161-L188 HydrophobicContact CB-CD2 4.27Å
162	V	95.5	Very high	94.5	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.8	-170.3	172	0	0	0	0	111.7	G83 I160 R164 Q165 V187 N189 Y243	G83-V162 CarbonylContact C-O 3.56Å; G83-V162 WeakPolarHBondContact CA-O 3.3Å; I160-V162 HydrophobicContact CG2-CG2 4.25Å; I160-V162 PolarHBondContact O-N 2.99Å; V162-R164 PolarHBondContact O-N 2.96Å; V162-Q165 PolarHBondContact O-N 2.83Å; V162-Q165 PolarHBondContact O-NE2 3.24Å; V162-V187 HydrophobicContact CB-CB 4.16Å; V162-V187 HydrophobicContact CB-CG1 3.84Å; V162-V187 WeakPolarHBondContact CB-O 3.17Å; V162-V187 HydrophobicContact CG1-CG1 4.2Å; V162-V187 HydrophobicContact CG2-CG1 4.03Å; V162-V187 PolarHBondContact N-O 2.85Å; V162-N189 HydrophobicContact CG2-CB 3.7Å; V162-Y243 VanDerWaalsContact CG1-N 3.35Å
163	A	91	Very high	94.5	Very high	58 Å²	58	49.2 Å²	49.2	48%	0.479	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-14.3	179.2	0	0	0	0	0	113.3	D161	D161-A163 PolarHBondContact O-N 2.81Å; D161-A163 PolarHBondContact OD1-N 2.94Å
164	R	89.3	Confident	94.5	Very high	127 Å²	127	50.3 Å²	50.3	48%	0.479	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-20.9	174.8	-66.1	175	60.6	177.8	-6.9	113.4	D161 V162 A166	D161-R164 HydrophobicContact CB-CB 4.22Å; D161-R164 HydrophobicContact CB-CG 4.36Å; D161-R164 CarbonylContact O-C 3.58Å; D161-R164 WeakPolarHBondContact O-CA 3.05Å; D161-R164 PolarHBondContact O-N 3.37Å; D161-R164 VanDerWaalsContact OD2-CD 3.28Å; D161-R164 WeakPolarHBondContact OD2-CD 3.37Å; V162-R164 PolarHBondContact O-N 2.96Å; R164-A166 VanDerWaalsContact C-N 3.3Å; R164-A166 HydrophobicContact CB-CB 4.06Å
165	Q	89.1	Confident	94.5	Very high	49 Å²	49	45.6 Å²	45.6	23%	0.229	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	52.6	-163.8	-62.9	-67	-82.6	0	0	110.7	T82 D161 V162 Y243	T82-Q165 HydrophobicContact CG2-CG 3.74Å; D161-Q165 PolarHBondContact O-N 3.33Å; V162-Q165 PolarHBondContact O-N 2.83Å; V162-Q165 PolarHBondContact O-NE2 3.24Å; Q165-Y243 PolarHBondContact NE2-O 3.22Å
166	A	87.6	Confident	94.6	Very high	32 Å²	32	43.1 Å²	43.1	26%	0.264	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	139	-179.9	0	0	0	0	0	110.4	D161 R164	D161-A166 PolarHBondContact N-O 3.22Å; R164-A166 VanDerWaalsContact C-N 3.3Å; R164-A166 HydrophobicContact CB-CB 4.06Å
167	D	86.7	Confident	94.6	Very high	81 Å²	81	43.5 Å²	43.5	43%	0.433	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	153	176.3	-55.3	-87.2	0	0	0	112.4	V159 I160	V159-D167 CarbonylContact O-C 3.55Å; I160-D167 WeakPolarHBondContact CG1-OD1 3.32Å
168	C	89.6	Confident	94.6	Very high	32 Å²	32	44.8 Å²	44.8	22%	0.216	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	157.3	160.1	65.9	0	0	0	0	110.4	V159	V159-C168 PolarHBondContact N-O 3.36Å; V159-C168 PolarHBondContact O-N 2.98Å
169	K	92.8	Very high	94.8	Very high	111 Å²	111	43.9 Å²	43.9	48%	0.483	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	141.3	176.2	-68.5	-175.2	-178	-62.8	0	111.3	E156 I157 D158	E156-K169 HydrophobicContact CG-CB 3.94Å; E156-K169 HydrophobicContact CG-CD 4.3Å; E156-K169 HydrophobicContact CG-CG 4.42Å; E156-K169 WeakPolarHBondContact OE1-CD 3.3Å; I157-K169 WeakPolarHBondContact O-CA 3.47Å; D158-K169 WeakPolarHBondContact OD1-CE 3.48Å; D158-K169 VanDerWaalsContact OD1-CG 3.3Å; D158-K169 WeakPolarHBondContact OD1-CG 3.44Å; D158-K169 IonicContact OD1-NZ 2.71Å; D158-K169 PolarHBondContact OD1-NZ 3.35Å; D158-K169 IonicContact OD2-NZ 2.62Å; D158-K169 PolarHBondContact OD2-NZ 2.87Å
170	M	96.3	Very high	94.8	Very high	40 Å²	40	48.5 Å²	48.5	20%	0.197	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	167.9	168.7	65.3	-172.4	67.4	0	0	111.2	I157 V159 F175 L188	I157-M170 VanDerWaalsContact CG1-O 3.3Å; I157-M170 WeakPolarHBondContact CG1-O 3.47Å; I157-M170 PolarHBondContact N-O 2.88Å; I157-M170 PolarHBondContact O-N 2.92Å; I157-M170 VanDerWaalsContact O-N 3.09Å; V159-M170 HydrophobicContact CB-CE 3.97Å; V159-M170 HydrophobicContact CB-CG 4.48Å; V159-M170 HydrophobicContact CB-SD 4.39Å; V159-M170 HydrophobicContact CG1-CE 4.12Å; V159-M170 HydrophobicContact CG1-SD 4.4Å; V159-M170 HydrophobicContact CG2-CE 4.08Å; V159-M170 HydrophobicContact CG2-CG 3.59Å; V159-M170 HydrophobicContact CG2-SD 3.92Å; M170-F175 HydrophobicContact CG-CB 4.45Å; M170-F175 HydrophobicContact SD-CB 4.06Å; M170-F175 HydrophobicContact SD-CD2 4.47Å; M170-L188 HydrophobicContact CE-CD1 4.09Å; M170-L188 HydrophobicContact SD-CD1 4.44Å
171	K	98.3	Very high	94.9	Very high	91 Å²	91	50.1 Å²	50.1	40%	0.396	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	141.9	173.3	-70.7	-175.8	170.1	-169.7	0	111.6	D154 G173 D174 F175	D154-K171 WeakPolarHBondContact OD1-CE 3.41Å; D154-K171 IonicContact OD1-NZ 2.61Å; D154-K171 PolarHBondContact OD1-NZ 3.22Å; K171-G173 VanDerWaalsContact C-N 3.26Å; K171-G173 PolarHBondContact O-N 3.29Å; K171-D174 HydrophobicContact CB-CB 4.5Å; K171-D174 PolarHBondContact O-N 3.49Å; K171-F175 PolarHBondContact O-N 3.26Å
172	L	98.7	Very high	94.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-52	-44.2	175.4	175	57.6	0	0	0	112.2	V147 V151 K155 I157 D174 F175 V176 L193 M237	V147-L172 HydrophobicContact CG1-CD2 4.32Å; V151-L172 HydrophobicContact CB-CD2 3.61Å; V151-L172 HydrophobicContact CG1-CD2 3.5Å; V151-L172 HydrophobicContact CG2-CD2 4.48Å; K155-L172 PolarHBondContact O-N 3.43Å; I157-L172 HydrophobicContact CD1-CB 4.35Å; I157-L172 HydrophobicContact CD1-CD1 4.01Å; I157-L172 HydrophobicContact CG2-CB 4.37Å; L172-D174 VanDerWaalsContact C-N 3.28Å; L172-D174 PolarHBondContact O-N 3.01Å; L172-F175 WeakPolarHBondContact O-CB 3.34Å; L172-F175 PolarHBondContact O-N 3.44Å; L172-V176 HydrophobicContact CD1-CG2 4Å; L172-V176 HydrophobicContact CG-CG2 4.24Å; L172-V176 WeakPolarHBondContact O-CG2 3.34Å; L172-V176 PolarHBondContact O-N 3.31Å; L172-L193 HydrophobicContact CD1-CD2 4.36Å; L172-M237 HydrophobicContact CD1-CE 3.7Å; L172-M237 HydrophobicContact CD1-SD 4.48Å
173	G	98.3	Very high	94.5	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-64.7	-28.5	178.5	0	0	0	0	0	114.1	E148 S153 K171 V176 K177	E148-G173 WeakPolarHBondContact OE1-CA 3.25Å; S153-G173 PolarHBondContact O-N 2.88Å; K171-G173 VanDerWaalsContact C-N 3.26Å; K171-G173 PolarHBondContact O-N 3.29Å; G173-V176 PolarHBondContact O-N 3.38Å; G173-K177 WeakPolarHBondContact O-CD 3.3Å; G173-K177 WeakPolarHBondContact O-CE 3.42Å; G173-K177 WeakPolarHBondContact O-CG 3.36Å; G173-K177 PolarHBondContact O-N 3.27Å
174	D	98.1	Very high	94.7	Very high	74 Å²	74	63.3 Å²	63.3	40%	0.396	32%	0.317	S	S	.	.	H	α-helix	trans	-77.3	-37.1	174	-68.1	-44.2	0	0	0	111.8	K171 L172 V176 K177 Y178	K171-D174 HydrophobicContact CB-CB 4.5Å; K171-D174 PolarHBondContact O-N 3.49Å; L172-D174 VanDerWaalsContact C-N 3.28Å; L172-D174 PolarHBondContact O-N 3.01Å; D174-V176 VanDerWaalsContact C-N 3.32Å; D174-V176 PolarHBondContact O-N 3.4Å; D174-K177 PolarHBondContact O-N 3.33Å; D174-K177 IonicContact OD1-NZ 2.83Å; D174-K177 PolarHBondContact OD1-NZ 3.38Å; D174-Y178 PolarHBondContact O-N 3.34Å
175	F	98.5	Very high	94.8	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-39.5	167.2	178.4	-95.7	0	0	0	112	I157 V159 M170 K171 L172 Y178 Y179 L188 V190 M237	I157-F175 HydrophobicContact CD1-CB 3.99Å; I157-F175 HydrophobicContact CD1-CG 4.28Å; V159-F175 HydrophobicContact CG1-CD2 4.04Å; V159-F175 HydrophobicContact CG1-CE2 4.25Å; M170-F175 HydrophobicContact CG-CB 4.45Å; M170-F175 HydrophobicContact SD-CB 4.06Å; M170-F175 HydrophobicContact SD-CD2 4.47Å; K171-F175 PolarHBondContact O-N 3.26Å; L172-F175 WeakPolarHBondContact O-CB 3.34Å; L172-F175 PolarHBondContact O-N 3.44Å; F175-Y178 HydrophobicContact CD2-CD1 4.09Å; F175-Y178 AromaticContact CE2-CD1 3.98Å; F175-Y178 HydrophobicContact CE2-CD1 3.98Å; F175-Y178 HydrophobicContact CE2-CE1 4.16Å; F175-Y178 WeakPolarHBondContact O-CB 3.5Å; F175-Y178 PolarHBondContact O-N 2.89Å; F175-Y179 HydrophobicContact CE1-CD2 4.01Å; F175-Y179 AromaticContact CZ-CD2 3.95Å; F175-Y179 HydrophobicContact CZ-CD2 3.95Å; F175-Y179 WeakPolarHBondContact O-CB 3.47Å; F175-Y179 PolarHBondContact O-N 2.9Å; F175-L188 HydrophobicContact CE2-CB 4.15Å; F175-V190 HydrophobicContact CD1-CG2 3.87Å; F175-V190 HydrophobicContact CD2-CG2 3.74Å; F175-V190 HydrophobicContact CE1-CG2 3.74Å; F175-V190 HydrophobicContact CE2-CG2 3.6Å; F175-V190 HydrophobicContact CG-CG2 3.87Å; F175-V190 HydrophobicContact CZ-CB 4.48Å; F175-V190 HydrophobicContact CZ-CG2 3.61Å; F175-M237 HydrophobicContact CD1-CE 4.2Å; F175-M237 HydrophobicContact CE1-CB 3.67Å; F175-M237 HydrophobicContact CE1-CE 4.15Å; F175-M237 HydrophobicContact CE1-SD 4.3Å; F175-M237 HydrophobicContact CZ-CB 4.09Å; F175-M237 WeakPolarHBondContact CZ-O 3.4Å
176	V	98.6	Very high	95	Very high	5 Å²	5	67.5 Å²	67.5	3%	0.03	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-42.8	177.5	178	0	0	0	0	111	V144 R145 E148 L172 G173 D174 Y178 Y179 Y180	V144-V176 HydrophobicContact CG1-CB 4.29Å; V144-V176 HydrophobicContact CG1-CG1 4.19Å; V144-V176 HydrophobicContact CG1-CG2 3.72Å; R145-V176 HydrophobicContact CG-CG1 4.11Å; E148-V176 HydrophobicContact CB-CG2 3.83Å; E148-V176 HydrophobicContact CG-CG2 4.09Å; E148-V176 WeakPolarHBondContact OE2-CG1 3.16Å; L172-V176 HydrophobicContact CD1-CG2 4Å; L172-V176 HydrophobicContact CG-CG2 4.24Å; L172-V176 WeakPolarHBondContact O-CG2 3.34Å; L172-V176 PolarHBondContact O-N 3.31Å; G173-V176 PolarHBondContact O-N 3.38Å; D174-V176 VanDerWaalsContact C-N 3.32Å; D174-V176 PolarHBondContact O-N 3.4Å; V176-Y178 VanDerWaalsContact C-N 3.34Å; V176-Y178 PolarHBondContact O-N 2.94Å; V176-Y179 PolarHBondContact O-N 3.3Å; V176-Y180 HydrophobicContact CG1-CD2 3.78Å; V176-Y180 HydrophobicContact CG1-CE2 3.93Å; V176-Y180 WeakPolarHBondContact O-CD2 3.24Å; V176-Y180 PolarHBondContact O-N 3.3Å
177	K	98	Very high	95.5	Very high	133 Å²	133	68.1 Å²	68.1	58%	0.578	34%	0.341	S	S	*	.	H	α-helix	trans	-58.3	-44.1	172.2	-69.3	160.7	-147.2	162.8	0	111.5	G173 D174 S181	G173-K177 WeakPolarHBondContact O-CD 3.3Å; G173-K177 WeakPolarHBondContact O-CE 3.42Å; G173-K177 WeakPolarHBondContact O-CG 3.36Å; G173-K177 PolarHBondContact O-N 3.27Å; D174-K177 PolarHBondContact O-N 3.33Å; D174-K177 IonicContact OD1-NZ 2.83Å; D174-K177 PolarHBondContact OD1-NZ 3.38Å; K177-S181 PolarHBondContact O-N 3.27Å; K177-S181 VanDerWaalsContact O-N 3.11Å
178	Y	98.1	Very high	96	Very high	34 Å²	34	64.8 Å²	64.8	13%	0.133	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-45.8	173.3	160.6	-91.2	0	0	0	112.2	D174 F175 V176 Y180 S181 R184 K186 L188 V239	D174-Y178 PolarHBondContact O-N 3.34Å; F175-Y178 HydrophobicContact CD2-CD1 4.09Å; F175-Y178 AromaticContact CE2-CD1 3.98Å; F175-Y178 HydrophobicContact CE2-CD1 3.98Å; F175-Y178 HydrophobicContact CE2-CE1 4.16Å; F175-Y178 WeakPolarHBondContact O-CB 3.5Å; F175-Y178 PolarHBondContact O-N 2.89Å; V176-Y178 VanDerWaalsContact C-N 3.34Å; V176-Y178 PolarHBondContact O-N 2.94Å; Y178-Y180 VanDerWaalsContact C-N 3.34Å; Y178-Y180 PolarHBondContact O-N 3.36Å; Y178-S181 VanDerWaalsContact O-CB 3.22Å; Y178-S181 WeakPolarHBondContact O-CB 3.13Å; Y178-S181 PolarHBondContact O-N 2.93Å; Y178-S181 VanDerWaalsContact O-N 3.08Å; Y178-R184 HydrophobicContact CD2-CG 4.46Å; Y178-R184 HydrophobicContact CE2-CB 3.8Å; Y178-R184 HydrophobicContact CE2-CG 3.88Å; Y178-K186 WeakPolarHBondContact CE2-O 3.15Å; Y178-K186 PolarHBondContact OH-O 3.01Å; Y178-L188 HydrophobicContact CD1-CB 4.25Å; Y178-L188 HydrophobicContact CD1-CD1 3.99Å; Y178-L188 HydrophobicContact CD1-CG 4.5Å; Y178-L188 HydrophobicContact CD2-CD1 3.9Å; Y178-L188 HydrophobicContact CE1-CB 3.61Å; Y178-L188 HydrophobicContact CE1-CD1 4.02Å; Y178-L188 HydrophobicContact CE1-CG 4.02Å; Y178-L188 HydrophobicContact CE2-CD1 3.89Å; Y178-L188 HydrophobicContact CE2-CG 4.03Å; Y178-L188 HydrophobicContact CG-CD1 3.95Å; Y178-L188 PolarHBondContact OH-N 2.95Å; Y178-V239 HydrophobicContact CE1-CG1 3.75Å
179	Y	98.3	Very high	96.5	Very high	24 Å²	24	63.3 Å²	63.3	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-42.1	-176.9	-170.3	-85.6	0	0	0	111.3	V144 F175 V176 S181 R184 V239	V144-Y179 HydrophobicContact CB-CD1 4.11Å; V144-Y179 HydrophobicContact CB-CE1 4.25Å; V144-Y179 HydrophobicContact CG1-CD1 4.24Å; V144-Y179 HydrophobicContact CG1-CG 4.21Å; V144-Y179 HydrophobicContact CG2-CD1 4.01Å; V144-Y179 HydrophobicContact CG2-CD2 4.4Å; V144-Y179 HydrophobicContact CG2-CE1 3.75Å; V144-Y179 HydrophobicContact CG2-CE2 4.16Å; V144-Y179 HydrophobicContact CG2-CG 4.33Å; F175-Y179 HydrophobicContact CE1-CD2 4.01Å; F175-Y179 AromaticContact CZ-CD2 3.95Å; F175-Y179 HydrophobicContact CZ-CD2 3.95Å; F175-Y179 WeakPolarHBondContact O-CB 3.47Å; F175-Y179 PolarHBondContact O-N 2.9Å; V176-Y179 PolarHBondContact O-N 3.3Å; Y179-S181 VanDerWaalsContact C-N 3.34Å; Y179-R184 PolarHBondContact O-NE 3.34Å; Y179-R184 PolarHBondContact O-NH2 3.38Å; Y179-V239 HydrophobicContact CD2-CG1 3.82Å; Y179-V239 HydrophobicContact CE2-CG1 4.08Å
180	Y	98.1	Very high	96.7	Very high	98 Å²	98	58 Å²	58	38%	0.384	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	2.9	176	-70	-74.3	0	0	0	114.7	T143 V144 R145 V176 Y178	T143-Y180 WeakPolarHBondContact CB-OH 3.3Å; V144-Y180 HydrophobicContact CB-CE2 3.89Å; V144-Y180 HydrophobicContact CG1-CE2 4.19Å; V144-Y180 PolarHBondContact N-OH 3.5Å; R145-Y180 HydrophobicContact CG-CD2 4.07Å; R145-Y180 HydrophobicContact CG-CE2 3.5Å; V176-Y180 HydrophobicContact CG1-CD2 3.78Å; V176-Y180 HydrophobicContact CG1-CE2 3.93Å; V176-Y180 WeakPolarHBondContact O-CD2 3.24Å; V176-Y180 PolarHBondContact O-N 3.3Å; Y178-Y180 VanDerWaalsContact C-N 3.34Å; Y178-Y180 PolarHBondContact O-N 3.36Å
181	S	96.9	Very high	96.8	Very high	51 Å²	51	58.1 Å²	58.1	36%	0.357	29%	0.291	S	S	.	.			trans	-68.6	132.7	175.8	-179.6	0	0	0	0	111.7	K177 Y178 Y179 K183	K177-S181 PolarHBondContact O-N 3.27Å; K177-S181 VanDerWaalsContact O-N 3.11Å; Y178-S181 VanDerWaalsContact O-CB 3.22Å; Y178-S181 WeakPolarHBondContact O-CB 3.13Å; Y178-S181 PolarHBondContact O-N 2.93Å; Y178-S181 VanDerWaalsContact O-N 3.08Å; Y179-S181 VanDerWaalsContact C-N 3.34Å; S181-K183 WeakPolarHBondContact CB-O 3.44Å; S181-K183 PolarHBondContact O-N 3.2Å; S181-K183 VanDerWaalsContact O-N 3.12Å; S181-K183 PolarHBondContact OG-N 3.12Å; S181-K183 VanDerWaalsContact OG-N 3.11Å; S181-K183 PolarHBondContact OG-O 3.37Å
182	G	91.1	Very high	96.6	Very high	86 Å²	86	56.4 Å²	56.4	89%	0.887	29%	0.29	S	S	*	.	S	Bend	trans	-67.6	-1.7	169.6	0	0	0	0	0	114.5
183	K	92.3	Very high	96.6	Very high	172 Å²	172	56.7 Å²	56.7	75%	0.748	29%	0.292	S	S	*	.			trans	-139.5	122.9	172.9	-65	180	-176.9	174.7	0	110	S181	S181-K183 WeakPolarHBondContact CB-O 3.44Å; S181-K183 PolarHBondContact O-N 3.2Å; S181-K183 VanDerWaalsContact O-N 3.12Å; S181-K183 PolarHBondContact OG-N 3.12Å; S181-K183 VanDerWaalsContact OG-N 3.11Å; S181-K183 PolarHBondContact OG-O 3.37Å
184	R	94.3	Very high	96.6	Very high	88 Å²	88	58 Å²	58	33%	0.332	30%	0.298	S	S	.	.			trans	-119.6	108.8	175.2	-59.9	179.8	-169	147.9	-0.6	108.3	Y178 Y179 D326	Y178-R184 HydrophobicContact CD2-CG 4.46Å; Y178-R184 HydrophobicContact CE2-CB 3.8Å; Y178-R184 HydrophobicContact CE2-CG 3.88Å; Y179-R184 PolarHBondContact O-NE 3.34Å; Y179-R184 PolarHBondContact O-NH2 3.38Å; R184-D326 IonicContact CZ-OD1 3.85Å; R184-D326 IonicContact CZ-OD2 2.97Å; R184-D326 VanDerWaalsContact NH1-CG 3.29Å; R184-D326 IonicContact NH1-OD1 2.73Å; R184-D326 PolarHBondContact NH1-OD1 3.07Å; R184-D326 IonicContact NH1-OD2 2.68Å; R184-D326 PolarHBondContact NH1-OD2 3.47Å; R184-D326 IonicContact NH2-OD1 3.83Å; R184-D326 IonicContact NH2-OD2 2.81Å; R184-D326 PolarHBondContact NH2-OD2 2.86Å
185	E	90.7	Very high	96.6	Very high	194 Å²	194	54.6 Å²	54.6	91%	0.907	28%	0.279	S	S	*	.	S	Bend	trans	-85.3	-34.5	-177.5	-59.9	-168	164.6	0	0	112.5
186	K	94.4	Very high	96.5	Very high	71 Å²	71	56 Å²	56	31%	0.309	29%	0.29	S	S	.	.	S	Bend	trans	-99.8	160	166.4	-63	178.7	177.3	-177.9	0	110.3	E40 D161 Y178 L188	E40-K186 IonicContact OE1-NZ 3.01Å; E40-K186 IonicContact OE2-NZ 2.71Å; E40-K186 PolarHBondContact OE2-NZ 3.23Å; D161-K186 WeakPolarHBondContact OD2-CD 3.38Å; D161-K186 IonicContact OD2-NZ 3.61Å; Y178-K186 WeakPolarHBondContact CE2-O 3.15Å; Y178-K186 PolarHBondContact OH-O 3.01Å; K186-L188 HydrophobicContact CB-CD2 3.94Å; K186-L188 HydrophobicContact CB-CG 4.15Å; K186-L188 HydrophobicContact CD-CD2 4.08Å
187	V	97.6	Very high	96.4	Very high	45 Å²	45	61.2 Å²	61.2	27%	0.273	32%	0.317	S	S	.	.			trans	-102.3	108.4	167.7	177.2	0	0	0	0	107.3	V162 V239 S242	V162-V187 HydrophobicContact CB-CB 4.16Å; V162-V187 HydrophobicContact CB-CG1 3.84Å; V162-V187 WeakPolarHBondContact CB-O 3.17Å; V162-V187 HydrophobicContact CG1-CG1 4.2Å; V162-V187 HydrophobicContact CG2-CG1 4.03Å; V162-V187 PolarHBondContact N-O 2.85Å; V187-V239 HydrophobicContact CG1-CG2 3.92Å; V187-S242 WeakPolarHBondContact CG1-OG 3.43Å
188	L	97.9	Very high	96.4	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.052	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	144.5	-175.7	-57.5	-179.7	0	0	0	111.3	V159 I160 D161 M170 F175 Y178 K186 V239 S242	V159-L188 HydrophobicContact CG1-CB 3.81Å; I160-L188 WeakPolarHBondContact O-CA 3.15Å; D161-L188 HydrophobicContact CB-CD2 4.27Å; M170-L188 HydrophobicContact CE-CD1 4.09Å; M170-L188 HydrophobicContact SD-CD1 4.44Å; F175-L188 HydrophobicContact CE2-CB 4.15Å; Y178-L188 HydrophobicContact CD1-CB 4.25Å; Y178-L188 HydrophobicContact CD1-CD1 3.99Å; Y178-L188 HydrophobicContact CD1-CG 4.5Å; Y178-L188 HydrophobicContact CD2-CD1 3.9Å; Y178-L188 HydrophobicContact CE1-CB 3.61Å; Y178-L188 HydrophobicContact CE1-CD1 4.02Å; Y178-L188 HydrophobicContact CE1-CG 4.02Å; Y178-L188 HydrophobicContact CE2-CD1 3.89Å; Y178-L188 HydrophobicContact CE2-CG 4.03Å; Y178-L188 HydrophobicContact CG-CD1 3.95Å; Y178-L188 PolarHBondContact OH-N 2.95Å; K186-L188 HydrophobicContact CB-CD2 3.94Å; K186-L188 HydrophobicContact CB-CG 4.15Å; K186-L188 HydrophobicContact CD-CD2 4.08Å; L188-V239 WeakPolarHBondContact O-CG2 3.33Å; L188-S242 PolarHBondContact O-OG 3.44Å
189	N	98.4	Very high	96.4	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	124.1	-173	-174.1	34.8	0	0	0	111.4	I160 V162 I191 S238 T244	I160-N189 HydrophobicContact CB-CB 4.31Å; I160-N189 PolarHBondContact N-O 2.82Å; I160-N189 PolarHBondContact O-N 3.27Å; V162-N189 HydrophobicContact CG2-CB 3.7Å; N189-I191 WeakPolarHBondContact ND2-CG2 3.34Å; N189-S238 VanDerWaalsContact OD1-CB 3.22Å; N189-S238 WeakPolarHBondContact OD1-CB 3.47Å; N189-S238 PolarHBondContact OD1-OG 2.92Å; N189-T244 PolarHBondContact ND2-OG1 2.86Å
190	V	98.6	Very high	96.4	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.7	173.1	-176.9	0	0	0	0	108.5	I157 V159 F175 L193 L236 M237	I157-V190 HydrophobicContact CD1-CG1 4.22Å; I157-V190 HydrophobicContact CD1-CG2 3.78Å; V159-V190 HydrophobicContact CG1-CG2 4.2Å; V159-V190 HydrophobicContact CG2-CG2 4.02Å; F175-V190 HydrophobicContact CD1-CG2 3.87Å; F175-V190 HydrophobicContact CD2-CG2 3.74Å; F175-V190 HydrophobicContact CE1-CG2 3.74Å; F175-V190 HydrophobicContact CE2-CG2 3.6Å; F175-V190 HydrophobicContact CG-CG2 3.87Å; F175-V190 HydrophobicContact CZ-CB 4.48Å; F175-V190 HydrophobicContact CZ-CG2 3.61Å; V190-L193 HydrophobicContact CG1-CB 3.8Å; V190-L236 CarbonylContact O-C 3.47Å; V190-L236 WeakPolarHBondContact O-CA 3.41Å; V190-M237 HydrophobicContact CB-CB 4.22Å; V190-M237 HydrophobicContact CB-CE 4.1Å; V190-M237 HydrophobicContact CG1-CE 3.9Å; V190-M237 HydrophobicContact CG2-CE 4.22Å; V190-M237 PolarHBondContact N-O 3.3Å; V190-M237 PolarHBondContact O-N 3.13Å
191	I	96.9	Very high	96.4	Very high	42 Å²	42	58.4 Å²	58.4	22%	0.215	31%	0.307	C	S	.	.			trans	-122.3	-29.5	175.2	66.2	175.7	0	0	0	113	I160 N189 L236 T244	I160-I191 HydrophobicContact CD1-CD1 3.6Å; I160-I191 HydrophobicContact CD1-CG1 3.93Å; N189-I191 WeakPolarHBondContact ND2-CG2 3.34Å; I191-L236 HydrophobicContact CB-CD2 3.85Å; I191-L236 HydrophobicContact CG2-CD2 4.06Å; I191-T244 HydrophobicContact CD1-CG2 4.3Å
192	S	94.9	Very high	96.5	Very high	55 Å²	55	62.5 Å²	62.5	39%	0.385	33%	0.325	S	S	.	.			trans	-97.2	14.9	-169.8	-42.2	0	0	0	0	115.1	E194	S192-E194 VanDerWaalsContact C-N 3.34Å; S192-E194 PolarHBondContact O-N 3.1Å
193	L	98.1	Very high	96.8	Very high	7 Å²	7	60.7 Å²	60.7	4%	0.037	30%	0.295	C	S	.	.			trans	-73.4	87.6	176.7	172.9	54.4	0	0	0	110.3	V147 V151 K155 I157 L172 V190 Y234 C235 M237	V147-L193 HydrophobicContact CG1-CD2 4Å; V151-L193 HydrophobicContact CG1-CD1 4.24Å; K155-L193 HydrophobicContact CD-CD1 4.35Å; I157-L193 HydrophobicContact CG2-CD1 3.87Å; I157-L193 HydrophobicContact CG2-CD2 4.48Å; L172-L193 HydrophobicContact CD1-CD2 4.36Å; V190-L193 HydrophobicContact CG1-CB 3.8Å; L193-Y234 CarbonylContact O-C 3.55Å; L193-Y234 WeakPolarHBondContact O-CA 3.36Å; L193-C235 HydrophobicContact CD2-CB 4.33Å; L193-C235 HydrophobicContact CG-CB 4.35Å; L193-C235 PolarHBondContact O-N 3.46Å; L193-M237 HydrophobicContact CD2-CE 3.62Å
194	E	97.9	Very high	97.1	Very high	29 Å²	29	52.6 Å²	52.6	14%	0.136	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-73	137.5	165.4	-132	-75.9	163.3	0	0	109.5	K155 S192 S196 N230 Q232 K233 Y234	K155-E194 PolarHBondContact NZ-O 2.82Å; S192-E194 VanDerWaalsContact C-N 3.34Å; S192-E194 PolarHBondContact O-N 3.1Å; E194-S196 VanDerWaalsContact CD-OG 3.32Å; E194-S196 PolarHBondContact OE1-OG 2.81Å; E194-S196 WeakPolarHBondContact OE2-CB 3.4Å; E194-S196 PolarHBondContact OE2-N 2.92Å; E194-S196 PolarHBondContact OE2-OG 2.92Å; E194-S196 VanDerWaalsContact OE2-OG 3.13Å; E194-N230 WeakPolarHBondContact CG-O 3.35Å; E194-Q232 PolarHBondContact OE1-N 3.08Å; E194-K233 WeakPolarHBondContact CA-O 3.29Å; E194-K233 PolarHBondContact OE1-N 2.89Å; E194-Y234 HydrophobicContact CB-CD1 3.88Å; E194-Y234 HydrophobicContact CB-CE1 3.6Å; E194-Y234 HydrophobicContact CG-CD1 3.85Å; E194-Y234 HydrophobicContact CG-CE1 3.51Å; E194-Y234 HydrophobicContact CG-CE2 4.39Å; E194-Y234 HydrophobicContact CG-CG 4.42Å
195	F	98.3	Very high	97.3	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	26%	0.26	C	S	.	.			trans	-135	11.2	-170.9	70.2	-97.6	0	0	0	114.3	V151 D197 T198 L200 V204 K233 Y234 C235 F330	V151-F195 HydrophobicContact CG2-CB 4.4Å; F195-D197 PolarHBondContact O-N 2.97Å; F195-T198 HydrophobicContact CB-CG2 4.28Å; F195-T198 WeakPolarHBondContact O-CB 3.17Å; F195-T198 PolarHBondContact O-N 3.32Å; F195-T198 PolarHBondContact O-OG1 2.91Å; F195-L200 HydrophobicContact CB-CB 4.39Å; F195-L200 HydrophobicContact CB-CD2 4.31Å; F195-L200 HydrophobicContact CD1-CD2 4.21Å; F195-L200 HydrophobicContact CD2-CB 3.58Å; F195-L200 HydrophobicContact CD2-CD2 3.89Å; F195-L200 HydrophobicContact CD2-CG 3.54Å; F195-L200 HydrophobicContact CE2-CB 4.14Å; F195-L200 HydrophobicContact CE2-CD2 4.22Å; F195-L200 HydrophobicContact CE2-CG 3.69Å; F195-L200 HydrophobicContact CG-CB 4.19Å; F195-L200 HydrophobicContact CG-CD2 3.88Å; F195-L200 HydrophobicContact CG-CG 4.08Å; F195-L200 HydrophobicContact CZ-CG 4.34Å; F195-V204 HydrophobicContact CE2-CB 3.85Å; F195-V204 HydrophobicContact CE2-CG1 4.44Å; F195-V204 HydrophobicContact CE2-CG2 3.91Å; F195-V204 HydrophobicContact CZ-CB 3.79Å; F195-V204 HydrophobicContact CZ-CG1 3.96Å; F195-V204 HydrophobicContact CZ-CG2 3.72Å; F195-K233 HydrophobicContact CD1-CB 4.28Å; F195-K233 WeakPolarHBondContact CD1-O 3.44Å; F195-K233 HydrophobicContact CD2-CB 4.33Å; F195-K233 VanDerWaalsContact CE1-C 3.48Å; F195-K233 HydrophobicContact CE1-CB 3.87Å; F195-K233 VanDerWaalsContact CE1-O 3.3Å; F195-K233 WeakPolarHBondContact CE1-O 3.21Å; F195-K233 HydrophobicContact CE2-CB 3.93Å; F195-K233 HydrophobicContact CE2-CD 4.11Å; F195-K233 HydrophobicContact CG-CB 4.49Å; F195-K233 HydrophobicContact CZ-CB 3.68Å; F195-K233 HydrophobicContact CZ-CD 4.48Å; F195-K233 PolarHBondContact N-O 3.32Å; F195-K233 VanDerWaalsContact N-O 3.09Å; F195-Y234 VanDerWaalsContact CE1-C 3.47Å; F195-C235 HydrophobicContact CD1-CB 3.61Å; F195-C235 HydrophobicContact CE1-CB 3.79Å; F195-F330 AromaticContact CE1-CD1 3.65Å; F195-F330 HydrophobicContact CE1-CD1 3.65Å; F195-F330 AromaticContact CE1-CE1 3.76Å; F195-F330 HydrophobicContact CE1-CE1 3.76Å; F195-F330 AromaticContact CZ-CD1 3.61Å; F195-F330 HydrophobicContact CZ-CD1 3.61Å; F195-F330 AromaticContact CZ-CE1 3.66Å; F195-F330 HydrophobicContact CZ-CE1 3.66Å
196	S	97.2	Very high	97.7	Very high	31 Å²	31	42.6 Å²	42.6	22%	0.217	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.8	177.2	-67.2	0	0	0	0	112.5	E194 T198 S201 K233	E194-S196 VanDerWaalsContact CD-OG 3.32Å; E194-S196 PolarHBondContact OE1-OG 2.81Å; E194-S196 WeakPolarHBondContact OE2-CB 3.4Å; E194-S196 PolarHBondContact OE2-N 2.92Å; E194-S196 PolarHBondContact OE2-OG 2.92Å; E194-S196 VanDerWaalsContact OE2-OG 3.13Å; S196-T198 VanDerWaalsContact C-N 3.32Å; S196-S201 WeakPolarHBondContact O-CB 3.41Å; S196-S201 PolarHBondContact O-OG 3.03Å; S196-K233 WeakPolarHBondContact OG-CB 3.36Å
197	D	96.3	Very high	97.9	Very high	113 Å²	113	39.2 Å²	39.2	60%	0.604	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-9.7	174	68	-32	0	0	0	114.7	K155 F195	K155-D197 IonicContact NZ-OD1 3.27Å; K155-D197 PolarHBondContact NZ-OD1 3.47Å; K155-D197 IonicContact NZ-OD2 2.71Å; K155-D197 PolarHBondContact NZ-OD2 3.09Å; F195-D197 PolarHBondContact O-N 2.97Å
198	T	98.3	Very high	98	Very high	21 Å²	21	43.1 Å²	43.1	13%	0.129	21%	0.212	C	C	.	.	S	Bend	trans	-108.7	170.4	-171.9	76	0	0	0	0	114	V151 K155 F195 S196 L200 S201	V151-T198 HydrophobicContact CB-CG2 4.43Å; V151-T198 HydrophobicContact CG1-CG2 4.18Å; V151-T198 HydrophobicContact CG2-CG2 4.26Å; K155-T198 HydrophobicContact CD-CG2 4.5Å; F195-T198 HydrophobicContact CB-CG2 4.28Å; F195-T198 WeakPolarHBondContact O-CB 3.17Å; F195-T198 PolarHBondContact O-N 3.32Å; F195-T198 PolarHBondContact O-OG1 2.91Å; S196-T198 VanDerWaalsContact C-N 3.32Å; T198-L200 PolarHBondContact O-N 2.78Å; T198-L200 VanDerWaalsContact O-N 3.15Å; T198-L200 WeakPolarHBondContact OG1-CB 3.42Å; T198-L200 PolarHBondContact OG1-N 3.12Å; T198-L200 VanDerWaalsContact OG1-N 3.13Å; T198-S201 WeakPolarHBondContact O-CB 3.27Å; T198-S201 PolarHBondContact O-N 2.86Å
199	R	98.3	Very high	98	Very high	189 Å²	189	43 Å²	43	71%	0.713	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-63.2	-17.8	172.4	-58.3	178.3	179.5	174.6	-0.1	113.3	Y150 S201 N202	Y150-R199 HydrophobicContact CD1-CB 4.01Å; Y150-R199 PolarHBondContact O-N 3.4Å; R199-S201 VanDerWaalsContact C-N 3.25Å; R199-S201 PolarHBondContact O-N 3.03Å; R199-N202 PolarHBondContact O-N 3.42Å
200	L	98.5	Very high	98	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-68.4	-26	174.1	-172.4	55.8	0	0	0	111.8	F142 V147 V151 F195 T198 N202 L203 C235 F330	F142-L200 HydrophobicContact CE1-CD1 4.18Å; F142-L200 HydrophobicContact CE2-CD1 4.41Å; F142-L200 HydrophobicContact CZ-CD1 3.57Å; V147-L200 HydrophobicContact CG1-CD2 4.23Å; V151-L200 HydrophobicContact CG2-CB 4.14Å; V151-L200 HydrophobicContact CG2-CD2 3.87Å; F195-L200 HydrophobicContact CB-CB 4.39Å; F195-L200 HydrophobicContact CB-CD2 4.31Å; F195-L200 HydrophobicContact CD1-CD2 4.21Å; F195-L200 HydrophobicContact CD2-CB 3.58Å; F195-L200 HydrophobicContact CD2-CD2 3.89Å; F195-L200 HydrophobicContact CD2-CG 3.54Å; F195-L200 HydrophobicContact CE2-CB 4.14Å; F195-L200 HydrophobicContact CE2-CD2 4.22Å; F195-L200 HydrophobicContact CE2-CG 3.69Å; F195-L200 HydrophobicContact CG-CB 4.19Å; F195-L200 HydrophobicContact CG-CD2 3.88Å; F195-L200 HydrophobicContact CG-CG 4.08Å; F195-L200 HydrophobicContact CZ-CG 4.34Å; T198-L200 PolarHBondContact O-N 2.78Å; T198-L200 VanDerWaalsContact O-N 3.15Å; T198-L200 WeakPolarHBondContact OG1-CB 3.42Å; T198-L200 PolarHBondContact OG1-N 3.12Å; T198-L200 VanDerWaalsContact OG1-N 3.13Å; L200-N202 PolarHBondContact O-N 2.9Å; L200-L203 HydrophobicContact CD1-CB 4.4Å; L200-L203 HydrophobicContact CD1-CD1 4.13Å; L200-L203 PolarHBondContact O-N 3.16Å; L200-C235 HydrophobicContact CD2-CB 4.41Å; L200-F330 HydrophobicContact CD2-CE1 4.2Å
201	S	98.3	Very high	98	Very high	20 Å²	20	46 Å²	46	14%	0.14	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-56.1	-32.9	176.4	-166.8	0	0	0	0	112.1	S196 T198 R199 L203 V204 K233	S196-S201 WeakPolarHBondContact O-CB 3.41Å; S196-S201 PolarHBondContact O-OG 3.03Å; T198-S201 WeakPolarHBondContact O-CB 3.27Å; T198-S201 PolarHBondContact O-N 2.86Å; R199-S201 VanDerWaalsContact C-N 3.25Å; R199-S201 PolarHBondContact O-N 3.03Å; S201-L203 VanDerWaalsContact C-N 3.26Å; S201-L203 PolarHBondContact O-N 2.96Å; S201-V204 PolarHBondContact O-N 3.42Å; S201-V204 VanDerWaalsContact O-O 3.05Å; S201-K233 PolarHBondContact O-NZ 2.89Å; S201-K233 PolarHBondContact OG-NZ 2.97Å
202	N	98.1	Very high	98.1	Very high	137 Å²	137	49.9 Å²	49.9	73%	0.733	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-71	-15.2	179	-58.7	-33.9	0	0	0	114.1	R199 L200	R199-N202 PolarHBondContact O-N 3.42Å; L200-N202 PolarHBondContact O-N 2.9Å
203	L	98.4	Very high	98.2	Very high	48 Å²	48	48.3 Å²	48.3	25%	0.251	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-99.8	-8	178.7	-57.8	-173.4	0	0	0	113.3	L137 P138 F142 Y150 L200 S201	L137-L203 CarbonylContact C-O 3.6Å; L137-L203 WeakPolarHBondContact CA-O 3.39Å; P138-L203 HydrophobicContact CB-CD1 4.44Å; F142-L203 HydrophobicContact CE2-CD1 3.9Å; F142-L203 HydrophobicContact CZ-CD1 4.47Å; Y150-L203 HydrophobicContact CD1-CD1 4.14Å; Y150-L203 HydrophobicContact CD2-CD1 4.1Å; Y150-L203 HydrophobicContact CE1-CD1 3.85Å; Y150-L203 HydrophobicContact CE1-CG 4.3Å; Y150-L203 HydrophobicContact CE2-CD1 3.81Å; Y150-L203 HydrophobicContact CG-CD1 4.27Å; L200-L203 HydrophobicContact CD1-CB 4.4Å; L200-L203 HydrophobicContact CD1-CD1 4.13Å; L200-L203 PolarHBondContact O-N 3.16Å; S201-L203 VanDerWaalsContact C-N 3.26Å; S201-L203 PolarHBondContact O-N 2.96Å
204	V	98.6	Very high	98.2	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.018	23%	0.225	C	C	.	.			trans	-128.7	116.7	-173.3	177.3	0	0	0	0	110.6	T136 L137 F195 S201 K233 W256 F330	T136-V204 WeakPolarHBondContact O-CA 3.49Å; L137-V204 HydrophobicContact CD2-CB 4.43Å; L137-V204 HydrophobicContact CD2-CG1 3.83Å; L137-V204 HydrophobicContact CD2-CG2 4.02Å; F195-V204 HydrophobicContact CE2-CB 3.85Å; F195-V204 HydrophobicContact CE2-CG1 4.44Å; F195-V204 HydrophobicContact CE2-CG2 3.91Å; F195-V204 HydrophobicContact CZ-CB 3.79Å; F195-V204 HydrophobicContact CZ-CG1 3.96Å; F195-V204 HydrophobicContact CZ-CG2 3.72Å; S201-V204 PolarHBondContact O-N 3.42Å; S201-V204 VanDerWaalsContact O-O 3.05Å; V204-K233 VanDerWaalsContact O-CE 3.3Å; V204-K233 WeakPolarHBondContact O-CE 3.43Å; V204-K233 PolarHBondContact O-NZ 3.09Å; V204-W256 HydrophobicContact CG1-CH2 4.28Å; V204-F330 HydrophobicContact CG2-CD1 3.89Å; V204-F330 HydrophobicContact CG2-CE1 3.79Å; V204-F330 HydrophobicContact CG2-CZ 4.37Å
205	E	98.5	Very high	98.3	Very high	69 Å²	69	47 Å²	47	32%	0.322	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	-115.1	126	171.4	179.9	69.5	156.7	0	0	108.8	M135 T136 R211	M135-E205 VanDerWaalsContact CA-O 3.28Å; M135-E205 WeakPolarHBondContact CA-O 3.49Å; M135-E205 WeakPolarHBondContact CB-O 3.21Å; T136-E205 PolarHBondContact N-O 3.19Å; T136-E205 PolarHBondContact O-N 2.96Å; E205-R211 IonicContact OE1-CZ 3.99Å; E205-R211 IonicContact OE1-NE 2.79Å; E205-R211 PolarHBondContact OE1-NE 3.15Å; E205-R211 IonicContact OE1-NH1 3.61Å; E205-R211 PolarHBondContact OE1-NH1 3.41Å; E205-R211 IonicContact OE1-NH2 3.58Å
206	T	98.6	Very high	98.2	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.018	22%	0.22	C	C	.	.			trans	-69.9	156.2	-172.7	66.7	0	0	0	0	111.1	R208 R211 Q232 K233 W256	T206-R208 PolarHBondContact O-N 2.83Å; T206-R211 PolarHBondContact O-NE 3.24Å; T206-R211 PolarHBondContact O-NH2 3.39Å; T206-R211 WeakPolarHBondContact OG1-CD 3.15Å; T206-R211 WeakPolarHBondContact OG1-CG 3.14Å; T206-Q232 HydrophobicContact CG2-CB 4.44Å; T206-Q232 WeakPolarHBondContact CG2-O 3.31Å; T206-K233 HydrophobicContact CG2-CG 4.11Å; T206-W256 HydrophobicContact CG2-CZ2 3.73Å
207	P	98.8	Very high	98.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.226	C	C	.	.			trans	-54.6	138.1	-176.8	-23.1	32	0	0	0	111.8	M135 I209 V210 R211 W256 F312	M135-P207 HydrophobicContact CB-CG 4.31Å; M135-P207 HydrophobicContact CE-CG 4.11Å; P207-I209 HydrophobicContact CB-CG2 4.34Å; P207-I209 PolarHBondContact O-N 3.31Å; P207-V210 HydrophobicContact CB-CG2 4.06Å; P207-V210 HydrophobicContact CG-CG2 4.13Å; P207-V210 WeakPolarHBondContact O-CA 3.49Å; P207-V210 VanDerWaalsContact O-CB 3.29Å; P207-V210 WeakPolarHBondContact O-CB 3.45Å; P207-V210 PolarHBondContact O-N 3.26Å; P207-R211 PolarHBondContact O-N 2.89Å; P207-W256 VanDerWaalsContact CD-CD2 3.44Å; P207-W256 HydrophobicContact CG-CB 4.21Å; P207-W256 HydrophobicContact CG-CD2 3.83Å; P207-W256 HydrophobicContact CG-CE3 3.73Å; P207-W256 HydrophobicContact CG-CG 4.04Å; P207-W256 HydrophobicContact CG-CZ3 4.44Å; P207-F312 HydrophobicContact CB-CE1 4.01Å; P207-F312 HydrophobicContact CB-CZ 3.96Å; P207-F312 HydrophobicContact CG-CE1 3.98Å; P207-F312 HydrophobicContact CG-CZ 4.02Å
208	R	98.6	Very high	98.3	Very high	126 Å²	126	48.4 Å²	48.4	48%	0.475	22%	0.222	S	C	.	.	H	α-helix	trans	-54.9	-31.2	-175.1	-179.8	177.6	59.6	-175	-4.8	113.3	G132 L133 G134 T206 K212	G132-R208 PolarHBondContact O-NH2 3.42Å; L133-R208 WeakPolarHBondContact O-CB 3.39Å; L133-R208 PolarHBondContact O-N 3.27Å; G134-R208 PolarHBondContact O-N 3.46Å; T206-R208 PolarHBondContact O-N 2.83Å; R208-K212 WeakPolarHBondContact O-CB 3.41Å; R208-K212 WeakPolarHBondContact O-CG 3.47Å; R208-K212 PolarHBondContact O-N 2.96Å
209	I	98.4	Very high	98.2	Very high	9 Å²	9	49 Å²	49	5%	0.046	22%	0.224	C	C	.	.	H	α-helix	trans	-70.4	-31.4	176.3	-166.9	56.4	0	0	0	113.2	L111 T112 V113 L116 P207 L213 F312	L111-I209 HydrophobicContact CD2-CG2 3.99Å; L111-I209 HydrophobicContact CG-CB 4.47Å; L111-I209 HydrophobicContact CG-CG1 4.34Å; L111-I209 HydrophobicContact CG-CG2 4.14Å; T112-I209 VanDerWaalsContact C-CD1 3.49Å; T112-I209 WeakPolarHBondContact O-CD1 3.36Å; V113-I209 HydrophobicContact CB-CD1 4.48Å; V113-I209 HydrophobicContact CG2-CD1 3.73Å; L116-I209 HydrophobicContact CD1-CD1 3.96Å; L116-I209 HydrophobicContact CD1-CG1 3.62Å; P207-I209 HydrophobicContact CB-CG2 4.34Å; P207-I209 PolarHBondContact O-N 3.31Å; I209-L213 HydrophobicContact CD1-CD1 4.14Å; I209-L213 HydrophobicContact CD1-CG 4.35Å; I209-L213 HydrophobicContact CG1-CD1 4.15Å; I209-L213 WeakPolarHBondContact O-CB 3.41Å; I209-L213 WeakPolarHBondContact O-CG 3.47Å; I209-L213 PolarHBondContact O-N 2.92Å; I209-F312 HydrophobicContact CG2-CE1 3.94Å; I209-F312 HydrophobicContact CG2-CZ 4.23Å
210	V	98.6	Very high	98.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-51.4	174.2	175.7	0	0	0	0	109.1	P207 K212 L213 S214 W256 F312 F334	P207-V210 HydrophobicContact CB-CG2 4.06Å; P207-V210 HydrophobicContact CG-CG2 4.13Å; P207-V210 WeakPolarHBondContact O-CA 3.49Å; P207-V210 VanDerWaalsContact O-CB 3.29Å; P207-V210 WeakPolarHBondContact O-CB 3.45Å; P207-V210 PolarHBondContact O-N 3.26Å; V210-K212 VanDerWaalsContact C-N 3.31Å; V210-K212 PolarHBondContact O-N 3.34Å; V210-L213 PolarHBondContact O-N 3.17Å; V210-S214 VanDerWaalsContact O-CB 3.23Å; V210-S214 WeakPolarHBondContact O-CB 3.35Å; V210-S214 PolarHBondContact O-N 3.23Å; V210-W256 HydrophobicContact CG2-CB 3.86Å; V210-W256 HydrophobicContact CG2-CG 3.88Å; V210-F312 HydrophobicContact CG2-CE1 4.04Å; V210-F334 HydrophobicContact CG1-CB 4.02Å; V210-F334 HydrophobicContact CG1-CD1 3.77Å; V210-F334 HydrophobicContact CG1-CD2 4.16Å; V210-F334 HydrophobicContact CG1-CE1 4.24Å; V210-F334 HydrophobicContact CG1-CG 3.74Å; V210-F334 HydrophobicContact CG2-CD1 4.2Å; V210-F334 HydrophobicContact CG2-CE1 3.82Å; V210-F334 HydrophobicContact CG2-CE2 4.48Å; V210-F334 HydrophobicContact CG2-CZ 3.98Å
211	R	98.1	Very high	97.9	Very high	64 Å²	64	42.9 Å²	42.9	24%	0.242	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-35.9	178.3	-67.1	179.6	-75.7	137.5	-5.2	112.8	G134 E205 T206 P207 L213 E217 N218	G134-R211 PolarHBondContact O-NH2 3.06Å; E205-R211 IonicContact OE1-CZ 3.99Å; E205-R211 IonicContact OE1-NE 2.79Å; E205-R211 PolarHBondContact OE1-NE 3.15Å; E205-R211 IonicContact OE1-NH1 3.61Å; E205-R211 PolarHBondContact OE1-NH1 3.41Å; E205-R211 IonicContact OE1-NH2 3.58Å; T206-R211 PolarHBondContact O-NE 3.24Å; T206-R211 PolarHBondContact O-NH2 3.39Å; T206-R211 WeakPolarHBondContact OG1-CD 3.15Å; T206-R211 WeakPolarHBondContact OG1-CG 3.14Å; P207-R211 PolarHBondContact O-N 2.89Å; R211-L213 VanDerWaalsContact C-N 3.3Å; R211-L213 PolarHBondContact O-N 3Å; R211-E217 HydrophobicContact CB-CG 4.37Å; R211-E217 HydrophobicContact CG-CG 4.41Å; R211-N218 PolarHBondContact O-ND2 3.15Å
212	K	98.3	Very high	97.4	Very high	123 Å²	123	51.3 Å²	51.3	54%	0.535	25%	0.245	S	C	.	.	H	α-helix	trans	-67.6	-20.8	173.2	-85.1	-163.2	169.2	-160.3	0	115.2	V113 R208 V210	V113-K212 HydrophobicContact CG2-CB 4.05Å; V113-K212 HydrophobicContact CG2-CD 3.75Å; R208-K212 WeakPolarHBondContact O-CB 3.41Å; R208-K212 WeakPolarHBondContact O-CG 3.47Å; R208-K212 PolarHBondContact O-N 2.96Å; V210-K212 VanDerWaalsContact C-N 3.31Å; V210-K212 PolarHBondContact O-N 3.34Å
213	L	98.3	Very high	96.7	Very high	22 Å²	22	54 Å²	54	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-113.5	-24	-174.3	-70	179.9	0	0	0	114.1	V113 L116 I209 V210 R211 W215 F334 H336 L338	V113-L213 HydrophobicContact CG1-CD2 4.33Å; V113-L213 HydrophobicContact CG2-CD2 4.32Å; L116-L213 HydrophobicContact CD1-CD1 3.73Å; I209-L213 HydrophobicContact CD1-CD1 4.14Å; I209-L213 HydrophobicContact CD1-CG 4.35Å; I209-L213 HydrophobicContact CG1-CD1 4.15Å; I209-L213 WeakPolarHBondContact O-CB 3.41Å; I209-L213 WeakPolarHBondContact O-CG 3.47Å; I209-L213 PolarHBondContact O-N 2.92Å; V210-L213 PolarHBondContact O-N 3.17Å; R211-L213 VanDerWaalsContact C-N 3.3Å; R211-L213 PolarHBondContact O-N 3Å; L213-W215 PolarHBondContact O-N 3.43Å; L213-F334 HydrophobicContact CB-CD2 4.32Å; L213-F334 HydrophobicContact CB-CE2 4.11Å; L213-F334 HydrophobicContact CD1-CE2 4.39Å; L213-H336 HydrophobicContact CB-CB 3.93Å; L213-H336 WeakPolarHBondContact O-CB 3.4Å; L213-L338 HydrophobicContact CD1-CD1 4.02Å; L213-L338 HydrophobicContact CD2-CD1 4.43Å
214	S	98.6	Very high	96.2	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.021	25%	0.249	C	C	.	.			trans	-61.9	118.8	-175	175.6	0	0	0	0	111.7	V210 V216 E217 N218 Q232 L335	V210-S214 VanDerWaalsContact O-CB 3.23Å; V210-S214 WeakPolarHBondContact O-CB 3.35Å; V210-S214 PolarHBondContact O-N 3.23Å; S214-V216 PolarHBondContact O-N 2.99Å; S214-E217 PolarHBondContact O-N 3.36Å; S214-E217 PolarHBondContact OG-N 3.05Å; S214-N218 PolarHBondContact O-N 3.47Å; S214-N218 VanDerWaalsContact O-N 3.14Å; S214-N218 PolarHBondContact O-ND2 3.13Å; S214-Q232 PolarHBondContact OG-OE1 3.06Å; S214-L335 CarbonylContact C-O 3.54Å; S214-L335 WeakPolarHBondContact CA-O 3.46Å
215	W	98.7	Very high	95.7	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-58.2	-45.7	175.6	-71.7	-11.2	0	0	0	112.5	L213 E217 N218 L219 L335 S337 I340 Q343 I367 V371	L213-W215 PolarHBondContact O-N 3.43Å; W215-E217 VanDerWaalsContact C-N 3.26Å; W215-E217 PolarHBondContact O-N 3.49Å; W215-N218 PolarHBondContact O-N 3.04Å; W215-L219 WeakPolarHBondContact O-CA 3.47Å; W215-L219 VanDerWaalsContact O-CB 3.25Å; W215-L219 WeakPolarHBondContact O-CB 3.34Å; W215-L219 PolarHBondContact O-N 2.76Å; W215-L335 HydrophobicContact CB-CB 4.26Å; W215-L335 HydrophobicContact CD2-CB 3.61Å; W215-L335 HydrophobicContact CE3-CB 3.33Å; W215-L335 HydrophobicContact CE3-CD1 3.65Å; W215-L335 HydrophobicContact CE3-CG 4.1Å; W215-L335 HydrophobicContact CG-CB 4.03Å; W215-L335 HydrophobicContact CZ3-CB 3.99Å; W215-L335 HydrophobicContact CZ3-CD1 3.96Å; W215-L335 HydrophobicContact CZ3-CG 4.49Å; W215-L335 PolarHBondContact N-O 3.12Å; W215-S337 PolarHBondContact NE1-OG 3.22Å; W215-I340 HydrophobicContact CH2-CG2 4.02Å; W215-I340 HydrophobicContact CZ2-CD1 4Å; W215-I340 HydrophobicContact CZ2-CG1 3.95Å; W215-I340 HydrophobicContact CZ2-CG2 4.19Å; W215-Q343 VanDerWaalsContact CZ3-NE2 3.31Å; W215-I367 HydrophobicContact CB-CD1 4Å; W215-I367 HydrophobicContact CB-CG1 3.73Å; W215-I367 HydrophobicContact CE3-CG1 4.09Å; W215-I367 HydrophobicContact CE3-CG2 4.36Å; W215-V371 HydrophobicContact CB-CG2 3.99Å; W215-V371 HydrophobicContact CD2-CB 4.4Å; W215-V371 HydrophobicContact CD2-CG1 4.36Å; W215-V371 HydrophobicContact CD2-CG2 3.33Å; W215-V371 HydrophobicContact CE3-CG2 3.64Å; W215-V371 HydrophobicContact CG-CG2 3.52Å; W215-V371 HydrophobicContact CH2-CG1 4.2Å; W215-V371 HydrophobicContact CH2-CG2 4.36Å; W215-V371 HydrophobicContact CZ2-CB 4.4Å; W215-V371 HydrophobicContact CZ2-CG1 3.68Å; W215-V371 HydrophobicContact CZ2-CG2 4.14Å; W215-V371 HydrophobicContact CZ3-CG2 4.14Å
216	V	97.8	Very high	95.4	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.024	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-38.2	179.4	179.3	0	0	0	0	110.6	S214 W220 R228 P229 F361 I367	S214-V216 PolarHBondContact O-N 2.99Å; V216-W220 HydrophobicContact CG1-CB 4.03Å; V216-W220 HydrophobicContact CG1-CG 4.41Å; V216-W220 VanDerWaalsContact O-CB 3.22Å; V216-W220 WeakPolarHBondContact O-CB 3.37Å; V216-W220 PolarHBondContact O-N 3.43Å; V216-R228 HydrophobicContact CG1-CG 3.78Å; V216-R228 PolarHBondContact O-NH1 2.7Å; V216-R228 PolarHBondContact O-NH2 2.9Å; V216-P229 HydrophobicContact CG2-CB 4.23Å; V216-P229 HydrophobicContact CG2-CG 4.31Å; V216-F361 HydrophobicContact CG2-CE1 4.39Å; V216-F361 HydrophobicContact CG2-CZ 3.82Å; V216-I367 HydrophobicContact CG2-CG1 4.46Å
217	E	96.3	Very high	95.1	Very high	74 Å²	74	65.3 Å²	65.3	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-67.9	-39.8	-178.2	-159.6	68.7	172.1	0	0	113	R211 S214 W215 R228 Q232	R211-E217 HydrophobicContact CB-CG 4.37Å; R211-E217 HydrophobicContact CG-CG 4.41Å; S214-E217 PolarHBondContact O-N 3.36Å; S214-E217 PolarHBondContact OG-N 3.05Å; W215-E217 VanDerWaalsContact C-N 3.26Å; W215-E217 PolarHBondContact O-N 3.49Å; E217-R228 IonicContact OE2-NH2 3.87Å; E217-R228 PolarHBondContact OE2-NH2 2.95Å; E217-Q232 PolarHBondContact OE2-NE2 3.48Å
218	N	97.7	Very high	94.9	Very high	98 Å²	98	69.1 Å²	69.1	52%	0.524	33%	0.328	S	S	.	.	H	α-helix	trans	-97.8	-21.3	-173.3	-64.6	-92.1	0	0	0	114.2	R211 S214 W215	R211-N218 PolarHBondContact O-ND2 3.15Å; S214-N218 PolarHBondContact O-N 3.47Å; S214-N218 VanDerWaalsContact O-N 3.14Å; S214-N218 PolarHBondContact O-ND2 3.13Å; W215-N218 PolarHBondContact O-N 3.04Å
219	L	97.3	Very high	94.8	Very high	32 Å²	32	63.2 Å²	63.2	17%	0.168	31%	0.306	C	S	.	.	H	α-helix	trans	-131.7	-8.6	-164.1	-51.2	174.1	0	0	0	115.3	W215 P221 I367 V371 H374	W215-L219 WeakPolarHBondContact O-CA 3.47Å; W215-L219 VanDerWaalsContact O-CB 3.25Å; W215-L219 WeakPolarHBondContact O-CB 3.34Å; W215-L219 PolarHBondContact O-N 2.76Å; L219-P221 WeakPolarHBondContact O-CD 3.49Å; L219-I367 HydrophobicContact CB-CD1 4.28Å; L219-V371 HydrophobicContact CD1-CB 4.41Å; L219-V371 HydrophobicContact CD1-CG2 3.69Å; L219-H374 HydrophobicContact CD1-CB 4.26Å; L219-H374 HydrophobicContact CD2-CB 3.92Å; L219-H374 VanDerWaalsContact CD2-CG 3.47Å; L219-H374 VanDerWaalsContact CD2-ND1 3.34Å; L219-H374 WeakPolarHBondContact CD2-ND1 3.49Å
220	W	96.6	Very high	94.7	Very high	15 Å²	15	66.4 Å²	66.4	6%	0.057	32%	0.323	C	S	.	.			trans	-81	116.8	176	-167.9	-77.8	0	0	0	110.6	V216 C224 F226 E227 R228 P229 N363 T366 I367	V216-W220 HydrophobicContact CG1-CB 4.03Å; V216-W220 HydrophobicContact CG1-CG 4.41Å; V216-W220 VanDerWaalsContact O-CB 3.22Å; V216-W220 WeakPolarHBondContact O-CB 3.37Å; V216-W220 PolarHBondContact O-N 3.43Å; W220-C224 HydrophobicContact CZ2-CB 4.5Å; W220-F226 HydrophobicContact CH2-CB 3.92Å; W220-F226 HydrophobicContact CZ2-CB 3.65Å; W220-F226 WeakPolarHBondContact CZ2-O 3.34Å; W220-E227 WeakPolarHBondContact CZ2-O 3.09Å; W220-R228 HydrophobicContact CG-CG 4.18Å; W220-P229 HydrophobicContact CE3-CG 4.08Å; W220-P229 HydrophobicContact CH2-CG 4.08Å; W220-P229 HydrophobicContact CZ3-CG 3.77Å; W220-N363 HydrophobicContact CH2-CB 3.57Å; W220-N363 HydrophobicContact CZ3-CB 4.05Å; W220-T366 HydrophobicContact CH2-CG2 3.85Å; W220-T366 HydrophobicContact CZ3-CG2 4.23Å; W220-I367 HydrophobicContact CE3-CB 4.07Å; W220-I367 HydrophobicContact CE3-CD1 4.12Å; W220-I367 HydrophobicContact CE3-CG1 4.47Å; W220-I367 HydrophobicContact CZ3-CB 3.98Å
221	P	94.1	Very high	94.6	Very high	47 Å²	47	66.7 Å²	66.7	31%	0.305	33%	0.325	S	S	.	.			trans	-68.2	149.5	-176.7	-19.5	33.6	0	0	0	113.1	L219 C224 Y370	L219-P221 WeakPolarHBondContact O-CD 3.49Å; P221-C224 HydrophobicContact CB-CB 4.4Å; P221-C224 VanDerWaalsContact O-CB 3.31Å; P221-C224 WeakPolarHBondContact O-CB 3.23Å; P221-C224 PolarHBondContact O-N 2.91Å; P221-Y370 HydrophobicContact CG-CD1 4.12Å; P221-Y370 HydrophobicContact CG-CE1 3.57Å; P221-Y370 HydrophobicContact CG-CE2 4.21Å
222	E	87	Confident	94.5	Very high	197 Å²	197	64.4 Å²	64.4	92%	0.921	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-41.9	174	-62.2	-178.9	171.2	0	0	111.7	C224	E222-C224 PolarHBondContact O-N 3.21Å; E222-C224 VanDerWaalsContact O-N 3.12Å
223	E	84.3	Confident	94.6	Very high	194 Å²	194	59.8 Å²	59.8	91%	0.907	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	28.9	176.8	-57.1	-177.6	154.6	0	0	112.9
224	C	86.3	Confident	94.6	Very high	24 Å²	24	60.5 Å²	60.5	16%	0.162	30%	0.299	C	S	.	.			trans	-76.6	138.3	177.9	-163.5	0	0	0	0	111	W220 P221 E222 F226 Y370	W220-C224 HydrophobicContact CZ2-CB 4.5Å; P221-C224 HydrophobicContact CB-CB 4.4Å; P221-C224 VanDerWaalsContact O-CB 3.31Å; P221-C224 WeakPolarHBondContact O-CB 3.23Å; P221-C224 PolarHBondContact O-N 2.91Å; E222-C224 PolarHBondContact O-N 3.21Å; E222-C224 VanDerWaalsContact O-N 3.12Å; C224-F226 VanDerWaalsContact C-N 3.28Å; C224-Y370 PolarHBondContact SG-OH 3.23Å; C224-Y370 VanDerWaalsContact SG-OH 3.37Å
225	V	89.7	Confident	94.6	Very high	125 Å²	125	60.4 Å²	60.4	76%	0.758	30%	0.298	S	S	*	.	S	Bend	trans	-71.6	-27.5	174.3	-171.4	0	0	0	0	111.4
226	F	91.6	Very high	94.6	Very high	57 Å²	57	61 Å²	61	25%	0.25	30%	0.301	C	S	.	.	S	Bend	trans	-84.3	144.6	176.8	-57.8	-86.5	0	0	0	111.2	W220 C224 T366 D418	W220-F226 HydrophobicContact CH2-CB 3.92Å; W220-F226 HydrophobicContact CZ2-CB 3.65Å; W220-F226 WeakPolarHBondContact CZ2-O 3.34Å; C224-F226 VanDerWaalsContact C-N 3.28Å; F226-T366 HydrophobicContact CB-CG2 4.34Å; F226-T366 HydrophobicContact CD2-CG2 3.57Å; F226-T366 HydrophobicContact CE2-CG2 3.96Å; F226-T366 HydrophobicContact CG-CG2 3.92Å; F226-D418 WeakPolarHBondContact CE1-O 3.28Å; F226-D418 WeakPolarHBondContact CZ-O 2.85Å
227	E	92.6	Very high	94.6	Very high	154 Å²	154	60.8 Å²	60.8	72%	0.72	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-64.3	136.2	176.3	-173	172.9	-176.7	0	0	111.7	W220 P229 N363	W220-E227 WeakPolarHBondContact CZ2-O 3.09Å; E227-P229 WeakPolarHBondContact O-CD 3.26Å; E227-N363 PolarHBondContact O-ND2 3.13Å
228	R	95.1	Very high	94.8	Very high	79 Å²	79	57.2 Å²	57.2	30%	0.298	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-64.6	122.6	178.2	-176.6	-177.3	179.8	95.3	-7.2	110.1	V216 E217 W220 N230	V216-R228 HydrophobicContact CG1-CG 3.78Å; V216-R228 PolarHBondContact O-NH1 2.7Å; V216-R228 PolarHBondContact O-NH2 2.9Å; E217-R228 IonicContact OE2-NH2 3.87Å; E217-R228 PolarHBondContact OE2-NH2 2.95Å; W220-R228 HydrophobicContact CG-CG 4.18Å; R228-N230 PolarHBondContact O-N 3.17Å; R228-N230 PolarHBondContact O-ND2 3.13Å
229	P	96.3	Very high	94.8	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.019	26%	0.259	C	S	.	.			trans	-64.7	99	-179.1	-25.1	36.2	0	0	0	112.7	V216 W220 E227 V231 F361 P362 N363	V216-P229 HydrophobicContact CG2-CB 4.23Å; V216-P229 HydrophobicContact CG2-CG 4.31Å; W220-P229 HydrophobicContact CE3-CG 4.08Å; W220-P229 HydrophobicContact CH2-CG 4.08Å; W220-P229 HydrophobicContact CZ3-CG 3.77Å; E227-P229 WeakPolarHBondContact O-CD 3.26Å; P229-V231 PolarHBondContact O-N 3.21Å; P229-F361 HydrophobicContact CB-CE1 3.89Å; P229-F361 HydrophobicContact CB-CZ 4.02Å; P229-F361 HydrophobicContact CG-CE1 4.03Å; P229-P362 HydrophobicContact CB-CB 4.17Å; P229-P362 HydrophobicContact CG-CB 4.37Å; P229-P362 WeakPolarHBondContact CG-O 3.3Å; P229-N363 HydrophobicContact CG-CB 4.41Å
230	N	95.7	Very high	94.9	Very high	75 Å²	75	57.8 Å²	57.8	40%	0.401	28%	0.276	S	S	.	.			trans	-85	90.1	177	-67.3	-49.6	0	0	0	109.6	E194 R228	E194-N230 WeakPolarHBondContact CG-O 3.35Å; R228-N230 PolarHBondContact O-N 3.17Å; R228-N230 PolarHBondContact O-ND2 3.13Å
231	V	97.1	Very high	94.9	Very high	6 Å²	6	58.9 Å²	58.9	4%	0.036	28%	0.283	C	S	.	.			trans	-131.9	13.9	179.3	-60.4	0	0	0	0	112.3	P229 Y234 F250 N333 F361 P362	P229-V231 PolarHBondContact O-N 3.21Å; V231-Y234 HydrophobicContact CB-CE2 4.2Å; V231-Y234 VanDerWaalsContact O-CE2 3.29Å; V231-Y234 WeakPolarHBondContact O-CE2 3.01Å; V231-F250 HydrophobicContact CB-CE2 3.98Å; V231-F250 HydrophobicContact CB-CZ 3.96Å; V231-F250 HydrophobicContact CG1-CE2 3.86Å; V231-F250 HydrophobicContact CG1-CZ 4.01Å; V231-F250 HydrophobicContact CG2-CE2 4.24Å; V231-N333 HydrophobicContact CB-CB 4.44Å; V231-N333 HydrophobicContact CG2-CB 4.33Å; V231-N333 PolarHBondContact O-N 3.14Å; V231-F361 HydrophobicContact CG2-CD2 4.47Å; V231-F361 HydrophobicContact CG2-CE2 3.75Å; V231-F361 HydrophobicContact CG2-CZ 4.27Å; V231-P362 HydrophobicContact CG1-CG 4.42Å
232	Q	96.3	Very high	95.1	Very high	17 Å²	17	56.6 Å²	56.6	8%	0.079	27%	0.268	C	S	.	.	S	Bend	trans	-94.9	-15.4	-169.8	-66.6	-166.8	93.4	0	0	113.7	E194 T206 S214 E217 W256	E194-Q232 PolarHBondContact OE1-N 3.08Å; T206-Q232 HydrophobicContact CG2-CB 4.44Å; T206-Q232 WeakPolarHBondContact CG2-O 3.31Å; S214-Q232 PolarHBondContact OG-OE1 3.06Å; E217-Q232 PolarHBondContact OE2-NE2 3.48Å; Q232-W256 PolarHBondContact O-NE1 2.84Å
233	K	98.5	Very high	95.7	Very high	26 Å²	26	47.2 Å²	47.2	11%	0.113	22%	0.224	C	C	.	.			trans	-135.7	88.9	-175.7	-57.3	-171.5	-172.8	-171.9	0	112.2	E194 F195 S196 S201 V204 T206	E194-K233 WeakPolarHBondContact CA-O 3.29Å; E194-K233 PolarHBondContact OE1-N 2.89Å; F195-K233 HydrophobicContact CD1-CB 4.28Å; F195-K233 WeakPolarHBondContact CD1-O 3.44Å; F195-K233 HydrophobicContact CD2-CB 4.33Å; F195-K233 VanDerWaalsContact CE1-C 3.48Å; F195-K233 HydrophobicContact CE1-CB 3.87Å; F195-K233 VanDerWaalsContact CE1-O 3.3Å; F195-K233 WeakPolarHBondContact CE1-O 3.21Å; F195-K233 HydrophobicContact CE2-CB 3.93Å; F195-K233 HydrophobicContact CE2-CD 4.11Å; F195-K233 HydrophobicContact CG-CB 4.49Å; F195-K233 HydrophobicContact CZ-CB 3.68Å; F195-K233 HydrophobicContact CZ-CD 4.48Å; F195-K233 PolarHBondContact N-O 3.32Å; F195-K233 VanDerWaalsContact N-O 3.09Å; S196-K233 WeakPolarHBondContact OG-CB 3.36Å; S201-K233 PolarHBondContact O-NZ 2.89Å; S201-K233 PolarHBondContact OG-NZ 2.97Å; V204-K233 VanDerWaalsContact O-CE 3.3Å; V204-K233 WeakPolarHBondContact O-CE 3.43Å; V204-K233 PolarHBondContact O-NZ 3.09Å; T206-K233 HydrophobicContact CG2-CG 4.11Å
234	Y	98.7	Very high	96.4	Very high	37 Å²	37	39 Å²	39	15%	0.145	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	138	171.5	-67.7	-74.7	0	0	0	112.7	L193 E194 F195 V231 F250 F330 G331	L193-Y234 CarbonylContact O-C 3.55Å; L193-Y234 WeakPolarHBondContact O-CA 3.36Å; E194-Y234 HydrophobicContact CB-CD1 3.88Å; E194-Y234 HydrophobicContact CB-CE1 3.6Å; E194-Y234 HydrophobicContact CG-CD1 3.85Å; E194-Y234 HydrophobicContact CG-CE1 3.51Å; E194-Y234 HydrophobicContact CG-CE2 4.39Å; E194-Y234 HydrophobicContact CG-CG 4.42Å; F195-Y234 VanDerWaalsContact CE1-C 3.47Å; V231-Y234 HydrophobicContact CB-CE2 4.2Å; V231-Y234 VanDerWaalsContact O-CE2 3.29Å; V231-Y234 WeakPolarHBondContact O-CE2 3.01Å; Y234-F250 HydrophobicContact CE2-CZ 4.3Å; Y234-F330 WeakPolarHBondContact O-CA 3.38Å; Y234-G331 PolarHBondContact N-O 2.91Å; Y234-G331 PolarHBondContact O-N 2.86Å
235	C	98.8	Very high	96.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	106.1	174.6	176.2	0	0	0	0	109.9	L193 F195 L200 F330	L193-C235 HydrophobicContact CD2-CB 4.33Å; L193-C235 HydrophobicContact CG-CB 4.35Å; L193-C235 PolarHBondContact O-N 3.46Å; F195-C235 HydrophobicContact CD1-CB 3.61Å; F195-C235 HydrophobicContact CE1-CB 3.79Å; L200-C235 HydrophobicContact CD2-CB 4.41Å; C235-F330 HydrophobicContact CB-CD1 4.39Å; C235-F330 HydrophobicContact CB-CE1 4.04Å
236	L	98.8	Very high	97.3	Very high	16 Å²	16	33 Å²	33	8%	0.084	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.4	-172.9	-54.2	99.2	0	0	0	110.7	V190 I191 Y257 A329	V190-L236 CarbonylContact O-C 3.47Å; V190-L236 WeakPolarHBondContact O-CA 3.41Å; I191-L236 HydrophobicContact CB-CD2 3.85Å; I191-L236 HydrophobicContact CG2-CD2 4.06Å; L236-Y257 HydrophobicContact CD1-CE2 4.04Å; L236-Y257 HydrophobicContact CD2-CE2 3.76Å; L236-Y257 HydrophobicContact CG-CE2 4.49Å; L236-A329 HydrophobicContact CB-CB 4.39Å; L236-A329 PolarHBondContact N-O 3.26Å; L236-A329 PolarHBondContact O-N 2.99Å
237	M	98.8	Very high	97.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	105.5	-175.8	-58.5	175.5	-69.6	0	0	109.1	V144 V147 L172 F175 V190 L193 L328	V144-M237 HydrophobicContact CB-SD 4.34Å; V144-M237 HydrophobicContact CG1-SD 3.81Å; V144-M237 HydrophobicContact CG2-CB 4.43Å; V144-M237 HydrophobicContact CG2-CG 4.1Å; V144-M237 HydrophobicContact CG2-SD 3.98Å; V147-M237 HydrophobicContact CB-SD 4.13Å; V147-M237 HydrophobicContact CG1-CE 4.3Å; V147-M237 HydrophobicContact CG1-SD 3.91Å; V147-M237 HydrophobicContact CG2-SD 4.16Å; L172-M237 HydrophobicContact CD1-CE 3.7Å; L172-M237 HydrophobicContact CD1-SD 4.48Å; F175-M237 HydrophobicContact CD1-CE 4.2Å; F175-M237 HydrophobicContact CE1-CB 3.67Å; F175-M237 HydrophobicContact CE1-CE 4.15Å; F175-M237 HydrophobicContact CE1-SD 4.3Å; F175-M237 HydrophobicContact CZ-CB 4.09Å; F175-M237 WeakPolarHBondContact CZ-O 3.4Å; V190-M237 HydrophobicContact CB-CB 4.22Å; V190-M237 HydrophobicContact CB-CE 4.1Å; V190-M237 HydrophobicContact CG1-CE 3.9Å; V190-M237 HydrophobicContact CG2-CE 4.22Å; V190-M237 PolarHBondContact N-O 3.3Å; V190-M237 PolarHBondContact O-N 3.13Å; L193-M237 HydrophobicContact CD2-CE 3.62Å; M237-L328 HydrophobicContact CG-CD1 3.78Å
238	S	98.7	Very high	97.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.4	-170.1	-54.2	0	0	0	0	109.9	N189 K264 T323 C327	N189-S238 VanDerWaalsContact OD1-CB 3.22Å; N189-S238 WeakPolarHBondContact OD1-CB 3.47Å; N189-S238 PolarHBondContact OD1-OG 2.92Å; S238-K264 PolarHBondContact OG-NZ 2.77Å; S238-T323 VanDerWaalsContact CB-CG2 3.46Å; S238-C327 PolarHBondContact N-O 3.34Å; S238-C327 PolarHBondContact O-N 2.99Å
239	V	98.6	Very high	98	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.018	11%	0.111	C	C	.	.			trans	-74.2	162.5	167.8	-57.2	0	0	0	0	110.7	Y178 Y179 V187 L188 S242 D326	Y178-V239 HydrophobicContact CE1-CG1 3.75Å; Y179-V239 HydrophobicContact CD2-CG1 3.82Å; Y179-V239 HydrophobicContact CE2-CG1 4.08Å; V187-V239 HydrophobicContact CG1-CG2 3.92Å; L188-V239 WeakPolarHBondContact O-CG2 3.33Å; V239-S242 WeakPolarHBondContact CG2-OG 3.28Å; V239-S242 VanDerWaalsContact O-CB 3.23Å; V239-S242 WeakPolarHBondContact O-CB 3.41Å; V239-S242 PolarHBondContact O-N 3.39Å; V239-S242 PolarHBondContact O-OG 3.19Å; V239-S242 VanDerWaalsContact O-OG 3.14Å; V239-D326 WeakPolarHBondContact CA-OD1 3.5Å
240	R	98.4	Very high	98	Very high	139 Å²	139	25.5 Å²	25.5	53%	0.525	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	140.6	167.8	167.4	174.6	169	155.6	5.4	111.3	S242 D326	R240-S242 PolarHBondContact O-N 2.84Å; R240-D326 WeakPolarHBondContact CB-OD1 3.24Å; R240-D326 PolarHBondContact N-OD1 2.82Å
241	D	98.3	Very high	98	Very high	37 Å²	37	21.9 Å²	21.9	20%	0.198	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	6.2	179.8	-67.5	-58.2	0	0	0	114.3	I88 R92 T323	I88-D241 HydrophobicContact CG2-CB 4.06Å; I88-D241 WeakPolarHBondContact CG2-OD1 3.41Å; R92-D241 IonicContact CZ-OD1 3.05Å; R92-D241 IonicContact NE-OD1 2.99Å; R92-D241 PolarHBondContact NE-OD1 3.02Å; R92-D241 IonicContact NH2-OD1 2.75Å; R92-D241 PolarHBondContact NH2-OD1 3.46Å; R92-D241 IonicContact NH2-OD2 2.97Å; D241-T323 PolarHBondContact N-O 3.5Å
242	S	98.7	Very high	98	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.098	C	C	.	.			trans	-65.9	138.1	167.7	-70.3	0	0	0	0	112.7	V187 L188 V239 R240 T323	V187-S242 WeakPolarHBondContact CG1-OG 3.43Å; L188-S242 PolarHBondContact O-OG 3.44Å; V239-S242 WeakPolarHBondContact CG2-OG 3.28Å; V239-S242 VanDerWaalsContact O-CB 3.23Å; V239-S242 WeakPolarHBondContact O-CB 3.41Å; V239-S242 PolarHBondContact O-N 3.39Å; V239-S242 PolarHBondContact O-OG 3.19Å; V239-S242 VanDerWaalsContact O-OG 3.14Å; R240-S242 PolarHBondContact O-N 2.84Å; S242-T323 VanDerWaalsContact O-CB 3.29Å; S242-T323 WeakPolarHBondContact O-CB 3.46Å; S242-T323 PolarHBondContact O-N 3.26Å; S242-T323 PolarHBondContact O-OG1 3.04Å
243	Y	98.6	Very high	98.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	137.5	-175.8	178.5	-95.2	0	0	0	112.1	T82 F87 I88 L91 V162 Q165 D245 A320 V321 L322	T82-Y243 HydrophobicContact CG2-CD1 4.07Å; T82-Y243 HydrophobicContact CG2-CE1 3.62Å; F87-Y243 AromaticContact CE1-CD1 3.81Å; F87-Y243 HydrophobicContact CE1-CD1 3.81Å; F87-Y243 HydrophobicContact CE1-CD2 4.25Å; F87-Y243 AromaticContact CE1-CE1 3.61Å; F87-Y243 HydrophobicContact CE1-CE1 3.61Å; F87-Y243 HydrophobicContact CE1-CE2 4.07Å; F87-Y243 HydrophobicContact CE1-CG 4.12Å; F87-Y243 AromaticContact CE1-CZ 3.75Å; F87-Y243 HydrophobicContact CZ-CD1 4.42Å; F87-Y243 AromaticContact CZ-CE1 3.75Å; F87-Y243 HydrophobicContact CZ-CE1 3.75Å; F87-Y243 HydrophobicContact CZ-CE2 4.28Å; F87-Y243 AromaticContact CZ-CZ 3.67Å; I88-Y243 VanDerWaalsContact CD1-CB 3.48Å; I88-Y243 HydrophobicContact CD1-CD2 4.32Å; I88-Y243 HydrophobicContact CD1-CG 3.96Å; L91-Y243 HydrophobicContact CD2-CD2 3.57Å; L91-Y243 HydrophobicContact CD2-CE2 3.35Å; V162-Y243 VanDerWaalsContact CG1-N 3.35Å; Q165-Y243 PolarHBondContact NE2-O 3.22Å; Y243-D245 HydrophobicContact CE1-CB 3.65Å; Y243-D245 WeakPolarHBondContact CE1-OD1 3.14Å; Y243-D245 PolarHBondContact OH-OD1 3.41Å; Y243-A320 HydrophobicContact CE2-CB 4.15Å; Y243-A320 WeakPolarHBondContact OH-CB 3.3Å; Y243-V321 VanDerWaalsContact CA-O 3.3Å; Y243-V321 WeakPolarHBondContact CA-O 3.32Å; Y243-V321 WeakPolarHBondContact CD2-O 3.32Å; Y243-L322 HydrophobicContact CD2-CB 4.22Å
244	T	97.9	Very high	98.2	Very high	22 Å²	22	19.7 Å²	19.7	14%	0.135	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.6	168.7	-58.3	0	0	0	0	107.3	N189 I191 V321	N189-T244 PolarHBondContact ND2-OG1 2.86Å; I191-T244 HydrophobicContact CD1-CG2 4.3Å; T244-V321 PolarHBondContact N-O 2.91Å; T244-V321 PolarHBondContact O-N 2.92Å
245	D	97.8	Very high	98.2	Very high	16 Å²	16	18.3 Å²	18.3	9%	0.086	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	179.8	-175.1	-148.2	2.3	0	0	0	113.6	T82 Y243 H247 W282	T82-D245 HydrophobicContact CG2-CB 3.88Å; T82-D245 WeakPolarHBondContact CG2-OD2 3.3Å; T82-D245 PolarHBondContact OG1-OD2 3.11Å; Y243-D245 HydrophobicContact CE1-CB 3.65Å; Y243-D245 WeakPolarHBondContact CE1-OD1 3.14Å; Y243-D245 PolarHBondContact OH-OD1 3.41Å; D245-H247 PolarHBondContact O-N 3.05Å; D245-H247 PolarHBondContact O-ND1 2.66Å; D245-W282 WeakPolarHBondContact OD2-CZ2 3.38Å
246	F	98.4	Very high	98.2	Very high	6 Å²	6	18.4 Å²	18.4	3%	0.026	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	125.1	-178	-70.1	-83.5	0	0	0	112.1	I269 W282 F292 F293 I318 H319 A320	F246-I269 HydrophobicContact CD1-CD1 3.76Å; F246-I269 HydrophobicContact CE1-CD1 3.45Å; F246-I269 VanDerWaalsContact CE1-CD1 3.45Å; F246-I269 HydrophobicContact CE1-CG1 4.16Å; F246-I269 HydrophobicContact CZ-CD1 4.17Å; F246-W282 HydrophobicContact CB-CH2 3.95Å; F246-W282 HydrophobicContact CB-CZ3 4.11Å; F246-W282 WeakPolarHBondContact O-CH2 3.46Å; F246-W282 WeakPolarHBondContact O-CZ3 3.39Å; F246-F292 AromaticContact CE2-CD2 3.87Å; F246-F292 HydrophobicContact CE2-CD2 3.87Å; F246-F292 HydrophobicContact CE2-CE1 4.19Å; F246-F292 AromaticContact CE2-CE2 3.47Å; F246-F292 HydrophobicContact CE2-CE2 3.47Å; F246-F292 VanDerWaalsContact CE2-CE2 3.47Å; F246-F292 HydrophobicContact CE2-CG 4.39Å; F246-F292 AromaticContact CE2-CZ 3.65Å; F246-F292 HydrophobicContact CE2-CZ 3.65Å; F246-F292 HydrophobicContact CZ-CE1 4.24Å; F246-F292 AromaticContact CZ-CE2 3.97Å; F246-F292 HydrophobicContact CZ-CE2 3.97Å; F246-F292 AromaticContact CZ-CZ 3.69Å; F246-F292 HydrophobicContact CZ-CZ 3.69Å; F246-F293 HydrophobicContact CB-CB 4.13Å; F246-F293 HydrophobicContact CB-CD1 4.1Å; F246-F293 HydrophobicContact CB-CG 4.47Å; F246-F293 HydrophobicContact CD1-CD1 4.17Å; F246-F293 HydrophobicContact CD2-CB 3.61Å; F246-F293 HydrophobicContact CD2-CD1 4.46Å; F246-F293 HydrophobicContact CE2-CB 4.18Å; F246-F293 HydrophobicContact CG-CB 3.93Å; F246-F293 AromaticContact CG-CD1 3.99Å; F246-F293 HydrophobicContact CG-CD1 3.99Å; F246-F293 HydrophobicContact CG-CG 4.43Å; F246-I318 HydrophobicContact CB-CG2 4.18Å; F246-I318 HydrophobicContact CD1-CG2 4.18Å; F246-H319 VanDerWaalsContact CA-O 3.32Å; F246-H319 WeakPolarHBondContact CA-O 3.49Å; F246-A320 HydrophobicContact CB-CB 4.44Å; F246-A320 HydrophobicContact CD1-CB 3.68Å; F246-A320 HydrophobicContact CD2-CB 3.79Å; F246-A320 HydrophobicContact CE1-CB 3.75Å; F246-A320 HydrophobicContact CE2-CB 3.88Å; F246-A320 HydrophobicContact CG-CB 3.71Å; F246-A320 HydrophobicContact CZ-CB 3.86Å
247	H	97.8	Very high	98.2	Very high	53 Å²	53	18.4 Å²	18.4	25%	0.245	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	169.6	176	60.8	-69.5	0	0	0	110.5	D245 I318 H319	D245-H247 PolarHBondContact O-N 3.05Å; D245-H247 PolarHBondContact O-ND1 2.66Å; H247-I318 CarbonylContact O-C 3.6Å; H247-I318 WeakPolarHBondContact O-CA 3.22Å; H247-H319 AromaticContact CE1-CE1 3.66Å; H247-H319 AromaticContact CE1-NE2 3.51Å; H247-H319 PolarHBondContact N-O 3.36Å; H247-H319 PolarHBondContact ND1-O 3.34Å; H247-H319 VanDerWaalsContact ND1-O 3.13Å; H247-H319 AromaticContact NE2-CE1 3.42Å; H247-H319 PolarHBondContact NE2-CE1 3.08Å; H247-H319 AromaticContact NE2-NE2 3.59Å; H247-H319 PolarHBondContact O-N 3.38Å
248	I	98.3	Very high	98.2	Very high	22 Å²	22	18.6 Å²	18.6	11%	0.113	9%	0.085	C	C	.	.			trans	-109.5	139.7	162.6	-60.4	176.8	0	0	0	105.8	L276 F279 I318 A346	I248-L276 HydrophobicContact CD1-CD2 3.62Å; I248-F279 HydrophobicContact CB-CE1 4.48Å; I248-F279 HydrophobicContact CD1-CD1 3.76Å; I248-F279 HydrophobicContact CD1-CE1 3.73Å; I248-F279 HydrophobicContact CD1-CZ 4.47Å; I248-F279 HydrophobicContact CG1-CD1 4.18Å; I248-F279 HydrophobicContact CG1-CE1 3.81Å; I248-F279 HydrophobicContact CG1-CZ 4.06Å; I248-I318 HydrophobicContact CD1-CG1 3.75Å; I248-I318 HydrophobicContact CG1-CB 4.32Å; I248-I318 HydrophobicContact CG1-CG1 3.57Å; I248-A346 HydrophobicContact CG2-CB 4.21Å
249	D	98.1	Very high	98.2	Very high	20 Å²	20	18.6 Å²	18.6	11%	0.107	9%	0.085	C	C	.	.			trans	-62.3	141.5	174.3	-73.1	-86.8	0	0	0	112.1	G252 T253 V255 H319 N333	D249-G252 WeakPolarHBondContact O-CA 3.03Å; D249-G252 PolarHBondContact O-N 2.9Å; D249-T253 WeakPolarHBondContact CB-OG1 3.34Å; D249-T253 PolarHBondContact O-N 3.35Å; D249-V255 HydrophobicContact CB-CG2 4.12Å; D249-V255 VanDerWaalsContact OD1-CG2 3.24Å; D249-V255 WeakPolarHBondContact OD1-CG2 3.42Å; D249-V255 WeakPolarHBondContact OD2-CG2 3.43Å; D249-H319 IonicContact OD2-CE1 3Å; D249-H319 PolarHBondContact OD2-CE1 3.03Å; D249-H319 IonicContact OD2-ND1 3.42Å; D249-N333 PolarHBondContact OD1-ND2 3Å
250	F	95.8	Very high	98.2	Very high	40 Å²	40	18.9 Å²	18.9	18%	0.175	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-54.8	140.7	-173.8	53.1	-99.9	0	0	0	113.7	V231 Y234 G252 T253 N333 F359 F361	V231-F250 HydrophobicContact CB-CE2 3.98Å; V231-F250 HydrophobicContact CB-CZ 3.96Å; V231-F250 HydrophobicContact CG1-CE2 3.86Å; V231-F250 HydrophobicContact CG1-CZ 4.01Å; V231-F250 HydrophobicContact CG2-CE2 4.24Å; Y234-F250 HydrophobicContact CE2-CZ 4.3Å; F250-G252 PolarHBondContact O-N 2.96Å; F250-T253 WeakPolarHBondContact O-CB 3.29Å; F250-T253 WeakPolarHBondContact O-CG2 3.41Å; F250-T253 PolarHBondContact O-N 3.29Å; F250-T253 VanDerWaalsContact O-N 3.09Å; F250-T253 PolarHBondContact O-OG1 3Å; F250-N333 HydrophobicContact CE1-CB 4.49Å; F250-N333 HydrophobicContact CE2-CB 3.89Å; F250-N333 HydrophobicContact CZ-CB 3.63Å; F250-N333 VanDerWaalsContact CZ-CG 3.47Å; F250-F359 WeakPolarHBondContact CB-O 3.3Å; F250-F361 HydrophobicContact CD2-CB 3.91Å; F250-F361 AromaticContact CD2-CD2 3.83Å; F250-F361 HydrophobicContact CD2-CD2 3.83Å; F250-F361 HydrophobicContact CD2-CG 4.31Å; F250-F361 AromaticContact CE2-CD2 3.87Å; F250-F361 HydrophobicContact CE2-CD2 3.87Å
251	G	95.9	Very high	98.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	61.8	14.8	-169.7	0	0	0	0	0	114	T253 L335 E350 F364	G251-T253 VanDerWaalsContact C-N 3.26Å; G251-T253 PolarHBondContact O-N 2.82Å; G251-L335 WeakPolarHBondContact O-CD2 3.22Å; G251-E350 VanDerWaalsContact N-CD 3.33Å; G251-E350 PolarHBondContact N-OE1 3.35Å; G251-E350 PolarHBondContact N-OE2 3.07Å; G251-F364 WeakPolarHBondContact O-CE2 3.18Å
252	G	97.8	Very high	98.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	61.2	29.6	-167.5	0	0	0	0	0	114.1	D249 F250 T315 E350	D249-G252 WeakPolarHBondContact O-CA 3.03Å; D249-G252 PolarHBondContact O-N 2.9Å; F250-G252 PolarHBondContact O-N 2.96Å; G252-T315 WeakPolarHBondContact O-CA 3.31Å; G252-T315 VanDerWaalsContact O-CG2 3.28Å; G252-T315 WeakPolarHBondContact O-CG2 3.4Å; G252-E350 PolarHBondContact N-OE1 3.4Å
253	T	98.7	Very high	98.2	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.012	8%	0.084	C	C	.	.			trans	-56.4	152.8	-174.9	35.8	0	0	0	0	113.7	D249 F250 G251 N333 L335 F361	D249-T253 WeakPolarHBondContact CB-OG1 3.34Å; D249-T253 PolarHBondContact O-N 3.35Å; F250-T253 WeakPolarHBondContact O-CB 3.29Å; F250-T253 WeakPolarHBondContact O-CG2 3.41Å; F250-T253 PolarHBondContact O-N 3.29Å; F250-T253 VanDerWaalsContact O-N 3.09Å; F250-T253 PolarHBondContact O-OG1 3Å; G251-T253 VanDerWaalsContact C-N 3.26Å; G251-T253 PolarHBondContact O-N 2.82Å; T253-N333 HydrophobicContact CG2-CB 4.11Å; T253-N333 PolarHBondContact OG1-ND2 3.21Å; T253-L335 HydrophobicContact CG2-CD2 3.45Å; T253-L335 VanDerWaalsContact CG2-CD2 3.45Å; T253-L335 HydrophobicContact CG2-CG 3.73Å; T253-F361 HydrophobicContact CG2-CD2 3.54Å; T253-F361 HydrophobicContact CG2-CE2 3.72Å
254	S	98.8	Very high	98.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	148.9	161.4	-68.7	0	0	0	0	109.1	I313 T315 N333 F334 H336	S254-I313 CarbonylContact C-O 3.54Å; S254-I313 VanDerWaalsContact CA-O 3.31Å; S254-I313 WeakPolarHBondContact CA-O 3.41Å; S254-T315 PolarHBondContact OG-N 3.27Å; S254-T315 PolarHBondContact OG-OG1 3.4Å; S254-N333 CarbonylContact O-C 3.5Å; S254-N333 WeakPolarHBondContact O-CA 3.5Å; S254-F334 PolarHBondContact N-O 3.25Å; S254-F334 WeakPolarHBondContact O-CD1 3.5Å; S254-F334 WeakPolarHBondContact O-CE1 3.47Å; S254-F334 PolarHBondContact O-N 3.11Å; S254-H336 PolarHBondContact OG-CE1 2.86Å; S254-H336 PolarHBondContact OG-NE2 3.18Å
255	V	98.8	Very high	98.3	Very high	9 Å²	9	16.2 Å²	16.2	6%	0.055	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.7	-175.5	177.5	0	0	0	0	111.3	D249 F312 I313 G332 N333	D249-V255 HydrophobicContact CB-CG2 4.12Å; D249-V255 VanDerWaalsContact OD1-CG2 3.24Å; D249-V255 WeakPolarHBondContact OD1-CG2 3.42Å; D249-V255 WeakPolarHBondContact OD2-CG2 3.43Å; V255-F312 CarbonylContact O-C 3.45Å; V255-F312 VanDerWaalsContact O-CA 3.25Å; V255-F312 WeakPolarHBondContact O-CA 3.48Å; V255-I313 HydrophobicContact CB-CB 4.35Å; V255-I313 PolarHBondContact N-O 2.92Å; V255-I313 PolarHBondContact O-N 3.16Å; V255-G332 WeakPolarHBondContact CA-O 3.07Å; V255-N333 WeakPolarHBondContact CG2-ND2 3.43Å
256	W	98.9	Very high	98.3	Very high	1 Å²	1	15.5 Å²	15.5	0%	0.004	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140.6	159.9	72.6	-83.3	0	0	0	110	V204 T206 P207 V210 Q232 H258 F312 F330 G331 G332	V204-W256 HydrophobicContact CG1-CH2 4.28Å; T206-W256 HydrophobicContact CG2-CZ2 3.73Å; P207-W256 VanDerWaalsContact CD-CD2 3.44Å; P207-W256 HydrophobicContact CG-CB 4.21Å; P207-W256 HydrophobicContact CG-CD2 3.83Å; P207-W256 HydrophobicContact CG-CE3 3.73Å; P207-W256 HydrophobicContact CG-CG 4.04Å; P207-W256 HydrophobicContact CG-CZ3 4.44Å; V210-W256 HydrophobicContact CG2-CB 3.86Å; V210-W256 HydrophobicContact CG2-CG 3.88Å; Q232-W256 PolarHBondContact O-NE1 2.84Å; W256-H258 HydrophobicContact CZ3-CB 4.17Å; W256-F312 HydrophobicContact CB-CD1 3.64Å; W256-F312 HydrophobicContact CB-CE1 3.57Å; W256-F330 HydrophobicContact CH2-CB 4.06Å; W256-F330 HydrophobicContact CZ3-CB 4.32Å; W256-G331 VanDerWaalsContact CE2-C 3.46Å; W256-G331 VanDerWaalsContact CZ2-C 3.48Å; W256-G331 WeakPolarHBondContact CZ2-O 3.26Å; W256-G331 CarbonylContact O-C 3.59Å; W256-G331 WeakPolarHBondContact O-CA 3.36Å; W256-G332 PolarHBondContact N-O 3.4Å; W256-G332 VanDerWaalsContact NE1-CA 3.35Å; W256-G332 PolarHBondContact O-N 3.05Å
257	Y	98.9	Very high	98.4	Very high	16 Å²	16	15.2 Å²	15.2	6%	0.063	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	112.3	-172.8	-158.2	-74.4	0	0	0	111.6	L236 V259 K264 F266 T310 L311 A329	L236-Y257 HydrophobicContact CD1-CE2 4.04Å; L236-Y257 HydrophobicContact CD2-CE2 3.76Å; L236-Y257 HydrophobicContact CG-CE2 4.49Å; Y257-V259 HydrophobicContact CD1-CG2 4.23Å; Y257-V259 HydrophobicContact CE1-CG2 4Å; Y257-K264 HydrophobicContact CE1-CG 3.95Å; Y257-K264 VanDerWaalsContact OH-CE 3.25Å; Y257-K264 WeakPolarHBondContact OH-CE 3.36Å; Y257-F266 HydrophobicContact CD1-CE2 4.28Å; Y257-F266 AromaticContact CD1-CZ 3.92Å; Y257-F266 HydrophobicContact CD1-CZ 3.92Å; Y257-F266 AromaticContact CD2-CZ 3.89Å; Y257-F266 HydrophobicContact CD2-CZ 3.89Å; Y257-F266 HydrophobicContact CE1-CE2 4.41Å; Y257-F266 HydrophobicContact CE1-CZ 4.08Å; Y257-F266 HydrophobicContact CE2-CZ 4.02Å; Y257-F266 AromaticContact CG-CZ 3.84Å; Y257-F266 HydrophobicContact CG-CZ 3.84Å; Y257-T310 CarbonylContact O-C 3.54Å; Y257-T310 VanDerWaalsContact O-CA 3.31Å; Y257-T310 WeakPolarHBondContact O-CA 3.47Å; Y257-L311 PolarHBondContact N-O 2.86Å; Y257-L311 PolarHBondContact O-N 2.83Å; Y257-A329 HydrophobicContact CD1-CB 4.35Å; Y257-A329 HydrophobicContact CE1-CB 3.49Å; Y257-A329 VanDerWaalsContact CE1-CB 3.49Å
258	H	98.9	Very high	98.4	Very high	5 Å²	5	12.8 Å²	12.8	2%	0.023	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.8	179.2	-169.7	89.3	0	0	0	111.9	L137 W256 L260 G308 Q309 T310 A329 F330	L137-H258 HydrophobicContact CD1-CB 3.99Å; L137-H258 WeakPolarHBondContact CD1-CD2 3.44Å; L137-H258 VanDerWaalsContact CD1-CG 3.5Å; W256-H258 HydrophobicContact CZ3-CB 4.17Å; H258-L260 PolarHBondContact O-N 2.71Å; H258-G308 PolarHBondContact CE1-O 2.62Å; H258-Q309 PolarHBondContact ND1-O 2.86Å; H258-T310 HydrophobicContact CB-CG2 4.28Å; H258-T310 PolarHBondContact ND1-OG1 3.27Å; H258-A329 CarbonylContact O-C 3.53Å; H258-A329 VanDerWaalsContact O-CA 3.26Å; H258-A329 WeakPolarHBondContact O-CA 3.48Å; H258-A329 WeakPolarHBondContact O-CB 3.4Å; H258-F330 PolarHBondContact N-O 3.35Å; H258-F330 PolarHBondContact O-N 2.74Å
259	V	98.9	Very high	98.4	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	104.8	176	178.9	0	0	0	0	109.2	Y257 K261 K264 V305 Q307 G308 Q309 A329	Y257-V259 HydrophobicContact CD1-CG2 4.23Å; Y257-V259 HydrophobicContact CE1-CG2 4Å; V259-K261 WeakPolarHBondContact CG1-O 3.42Å; V259-K264 HydrophobicContact CG2-CB 4.29Å; V259-K264 HydrophobicContact CG2-CG 4.09Å; V259-V305 HydrophobicContact CG2-CB 4.28Å; V259-V305 HydrophobicContact CG2-CG1 3.79Å; V259-Q307 CarbonylContact O-C 3.58Å; V259-Q307 WeakPolarHBondContact O-CA 3.11Å; V259-G308 PolarHBondContact O-N 3.35Å; V259-Q309 PolarHBondContact N-O 3.17Å; V259-A329 HydrophobicContact CG2-CB 4.46Å
260	L	98.7	Very high	98.5	Very high	8 Å²	8	14.8 Å²	14.8	4%	0.042	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-35	178.7	-175.3	62.2	0	0	0	111.9	P138 F142 H258 Q307 L328 F330	P138-L260 HydrophobicContact CG-CD2 4.02Å; F142-L260 HydrophobicContact CB-CD2 4.22Å; F142-L260 HydrophobicContact CD1-CD2 4.43Å; H258-L260 PolarHBondContact O-N 2.71Å; L260-Q307 WeakPolarHBondContact O-CG 3.18Å; L260-Q307 PolarHBondContact O-NE2 2.71Å; L260-L328 HydrophobicContact CD2-CD2 4.39Å; L260-L328 PolarHBondContact N-O 2.95Å; L260-F330 HydrophobicContact CB-CD2 4.31Å; L260-F330 HydrophobicContact CD2-CD2 4.23Å; L260-F330 HydrophobicContact CD2-CE2 3.73Å
261	K	98.6	Very high	98.6	Very high	56 Å²	56	13.7 Å²	13.7	24%	0.243	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	143	173	-69.5	-178	173.1	172	0	111.4	P140 S141 F142 V259 C327 L328	P140-K261 WeakPolarHBondContact O-CE 3.25Å; S141-K261 VanDerWaalsContact C-NZ 3.3Å; S141-K261 PolarHBondContact O-NZ 3.35Å; F142-K261 WeakPolarHBondContact O-CE 3.37Å; F142-K261 PolarHBondContact O-NZ 2.9Å; V259-K261 WeakPolarHBondContact CG1-O 3.42Å; K261-C327 WeakPolarHBondContact O-CA 3.46Å; K261-C327 PolarHBondContact O-SG 3.01Å; K261-C327 VanDerWaalsContact O-SG 3.4Å; K261-L328 HydrophobicContact CB-CB 4.33Å; K261-L328 PolarHBondContact N-O 2.97Å; K261-L328 PolarHBondContact O-N 3.45Å
262	G	98.6	Very high	98.7	Very high	20 Å²	20	16.2 Å²	16.2	21%	0.206	8%	0.083	C	C	.	.	S	Bend	trans	90.2	-147.3	176.5	0	0	0	0	0	113.7	Q307	G262-Q307 WeakPolarHBondContact O-CB 3.27Å; G262-Q307 PolarHBondContact O-N 3.1Å
263	E	98.8	Very high	98.7	Very high	47 Å²	47	21.5 Å²	21.5	22%	0.22	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	148	178.9	179.2	177.1	153.7	0	0	109.8	S304 V305 K306 P324 V325	E263-S304 VanDerWaalsContact CD-OG 3.24Å; E263-S304 PolarHBondContact OE1-OG 2.81Å; E263-V305 WeakPolarHBondContact CA-O 3.44Å; E263-K306 HydrophobicContact CG-CG 3.95Å; E263-K306 WeakPolarHBondContact OE2-CE 3.29Å; E263-P324 HydrophobicContact CB-CG 3.88Å; E263-P324 HydrophobicContact CG-CG 3.77Å; E263-P324 VanDerWaalsContact O-CD 3.27Å; E263-P324 WeakPolarHBondContact O-CD 3.38Å; E263-V325 HydrophobicContact CB-CG2 4.15Å
264	K	98.8	Very high	98.6	Very high	3 Å²	3	24.4 Å²	24.4	1%	0.013	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.2	169.2	-72.9	-74.6	-174.3	165.2	0	110	S238 Y257 V259 F266 V305 V321 T323	S238-K264 PolarHBondContact OG-NZ 2.77Å; Y257-K264 HydrophobicContact CE1-CG 3.95Å; Y257-K264 VanDerWaalsContact OH-CE 3.25Å; Y257-K264 WeakPolarHBondContact OH-CE 3.36Å; V259-K264 HydrophobicContact CG2-CB 4.29Å; V259-K264 HydrophobicContact CG2-CG 4.09Å; K264-F266 HydrophobicContact CB-CD2 4.25Å; K264-F266 HydrophobicContact CB-CE2 3.73Å; K264-V305 PolarHBondContact N-O 3.02Å; K264-V305 PolarHBondContact O-N 3.27Å; K264-V321 HydrophobicContact CD-CG1 3.79Å; K264-T323 HydrophobicContact CD-CG2 4.03Å; K264-T323 PolarHBondContact NZ-OG1 3.5Å
265	I	98.9	Very high	98.6	Very high	16 Å²	16	25.4 Å²	25.4	8%	0.082	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	116.2	172.2	-64.3	169.9	0	0	0	107.9	Y267 K302 C303 V321 L322 P324	I265-Y267 HydrophobicContact CG2-CE1 4.2Å; I265-Y267 HydrophobicContact CG2-CE2 3.96Å; I265-K302 HydrophobicContact CG2-CD 4.48Å; I265-K302 HydrophobicContact CG2-CG 3.81Å; I265-C303 CarbonylContact C-O 3.59Å; I265-C303 WeakPolarHBondContact CA-O 3.43Å; I265-V321 WeakPolarHBondContact O-CA 3.4Å; I265-L322 HydrophobicContact CB-CB 4.36Å; I265-L322 PolarHBondContact N-O 3.44Å; I265-L322 PolarHBondContact O-N 3.21Å; I265-P324 HydrophobicContact CD1-CB 4.01Å; I265-P324 HydrophobicContact CD1-CG 3.89Å; I265-P324 HydrophobicContact CG1-CG 3.98Å
266	F	98.9	Very high	98.5	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.009	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.5	174.9	-68.5	-104.7	0	0	0	109.6	Y257 K264 L268 C303 V305 L311 I313 H319 A320 V321	Y257-F266 HydrophobicContact CD1-CE2 4.28Å; Y257-F266 AromaticContact CD1-CZ 3.92Å; Y257-F266 HydrophobicContact CD1-CZ 3.92Å; Y257-F266 AromaticContact CD2-CZ 3.89Å; Y257-F266 HydrophobicContact CD2-CZ 3.89Å; Y257-F266 HydrophobicContact CE1-CE2 4.41Å; Y257-F266 HydrophobicContact CE1-CZ 4.08Å; Y257-F266 HydrophobicContact CE2-CZ 4.02Å; Y257-F266 AromaticContact CG-CZ 3.84Å; Y257-F266 HydrophobicContact CG-CZ 3.84Å; K264-F266 HydrophobicContact CB-CD2 4.25Å; K264-F266 HydrophobicContact CB-CE2 3.73Å; F266-L268 HydrophobicContact CB-CD1 4.41Å; F266-L268 HydrophobicContact CB-CD2 4.03Å; F266-L268 HydrophobicContact CB-CG 4Å; F266-C303 HydrophobicContact CB-CB 4.34Å; F266-C303 PolarHBondContact N-O 3.38Å; F266-C303 PolarHBondContact O-N 3.31Å; F266-V305 HydrophobicContact CD2-CB 4.48Å; F266-V305 HydrophobicContact CD2-CG2 3.68Å; F266-V305 HydrophobicContact CE2-CB 4.3Å; F266-V305 HydrophobicContact CE2-CG2 3.8Å; F266-L311 HydrophobicContact CB-CD2 4.42Å; F266-L311 HydrophobicContact CD1-CD2 4.02Å; F266-L311 HydrophobicContact CD2-CD2 3.76Å; F266-L311 HydrophobicContact CE1-CD2 4.21Å; F266-L311 HydrophobicContact CE2-CD2 3.95Å; F266-L311 HydrophobicContact CG-CD2 3.81Å; F266-L311 HydrophobicContact CZ-CD2 4.18Å; F266-I313 HydrophobicContact CD1-CD1 3.74Å; F266-I313 HydrophobicContact CE1-CD1 3.72Å; F266-H319 AromaticContact CD1-CD2 3.68Å; F266-A320 CarbonylContact C-O 3.56Å; F266-A320 WeakPolarHBondContact CA-O 3.43Å; F266-V321 HydrophobicContact CD1-CG2 3.68Å; F266-V321 HydrophobicContact CE1-CG1 4.39Å; F266-V321 HydrophobicContact CE1-CG2 3.63Å; F266-V321 HydrophobicContact CG-CG2 4.43Å; F266-V321 HydrophobicContact CZ-CG1 4.35Å; F266-V321 HydrophobicContact CZ-CG2 4.36Å
267	Y	98.9	Very high	98.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	104.5	170.8	-59	-83.3	0	0	0	107.1	L91 F96 I265 Y301 K302 H319 A320 L322	L91-Y267 HydrophobicContact CD1-CE1 4.03Å; L91-Y267 HydrophobicContact CD1-CE2 3.99Å; L91-Y267 HydrophobicContact CD2-CE2 4.07Å; L91-Y267 HydrophobicContact CG-CE2 4.22Å; L91-Y267 WeakPolarHBondContact CG-OH 3.36Å; F96-Y267 AromaticContact CD1-CD1 3.81Å; F96-Y267 HydrophobicContact CD1-CD1 3.81Å; F96-Y267 HydrophobicContact CD1-CE1 4.17Å; F96-Y267 HydrophobicContact CD2-CD1 4.32Å; F96-Y267 AromaticContact CD2-CE1 3.85Å; F96-Y267 HydrophobicContact CD2-CE1 3.85Å; F96-Y267 AromaticContact CE1-CD1 3.5Å; F96-Y267 HydrophobicContact CE1-CD1 3.5Å; F96-Y267 VanDerWaalsContact CE1-CD1 3.5Å; F96-Y267 AromaticContact CE1-CE1 3.79Å; F96-Y267 HydrophobicContact CE1-CE1 3.79Å; F96-Y267 HydrophobicContact CE1-CG 4.5Å; F96-Y267 HydrophobicContact CE2-CD1 4.04Å; F96-Y267 AromaticContact CE2-CE1 3.44Å; F96-Y267 HydrophobicContact CE2-CE1 3.44Å; F96-Y267 VanDerWaalsContact CE2-CE1 3.44Å; F96-Y267 HydrophobicContact CG-CD1 4.22Å; F96-Y267 HydrophobicContact CG-CE1 4.2Å; F96-Y267 AromaticContact CZ-CD1 3.63Å; F96-Y267 HydrophobicContact CZ-CD1 3.63Å; F96-Y267 AromaticContact CZ-CE1 3.41Å; F96-Y267 HydrophobicContact CZ-CE1 3.41Å; F96-Y267 VanDerWaalsContact CZ-CE1 3.41Å; I265-Y267 HydrophobicContact CG2-CE1 4.2Å; I265-Y267 HydrophobicContact CG2-CE2 3.96Å; Y267-Y301 WeakPolarHBondContact CA-O 3.43Å; Y267-K302 HydrophobicContact CD1-CB 4.47Å; Y267-K302 HydrophobicContact CD1-CG 4.48Å; Y267-K302 HydrophobicContact CE1-CB 4.5Å; Y267-K302 HydrophobicContact CE1-CD 4.25Å; Y267-K302 HydrophobicContact CE1-CG 4.11Å; Y267-H319 WeakPolarHBondContact O-CA 3.41Å; Y267-A320 HydrophobicContact CD2-CB 4.38Å; Y267-A320 PolarHBondContact N-O 3.32Å; Y267-A320 PolarHBondContact O-N 2.81Å; Y267-L322 HydrophobicContact CE2-CB 3.8Å
268	L	98.9	Very high	98.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.6	-164.5	-61.3	163.3	0	0	0	110.3	P124 F266 Y301 C303 I313 W317 H319	P124-L268 HydrophobicContact CB-CD1 4.38Å; P124-L268 HydrophobicContact CG-CD1 4.18Å; F266-L268 HydrophobicContact CB-CD1 4.41Å; F266-L268 HydrophobicContact CB-CD2 4.03Å; F266-L268 HydrophobicContact CB-CG 4Å; L268-Y301 PolarHBondContact N-O 3.1Å; L268-Y301 WeakPolarHBondContact O-CD2 3.29Å; L268-Y301 PolarHBondContact O-N 2.82Å; L268-C303 HydrophobicContact CD1-CB 3.58Å; L268-I313 HydrophobicContact CD2-CD1 4.19Å; L268-I313 HydrophobicContact CD2-CG1 4.5Å; L268-W317 HydrophobicContact CB-CE3 4.11Å; L268-W317 HydrophobicContact CB-CZ3 4.14Å; L268-H319 HydrophobicContact CD2-CB 3.89Å
269	I	98.9	Very high	98	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.8	-179.8	-63.8	170.2	0	0	0	108.7	F246 N275 F293 V297 C300 I318	F246-I269 HydrophobicContact CD1-CD1 3.76Å; F246-I269 HydrophobicContact CE1-CD1 3.45Å; F246-I269 VanDerWaalsContact CE1-CD1 3.45Å; F246-I269 HydrophobicContact CE1-CG1 4.16Å; F246-I269 HydrophobicContact CZ-CD1 4.17Å; I269-N275 HydrophobicContact CG2-CB 4.15Å; I269-F293 HydrophobicContact CD1-CD1 3.61Å; I269-F293 HydrophobicContact CD1-CE1 3.7Å; I269-V297 HydrophobicContact CD1-CG1 4.5Å; I269-V297 HydrophobicContact CD1-CG2 3.74Å; I269-V297 HydrophobicContact CG1-CG2 4.01Å; I269-V297 HydrophobicContact CG2-CB 4.36Å; I269-V297 HydrophobicContact CG2-CG1 4.08Å; I269-V297 HydrophobicContact CG2-CG2 4.15Å; I269-C300 HydrophobicContact CG1-CB 4.21Å; I269-I318 HydrophobicContact CB-CB 4.13Å; I269-I318 WeakPolarHBondContact CB-O 3.29Å; I269-I318 HydrophobicContact CG2-CB 4.44Å; I269-I318 HydrophobicContact CG2-CD1 4.29Å; I269-I318 PolarHBondContact N-O 3.08Å; I269-I318 PolarHBondContact O-N 2.99Å
270	R	98.5	Very high	97.7	Very high	84 Å²	84	34.2 Å²	34.2	32%	0.317	19%	0.189	S	C	.	.			trans	-66.4	135	-178.5	-176.2	-177.4	-67.7	-81.7	3.3	110.3	S122 V123 T272 N275 W317	S122-R270 PolarHBondContact O-NH1 3.41Å; V123-R270 VanDerWaalsContact CG1-NH2 3.35Å; R270-T272 HydrophobicContact CB-CG2 4.49Å; R270-T272 HydrophobicContact CG-CG2 4.18Å; R270-T272 PolarHBondContact O-N 2.82Å; R270-N275 WeakPolarHBondContact O-CB 3.33Å; R270-N275 PolarHBondContact O-ND2 2.92Å; R270-W317 HydrophobicContact CB-CH2 3.77Å; R270-W317 HydrophobicContact CB-CZ2 3.92Å; R270-W317 HydrophobicContact CB-CZ3 4.14Å; R270-W317 HydrophobicContact CG-CH2 4.17Å; R270-W317 HydrophobicContact CG-CZ2 3.84Å
271	P	98	Very high	97.2	Very high	17 Å²	17	37.4 Å²	37.4	11%	0.11	21%	0.212	C	C	.	.			trans	-78.2	70.4	177.4	31.3	-33.1	0	0	0	111.5	L276 G316 W317 M342	P271-L276 HydrophobicContact CB-CD1 4.28Å; P271-L276 HydrophobicContact CB-CD2 4.01Å; P271-L276 HydrophobicContact CB-CG 4.21Å; P271-G316 WeakPolarHBondContact CB-O 3.49Å; P271-W317 HydrophobicContact CG-CG 4.23Å; P271-M342 HydrophobicContact CB-CE 3.95Å; P271-M342 HydrophobicContact CB-SD 4.22Å; P271-M342 HydrophobicContact CG-CE 4.2Å; P271-M342 WeakPolarHBondContact O-CE 3.38Å
272	T	98.2	Very high	96.9	Very high	54 Å²	54	34.9 Å²	34.9	33%	0.331	20%	0.201	S	C	.	.			trans	-76	154	163.3	71.5	0	0	0	0	108.8	R270 A274 N275 L276	R270-T272 HydrophobicContact CB-CG2 4.49Å; R270-T272 HydrophobicContact CG-CG2 4.18Å; R270-T272 PolarHBondContact O-N 2.82Å; T272-A274 PolarHBondContact O-N 3.26Å; T272-A274 VanDerWaalsContact O-N 3.16Å; T272-N275 PolarHBondContact O-N 3.32Å; T272-N275 WeakPolarHBondContact OG1-CB 3.19Å; T272-N275 PolarHBondContact OG1-N 2.96Å; T272-N275 VanDerWaalsContact OG1-N 3.09Å; T272-N275 PolarHBondContact OG1-ND2 2.89Å; T272-N275 PolarHBondContact OG1-OD1 2.76Å; T272-L276 WeakPolarHBondContact O-CG 3.38Å; T272-L276 PolarHBondContact O-N 2.61Å
273	N	97.4	Very high	96.3	Very high	111 Å²	111	35.2 Å²	35.2	59%	0.594	20%	0.199	S	C	*	.	H	α-helix	trans	-54.1	-38.1	176.7	-65	-15.5	0	0	0	111.8	L276 T277	N273-L276 PolarHBondContact O-N 2.71Å; N273-T277 PolarHBondContact O-N 2.6Å; N273-T277 PolarHBondContact O-OG1 2.84Å; N273-T277 VanDerWaalsContact O-OG1 3.13Å
274	A	97.4	Very high	95.5	Very high	63 Å²	63	37 Å²	37	52%	0.521	22%	0.217	S	C	.	.	H	α-helix	trans	-64.1	-46.3	176	0	0	0	0	0	112.5	T272 L276 T277 L278	T272-A274 PolarHBondContact O-N 3.26Å; T272-A274 VanDerWaalsContact O-N 3.16Å; A274-L276 VanDerWaalsContact C-N 3.33Å; A274-L276 PolarHBondContact O-N 3.03Å; A274-T277 PolarHBondContact O-N 3.06Å; A274-L278 WeakPolarHBondContact O-CB 3.45Å; A274-L278 VanDerWaalsContact O-CG 3.31Å; A274-L278 WeakPolarHBondContact O-CG 3.36Å; A274-L278 PolarHBondContact O-N 2.82Å
275	N	98.3	Very high	94.6	Very high	20 Å²	20	38.4 Å²	38.4	11%	0.107	23%	0.228	C	C	.	.	H	α-helix	trans	-66.9	-34.1	178.8	-68.1	-5.3	0	0	0	112	I269 R270 T272 F279 V297 I318	I269-N275 HydrophobicContact CG2-CB 4.15Å; R270-N275 WeakPolarHBondContact O-CB 3.33Å; R270-N275 PolarHBondContact O-ND2 2.92Å; T272-N275 PolarHBondContact O-N 3.32Å; T272-N275 WeakPolarHBondContact OG1-CB 3.19Å; T272-N275 PolarHBondContact OG1-N 2.96Å; T272-N275 VanDerWaalsContact OG1-N 3.09Å; T272-N275 PolarHBondContact OG1-ND2 2.89Å; T272-N275 PolarHBondContact OG1-OD1 2.76Å; N275-F279 VanDerWaalsContact O-CB 3.27Å; N275-F279 WeakPolarHBondContact O-CB 3.4Å; N275-F279 PolarHBondContact O-N 2.97Å; N275-V297 HydrophobicContact CB-CG1 4.4Å; N275-I318 HydrophobicContact CB-CD1 4.18Å
276	L	97.7	Very high	93.6	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-43.9	174.7	-68	169.4	0	0	0	111.8	I248 P271 T272 N273 A274 F279 E280 I318 M342 I349	I248-L276 HydrophobicContact CD1-CD2 3.62Å; P271-L276 HydrophobicContact CB-CD1 4.28Å; P271-L276 HydrophobicContact CB-CD2 4.01Å; P271-L276 HydrophobicContact CB-CG 4.21Å; T272-L276 WeakPolarHBondContact O-CG 3.38Å; T272-L276 PolarHBondContact O-N 2.61Å; N273-L276 PolarHBondContact O-N 2.71Å; A274-L276 VanDerWaalsContact C-N 3.33Å; A274-L276 PolarHBondContact O-N 3.03Å; L276-F279 PolarHBondContact O-N 3.37Å; L276-E280 PolarHBondContact O-N 3.09Å; L276-I318 HydrophobicContact CD2-CD1 4.24Å; L276-M342 HydrophobicContact CD1-CE 4.01Å; L276-M342 HydrophobicContact CD1-SD 3.69Å; L276-I349 HydrophobicContact CB-CD1 4.39Å; L276-I349 HydrophobicContact CD2-CD1 4.18Å
277	T	94.7	Very high	92.6	Very high	87 Å²	87	47.1 Å²	47.1	53%	0.534	28%	0.284	S	S	.	.	H	α-helix	trans	-63	-43.3	173.5	-59.1	0	0	0	0	111.7	N273 A274 F279 E280 C281	N273-T277 PolarHBondContact O-N 2.6Å; N273-T277 PolarHBondContact O-OG1 2.84Å; N273-T277 VanDerWaalsContact O-OG1 3.13Å; A274-T277 PolarHBondContact O-N 3.06Å; T277-F279 VanDerWaalsContact C-N 3.33Å; T277-F279 PolarHBondContact O-N 3.34Å; T277-E280 PolarHBondContact O-N 2.88Å; T277-C281 WeakPolarHBondContact O-CB 3.17Å; T277-C281 PolarHBondContact O-N 3.29Å; T277-C281 PolarHBondContact O-SG 3.28Å
278	L	94.9	Very high	91.7	Very high	61 Å²	61	49.8 Å²	49.8	32%	0.319	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-41.9	174.7	-72.7	168.3	0	0	0	111.7	A274 C281 W282 F293 Q296 V297	A274-L278 WeakPolarHBondContact O-CB 3.45Å; A274-L278 VanDerWaalsContact O-CG 3.31Å; A274-L278 WeakPolarHBondContact O-CG 3.36Å; A274-L278 PolarHBondContact O-N 2.82Å; L278-C281 PolarHBondContact O-N 3.42Å; L278-W282 WeakPolarHBondContact O-CB 3.32Å; L278-W282 PolarHBondContact O-N 2.99Å; L278-F293 HydrophobicContact CB-CE2 3.88Å; L278-F293 HydrophobicContact CB-CZ 4.06Å; L278-Q296 WeakPolarHBondContact CD1-O 3.41Å; L278-V297 HydrophobicContact CD1-CG1 4.31Å
279	F	96.7	Very high	91	Very high	12 Å²	12	52.9 Å²	52.9	5%	0.053	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-46.3	177.1	172.9	-102.2	0	0	0	111.9	I248 N275 L276 T277 C281 W282 S283 F293 I318 I349 L353	I248-F279 HydrophobicContact CB-CE1 4.48Å; I248-F279 HydrophobicContact CD1-CD1 3.76Å; I248-F279 HydrophobicContact CD1-CE1 3.73Å; I248-F279 HydrophobicContact CD1-CZ 4.47Å; I248-F279 HydrophobicContact CG1-CD1 4.18Å; I248-F279 HydrophobicContact CG1-CE1 3.81Å; I248-F279 HydrophobicContact CG1-CZ 4.06Å; N275-F279 VanDerWaalsContact O-CB 3.27Å; N275-F279 WeakPolarHBondContact O-CB 3.4Å; N275-F279 PolarHBondContact O-N 2.97Å; L276-F279 PolarHBondContact O-N 3.37Å; T277-F279 VanDerWaalsContact C-N 3.33Å; T277-F279 PolarHBondContact O-N 3.34Å; F279-C281 VanDerWaalsContact C-N 3.35Å; F279-C281 PolarHBondContact O-N 3Å; F279-W282 HydrophobicContact CD2-CE3 4.04Å; F279-W282 HydrophobicContact CD2-CZ3 4.22Å; F279-W282 HydrophobicContact CE2-CE3 4.13Å; F279-W282 AromaticContact CE2-CZ3 3.89Å; F279-W282 HydrophobicContact CE2-CZ3 3.89Å; F279-W282 PolarHBondContact O-N 3.44Å; F279-S283 WeakPolarHBondContact CE2-OG 3.45Å; F279-S283 WeakPolarHBondContact CZ-OG 3.38Å; F279-S283 WeakPolarHBondContact O-CB 3.37Å; F279-S283 PolarHBondContact O-N 2.97Å; F279-S283 PolarHBondContact O-OG 3.22Å; F279-S283 VanDerWaalsContact O-OG 3.09Å; F279-F293 HydrophobicContact CB-CE1 4.24Å; F279-F293 HydrophobicContact CB-CE2 4.28Å; F279-F293 HydrophobicContact CB-CZ 3.76Å; F279-F293 HydrophobicContact CD2-CE1 4.43Å; F279-I318 HydrophobicContact CB-CD1 3.75Å; F279-I318 HydrophobicContact CB-CG1 4.27Å; F279-I318 HydrophobicContact CD2-CG1 4.27Å; F279-I318 HydrophobicContact CD2-CG2 3.7Å; F279-I318 HydrophobicContact CE2-CG2 4.09Å; F279-I318 HydrophobicContact CG-CD1 4.16Å; F279-I318 HydrophobicContact CG-CG1 4.12Å; F279-I318 HydrophobicContact CG-CG2 4.37Å; F279-I349 HydrophobicContact CE1-CG2 4.49Å; F279-L353 HydrophobicContact CE1-CD1 4.46Å
280	E	91.9	Very high	90.4	Very high	44 Å²	44	56.2 Å²	56.2	21%	0.206	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-41.6	177	-169.1	176.2	159.9	0	0	111.6	L276 T277 S284 I349 R352 L353	L276-E280 PolarHBondContact O-N 3.09Å; T277-E280 PolarHBondContact O-N 2.88Å; E280-S284 WeakPolarHBondContact O-CB 3.42Å; E280-S284 PolarHBondContact O-N 3.09Å; E280-S284 VanDerWaalsContact O-N 3.14Å; E280-S284 PolarHBondContact O-OG 3.03Å; E280-I349 HydrophobicContact CG-CG2 4.38Å; E280-R352 IonicContact OE1-CZ 3.91Å; E280-R352 IonicContact OE1-NE 2.68Å; E280-R352 PolarHBondContact OE1-NE 3.11Å; E280-R352 IonicContact OE1-NH2 3.41Å; E280-R352 PolarHBondContact OE1-NH2 3.3Å; E280-R352 IonicContact OE2-CZ 2.64Å; E280-R352 IonicContact OE2-NE 2.85Å; E280-R352 IonicContact OE2-NH2 2.88Å; E280-R352 PolarHBondContact OE2-NH2 2.95Å; E280-L353 HydrophobicContact CG-CD2 4.08Å; E280-L353 HydrophobicContact CG-CG 4.41Å
281	C	88.4	Confident	89.9	Confident	76 Å²	76	55.3 Å²	55.3	51%	0.514	33%	0.329	S	S	.	.	H	α-helix	trans	-67.9	-32.9	174.1	-67.8	0	0	0	0	113.9	T277 L278 F279 S284 S285	T277-C281 WeakPolarHBondContact O-CB 3.17Å; T277-C281 PolarHBondContact O-N 3.29Å; T277-C281 PolarHBondContact O-SG 3.28Å; L278-C281 PolarHBondContact O-N 3.42Å; F279-C281 VanDerWaalsContact C-N 3.35Å; F279-C281 PolarHBondContact O-N 3Å; C281-S284 PolarHBondContact O-OG 2.91Å; C281-S285 WeakPolarHBondContact O-CB 3.43Å; C281-S285 PolarHBondContact O-N 3.5Å
282	W	92.4	Very high	89.8	Confident	3 Å²	3	55 Å²	55	1%	0.011	33%	0.326	C	S	.	.	H	α-helix	trans	-74.4	-45.6	175.9	167.9	85.7	0	0	0	111.6	D245 F246 L278 F279 S284 S285 Q288 M291 F293	D245-W282 WeakPolarHBondContact OD2-CZ2 3.38Å; F246-W282 HydrophobicContact CB-CH2 3.95Å; F246-W282 HydrophobicContact CB-CZ3 4.11Å; F246-W282 WeakPolarHBondContact O-CH2 3.46Å; F246-W282 WeakPolarHBondContact O-CZ3 3.39Å; L278-W282 WeakPolarHBondContact O-CB 3.32Å; L278-W282 PolarHBondContact O-N 2.99Å; F279-W282 HydrophobicContact CD2-CE3 4.04Å; F279-W282 HydrophobicContact CD2-CZ3 4.22Å; F279-W282 HydrophobicContact CE2-CE3 4.13Å; F279-W282 AromaticContact CE2-CZ3 3.89Å; F279-W282 HydrophobicContact CE2-CZ3 3.89Å; F279-W282 PolarHBondContact O-N 3.44Å; W282-S284 VanDerWaalsContact C-N 3.28Å; W282-S284 PolarHBondContact O-N 3.3Å; W282-S285 WeakPolarHBondContact O-CB 3.4Å; W282-S285 PolarHBondContact O-N 2.76Å; W282-S285 PolarHBondContact O-OG 3.21Å; W282-Q288 HydrophobicContact CD2-CG 3.83Å; W282-Q288 VanDerWaalsContact CE2-CG 3.43Å; W282-Q288 HydrophobicContact CE3-CG 4.16Å; W282-Q288 HydrophobicContact CG-CG 4.48Å; W282-Q288 HydrophobicContact CH2-CG 3.8Å; W282-Q288 HydrophobicContact CZ2-CG 3.44Å; W282-Q288 VanDerWaalsContact CZ2-CG 3.44Å; W282-Q288 HydrophobicContact CZ3-CG 4.13Å; W282-Q288 VanDerWaalsContact CZ3-NE2 3.32Å; W282-M291 PolarHBondContact NE1-O 2.75Å; W282-F293 HydrophobicContact CB-CD2 3.63Å; W282-F293 HydrophobicContact CB-CE2 4.03Å; W282-F293 HydrophobicContact CD2-CB 3.86Å; W282-F293 AromaticContact CD2-CD2 3.95Å; W282-F293 HydrophobicContact CD2-CD2 3.95Å; W282-F293 HydrophobicContact CD2-CG 4.1Å; W282-F293 HydrophobicContact CE3-CB 4.37Å; W282-F293 HydrophobicContact CE3-CD2 4.39Å; W282-F293 HydrophobicContact CE3-CG 4.38Å; W282-F293 HydrophobicContact CG-CB 4.14Å; W282-F293 AromaticContact CG-CD2 3.61Å; W282-F293 HydrophobicContact CG-CD2 3.61Å; W282-F293 HydrophobicContact CG-CE2 4.47Å; W282-F293 HydrophobicContact CG-CG 4.21Å; W282-F293 HydrophobicContact CZ2-CB 4.14Å
283	S	86.6	Confident	89.7	Confident	26 Å²	26	52.5 Å²	52.5	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-30.7	179.7	-65.8	0	0	0	0	113.2	F279	F279-S283 WeakPolarHBondContact CE2-OG 3.45Å; F279-S283 WeakPolarHBondContact CZ-OG 3.38Å; F279-S283 WeakPolarHBondContact O-CB 3.37Å; F279-S283 PolarHBondContact O-N 2.97Å; F279-S283 PolarHBondContact O-OG 3.22Å; F279-S283 VanDerWaalsContact O-OG 3.09Å
284	S	81.4	Confident	89.7	Confident	84 Å²	84	47.7 Å²	47.7	59%	0.587	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-0.2	173.5	55.4	0	0	0	0	114.2	E280 C281 W282	E280-S284 WeakPolarHBondContact O-CB 3.42Å; E280-S284 PolarHBondContact O-N 3.09Å; E280-S284 VanDerWaalsContact O-N 3.14Å; E280-S284 PolarHBondContact O-OG 3.03Å; C281-S284 PolarHBondContact O-OG 2.91Å; W282-S284 VanDerWaalsContact C-N 3.28Å; W282-S284 PolarHBondContact O-N 3.3Å
285	S	80.1	Confident	89.6	Confident	34 Å²	34	49.6 Å²	49.6	24%	0.238	29%	0.288	C	S	.	.			trans	-84.4	139	-175.4	76.7	0	0	0	0	113.4	C281 W282 N287 Q288 M291	C281-S285 WeakPolarHBondContact O-CB 3.43Å; C281-S285 PolarHBondContact O-N 3.5Å; W282-S285 WeakPolarHBondContact O-CB 3.4Å; W282-S285 PolarHBondContact O-N 2.76Å; W282-S285 PolarHBondContact O-OG 3.21Å; S285-N287 PolarHBondContact O-N 3.43Å; S285-Q288 WeakPolarHBondContact O-CB 3.25Å; S285-Q288 PolarHBondContact O-N 2.78Å; S285-Q288 VanDerWaalsContact O-N 3.15Å; S285-Q288 PolarHBondContact OG-N 3.34Å; S285-M291 WeakPolarHBondContact OG-CE 3.33Å
286	S	77.7	Confident	89.4	Confident	122 Å²	122	52 Å²	52	85%	0.853	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.8	173.8	60.1	0	0	0	0	114.3
287	N	78.5	Confident	89.4	Confident	79 Å²	79	52.4 Å²	52.4	42%	0.422	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	9.2	-173	-59.2	7.1	0	0	0	112.3	S285 N289 E290 M291	S285-N287 PolarHBondContact O-N 3.43Å; N287-N289 VanDerWaalsContact C-N 3.31Å; N287-N289 PolarHBondContact O-N 2.89Å; N287-E290 CarbonylContact O-C 3.26Å; N287-E290 WeakPolarHBondContact O-CA 3.45Å; N287-E290 PolarHBondContact O-N 2.97Å; N287-M291 HydrophobicContact CB-CE 3.88Å; N287-M291 HydrophobicContact CB-CG 4.39Å; N287-M291 HydrophobicContact CB-SD 4.2Å; N287-M291 PolarHBondContact O-N 2.87Å
288	Q	78.9	Confident	89.5	Confident	55 Å²	55	57 Å²	57	26%	0.257	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-45.3	-54.2	-178.9	-173.1	-164.2	22.9	0	0	111.9	W282 S285 E290 M291	W282-Q288 HydrophobicContact CD2-CG 3.83Å; W282-Q288 VanDerWaalsContact CE2-CG 3.43Å; W282-Q288 HydrophobicContact CE3-CG 4.16Å; W282-Q288 HydrophobicContact CG-CG 4.48Å; W282-Q288 HydrophobicContact CH2-CG 3.8Å; W282-Q288 HydrophobicContact CZ2-CG 3.44Å; W282-Q288 VanDerWaalsContact CZ2-CG 3.44Å; W282-Q288 HydrophobicContact CZ3-CG 4.13Å; W282-Q288 VanDerWaalsContact CZ3-NE2 3.32Å; S285-Q288 WeakPolarHBondContact O-CB 3.25Å; S285-Q288 PolarHBondContact O-N 2.78Å; S285-Q288 VanDerWaalsContact O-N 3.15Å; S285-Q288 PolarHBondContact OG-N 3.34Å; Q288-E290 PolarHBondContact O-N 3.14Å; Q288-M291 PolarHBondContact O-N 3.05Å; Q288-M291 VanDerWaalsContact O-N 3.14Å
289	N	84.6	Confident	89.6	Confident	67 Å²	67	57.4 Å²	57.4	36%	0.358	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-65.7	2.5	178.6	-79	-73.8	0	0	0	115.5	K81 T82 N287	K81-N289 VanDerWaalsContact CA-O 3.28Å; K81-N289 WeakPolarHBondContact CA-O 3.36Å; T82-N289 PolarHBondContact N-O 2.99Å; T82-N289 PolarHBondContact OG1-O 2.72Å; N287-N289 VanDerWaalsContact C-N 3.31Å; N287-N289 PolarHBondContact O-N 2.89Å
290	E	87	Confident	89.7	Confident	69 Å²	69	57.1 Å²	57.1	32%	0.322	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-127.8	6.8	-178.9	-57.3	-167.6	161.5	0	0	112.1	P79 K81 N287 Q288	P79-E290 HydrophobicContact CB-CB 4.06Å; P79-E290 HydrophobicContact CG-CB 3.72Å; P79-E290 HydrophobicContact CG-CG 4.01Å; P79-E290 WeakPolarHBondContact CG-OE2 3.42Å; K81-E290 WeakPolarHBondContact CE-OE1 3.46Å; K81-E290 HydrophobicContact CG-CG 4.3Å; K81-E290 IonicContact NZ-OE1 3.14Å; K81-E290 PolarHBondContact NZ-OE1 2.95Å; N287-E290 CarbonylContact O-C 3.26Å; N287-E290 WeakPolarHBondContact O-CA 3.45Å; N287-E290 PolarHBondContact O-N 2.97Å; Q288-E290 PolarHBondContact O-N 3.14Å
291	M	87.1	Confident	90	Very high	65 Å²	65	56 Å²	56	32%	0.32	31%	0.31	S	S	.	.	S	Bend	trans	-137	120.8	-177.9	-62.2	-172.9	-58.1	0	0	111.8	W282 S285 N287 Q288 F293	W282-M291 PolarHBondContact NE1-O 2.75Å; S285-M291 WeakPolarHBondContact OG-CE 3.33Å; N287-M291 HydrophobicContact CB-CE 3.88Å; N287-M291 HydrophobicContact CB-CG 4.39Å; N287-M291 HydrophobicContact CB-SD 4.2Å; N287-M291 PolarHBondContact O-N 2.87Å; Q288-M291 PolarHBondContact O-N 3.05Å; Q288-M291 VanDerWaalsContact O-N 3.14Å; M291-F293 PolarHBondContact O-N 2.83Å
292	F	95.5	Very high	90.5	Very high	12 Å²	12	55.8 Å²	55.8	5%	0.053	30%	0.3	C	S	.	.			trans	-74.6	110.2	174.6	-176.2	-103.5	0	0	0	110.5	F87 L91 F96 F246 G294 D295	F87-F292 AromaticContact CE2-CD2 3.87Å; F87-F292 HydrophobicContact CE2-CD2 3.87Å; F87-F292 AromaticContact CZ-CD2 3.92Å; F87-F292 HydrophobicContact CZ-CD2 3.92Å; F87-F292 HydrophobicContact CZ-CE2 4.37Å; L91-F292 HydrophobicContact CD1-CD2 4.48Å; L91-F292 HydrophobicContact CD1-CE2 3.54Å; L91-F292 HydrophobicContact CD1-CZ 3.73Å; F96-F292 AromaticContact CE1-CE1 3.77Å; F96-F292 HydrophobicContact CE1-CE1 3.77Å; F96-F292 AromaticContact CE1-CZ 3.73Å; F96-F292 HydrophobicContact CE1-CZ 3.73Å; F96-F292 AromaticContact CZ-CE1 3.97Å; F96-F292 HydrophobicContact CZ-CE1 3.97Å; F96-F292 AromaticContact CZ-CZ 3.73Å; F96-F292 HydrophobicContact CZ-CZ 3.73Å; F246-F292 AromaticContact CE2-CD2 3.87Å; F246-F292 HydrophobicContact CE2-CD2 3.87Å; F246-F292 HydrophobicContact CE2-CE1 4.19Å; F246-F292 AromaticContact CE2-CE2 3.47Å; F246-F292 HydrophobicContact CE2-CE2 3.47Å; F246-F292 VanDerWaalsContact CE2-CE2 3.47Å; F246-F292 HydrophobicContact CE2-CG 4.39Å; F246-F292 AromaticContact CE2-CZ 3.65Å; F246-F292 HydrophobicContact CE2-CZ 3.65Å; F246-F292 HydrophobicContact CZ-CE1 4.24Å; F246-F292 AromaticContact CZ-CE2 3.97Å; F246-F292 HydrophobicContact CZ-CE2 3.97Å; F246-F292 AromaticContact CZ-CZ 3.69Å; F246-F292 HydrophobicContact CZ-CZ 3.69Å; F292-G294 PolarHBondContact O-N 2.71Å; F292-G294 VanDerWaalsContact O-N 3.14Å; F292-D295 WeakPolarHBondContact O-CB 3.27Å; F292-D295 PolarHBondContact O-N 3.38Å
293	F	96.6	Very high	90.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-57.7	-31.4	-174.8	180	-111.4	0	0	0	113.9	F246 I269 L278 F279 W282 M291 D295 Q296 V297 I318	F246-F293 HydrophobicContact CB-CB 4.13Å; F246-F293 HydrophobicContact CB-CD1 4.1Å; F246-F293 HydrophobicContact CB-CG 4.47Å; F246-F293 HydrophobicContact CD1-CD1 4.17Å; F246-F293 HydrophobicContact CD2-CB 3.61Å; F246-F293 HydrophobicContact CD2-CD1 4.46Å; F246-F293 HydrophobicContact CE2-CB 4.18Å; F246-F293 HydrophobicContact CG-CB 3.93Å; F246-F293 AromaticContact CG-CD1 3.99Å; F246-F293 HydrophobicContact CG-CD1 3.99Å; F246-F293 HydrophobicContact CG-CG 4.43Å; I269-F293 HydrophobicContact CD1-CD1 3.61Å; I269-F293 HydrophobicContact CD1-CE1 3.7Å; L278-F293 HydrophobicContact CB-CE2 3.88Å; L278-F293 HydrophobicContact CB-CZ 4.06Å; F279-F293 HydrophobicContact CB-CE1 4.24Å; F279-F293 HydrophobicContact CB-CE2 4.28Å; F279-F293 HydrophobicContact CB-CZ 3.76Å; F279-F293 HydrophobicContact CD2-CE1 4.43Å; W282-F293 HydrophobicContact CB-CD2 3.63Å; W282-F293 HydrophobicContact CB-CE2 4.03Å; W282-F293 HydrophobicContact CD2-CB 3.86Å; W282-F293 AromaticContact CD2-CD2 3.95Å; W282-F293 HydrophobicContact CD2-CD2 3.95Å; W282-F293 HydrophobicContact CD2-CG 4.1Å; W282-F293 HydrophobicContact CE3-CB 4.37Å; W282-F293 HydrophobicContact CE3-CD2 4.39Å; W282-F293 HydrophobicContact CE3-CG 4.38Å; W282-F293 HydrophobicContact CG-CB 4.14Å; W282-F293 AromaticContact CG-CD2 3.61Å; W282-F293 HydrophobicContact CG-CD2 3.61Å; W282-F293 HydrophobicContact CG-CE2 4.47Å; W282-F293 HydrophobicContact CG-CG 4.21Å; W282-F293 HydrophobicContact CZ2-CB 4.14Å; M291-F293 PolarHBondContact O-N 2.83Å; F293-D295 PolarHBondContact O-N 3.45Å; F293-Q296 HydrophobicContact CD2-CB 4.38Å; F293-Q296 HydrophobicContact CD2-CG 4.46Å; F293-Q296 HydrophobicContact CE2-CB 4.4Å; F293-Q296 WeakPolarHBondContact O-CB 3.49Å; F293-Q296 PolarHBondContact O-N 3.34Å; F293-V297 HydrophobicContact CE1-CG1 3.95Å; F293-V297 HydrophobicContact CE2-CG1 4.47Å; F293-V297 HydrophobicContact CZ-CG1 3.78Å; F293-I318 HydrophobicContact CD1-CG2 4.09Å; F293-I318 HydrophobicContact CE1-CD1 4.29Å; F293-I318 HydrophobicContact CE1-CG2 3.83Å
294	G	96.8	Very high	91.4	Very high	10 Å²	10	56.2 Å²	56.2	10%	0.103	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-60.1	-13.5	175.7	0	0	0	0	0	115.5	F292	F292-G294 PolarHBondContact O-N 2.71Å; F292-G294 VanDerWaalsContact O-N 3.14Å
295	D	95.6	Very high	92.2	Very high	103 Å²	103	52.2 Å²	52.2	55%	0.551	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-83.7	-9	172.9	-65.7	-23.6	0	0	0	113.2	R94 F292 F293	R94-D295 IonicContact CZ-OD1 3.72Å; R94-D295 IonicContact CZ-OD2 3.51Å; R94-D295 IonicContact NH1-OD1 2.68Å; R94-D295 PolarHBondContact NH1-OD1 2.88Å; R94-D295 IonicContact NH1-OD2 3.79Å; R94-D295 PolarHBondContact NH1-OD2 3.03Å; R94-D295 IonicContact NH2-OD2 3.21Å; R94-D295 PolarHBondContact NH2-OD2 3.04Å; F292-D295 WeakPolarHBondContact O-CB 3.27Å; F292-D295 PolarHBondContact O-N 3.38Å; F293-D295 PolarHBondContact O-N 3.45Å
296	Q	95	Very high	93.1	Very high	72 Å²	72	55.7 Å²	55.7	34%	0.336	29%	0.286	S	S	.	.	S	Bend	trans	-97.1	-11.1	-176.2	-54.2	-168.9	19.9	0	0	113.9	L278 F293	L278-Q296 WeakPolarHBondContact CD1-O 3.41Å; F293-Q296 HydrophobicContact CD2-CB 4.38Å; F293-Q296 HydrophobicContact CD2-CG 4.46Å; F293-Q296 HydrophobicContact CE2-CB 4.4Å; F293-Q296 WeakPolarHBondContact O-CB 3.49Å; F293-Q296 PolarHBondContact O-N 3.34Å
297	V	97.3	Very high	94.1	Very high	19 Å²	19	54.8 Å²	54.8	12%	0.115	27%	0.269	C	S	.	.	S	Bend	trans	-113	157.2	-173.4	-62.6	0	0	0	0	112	I269 N275 L278 F293 K299 C300	I269-V297 HydrophobicContact CD1-CG1 4.5Å; I269-V297 HydrophobicContact CD1-CG2 3.74Å; I269-V297 HydrophobicContact CG1-CG2 4.01Å; I269-V297 HydrophobicContact CG2-CB 4.36Å; I269-V297 HydrophobicContact CG2-CG1 4.08Å; I269-V297 HydrophobicContact CG2-CG2 4.15Å; N275-V297 HydrophobicContact CB-CG1 4.4Å; L278-V297 HydrophobicContact CD1-CG1 4.31Å; F293-V297 HydrophobicContact CE1-CG1 3.95Å; F293-V297 HydrophobicContact CE2-CG1 4.47Å; F293-V297 HydrophobicContact CZ-CG1 3.78Å; V297-K299 PolarHBondContact O-N 2.99Å; V297-C300 HydrophobicContact CG2-CB 4.29Å
298	E	95.6	Very high	95	Very high	185 Å²	185	52.4 Å²	52.4	86%	0.864	26%	0.263	S	S	*	.	S	Bend	trans	-64	-38.3	-176.1	-173.1	-173.7	174.5	0	0	113.9
299	K	97.5	Very high	96	Very high	68 Å²	68	51.4 Å²	51.4	30%	0.296	26%	0.258	S	S	.	.			trans	-141.5	138.1	177.7	-78.8	-171.5	165.3	-90.4	0	111	D97 E101 V297 Y301	D97-K299 IonicContact OD1-NZ 2.69Å; D97-K299 PolarHBondContact OD1-NZ 3.05Å; D97-K299 VanDerWaalsContact OD2-CA 3.29Å; D97-K299 WeakPolarHBondContact OD2-CA 3.37Å; D97-K299 WeakPolarHBondContact OD2-CB 3.42Å; E101-K299 IonicContact OE2-NZ 2.87Å; E101-K299 PolarHBondContact OE2-NZ 3.04Å; V297-K299 PolarHBondContact O-N 2.99Å; K299-Y301 HydrophobicContact CB-CE1 4.35Å; K299-Y301 HydrophobicContact CB-CE2 3.98Å; K299-Y301 HydrophobicContact CD-CE1 3.88Å; K299-Y301 WeakPolarHBondContact CD-OH 3.49Å
300	C	98.6	Very high	96.6	Very high	6 Å²	6	48.2 Å²	48.2	4%	0.041	24%	0.241	C	C	.	.			trans	-134.1	105.7	177	-176.2	0	0	0	0	108.6	F96 D97 I269 V297	F96-C300 HydrophobicContact CD1-CB 4.27Å; D97-C300 PolarHBondContact N-O 3.27Å; D97-C300 PolarHBondContact OD2-N 2.92Å; I269-C300 HydrophobicContact CG1-CB 4.21Å; V297-C300 HydrophobicContact CG2-CB 4.29Å
301	Y	98.8	Very high	97.2	Very high	22 Å²	22	45 Å²	45	9%	0.086	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.7	-166.8	-55.8	-87	0	0	0	111.7	D97 E101 V102 Y267 L268 K299 W317	D97-Y301 HydrophobicContact CB-CD1 3.61Å; D97-Y301 HydrophobicContact CB-CE1 4.04Å; D97-Y301 HydrophobicContact CB-CG 4.31Å; E101-Y301 HydrophobicContact CB-CE1 4.28Å; V102-Y301 HydrophobicContact CB-CE1 4.4Å; V102-Y301 HydrophobicContact CG1-CD1 4.31Å; V102-Y301 HydrophobicContact CG1-CE1 3.58Å; V102-Y301 HydrophobicContact CG1-CE2 4.22Å; V102-Y301 HydrophobicContact CG2-CD1 3.74Å; V102-Y301 HydrophobicContact CG2-CD2 4.05Å; V102-Y301 HydrophobicContact CG2-CE1 3.88Å; V102-Y301 HydrophobicContact CG2-CE2 4.22Å; V102-Y301 HydrophobicContact CG2-CG 3.83Å; Y267-Y301 WeakPolarHBondContact CA-O 3.43Å; L268-Y301 PolarHBondContact N-O 3.1Å; L268-Y301 WeakPolarHBondContact O-CD2 3.29Å; L268-Y301 PolarHBondContact O-N 2.82Å; K299-Y301 HydrophobicContact CB-CE1 4.35Å; K299-Y301 HydrophobicContact CB-CE2 3.98Å; K299-Y301 HydrophobicContact CD-CE1 3.88Å; K299-Y301 WeakPolarHBondContact CD-OH 3.49Å; Y301-W317 HydrophobicContact CD2-CZ3 4.48Å
302	K	98.8	Very high	97.8	Very high	70 Å²	70	42 Å²	42	30%	0.304	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	115.5	177.8	-177.6	177.8	-177	175.6	0	111	F96 D97 S99 I265 Y267	F96-K302 HydrophobicContact CB-CB 3.6Å; F96-K302 HydrophobicContact CB-CD 4.27Å; F96-K302 HydrophobicContact CD2-CB 4.48Å; F96-K302 HydrophobicContact CD2-CD 3.95Å; F96-K302 HydrophobicContact CG-CB 4.08Å; F96-K302 HydrophobicContact CG-CD 4.36Å; D97-K302 PolarHBondContact O-N 3.34Å; S99-K302 WeakPolarHBondContact CB-O 3.49Å; S99-K302 PolarHBondContact N-O 3.18Å; S99-K302 PolarHBondContact OG-O 3.38Å; I265-K302 HydrophobicContact CG2-CD 4.48Å; I265-K302 HydrophobicContact CG2-CG 3.81Å; Y267-K302 HydrophobicContact CD1-CB 4.47Å; Y267-K302 HydrophobicContact CD1-CG 4.48Å; Y267-K302 HydrophobicContact CE1-CB 4.5Å; Y267-K302 HydrophobicContact CE1-CD 4.25Å; Y267-K302 HydrophobicContact CE1-CG 4.11Å
303	C	98.7	Very high	97.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.2	178	-172.8	0	0	0	0	110.9	S99 I265 F266 L268	S99-C303 WeakPolarHBondContact OG-CA 3.24Å; I265-C303 CarbonylContact C-O 3.59Å; I265-C303 WeakPolarHBondContact CA-O 3.43Å; F266-C303 HydrophobicContact CB-CB 4.34Å; F266-C303 PolarHBondContact N-O 3.38Å; F266-C303 PolarHBondContact O-N 3.31Å; L268-C303 HydrophobicContact CD1-CB 3.58Å
304	S	98.6	Very high	98	Very high	38 Å²	38	41.7 Å²	41.7	27%	0.266	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121.4	172.8	167.9	0	0	0	0	109.3	E263 K306	E263-S304 VanDerWaalsContact CD-OG 3.24Å; E263-S304 PolarHBondContact OE1-OG 2.81Å; S304-K306 WeakPolarHBondContact OG-CE 3.49Å
305	V	98.8	Very high	98.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	109.4	177	-171.7	0	0	0	0	107.9	L126 V259 E263 K264 F266 Q309 L311	L126-V305 HydrophobicContact CD1-CG1 4.26Å; L126-V305 HydrophobicContact CD1-CG2 4.22Å; V259-V305 HydrophobicContact CG2-CB 4.28Å; V259-V305 HydrophobicContact CG2-CG1 3.79Å; E263-V305 WeakPolarHBondContact CA-O 3.44Å; K264-V305 PolarHBondContact N-O 3.02Å; K264-V305 PolarHBondContact O-N 3.27Å; F266-V305 HydrophobicContact CD2-CB 4.48Å; F266-V305 HydrophobicContact CD2-CG2 3.68Å; F266-V305 HydrophobicContact CE2-CB 4.3Å; F266-V305 HydrophobicContact CE2-CG2 3.8Å; V305-Q309 HydrophobicContact CG1-CB 4.14Å; V305-L311 HydrophobicContact CG1-CB 4.33Å; V305-L311 HydrophobicContact CG2-CB 3.85Å; V305-L311 HydrophobicContact CG2-CD2 3.85Å; V305-L311 HydrophobicContact CG2-CG 4.35Å
306	K	98.7	Very high	98.2	Very high	107 Å²	107	36.5 Å²	36.5	47%	0.465	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	162.9	-173.7	-63.2	-179.9	179.7	179.1	0	111.5	E263 S304 G308 Q309	E263-K306 HydrophobicContact CG-CG 3.95Å; E263-K306 WeakPolarHBondContact OE2-CE 3.29Å; S304-K306 WeakPolarHBondContact OG-CE 3.49Å; K306-G308 PolarHBondContact O-N 2.83Å; K306-Q309 HydrophobicContact CB-CG 4.49Å; K306-Q309 VanDerWaalsContact O-CB 3.23Å; K306-Q309 WeakPolarHBondContact O-CB 3.44Å; K306-Q309 WeakPolarHBondContact O-CG 3.42Å; K306-Q309 PolarHBondContact O-N 2.83Å
307	Q	98.6	Very high	98.4	Very high	103 Å²	103	33.4 Å²	33.4	48%	0.481	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.9	126.4	173.6	176.7	162.7	-10.1	0	0	113.3	V259 L260 G262	V259-Q307 CarbonylContact O-C 3.58Å; V259-Q307 WeakPolarHBondContact O-CA 3.11Å; L260-Q307 WeakPolarHBondContact O-CG 3.18Å; L260-Q307 PolarHBondContact O-NE2 2.71Å; G262-Q307 WeakPolarHBondContact O-CB 3.27Å; G262-Q307 PolarHBondContact O-N 3.1Å
308	G	98.4	Very high	98.5	Very high	29 Å²	29	32.5 Å²	32.5	30%	0.299	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-6.5	-178.5	0	0	0	0	0	115.5	H258 V259 K306	H258-G308 PolarHBondContact CE1-O 2.62Å; V259-G308 PolarHBondContact O-N 3.35Å; K306-G308 PolarHBondContact O-N 2.83Å
309	Q	98.8	Very high	98.6	Very high	35 Å²	35	24.2 Å²	24.2	16%	0.164	12%	0.122	C	C	.	.			trans	-92.6	153.2	177.6	-55.7	-176.4	-35	0	0	111.7	L126 H258 V259 V305 K306	L126-Q309 HydrophobicContact CD1-CB 4.21Å; H258-Q309 PolarHBondContact ND1-O 2.86Å; V259-Q309 PolarHBondContact N-O 3.17Å; V305-Q309 HydrophobicContact CG1-CB 4.14Å; K306-Q309 HydrophobicContact CB-CG 4.49Å; K306-Q309 VanDerWaalsContact O-CB 3.23Å; K306-Q309 WeakPolarHBondContact O-CB 3.44Å; K306-Q309 WeakPolarHBondContact O-CG 3.42Å; K306-Q309 PolarHBondContact O-N 2.83Å
310	T	98.9	Very high	98.7	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	120.4	177.1	-39.2	0	0	0	0	109.8	V127 L133 M135 Y257 H258 F312	V127-T310 PolarHBondContact N-O 3.35Å; V127-T310 PolarHBondContact O-N 2.88Å; L133-T310 HydrophobicContact CD1-CG2 4.24Å; M135-T310 HydrophobicContact CE-CG2 3.99Å; M135-T310 WeakPolarHBondContact CE-OG1 3.18Å; Y257-T310 CarbonylContact O-C 3.54Å; Y257-T310 VanDerWaalsContact O-CA 3.31Å; Y257-T310 WeakPolarHBondContact O-CA 3.47Å; H258-T310 HydrophobicContact CB-CG2 4.28Å; H258-T310 PolarHBondContact ND1-OG1 3.27Å; T310-F312 HydrophobicContact CG2-CD2 4.36Å; T310-F312 HydrophobicContact CG2-CE2 3.69Å; T310-F312 HydrophobicContact CG2-CZ 3.83Å
311	L	98.9	Very high	98.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	139.9	168.8	-179.2	65.6	0	0	0	109	P124 I125 L126 Y257 F266 V305 I313	P124-L311 HydrophobicContact CB-CD1 4.15Å; I125-L311 CarbonylContact O-C 3.59Å; I125-L311 WeakPolarHBondContact O-CA 3.36Å; L126-L311 HydrophobicContact CB-CD1 4.38Å; L126-L311 HydrophobicContact CD1-CB 4.34Å; L126-L311 HydrophobicContact CD1-CD1 4.5Å; Y257-L311 PolarHBondContact N-O 2.86Å; Y257-L311 PolarHBondContact O-N 2.83Å; F266-L311 HydrophobicContact CB-CD2 4.42Å; F266-L311 HydrophobicContact CD1-CD2 4.02Å; F266-L311 HydrophobicContact CD2-CD2 3.76Å; F266-L311 HydrophobicContact CE1-CD2 4.21Å; F266-L311 HydrophobicContact CE2-CD2 3.95Å; F266-L311 HydrophobicContact CG-CD2 3.81Å; F266-L311 HydrophobicContact CZ-CD2 4.18Å; V305-L311 HydrophobicContact CG1-CB 4.33Å; V305-L311 HydrophobicContact CG2-CB 3.85Å; V305-L311 HydrophobicContact CG2-CD2 3.85Å; V305-L311 HydrophobicContact CG2-CG 4.35Å; L311-I313 HydrophobicContact CD2-CD1 3.94Å; L311-I313 HydrophobicContact CD2-CG1 3.79Å; L311-I313 HydrophobicContact CG-CG1 3.95Å
312	F	98.9	Very high	98.7	Very high	3 Å²	3	20.1 Å²	20.1	1%	0.013	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.4	164.7	-59.7	-97.1	0	0	0	108.4	L111 F121 P124 I125 V127 L133 P207 I209 V210 V255 W256 T310	L111-F312 HydrophobicContact CD2-CD2 3.79Å; L111-F312 HydrophobicContact CD2-CE1 4.43Å; L111-F312 HydrophobicContact CD2-CE2 3.47Å; L111-F312 VanDerWaalsContact CD2-CE2 3.47Å; L111-F312 HydrophobicContact CD2-CG 4.41Å; L111-F312 HydrophobicContact CD2-CZ 3.83Å; F121-F312 HydrophobicContact CE2-CB 4.25Å; F121-F312 HydrophobicContact CZ-CB 3.9Å; P124-F312 CarbonylContact C-O 3.55Å; P124-F312 VanDerWaalsContact CA-O 3.28Å; P124-F312 WeakPolarHBondContact CA-O 3.27Å; I125-F312 HydrophobicContact CB-CB 4.29Å; I125-F312 PolarHBondContact N-O 3.38Å; I125-F312 PolarHBondContact O-N 3.06Å; V127-F312 HydrophobicContact CG2-CD2 4.24Å; V127-F312 HydrophobicContact CG2-CE2 3.9Å; L133-F312 HydrophobicContact CD1-CE2 4.03Å; L133-F312 HydrophobicContact CD1-CZ 4.09Å; L133-F312 HydrophobicContact CD2-CE2 4.18Å; L133-F312 HydrophobicContact CD2-CZ 4.1Å; P207-F312 HydrophobicContact CB-CE1 4.01Å; P207-F312 HydrophobicContact CB-CZ 3.96Å; P207-F312 HydrophobicContact CG-CE1 3.98Å; P207-F312 HydrophobicContact CG-CZ 4.02Å; I209-F312 HydrophobicContact CG2-CE1 3.94Å; I209-F312 HydrophobicContact CG2-CZ 4.23Å; V210-F312 HydrophobicContact CG2-CE1 4.04Å; V255-F312 CarbonylContact O-C 3.45Å; V255-F312 VanDerWaalsContact O-CA 3.25Å; V255-F312 WeakPolarHBondContact O-CA 3.48Å; W256-F312 HydrophobicContact CB-CD1 3.64Å; W256-F312 HydrophobicContact CB-CE1 3.57Å; T310-F312 HydrophobicContact CG2-CD2 4.36Å; T310-F312 HydrophobicContact CG2-CE2 3.69Å; T310-F312 HydrophobicContact CG2-CZ 3.83Å
313	I	98.8	Very high	98.7	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.5	178.5	-55.6	178.7	0	0	0	107.2	S254 V255 F266 L268 L311 W317	S254-I313 CarbonylContact C-O 3.54Å; S254-I313 VanDerWaalsContact CA-O 3.31Å; S254-I313 WeakPolarHBondContact CA-O 3.41Å; V255-I313 HydrophobicContact CB-CB 4.35Å; V255-I313 PolarHBondContact N-O 2.92Å; V255-I313 PolarHBondContact O-N 3.16Å; F266-I313 HydrophobicContact CD1-CD1 3.74Å; F266-I313 HydrophobicContact CE1-CD1 3.72Å; L268-I313 HydrophobicContact CD2-CD1 4.19Å; L268-I313 HydrophobicContact CD2-CG1 4.5Å; L311-I313 HydrophobicContact CD2-CD1 3.94Å; L311-I313 HydrophobicContact CD2-CG1 3.79Å; L311-I313 HydrophobicContact CG-CG1 3.95Å; I313-W317 HydrophobicContact CG2-CB 3.72Å
314	P	98.5	Very high	98.7	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.019	9%	0.094	C	C	.	.			trans	-84.4	158.5	178.7	27.5	-28.7	0	0	0	113.5	F121 G316 W317	F121-P314 HydrophobicContact CD1-CB 4.01Å; F121-P314 HydrophobicContact CD2-CB 3.73Å; F121-P314 HydrophobicContact CD2-CG 4.07Å; F121-P314 HydrophobicContact CE1-CB 3.92Å; F121-P314 HydrophobicContact CE2-CB 3.63Å; F121-P314 HydrophobicContact CE2-CG 3.87Å; F121-P314 HydrophobicContact CG-CB 3.89Å; F121-P314 HydrophobicContact CZ-CB 3.71Å; F121-P314 HydrophobicContact CZ-CG 4.32Å; F121-P314 WeakPolarHBondContact O-CB 3.4Å; F121-P314 VanDerWaalsContact O-CG 3.28Å; F121-P314 WeakPolarHBondContact O-CG 3.18Å; P314-G316 PolarHBondContact O-N 3Å; P314-W317 HydrophobicContact CG-CG 4.43Å; P314-W317 VanDerWaalsContact O-CD1 3.28Å; P314-W317 PolarHBondContact O-N 2.94Å
315	T	98.3	Very high	98.7	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.012	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-19.9	118.1	172.1	-52.1	0	0	0	0	115.6	G252 S254 W317 H336 N339 M342 Q343	G252-T315 WeakPolarHBondContact O-CA 3.31Å; G252-T315 VanDerWaalsContact O-CG2 3.28Å; G252-T315 WeakPolarHBondContact O-CG2 3.4Å; S254-T315 PolarHBondContact OG-N 3.27Å; S254-T315 PolarHBondContact OG-OG1 3.4Å; T315-W317 VanDerWaalsContact C-N 3.3Å; T315-W317 PolarHBondContact O-N 3Å; T315-H336 PolarHBondContact OG1-CE1 3.49Å; T315-N339 HydrophobicContact CG2-CB 4.33Å; T315-M342 HydrophobicContact CG2-CB 3.54Å; T315-M342 HydrophobicContact CG2-CG 3.7Å; T315-Q343 HydrophobicContact CG2-CB 4.36Å; T315-Q343 HydrophobicContact CG2-CG 3.51Å
316	G	97.9	Very high	98.7	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.021	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-4.5	168.8	0	0	0	0	0	116.1	P271 P314 I318	P271-G316 WeakPolarHBondContact CB-O 3.49Å; P314-G316 PolarHBondContact O-N 3Å; G316-I318 PolarHBondContact O-N 3.41Å; G316-I318 VanDerWaalsContact O-N 3.08Å
317	W	98.7	Very high	98.7	Very high	8 Å²	8	16.3 Å²	16.3	3%	0.03	9%	0.092	C	C	.	.			trans	-64.1	111.8	-179.3	-87.4	69.6	0	0	0	112	S122 V123 P124 L268 R270 P271 Y301 I313 P314 T315 H319	S122-W317 PolarHBondContact O-NE1 3.21Å; V123-W317 HydrophobicContact CB-CZ2 4.46Å; V123-W317 HydrophobicContact CG1-CZ2 4.14Å; P124-W317 HydrophobicContact CG-CD2 3.99Å; P124-W317 HydrophobicContact CG-CE3 3.85Å; P124-W317 HydrophobicContact CG-CH2 4.25Å; P124-W317 HydrophobicContact CG-CZ2 4.39Å; P124-W317 HydrophobicContact CG-CZ3 3.98Å; L268-W317 HydrophobicContact CB-CE3 4.11Å; L268-W317 HydrophobicContact CB-CZ3 4.14Å; R270-W317 HydrophobicContact CB-CH2 3.77Å; R270-W317 HydrophobicContact CB-CZ2 3.92Å; R270-W317 HydrophobicContact CB-CZ3 4.14Å; R270-W317 HydrophobicContact CG-CH2 4.17Å; R270-W317 HydrophobicContact CG-CZ2 3.84Å; P271-W317 HydrophobicContact CG-CG 4.23Å; Y301-W317 HydrophobicContact CD2-CZ3 4.48Å; I313-W317 HydrophobicContact CG2-CB 3.72Å; P314-W317 HydrophobicContact CG-CG 4.43Å; P314-W317 VanDerWaalsContact O-CD1 3.28Å; P314-W317 PolarHBondContact O-N 2.94Å; T315-W317 VanDerWaalsContact C-N 3.3Å; T315-W317 PolarHBondContact O-N 3Å; W317-H319 PolarHBondContact O-N 3.42Å; W317-H319 PolarHBondContact O-ND1 3.21Å
318	I	98.8	Very high	98.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	126	177.5	-57.4	150.5	0	0	0	108.2	F246 H247 I248 I269 N275 L276 F279 F293 G316	F246-I318 HydrophobicContact CB-CG2 4.18Å; F246-I318 HydrophobicContact CD1-CG2 4.18Å; H247-I318 CarbonylContact O-C 3.6Å; H247-I318 WeakPolarHBondContact O-CA 3.22Å; I248-I318 HydrophobicContact CD1-CG1 3.75Å; I248-I318 HydrophobicContact CG1-CB 4.32Å; I248-I318 HydrophobicContact CG1-CG1 3.57Å; I269-I318 HydrophobicContact CB-CB 4.13Å; I269-I318 WeakPolarHBondContact CB-O 3.29Å; I269-I318 HydrophobicContact CG2-CB 4.44Å; I269-I318 HydrophobicContact CG2-CD1 4.29Å; I269-I318 PolarHBondContact N-O 3.08Å; I269-I318 PolarHBondContact O-N 2.99Å; N275-I318 HydrophobicContact CB-CD1 4.18Å; L276-I318 HydrophobicContact CD2-CD1 4.24Å; F279-I318 HydrophobicContact CB-CD1 3.75Å; F279-I318 HydrophobicContact CB-CG1 4.27Å; F279-I318 HydrophobicContact CD2-CG1 4.27Å; F279-I318 HydrophobicContact CD2-CG2 3.7Å; F279-I318 HydrophobicContact CE2-CG2 4.09Å; F279-I318 HydrophobicContact CG-CD1 4.16Å; F279-I318 HydrophobicContact CG-CG1 4.12Å; F279-I318 HydrophobicContact CG-CG2 4.37Å; F293-I318 HydrophobicContact CD1-CG2 4.09Å; F293-I318 HydrophobicContact CE1-CD1 4.29Å; F293-I318 HydrophobicContact CE1-CG2 3.83Å; G316-I318 PolarHBondContact O-N 3.41Å; G316-I318 VanDerWaalsContact O-N 3.08Å
319	H	98.9	Very high	98.7	Very high	10 Å²	10	10.1 Å²	10.1	5%	0.046	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	150.1	-177.6	78.1	-79.3	0	0	0	114.8	F246 H247 D249 F266 Y267 L268 W317	F246-H319 VanDerWaalsContact CA-O 3.32Å; F246-H319 WeakPolarHBondContact CA-O 3.49Å; H247-H319 AromaticContact CE1-CE1 3.66Å; H247-H319 AromaticContact CE1-NE2 3.51Å; H247-H319 PolarHBondContact N-O 3.36Å; H247-H319 PolarHBondContact ND1-O 3.34Å; H247-H319 VanDerWaalsContact ND1-O 3.13Å; H247-H319 AromaticContact NE2-CE1 3.42Å; H247-H319 PolarHBondContact NE2-CE1 3.08Å; H247-H319 AromaticContact NE2-NE2 3.59Å; H247-H319 PolarHBondContact O-N 3.38Å; D249-H319 IonicContact OD2-CE1 3Å; D249-H319 PolarHBondContact OD2-CE1 3.03Å; D249-H319 IonicContact OD2-ND1 3.42Å; F266-H319 AromaticContact CD1-CD2 3.68Å; Y267-H319 WeakPolarHBondContact O-CA 3.41Å; L268-H319 HydrophobicContact CD2-CB 3.89Å; W317-H319 PolarHBondContact O-N 3.42Å; W317-H319 PolarHBondContact O-ND1 3.21Å
320	A	98.8	Very high	98.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	157.3	169.6	0	0	0	0	0	110.5	Y243 F246 F266 Y267	Y243-A320 HydrophobicContact CE2-CB 4.15Å; Y243-A320 WeakPolarHBondContact OH-CB 3.3Å; F246-A320 HydrophobicContact CB-CB 4.44Å; F246-A320 HydrophobicContact CD1-CB 3.68Å; F246-A320 HydrophobicContact CD2-CB 3.79Å; F246-A320 HydrophobicContact CE1-CB 3.75Å; F246-A320 HydrophobicContact CE2-CB 3.88Å; F246-A320 HydrophobicContact CG-CB 3.71Å; F246-A320 HydrophobicContact CZ-CB 3.86Å; F266-A320 CarbonylContact C-O 3.56Å; F266-A320 WeakPolarHBondContact CA-O 3.43Å; Y267-A320 HydrophobicContact CD2-CB 4.38Å; Y267-A320 PolarHBondContact N-O 3.32Å; Y267-A320 PolarHBondContact O-N 2.81Å
321	V	98.8	Very high	98.7	Very high	11 Å²	11	8.6 Å²	8.6	7%	0.067	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	118.5	-172.9	-170	0	0	0	0	112	Y243 T244 K264 I265 F266	Y243-V321 VanDerWaalsContact CA-O 3.3Å; Y243-V321 WeakPolarHBondContact CA-O 3.32Å; Y243-V321 WeakPolarHBondContact CD2-O 3.32Å; T244-V321 PolarHBondContact N-O 2.91Å; T244-V321 PolarHBondContact O-N 2.92Å; K264-V321 HydrophobicContact CD-CG1 3.79Å; I265-V321 WeakPolarHBondContact O-CA 3.4Å; F266-V321 HydrophobicContact CD1-CG2 3.68Å; F266-V321 HydrophobicContact CE1-CG1 4.39Å; F266-V321 HydrophobicContact CE1-CG2 3.63Å; F266-V321 HydrophobicContact CG-CG2 4.43Å; F266-V321 HydrophobicContact CZ-CG1 4.35Å; F266-V321 HydrophobicContact CZ-CG2 4.36Å
322	L	98.9	Very high	98.7	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	140.7	168.1	173.8	65.3	0	0	0	110.8	I88 L91 R92 Y243 I265 Y267 P324	I88-L322 HydrophobicContact CD1-CD1 4.11Å; I88-L322 HydrophobicContact CG2-CD1 3.92Å; L91-L322 HydrophobicContact CD2-CB 4.36Å; L91-L322 HydrophobicContact CD2-CD2 4.3Å; L91-L322 HydrophobicContact CG-CD2 4.46Å; R92-L322 HydrophobicContact CG-CD2 3.9Å; Y243-L322 HydrophobicContact CD2-CB 4.22Å; I265-L322 HydrophobicContact CB-CB 4.36Å; I265-L322 PolarHBondContact N-O 3.44Å; I265-L322 PolarHBondContact O-N 3.21Å; Y267-L322 HydrophobicContact CE2-CB 3.8Å; L322-P324 WeakPolarHBondContact O-CD 3.35Å
323	T	98.8	Very high	98.7	Very high	1 Å²	1	9 Å²	9	1%	0.006	5%	0.052	C	C	.	.			trans	-104.8	91.3	175.4	-40.2	0	0	0	0	109.6	S238 D241 S242 K264 V325 C327	S238-T323 VanDerWaalsContact CB-CG2 3.46Å; D241-T323 PolarHBondContact N-O 3.5Å; S242-T323 VanDerWaalsContact O-CB 3.29Å; S242-T323 WeakPolarHBondContact O-CB 3.46Å; S242-T323 PolarHBondContact O-N 3.26Å; S242-T323 PolarHBondContact O-OG1 3.04Å; K264-T323 HydrophobicContact CD-CG2 4.03Å; K264-T323 PolarHBondContact NZ-OG1 3.5Å; T323-V325 VanDerWaalsContact C-N 3.26Å; T323-V325 WeakPolarHBondContact CG2-O 3.36Å; T323-V325 PolarHBondContact O-N 3.38Å; T323-C327 HydrophobicContact CG2-CB 3.51Å
324	P	98.4	Very high	98.7	Very high	12 Å²	12	9 Å²	9	8%	0.078	5%	0.052	C	C	.	.	S	Bend	trans	-64.2	-24.7	-173.2	24.1	-37.6	0	0	0	115.2	R92 E263 I265 L322	R92-P324 PolarHBondContact NH2-O 2.97Å; E263-P324 HydrophobicContact CB-CG 3.88Å; E263-P324 HydrophobicContact CG-CG 3.77Å; E263-P324 VanDerWaalsContact O-CD 3.27Å; E263-P324 WeakPolarHBondContact O-CD 3.38Å; I265-P324 HydrophobicContact CD1-CB 4.01Å; I265-P324 HydrophobicContact CD1-CG 3.89Å; I265-P324 HydrophobicContact CG1-CG 3.98Å; L322-P324 WeakPolarHBondContact O-CD 3.35Å
325	V	98.6	Very high	98.7	Very high	64 Å²	64	9 Å²	9	39%	0.388	5%	0.052	S	C	.	.	S	Bend	trans	-142.4	170.1	178.8	-65.6	0	0	0	0	109.4	E263 T323 C327	E263-V325 HydrophobicContact CB-CG2 4.15Å; T323-V325 VanDerWaalsContact C-N 3.26Å; T323-V325 WeakPolarHBondContact CG2-O 3.36Å; T323-V325 PolarHBondContact O-N 3.38Å; V325-C327 PolarHBondContact O-N 3.08Å
326	D	98.7	Very high	98.7	Very high	56 Å²	56	9 Å²	9	30%	0.299	5%	0.051	S	C	.	.			trans	-56.9	133	171.2	-72.4	2.8	0	0	0	110.6	R184 V239 R240	R184-D326 IonicContact CZ-OD1 3.85Å; R184-D326 IonicContact CZ-OD2 2.97Å; R184-D326 VanDerWaalsContact NH1-CG 3.29Å; R184-D326 IonicContact NH1-OD1 2.73Å; R184-D326 PolarHBondContact NH1-OD1 3.07Å; R184-D326 IonicContact NH1-OD2 2.68Å; R184-D326 PolarHBondContact NH1-OD2 3.47Å; R184-D326 IonicContact NH2-OD1 3.83Å; R184-D326 IonicContact NH2-OD2 2.81Å; R184-D326 PolarHBondContact NH2-OD2 2.86Å; V239-D326 WeakPolarHBondContact CA-OD1 3.5Å; R240-D326 WeakPolarHBondContact CB-OD1 3.24Å; R240-D326 PolarHBondContact N-OD1 2.82Å
327	C	98.9	Very high	98.7	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.007	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	136.5	-165.7	-177.2	0	0	0	0	112.1	S238 K261 T323 V325	S238-C327 PolarHBondContact N-O 3.34Å; S238-C327 PolarHBondContact O-N 2.99Å; K261-C327 WeakPolarHBondContact O-CA 3.46Å; K261-C327 PolarHBondContact O-SG 3.01Å; K261-C327 VanDerWaalsContact O-SG 3.4Å; T323-C327 HydrophobicContact CG2-CB 3.51Å; V325-C327 PolarHBondContact O-N 3.08Å
328	L	98.9	Very high	98.7	Very high	3 Å²	3	10.3 Å²	10.3	2%	0.016	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.8	166.9	174.4	64	0	0	0	107.9	F142 V147 M237 L260 K261	F142-L328 HydrophobicContact CD1-CD2 4.17Å; V147-L328 HydrophobicContact CG2-CD1 4.22Å; M237-L328 HydrophobicContact CG-CD1 3.78Å; L260-L328 HydrophobicContact CD2-CD2 4.39Å; L260-L328 PolarHBondContact N-O 2.95Å; K261-L328 HydrophobicContact CB-CB 4.33Å; K261-L328 PolarHBondContact N-O 2.97Å; K261-L328 PolarHBondContact O-N 3.45Å
329	A	98.9	Very high	98.6	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	158.2	-177.9	0	0	0	0	0	111.5	L236 Y257 H258 V259	L236-A329 HydrophobicContact CB-CB 4.39Å; L236-A329 PolarHBondContact N-O 3.26Å; L236-A329 PolarHBondContact O-N 2.99Å; Y257-A329 HydrophobicContact CD1-CB 4.35Å; Y257-A329 HydrophobicContact CE1-CB 3.49Å; Y257-A329 VanDerWaalsContact CE1-CB 3.49Å; H258-A329 CarbonylContact O-C 3.53Å; H258-A329 VanDerWaalsContact O-CA 3.26Å; H258-A329 WeakPolarHBondContact O-CA 3.48Å; H258-A329 WeakPolarHBondContact O-CB 3.4Å; V259-A329 HydrophobicContact CG2-CB 4.46Å
330	F	98.9	Very high	98.6	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142.9	173.7	-73.1	-86.3	0	0	0	108.9	L137 P138 F142 F195 L200 V204 Y234 C235 W256 H258 L260	L137-F330 HydrophobicContact CD2-CB 3.89Å; L137-F330 HydrophobicContact CD2-CD2 4.12Å; L137-F330 HydrophobicContact CD2-CG 3.96Å; P138-F330 HydrophobicContact CG-CE2 4.01Å; P138-F330 HydrophobicContact CG-CZ 4.08Å; F142-F330 HydrophobicContact CE1-CZ 4.22Å; F195-F330 AromaticContact CE1-CD1 3.65Å; F195-F330 HydrophobicContact CE1-CD1 3.65Å; F195-F330 AromaticContact CE1-CE1 3.76Å; F195-F330 HydrophobicContact CE1-CE1 3.76Å; F195-F330 AromaticContact CZ-CD1 3.61Å; F195-F330 HydrophobicContact CZ-CD1 3.61Å; F195-F330 AromaticContact CZ-CE1 3.66Å; F195-F330 HydrophobicContact CZ-CE1 3.66Å; L200-F330 HydrophobicContact CD2-CE1 4.2Å; V204-F330 HydrophobicContact CG2-CD1 3.89Å; V204-F330 HydrophobicContact CG2-CE1 3.79Å; V204-F330 HydrophobicContact CG2-CZ 4.37Å; Y234-F330 WeakPolarHBondContact O-CA 3.38Å; C235-F330 HydrophobicContact CB-CD1 4.39Å; C235-F330 HydrophobicContact CB-CE1 4.04Å; W256-F330 HydrophobicContact CH2-CB 4.06Å; W256-F330 HydrophobicContact CZ3-CB 4.32Å; H258-F330 PolarHBondContact N-O 3.35Å; H258-F330 PolarHBondContact O-N 2.74Å; L260-F330 HydrophobicContact CB-CD2 4.31Å; L260-F330 HydrophobicContact CD2-CD2 4.23Å; L260-F330 HydrophobicContact CD2-CE2 3.73Å
331	G	98.6	Very high	98.6	Very high	2 Å²	2	16.5 Å²	16.5	2%	0.021	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	-174.1	177.7	0	0	0	0	0	112.9	Y234 W256	Y234-G331 PolarHBondContact N-O 2.91Å; Y234-G331 PolarHBondContact O-N 2.86Å; W256-G331 VanDerWaalsContact CE2-C 3.46Å; W256-G331 VanDerWaalsContact CZ2-C 3.48Å; W256-G331 WeakPolarHBondContact CZ2-O 3.26Å; W256-G331 CarbonylContact O-C 3.59Å; W256-G331 WeakPolarHBondContact O-CA 3.36Å
332	G	98.4	Very high	98.5	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.01	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179	157.6	179.1	0	0	0	0	0	113.2	V255 W256	V255-G332 WeakPolarHBondContact CA-O 3.07Å; W256-G332 PolarHBondContact N-O 3.4Å; W256-G332 VanDerWaalsContact NE1-CA 3.35Å; W256-G332 PolarHBondContact O-N 3.05Å
333	N	98.8	Very high	98.5	Very high	10 Å²	10	16.9 Å²	16.9	5%	0.053	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.7	-172.3	-67.5	62.7	0	0	0	109.7	V231 D249 F250 T253 S254 V255	V231-N333 HydrophobicContact CB-CB 4.44Å; V231-N333 HydrophobicContact CG2-CB 4.33Å; V231-N333 PolarHBondContact O-N 3.14Å; D249-N333 PolarHBondContact OD1-ND2 3Å; F250-N333 HydrophobicContact CE1-CB 4.49Å; F250-N333 HydrophobicContact CE2-CB 3.89Å; F250-N333 HydrophobicContact CZ-CB 3.63Å; F250-N333 VanDerWaalsContact CZ-CG 3.47Å; T253-N333 HydrophobicContact CG2-CB 4.11Å; T253-N333 PolarHBondContact OG1-ND2 3.21Å; S254-N333 CarbonylContact O-C 3.5Å; S254-N333 WeakPolarHBondContact O-CA 3.5Å; V255-N333 WeakPolarHBondContact CG2-ND2 3.43Å
334	F	98.8	Very high	98.5	Very high	4 Å²	4	17.6 Å²	17.6	2%	0.018	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	139.7	179.3	65.1	-70.8	0	0	0	112.3	F121 V210 L213 S254 H336	F121-F334 HydrophobicContact CE1-CZ 4.17Å; V210-F334 HydrophobicContact CG1-CB 4.02Å; V210-F334 HydrophobicContact CG1-CD1 3.77Å; V210-F334 HydrophobicContact CG1-CD2 4.16Å; V210-F334 HydrophobicContact CG1-CE1 4.24Å; V210-F334 HydrophobicContact CG1-CG 3.74Å; V210-F334 HydrophobicContact CG2-CD1 4.2Å; V210-F334 HydrophobicContact CG2-CE1 3.82Å; V210-F334 HydrophobicContact CG2-CE2 4.48Å; V210-F334 HydrophobicContact CG2-CZ 3.98Å; L213-F334 HydrophobicContact CB-CD2 4.32Å; L213-F334 HydrophobicContact CB-CE2 4.11Å; L213-F334 HydrophobicContact CD1-CE2 4.39Å; S254-F334 PolarHBondContact N-O 3.25Å; S254-F334 WeakPolarHBondContact O-CD1 3.5Å; S254-F334 WeakPolarHBondContact O-CE1 3.47Å; S254-F334 PolarHBondContact O-N 3.11Å; F334-H336 AromaticContact CE2-CD2 3.76Å
335	L	98.8	Very high	98.5	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.01	11%	0.107	C	C	.	.			trans	-93.4	146.5	170.3	-61.4	172	0	0	0	109.4	S214 W215 G251 T253 Q343 F361 F364 I367	S214-L335 CarbonylContact C-O 3.54Å; S214-L335 WeakPolarHBondContact CA-O 3.46Å; W215-L335 HydrophobicContact CB-CB 4.26Å; W215-L335 HydrophobicContact CD2-CB 3.61Å; W215-L335 HydrophobicContact CE3-CB 3.33Å; W215-L335 HydrophobicContact CE3-CD1 3.65Å; W215-L335 HydrophobicContact CE3-CG 4.1Å; W215-L335 HydrophobicContact CG-CB 4.03Å; W215-L335 HydrophobicContact CZ3-CB 3.99Å; W215-L335 HydrophobicContact CZ3-CD1 3.96Å; W215-L335 HydrophobicContact CZ3-CG 4.49Å; W215-L335 PolarHBondContact N-O 3.12Å; G251-L335 WeakPolarHBondContact O-CD2 3.22Å; T253-L335 HydrophobicContact CG2-CD2 3.45Å; T253-L335 VanDerWaalsContact CG2-CD2 3.45Å; T253-L335 HydrophobicContact CG2-CG 3.73Å; L335-Q343 HydrophobicContact CD2-CB 4.39Å; L335-Q343 HydrophobicContact CD2-CG 3.97Å; L335-F361 HydrophobicContact CD1-CD1 3.95Å; L335-F361 HydrophobicContact CD1-CD2 3.96Å; L335-F361 HydrophobicContact CD1-CE1 3.71Å; L335-F361 HydrophobicContact CD1-CE2 3.71Å; L335-F361 HydrophobicContact CD1-CG 4.08Å; L335-F361 HydrophobicContact CD1-CZ 3.59Å; L335-F361 HydrophobicContact CD2-CD2 4.49Å; L335-F361 HydrophobicContact CG-CD2 4.1Å; L335-F361 HydrophobicContact CG-CE2 3.76Å; L335-F361 HydrophobicContact CG-CZ 4.06Å; L335-F364 HydrophobicContact CD1-CD2 3.83Å; L335-F364 HydrophobicContact CD1-CE2 3.87Å; L335-F364 HydrophobicContact CD2-CE2 3.96Å; L335-I367 HydrophobicContact CD1-CG2 3.95Å
336	H	98.7	Very high	98.4	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	9%	0.089	C	C	.	.			trans	-152.6	160.1	-175.7	63	20.8	0	0	0	114	F121 L213 S254 T315 F334 L338 Q343	F121-H336 AromaticContact CD1-CD2 3.98Å; F121-H336 AromaticContact CD1-NE2 3.34Å; F121-H336 VanDerWaalsContact CD1-NE2 3.34Å; F121-H336 WeakPolarHBondContact CD1-NE2 3.19Å; F121-H336 AromaticContact CE1-NE2 3.8Å; L213-H336 HydrophobicContact CB-CB 3.93Å; L213-H336 WeakPolarHBondContact O-CB 3.4Å; S254-H336 PolarHBondContact OG-CE1 2.86Å; S254-H336 PolarHBondContact OG-NE2 3.18Å; T315-H336 PolarHBondContact OG1-CE1 3.49Å; F334-H336 AromaticContact CE2-CD2 3.76Å; H336-L338 VanDerWaalsContact C-N 3.28Å; H336-L338 PolarHBondContact O-N 2.68Å; H336-Q343 PolarHBondContact ND1-OE1 3.23Å; H336-Q343 PolarHBondContact O-OE1 2.83Å
337	S	98.3	Very high	98.4	Very high	28 Å²	28	15.4 Å²	15.4	20%	0.196	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.2	-173.4	-54.9	0	0	0	0	115.6	W215 Y392	W215-S337 PolarHBondContact NE1-OG 3.22Å; S337-Y392 WeakPolarHBondContact O-CD2 3.45Å
338	L	97.9	Very high	98.3	Very high	10 Å²	10	18.9 Å²	18.9	5%	0.052	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-30.8	-176.8	-63.4	177.2	0	0	0	113.6	L116 E117 F121 L213 H336 Y392	L116-L338 HydrophobicContact CB-CD1 3.85Å; E117-L338 HydrophobicContact CG-CD2 4.07Å; F121-L338 HydrophobicContact CB-CD1 3.77Å; F121-L338 HydrophobicContact CD1-CD1 4.49Å; L213-L338 HydrophobicContact CD1-CD1 4.02Å; L213-L338 HydrophobicContact CD2-CD1 4.43Å; H336-L338 VanDerWaalsContact C-N 3.28Å; H336-L338 PolarHBondContact O-N 2.68Å; L338-Y392 HydrophobicContact CD2-CD2 4.21Å; L338-Y392 HydrophobicContact CD2-CE1 4.27Å; L338-Y392 HydrophobicContact CD2-CE2 3.86Å
339	N	97.4	Very high	98	Very high	53 Å²	53	19.2 Å²	19.2	28%	0.283	10%	0.096	S	C	.	.	S	Bend	trans	-145.6	54.3	-176.5	-164.8	0.1	0	0	0	112.8	T315 E341 M342 Q343	T315-N339 HydrophobicContact CG2-CB 4.33Å; N339-E341 PolarHBondContact O-N 2.91Å; N339-M342 WeakPolarHBondContact ND2-CB 3.13Å; N339-M342 PolarHBondContact O-N 3.34Å; N339-M342 VanDerWaalsContact O-N 3.15Å; N339-M342 VanDerWaalsContact OD1-CB 3.3Å; N339-M342 WeakPolarHBondContact OD1-CB 3.3Å; N339-M342 PolarHBondContact OD1-N 2.84Å; N339-Q343 PolarHBondContact O-N 2.98Å
340	I	98.6	Very high	97.7	Very high	1 Å²	1	20 Å²	20	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-56.7	-37.5	-176.9	-48.3	-169.5	0	0	0	112.1	W215 M342 Q343 L344 I375 L400	W215-I340 HydrophobicContact CH2-CG2 4.02Å; W215-I340 HydrophobicContact CZ2-CD1 4Å; W215-I340 HydrophobicContact CZ2-CG1 3.95Å; W215-I340 HydrophobicContact CZ2-CG2 4.19Å; I340-M342 VanDerWaalsContact C-N 3.32Å; I340-M342 PolarHBondContact O-N 2.91Å; I340-Q343 PolarHBondContact O-N 3.45Å; I340-L344 HydrophobicContact CG2-CD1 3.98Å; I340-L344 HydrophobicContact CG2-CG 4.4Å; I340-L344 WeakPolarHBondContact O-CG 3.43Å; I340-L344 PolarHBondContact O-N 3.4Å; I340-I375 HydrophobicContact CD1-CD1 3.58Å; I340-L400 HydrophobicContact CG2-CB 4.19Å; I340-L400 HydrophobicContact CG2-CD1 4.43Å
341	E	97.9	Very high	97.3	Very high	86 Å²	86	23.3 Å²	23.3	40%	0.402	11%	0.114	S	C	.	.	H	α-helix	trans	-61.6	-38	179.9	-167.8	-169.8	132.7	0	0	112.4	N339 K345 A399	N339-E341 PolarHBondContact O-N 2.91Å; E341-K345 HydrophobicContact CG-CD 4.47Å; E341-K345 VanDerWaalsContact O-CG 3.3Å; E341-K345 WeakPolarHBondContact O-CG 2.95Å; E341-K345 PolarHBondContact O-N 2.85Å; E341-K345 VanDerWaalsContact OE1-CE 3.29Å; E341-K345 WeakPolarHBondContact OE1-CE 3.31Å; E341-K345 IonicContact OE1-NZ 3.39Å; E341-K345 PolarHBondContact OE1-NZ 3.45Å; E341-A399 HydrophobicContact CB-CB 3.95Å; E341-A399 HydrophobicContact CG-CB 4.07Å
342	M	98.2	Very high	97	Very high	20 Å²	20	29.5 Å²	29.5	10%	0.099	14%	0.136	C	C	.	.	H	α-helix	trans	-77.9	-31.9	179.5	-171.6	66.6	76.3	0	0	112.6	P271 L276 T315 N339 I340 K345 A346	P271-M342 HydrophobicContact CB-CE 3.95Å; P271-M342 HydrophobicContact CB-SD 4.22Å; P271-M342 HydrophobicContact CG-CE 4.2Å; P271-M342 WeakPolarHBondContact O-CE 3.38Å; L276-M342 HydrophobicContact CD1-CE 4.01Å; L276-M342 HydrophobicContact CD1-SD 3.69Å; T315-M342 HydrophobicContact CG2-CB 3.54Å; T315-M342 HydrophobicContact CG2-CG 3.7Å; N339-M342 WeakPolarHBondContact ND2-CB 3.13Å; N339-M342 PolarHBondContact O-N 3.34Å; N339-M342 VanDerWaalsContact O-N 3.15Å; N339-M342 VanDerWaalsContact OD1-CB 3.3Å; N339-M342 WeakPolarHBondContact OD1-CB 3.3Å; N339-M342 PolarHBondContact OD1-N 2.84Å; I340-M342 VanDerWaalsContact C-N 3.32Å; I340-M342 PolarHBondContact O-N 2.91Å; M342-K345 PolarHBondContact O-N 3.25Å; M342-K345 HydrophobicContact SD-CB 4.31Å; M342-K345 HydrophobicContact SD-CD 4.2Å; M342-A346 PolarHBondContact O-N 2.81Å
343	Q	98.7	Very high	96.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-48.1	170.1	-67.6	174	-169.3	0	0	110.6	W215 T315 L335 H336 N339 I340 K345 A346 Y347 F364	W215-Q343 VanDerWaalsContact CZ3-NE2 3.31Å; T315-Q343 HydrophobicContact CG2-CB 4.36Å; T315-Q343 HydrophobicContact CG2-CG 3.51Å; L335-Q343 HydrophobicContact CD2-CB 4.39Å; L335-Q343 HydrophobicContact CD2-CG 3.97Å; H336-Q343 PolarHBondContact ND1-OE1 3.23Å; H336-Q343 PolarHBondContact O-OE1 2.83Å; N339-Q343 PolarHBondContact O-N 2.98Å; I340-Q343 PolarHBondContact O-N 3.45Å; Q343-K345 VanDerWaalsContact C-N 3.35Å; Q343-K345 PolarHBondContact O-N 3.06Å; Q343-A346 PolarHBondContact O-N 2.88Å; Q343-Y347 PolarHBondContact O-N 2.84Å; Q343-F364 HydrophobicContact CB-CZ 4.48Å
344	L	98.6	Very high	95.6	Very high	16 Å²	16	36.2 Å²	36.2	8%	0.084	18%	0.18	C	C	.	.	H	α-helix	trans	-62.1	-39.8	176.1	-67.6	167.7	0	0	0	112	I340 A346 Y347 E348 F364 A399 L400 A403 W407	I340-L344 HydrophobicContact CG2-CD1 3.98Å; I340-L344 HydrophobicContact CG2-CG 4.4Å; I340-L344 WeakPolarHBondContact O-CG 3.43Å; I340-L344 PolarHBondContact O-N 3.4Å; L344-A346 PolarHBondContact O-N 3.09Å; L344-Y347 PolarHBondContact O-N 3.03Å; L344-E348 WeakPolarHBondContact O-CB 3.48Å; L344-E348 VanDerWaalsContact O-CG 3.29Å; L344-E348 WeakPolarHBondContact O-CG 3.5Å; L344-E348 PolarHBondContact O-N 3.01Å; L344-F364 HydrophobicContact CD2-CE1 4.14Å; L344-F364 HydrophobicContact CD2-CZ 4.42Å; L344-A399 HydrophobicContact CD1-CB 4.05Å; L344-L400 HydrophobicContact CD1-CD1 4.45Å; L344-A403 HydrophobicContact CD1-CB 4.15Å; L344-A403 HydrophobicContact CD2-CB 3.95Å; L344-W407 HydrophobicContact CD2-CH2 4.09Å; L344-W407 HydrophobicContact CD2-CZ2 4.06Å
345	K	98.1	Very high	94.6	Very high	67 Å²	67	37.8 Å²	37.8	29%	0.291	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-40.6	174.9	-79.3	167.8	172.1	172.4	0	113.1	E341 M342 Q343 E348 I349	E341-K345 HydrophobicContact CG-CD 4.47Å; E341-K345 VanDerWaalsContact O-CG 3.3Å; E341-K345 WeakPolarHBondContact O-CG 2.95Å; E341-K345 PolarHBondContact O-N 2.85Å; E341-K345 VanDerWaalsContact OE1-CE 3.29Å; E341-K345 WeakPolarHBondContact OE1-CE 3.31Å; E341-K345 IonicContact OE1-NZ 3.39Å; E341-K345 PolarHBondContact OE1-NZ 3.45Å; M342-K345 PolarHBondContact O-N 3.25Å; M342-K345 HydrophobicContact SD-CB 4.31Å; M342-K345 HydrophobicContact SD-CD 4.2Å; Q343-K345 VanDerWaalsContact C-N 3.35Å; Q343-K345 PolarHBondContact O-N 3.06Å; K345-E348 PolarHBondContact O-N 2.85Å; K345-I349 WeakPolarHBondContact O-CD1 3.5Å; K345-I349 VanDerWaalsContact O-CG1 3.27Å; K345-I349 WeakPolarHBondContact O-CG1 3.48Å; K345-I349 PolarHBondContact O-N 3.48Å
346	A	97.4	Very high	93.5	Very high	3 Å²	3	40.4 Å²	40.4	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-67	-46.2	177.4	0	0	0	0	0	111.6	I248 M342 Q343 L344 E348 I349 E350	I248-A346 HydrophobicContact CG2-CB 4.21Å; M342-A346 PolarHBondContact O-N 2.81Å; Q343-A346 PolarHBondContact O-N 2.88Å; L344-A346 PolarHBondContact O-N 3.09Å; A346-E348 VanDerWaalsContact C-N 3.31Å; A346-E348 PolarHBondContact O-N 2.94Å; A346-I349 CarbonylContact O-C 3.55Å; A346-I349 WeakPolarHBondContact O-CA 3.47Å; A346-I349 WeakPolarHBondContact O-CB 3.41Å; A346-I349 PolarHBondContact O-N 3.37Å; A346-E350 WeakPolarHBondContact O-CG 3.32Å; A346-E350 PolarHBondContact O-N 3.46Å
347	Y	97.4	Very high	92.3	Very high	16 Å²	16	46.2 Å²	46.2	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-55.8	-43.4	173.7	178.7	-108.9	0	0	0	112.5	Q343 L344 I349 E350 K351 F364 E365 W407	Q343-Y347 PolarHBondContact O-N 2.84Å; L344-Y347 PolarHBondContact O-N 3.03Å; Y347-I349 VanDerWaalsContact C-N 3.34Å; Y347-I349 PolarHBondContact O-N 3.47Å; Y347-E350 WeakPolarHBondContact O-CB 3.3Å; Y347-E350 PolarHBondContact O-N 3.13Å; Y347-K351 HydrophobicContact CD1-CD 4.17Å; Y347-K351 HydrophobicContact CE1-CD 3.59Å; Y347-K351 HydrophobicContact CE1-CG 4.45Å; Y347-K351 PolarHBondContact O-N 2.71Å; Y347-K351 PolarHBondContact OH-NZ 3.13Å; Y347-F364 AromaticContact CD1-CD1 3.78Å; Y347-F364 HydrophobicContact CD1-CD1 3.78Å; Y347-F364 AromaticContact CD1-CE1 3.63Å; Y347-F364 HydrophobicContact CD1-CE1 3.63Å; Y347-F364 HydrophobicContact CD2-CB 4.24Å; Y347-F364 AromaticContact CD2-CD1 3.4Å; Y347-F364 HydrophobicContact CD2-CD1 3.4Å; Y347-F364 VanDerWaalsContact CD2-CD1 3.4Å; Y347-F364 HydrophobicContact CD2-CD2 4.48Å; Y347-F364 AromaticContact CD2-CE1 3.79Å; Y347-F364 HydrophobicContact CD2-CE1 3.79Å; Y347-F364 AromaticContact CD2-CG 3.79Å; Y347-F364 HydrophobicContact CD2-CG 3.79Å; Y347-F364 HydrophobicContact CD2-CZ 4.46Å; Y347-F364 HydrophobicContact CE1-CD1 4.02Å; Y347-F364 HydrophobicContact CE1-CE1 4.28Å; Y347-F364 HydrophobicContact CE2-CB 4.07Å; Y347-F364 AromaticContact CE2-CD1 3.68Å; Y347-F364 HydrophobicContact CE2-CD1 3.68Å; Y347-F364 HydrophobicContact CE2-CE1 4.43Å; Y347-F364 HydrophobicContact CE2-CG 4.07Å; Y347-F364 AromaticContact CG-CD1 3.47Å; Y347-F364 HydrophobicContact CG-CD1 3.47Å; Y347-F364 VanDerWaalsContact CG-CD1 3.47Å; Y347-F364 AromaticContact CG-CE1 3.36Å; Y347-F364 HydrophobicContact CG-CE1 3.36Å; Y347-F364 HydrophobicContact CG-CG 4.25Å; Y347-F364 HydrophobicContact CG-CZ 4.05Å; Y347-E365 HydrophobicContact CE1-CG 4.02Å; Y347-E365 VanDerWaalsContact CE1-OE1 3.25Å; Y347-E365 WeakPolarHBondContact CE1-OE1 3.38Å; Y347-E365 PolarHBondContact OH-OE1 2.89Å; Y347-W407 HydrophobicContact CD1-CZ2 4.48Å; Y347-W407 HydrophobicContact CE1-CZ2 4.24Å
348	E	96.5	Very high	91	Very high	74 Å²	74	51.2 Å²	51.2	35%	0.346	27%	0.267	S	S	.	.	H	α-helix	trans	-67.2	-30.5	174.9	-70	-67.4	154.2	0	0	113	L344 K345 A346 R352	L344-E348 WeakPolarHBondContact O-CB 3.48Å; L344-E348 VanDerWaalsContact O-CG 3.29Å; L344-E348 WeakPolarHBondContact O-CG 3.5Å; L344-E348 PolarHBondContact O-N 3.01Å; K345-E348 PolarHBondContact O-N 2.85Å; A346-E348 VanDerWaalsContact C-N 3.31Å; A346-E348 PolarHBondContact O-N 2.94Å; E348-R352 VanDerWaalsContact C-NH1 3.29Å; E348-R352 WeakPolarHBondContact O-CG 3.48Å; E348-R352 PolarHBondContact O-N 2.87Å; E348-R352 PolarHBondContact O-NH1 2.94Å
349	I	94	Very high	90.1	Very high	10 Å²	10	55.8 Å²	55.8	5%	0.051	29%	0.287	C	S	.	.	H	α-helix	trans	-68.2	-45.1	170.6	-69.2	161.6	0	0	0	110.2	L276 F279 E280 K345 A346 Y347 K351 R352 L353	L276-I349 HydrophobicContact CB-CD1 4.39Å; L276-I349 HydrophobicContact CD2-CD1 4.18Å; F279-I349 HydrophobicContact CE1-CG2 4.49Å; E280-I349 HydrophobicContact CG-CG2 4.38Å; K345-I349 WeakPolarHBondContact O-CD1 3.5Å; K345-I349 VanDerWaalsContact O-CG1 3.27Å; K345-I349 WeakPolarHBondContact O-CG1 3.48Å; K345-I349 PolarHBondContact O-N 3.48Å; A346-I349 CarbonylContact O-C 3.55Å; A346-I349 WeakPolarHBondContact O-CA 3.47Å; A346-I349 WeakPolarHBondContact O-CB 3.41Å; A346-I349 PolarHBondContact O-N 3.37Å; Y347-I349 VanDerWaalsContact C-N 3.34Å; Y347-I349 PolarHBondContact O-N 3.47Å; I349-K351 VanDerWaalsContact C-N 3.3Å; I349-K351 PolarHBondContact O-N 2.98Å; I349-R352 VanDerWaalsContact CG1-NH2 3.3Å; I349-R352 PolarHBondContact O-N 2.83Å; I349-R352 VanDerWaalsContact O-N 3.12Å; I349-L353 HydrophobicContact CG2-CD1 3.69Å; I349-L353 HydrophobicContact CG2-CG 4.15Å; I349-L353 WeakPolarHBondContact O-CB 3.47Å; I349-L353 WeakPolarHBondContact O-CG 3.42Å; I349-L353 PolarHBondContact O-N 2.9Å
350	E	92.5	Very high	89.8	Confident	15 Å²	15	55.3 Å²	55.3	7%	0.07	28%	0.282	C	S	.	.	H	α-helix	trans	-58.8	-39.3	177.3	-70.2	160.1	-145.5	0	0	111.9	G251 G252 A346 Y347 S354 T355	G251-E350 VanDerWaalsContact N-CD 3.33Å; G251-E350 PolarHBondContact N-OE1 3.35Å; G251-E350 PolarHBondContact N-OE2 3.07Å; G252-E350 PolarHBondContact N-OE1 3.4Å; A346-E350 WeakPolarHBondContact O-CG 3.32Å; A346-E350 PolarHBondContact O-N 3.46Å; Y347-E350 WeakPolarHBondContact O-CB 3.3Å; Y347-E350 PolarHBondContact O-N 3.13Å; E350-S354 PolarHBondContact O-N 2.92Å; E350-T355 PolarHBondContact O-N 2.77Å; E350-T355 VanDerWaalsContact O-N 3.16Å; E350-T355 PolarHBondContact O-OG1 3.39Å
351	K	89.6	Confident	89.7	Confident	71 Å²	71	55.6 Å²	55.6	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-44.4	172.7	-71.4	179	108.4	148.6	0	112.3	Y347 I349 S354 E365 H416	Y347-K351 HydrophobicContact CD1-CD 4.17Å; Y347-K351 HydrophobicContact CE1-CD 3.59Å; Y347-K351 HydrophobicContact CE1-CG 4.45Å; Y347-K351 PolarHBondContact O-N 2.71Å; Y347-K351 PolarHBondContact OH-NZ 3.13Å; I349-K351 VanDerWaalsContact C-N 3.3Å; I349-K351 PolarHBondContact O-N 2.98Å; K351-S354 PolarHBondContact O-N 2.89Å; K351-E365 IonicContact NZ-OE1 2.79Å; K351-E365 PolarHBondContact NZ-OE1 3.24Å; K351-H416 PolarHBondContact NZ-CE1 2.97Å
352	R	91.3	Very high	89.6	Confident	131 Å²	131	54.2 Å²	54.2	49%	0.494	28%	0.282	S	S	.	.	H	α-helix	trans	-73.1	-27.9	-179.9	-70.7	-168.8	-53.5	-77.4	-1.6	114.3	E280 E348 I349 S354	E280-R352 IonicContact OE1-CZ 3.91Å; E280-R352 IonicContact OE1-NE 2.68Å; E280-R352 PolarHBondContact OE1-NE 3.11Å; E280-R352 IonicContact OE1-NH2 3.41Å; E280-R352 PolarHBondContact OE1-NH2 3.3Å; E280-R352 IonicContact OE2-CZ 2.64Å; E280-R352 IonicContact OE2-NE 2.85Å; E280-R352 IonicContact OE2-NH2 2.88Å; E280-R352 PolarHBondContact OE2-NH2 2.95Å; E348-R352 VanDerWaalsContact C-NH1 3.29Å; E348-R352 WeakPolarHBondContact O-CG 3.48Å; E348-R352 PolarHBondContact O-N 2.87Å; E348-R352 PolarHBondContact O-NH1 2.94Å; I349-R352 VanDerWaalsContact CG1-NH2 3.3Å; I349-R352 PolarHBondContact O-N 2.83Å; I349-R352 VanDerWaalsContact O-N 3.12Å; R352-S354 PolarHBondContact O-N 3.3Å
353	L	84.4	Confident	89.5	Confident	46 Å²	46	55.4 Å²	55.4	24%	0.241	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-1.9	172.8	-69	177.5	0	0	0	113.2	F279 E280 I349 T355	F279-L353 HydrophobicContact CE1-CD1 4.46Å; E280-L353 HydrophobicContact CG-CD2 4.08Å; E280-L353 HydrophobicContact CG-CG 4.41Å; I349-L353 HydrophobicContact CG2-CD1 3.69Å; I349-L353 HydrophobicContact CG2-CG 4.15Å; I349-L353 WeakPolarHBondContact O-CB 3.47Å; I349-L353 WeakPolarHBondContact O-CG 3.42Å; I349-L353 PolarHBondContact O-N 2.9Å; L353-T355 PolarHBondContact O-N 2.62Å
354	S	85.2	Confident	89.5	Confident	106 Å²	106	55.5 Å²	55.5	74%	0.741	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	36.8	-175.8	-58.4	0	0	0	0	112.9	E350 K351 R352 A356	E350-S354 PolarHBondContact O-N 2.92Å; K351-S354 PolarHBondContact O-N 2.89Å; R352-S354 PolarHBondContact O-N 3.3Å; S354-A356 PolarHBondContact O-N 2.73Å
355	T	77.3	Confident	89.5	Confident	38 Å²	38	54.8 Å²	54.8	23%	0.233	29%	0.285	C	S	.	.			trans	-56	135.6	177.9	-62.7	0	0	0	0	110	E350 L353 F359 K360	E350-T355 PolarHBondContact O-N 2.77Å; E350-T355 VanDerWaalsContact O-N 3.16Å; E350-T355 PolarHBondContact O-OG1 3.39Å; L353-T355 PolarHBondContact O-N 2.62Å; T355-F359 HydrophobicContact CG2-CB 3.76Å; T355-K360 HydrophobicContact CG2-CG 4.22Å; T355-K360 WeakPolarHBondContact O-CE 3.38Å; T355-K360 PolarHBondContact O-NZ 2.84Å
356	A	74.9	Confident	89.5	Confident	57 Å²	57	51.6 Å²	51.6	47%	0.471	27%	0.272	S	S	.	.			trans	-71.1	146.2	175.7	0	0	0	0	0	111.1	S354 L358 F359	S354-A356 PolarHBondContact O-N 2.73Å; A356-L358 VanDerWaalsContact C-N 3.25Å; A356-L358 PolarHBondContact O-N 3.21Å; A356-L358 VanDerWaalsContact O-N 3.14Å; A356-F359 HydrophobicContact CB-CD2 4.27Å; A356-F359 PolarHBondContact O-N 3.46Å
357	D	73.3	Confident	89.5	Confident	123 Å²	123	51.5 Å²	51.5	66%	0.658	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-66.4	-23.7	-164.7	-51	-63.7	0	0	0	114.5	F359 K360	D357-F359 PolarHBondContact O-N 3.36Å; D357-F359 VanDerWaalsContact O-N 3.14Å; D357-K360 PolarHBondContact O-N 3.48Å; D357-K360 IonicContact OD1-NZ 2.66Å; D357-K360 PolarHBondContact OD1-NZ 3.49Å
358	L	71.8	Confident	89.6	Confident	133 Å²	133	50.7 Å²	50.7	70%	0.696	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-59.3	-20.6	170.2	-174.9	61.8	0	0	0	113.3	A356	A356-L358 VanDerWaalsContact C-N 3.25Å; A356-L358 PolarHBondContact O-N 3.21Å; A356-L358 VanDerWaalsContact O-N 3.14Å
359	F	79.8	Confident	89.7	Confident	105 Å²	105	47.2 Å²	47.2	46%	0.461	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-110.5	17.1	177.9	-53.3	-69.6	0	0	0	112.9	F250 T355 A356 D357	F250-F359 WeakPolarHBondContact CB-O 3.3Å; T355-F359 HydrophobicContact CG2-CB 3.76Å; A356-F359 HydrophobicContact CB-CD2 4.27Å; A356-F359 PolarHBondContact O-N 3.46Å; D357-F359 PolarHBondContact O-N 3.36Å; D357-F359 VanDerWaalsContact O-N 3.14Å
360	K	89.6	Confident	89.9	Confident	44 Å²	44	47.8 Å²	47.8	19%	0.191	25%	0.253	C	S	.	.	S	Bend	trans	-106.7	167.3	170.9	-67.1	-179.7	-172.5	143.8	0	110.6	T355 D357 P362	T355-K360 HydrophobicContact CG2-CG 4.22Å; T355-K360 WeakPolarHBondContact O-CE 3.38Å; T355-K360 PolarHBondContact O-NZ 2.84Å; D357-K360 PolarHBondContact O-N 3.48Å; D357-K360 IonicContact OD1-NZ 2.66Å; D357-K360 PolarHBondContact OD1-NZ 3.49Å; K360-P362 WeakPolarHBondContact O-CD 3.33Å
361	F	96.7	Very high	90.2	Very high	7 Å²	7	47 Å²	47	3%	0.031	25%	0.249	C	C	.	.			trans	-72.7	123.4	170	-169.9	-80	0	0	0	109.8	V216 P229 V231 F250 T253 L335 N363 F364 I367	V216-F361 HydrophobicContact CG2-CE1 4.39Å; V216-F361 HydrophobicContact CG2-CZ 3.82Å; P229-F361 HydrophobicContact CB-CE1 3.89Å; P229-F361 HydrophobicContact CB-CZ 4.02Å; P229-F361 HydrophobicContact CG-CE1 4.03Å; V231-F361 HydrophobicContact CG2-CD2 4.47Å; V231-F361 HydrophobicContact CG2-CE2 3.75Å; V231-F361 HydrophobicContact CG2-CZ 4.27Å; F250-F361 HydrophobicContact CD2-CB 3.91Å; F250-F361 AromaticContact CD2-CD2 3.83Å; F250-F361 HydrophobicContact CD2-CD2 3.83Å; F250-F361 HydrophobicContact CD2-CG 4.31Å; F250-F361 AromaticContact CE2-CD2 3.87Å; F250-F361 HydrophobicContact CE2-CD2 3.87Å; T253-F361 HydrophobicContact CG2-CD2 3.54Å; T253-F361 HydrophobicContact CG2-CE2 3.72Å; L335-F361 HydrophobicContact CD1-CD1 3.95Å; L335-F361 HydrophobicContact CD1-CD2 3.96Å; L335-F361 HydrophobicContact CD1-CE1 3.71Å; L335-F361 HydrophobicContact CD1-CE2 3.71Å; L335-F361 HydrophobicContact CD1-CG 4.08Å; L335-F361 HydrophobicContact CD1-CZ 3.59Å; L335-F361 HydrophobicContact CD2-CD2 4.49Å; L335-F361 HydrophobicContact CG-CD2 4.1Å; L335-F361 HydrophobicContact CG-CE2 3.76Å; L335-F361 HydrophobicContact CG-CZ 4.06Å; F361-N363 PolarHBondContact O-N 3.43Å; F361-F364 HydrophobicContact CB-CB 4.22Å; F361-F364 HydrophobicContact CB-CD2 3.91Å; F361-F364 HydrophobicContact CD1-CB 4.08Å; F361-F364 HydrophobicContact CD1-CD2 4.07Å; F361-F364 HydrophobicContact CG-CD2 4.08Å; F361-I367 HydrophobicContact CE1-CG2 3.99Å
362	P	96	Very high	90.6	Very high	56 Å²	56	43.7 Å²	43.7	36%	0.364	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	132.8	-179.8	-21.9	33.1	0	0	0	112	P229 V231 K360 F364	P229-P362 HydrophobicContact CB-CB 4.17Å; P229-P362 HydrophobicContact CG-CB 4.37Å; P229-P362 WeakPolarHBondContact CG-O 3.3Å; V231-P362 HydrophobicContact CG1-CG 4.42Å; K360-P362 WeakPolarHBondContact O-CD 3.33Å; P362-F364 VanDerWaalsContact C-N 3.32Å; P362-F364 PolarHBondContact O-N 3.37Å
363	N	96.7	Very high	90.9	Very high	46 Å²	46	41.2 Å²	41.2	25%	0.246	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	44.8	175.8	-49.7	-32.9	0	0	0	113	W220 E227 P229 F361 T366 I367 E419	W220-N363 HydrophobicContact CH2-CB 3.57Å; W220-N363 HydrophobicContact CZ3-CB 4.05Å; E227-N363 PolarHBondContact O-ND2 3.13Å; P229-N363 HydrophobicContact CG-CB 4.41Å; F361-N363 PolarHBondContact O-N 3.43Å; N363-T366 WeakPolarHBondContact O-CB 3.23Å; N363-T366 PolarHBondContact O-N 3.16Å; N363-I367 PolarHBondContact O-N 2.92Å; N363-E419 WeakPolarHBondContact CA-OE2 3.49Å
364	F	98.3	Very high	91.6	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-42.6	-173.3	179.6	-94.1	0	0	0	113.2	G251 L335 Q343 L344 Y347 F361 P362 I367 C368 E419	G251-F364 WeakPolarHBondContact O-CE2 3.18Å; L335-F364 HydrophobicContact CD1-CD2 3.83Å; L335-F364 HydrophobicContact CD1-CE2 3.87Å; L335-F364 HydrophobicContact CD2-CE2 3.96Å; Q343-F364 HydrophobicContact CB-CZ 4.48Å; L344-F364 HydrophobicContact CD2-CE1 4.14Å; L344-F364 HydrophobicContact CD2-CZ 4.42Å; Y347-F364 AromaticContact CD1-CD1 3.78Å; Y347-F364 HydrophobicContact CD1-CD1 3.78Å; Y347-F364 AromaticContact CD1-CE1 3.63Å; Y347-F364 HydrophobicContact CD1-CE1 3.63Å; Y347-F364 HydrophobicContact CD2-CB 4.24Å; Y347-F364 AromaticContact CD2-CD1 3.4Å; Y347-F364 HydrophobicContact CD2-CD1 3.4Å; Y347-F364 VanDerWaalsContact CD2-CD1 3.4Å; Y347-F364 HydrophobicContact CD2-CD2 4.48Å; Y347-F364 AromaticContact CD2-CE1 3.79Å; Y347-F364 HydrophobicContact CD2-CE1 3.79Å; Y347-F364 AromaticContact CD2-CG 3.79Å; Y347-F364 HydrophobicContact CD2-CG 3.79Å; Y347-F364 HydrophobicContact CD2-CZ 4.46Å; Y347-F364 HydrophobicContact CE1-CD1 4.02Å; Y347-F364 HydrophobicContact CE1-CE1 4.28Å; Y347-F364 HydrophobicContact CE2-CB 4.07Å; Y347-F364 AromaticContact CE2-CD1 3.68Å; Y347-F364 HydrophobicContact CE2-CD1 3.68Å; Y347-F364 HydrophobicContact CE2-CE1 4.43Å; Y347-F364 HydrophobicContact CE2-CG 4.07Å; Y347-F364 AromaticContact CG-CD1 3.47Å; Y347-F364 HydrophobicContact CG-CD1 3.47Å; Y347-F364 VanDerWaalsContact CG-CD1 3.47Å; Y347-F364 AromaticContact CG-CE1 3.36Å; Y347-F364 HydrophobicContact CG-CE1 3.36Å; Y347-F364 HydrophobicContact CG-CG 4.25Å; Y347-F364 HydrophobicContact CG-CZ 4.05Å; F361-F364 HydrophobicContact CB-CB 4.22Å; F361-F364 HydrophobicContact CB-CD2 3.91Å; F361-F364 HydrophobicContact CD1-CB 4.08Å; F361-F364 HydrophobicContact CD1-CD2 4.07Å; F361-F364 HydrophobicContact CG-CD2 4.08Å; P362-F364 VanDerWaalsContact C-N 3.32Å; P362-F364 PolarHBondContact O-N 3.37Å; F364-I367 VanDerWaalsContact O-CG2 3.24Å; F364-I367 WeakPolarHBondContact O-CG2 3.49Å; F364-C368 WeakPolarHBondContact O-CB 3.43Å; F364-C368 PolarHBondContact O-N 2.85Å; F364-C368 VanDerWaalsContact O-N 3.08Å; F364-C368 PolarHBondContact O-SG 2.82Å; F364-E419 PolarHBondContact N-OE2 3.42Å; F364-E419 VanDerWaalsContact N-OE2 3.14Å
365	E	98.2	Very high	92.2	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-73.7	-35.1	178	-56.7	-164.1	-178.1	0	0	110.2	Y347 K351 I367 C368 W369 W407 H416 E419	Y347-E365 HydrophobicContact CE1-CG 4.02Å; Y347-E365 VanDerWaalsContact CE1-OE1 3.25Å; Y347-E365 WeakPolarHBondContact CE1-OE1 3.38Å; Y347-E365 PolarHBondContact OH-OE1 2.89Å; K351-E365 IonicContact NZ-OE1 2.79Å; K351-E365 PolarHBondContact NZ-OE1 3.24Å; E365-I367 PolarHBondContact O-N 3.07Å; E365-C368 CarbonylContact O-C 3.6Å; E365-C368 WeakPolarHBondContact O-CA 3.22Å; E365-C368 VanDerWaalsContact O-CB 3.3Å; E365-C368 WeakPolarHBondContact O-CB 3.35Å; E365-C368 PolarHBondContact O-N 3.09Å; E365-C368 VanDerWaalsContact O-N 3.13Å; E365-W369 PolarHBondContact O-N 3.12Å; E365-W407 HydrophobicContact CB-CE3 4.16Å; E365-W407 HydrophobicContact CB-CH2 4.03Å; E365-W407 HydrophobicContact CB-CZ3 3.76Å; E365-W407 HydrophobicContact CG-CD2 4.35Å; E365-W407 HydrophobicContact CG-CE3 4.17Å; E365-W407 HydrophobicContact CG-CH2 3.68Å; E365-W407 HydrophobicContact CG-CZ2 3.85Å; E365-W407 HydrophobicContact CG-CZ3 3.85Å; E365-W407 VanDerWaalsContact OE2-CD2 3.32Å; E365-H416 IonicContact OE1-CE1 2.74Å; E365-H416 PolarHBondContact OE1-CE1 2.87Å; E365-H416 IonicContact OE1-ND1 2.66Å; E365-H416 PolarHBondContact OE1-ND1 3.25Å; E365-H416 IonicContact OE2-CE1 3.35Å; E365-H416 IonicContact OE2-CG 3.79Å; E365-H416 IonicContact OE2-ND1 3.62Å; E365-H416 PolarHBondContact OE2-ND1 3.43Å; E365-E419 WeakPolarHBondContact CA-OE2 3.33Å; E365-E419 HydrophobicContact CB-CB 3.96Å; E365-E419 HydrophobicContact CB-CG 4.45Å; E365-E419 WeakPolarHBondContact CB-OE2 3.4Å; E365-E419 PolarHBondContact N-OE2 2.89Å
366	T	98.2	Very high	93.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-55.7	-50	172.6	-47	0	0	0	0	112.3	W220 F226 N363 W369 Y370 E419 P421	W220-T366 HydrophobicContact CH2-CG2 3.85Å; W220-T366 HydrophobicContact CZ3-CG2 4.23Å; F226-T366 HydrophobicContact CB-CG2 4.34Å; F226-T366 HydrophobicContact CD2-CG2 3.57Å; F226-T366 HydrophobicContact CE2-CG2 3.96Å; F226-T366 HydrophobicContact CG-CG2 3.92Å; N363-T366 WeakPolarHBondContact O-CB 3.23Å; N363-T366 PolarHBondContact O-N 3.16Å; T366-W369 PolarHBondContact O-N 2.89Å; T366-Y370 HydrophobicContact CG2-CD2 4.48Å; T366-Y370 HydrophobicContact CG2-CE2 4.01Å; T366-Y370 VanDerWaalsContact O-CD2 3.25Å; T366-Y370 WeakPolarHBondContact O-CD2 3.38Å; T366-Y370 PolarHBondContact O-N 3.14Å; T366-E419 VanDerWaalsContact CA-O 3.27Å; T366-E419 WeakPolarHBondContact CA-O 3.48Å; T366-E419 WeakPolarHBondContact CB-O 3.28Å; T366-E419 PolarHBondContact N-OE2 3.21Å; T366-E419 PolarHBondContact OG1-O 3.26Å; T366-E419 PolarHBondContact OG1-OE2 3.33Å; T366-P421 HydrophobicContact CG2-CG 3.88Å
367	I	98.4	Very high	94.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.9	-35.4	175.3	-173.6	55	0	0	0	111.9	W215 V216 L219 W220 L335 F361 N363 F364 E365 W369 Y370 V371	W215-I367 HydrophobicContact CB-CD1 4Å; W215-I367 HydrophobicContact CB-CG1 3.73Å; W215-I367 HydrophobicContact CE3-CG1 4.09Å; W215-I367 HydrophobicContact CE3-CG2 4.36Å; V216-I367 HydrophobicContact CG2-CG1 4.46Å; L219-I367 HydrophobicContact CB-CD1 4.28Å; W220-I367 HydrophobicContact CE3-CB 4.07Å; W220-I367 HydrophobicContact CE3-CD1 4.12Å; W220-I367 HydrophobicContact CE3-CG1 4.47Å; W220-I367 HydrophobicContact CZ3-CB 3.98Å; L335-I367 HydrophobicContact CD1-CG2 3.95Å; F361-I367 HydrophobicContact CE1-CG2 3.99Å; N363-I367 PolarHBondContact O-N 2.92Å; F364-I367 VanDerWaalsContact O-CG2 3.24Å; F364-I367 WeakPolarHBondContact O-CG2 3.49Å; E365-I367 PolarHBondContact O-N 3.07Å; I367-W369 VanDerWaalsContact C-N 3.31Å; I367-W369 PolarHBondContact O-N 2.98Å; I367-Y370 PolarHBondContact O-N 2.87Å; I367-V371 HydrophobicContact CD1-CG2 4.27Å; I367-V371 HydrophobicContact CG1-CG2 4.24Å; I367-V371 WeakPolarHBondContact O-CG2 3.44Å; I367-V371 PolarHBondContact O-N 2.67Å
368	C	98.7	Very high	95.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57	-42.5	172.8	-77	0	0	0	0	112.1	F364 E365 V371 G372 L400 F404 W407	F364-C368 WeakPolarHBondContact O-CB 3.43Å; F364-C368 PolarHBondContact O-N 2.85Å; F364-C368 VanDerWaalsContact O-N 3.08Å; F364-C368 PolarHBondContact O-SG 2.82Å; E365-C368 CarbonylContact O-C 3.6Å; E365-C368 WeakPolarHBondContact O-CA 3.22Å; E365-C368 VanDerWaalsContact O-CB 3.3Å; E365-C368 WeakPolarHBondContact O-CB 3.35Å; E365-C368 PolarHBondContact O-N 3.09Å; E365-C368 VanDerWaalsContact O-N 3.13Å; C368-V371 PolarHBondContact O-N 3.27Å; C368-G372 PolarHBondContact O-N 2.88Å; C368-L400 HydrophobicContact CB-CD1 3.83Å; C368-F404 HydrophobicContact CB-CE1 4.33Å; C368-F404 VanDerWaalsContact O-CZ 3.3Å; C368-F404 WeakPolarHBondContact O-CZ 3.43Å; C368-W407 HydrophobicContact CB-CH2 3.93Å; C368-W407 HydrophobicContact CB-CZ3 3.94Å
369	W	98.6	Very high	96.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.8	-44.1	176.5	-75.4	115.1	0	0	0	113.1	E365 T366 I367 G372 K373 F404 W407 T408 I420 P421 V424 T426 L429 I430	E365-W369 PolarHBondContact O-N 3.12Å; T366-W369 PolarHBondContact O-N 2.89Å; I367-W369 VanDerWaalsContact C-N 3.31Å; I367-W369 PolarHBondContact O-N 2.98Å; W369-G372 PolarHBondContact O-N 2.74Å; W369-K373 PolarHBondContact O-N 2.83Å; W369-K373 VanDerWaalsContact O-N 3.14Å; W369-F404 AromaticContact CD2-CD1 3.84Å; W369-F404 HydrophobicContact CD2-CD1 3.84Å; W369-F404 AromaticContact CD2-CE1 3.65Å; W369-F404 HydrophobicContact CD2-CE1 3.65Å; W369-F404 HydrophobicContact CD2-CZ 4.29Å; W369-F404 AromaticContact CE2-CD1 3.96Å; W369-F404 AromaticContact CE3-CD1 3.58Å; W369-F404 HydrophobicContact CE3-CD1 3.58Å; W369-F404 HydrophobicContact CE3-CD2 4.2Å; W369-F404 AromaticContact CE3-CE1 3.47Å; W369-F404 HydrophobicContact CE3-CE1 3.47Å; W369-F404 VanDerWaalsContact CE3-CE1 3.47Å; W369-F404 HydrophobicContact CE3-CE2 4.12Å; W369-F404 AromaticContact CE3-CG 3.95Å; W369-F404 HydrophobicContact CE3-CG 3.95Å; W369-F404 AromaticContact CE3-CZ 3.75Å; W369-F404 HydrophobicContact CE3-CZ 3.75Å; W369-F404 HydrophobicContact CG-CE1 4.16Å; W369-F404 HydrophobicContact CH2-CB 3.64Å; W369-F404 AromaticContact CH2-CD1 3.65Å; W369-F404 HydrophobicContact CH2-CD1 3.65Å; W369-F404 HydrophobicContact CH2-CD2 4.47Å; W369-F404 HydrophobicContact CH2-CE1 4.4Å; W369-F404 AromaticContact CH2-CG 3.69Å; W369-F404 HydrophobicContact CH2-CG 3.69Å; W369-F404 HydrophobicContact CZ2-CB 4.41Å; W369-F404 AromaticContact CZ2-CD1 3.89Å; W369-F404 HydrophobicContact CZ2-CD1 3.89Å; W369-F404 HydrophobicContact CZ2-CG 4.37Å; W369-F404 HydrophobicContact CZ3-CB 3.84Å; W369-F404 AromaticContact CZ3-CD1 3.49Å; W369-F404 HydrophobicContact CZ3-CD1 3.49Å; W369-F404 VanDerWaalsContact CZ3-CD1 3.49Å; W369-F404 AromaticContact CZ3-CD2 3.81Å; W369-F404 HydrophobicContact CZ3-CD2 3.81Å; W369-F404 AromaticContact CZ3-CE1 3.88Å; W369-F404 HydrophobicContact CZ3-CE1 3.88Å; W369-F404 HydrophobicContact CZ3-CE2 4.18Å; W369-F404 AromaticContact CZ3-CG 3.45Å; W369-F404 HydrophobicContact CZ3-CG 3.45Å; W369-F404 VanDerWaalsContact CZ3-CG 3.45Å; W369-F404 HydrophobicContact CZ3-CZ 4.2Å; W369-W407 HydrophobicContact CZ2-CE3 4.35Å; W369-T408 HydrophobicContact CH2-CG2 3.67Å; W369-T408 HydrophobicContact CZ2-CG2 3.86Å; W369-I420 HydrophobicContact CZ2-CD1 4.3Å; W369-I420 HydrophobicContact CZ2-CG1 4.38Å; W369-P421 HydrophobicContact CB-CG 3.92Å; W369-V424 HydrophobicContact CB-CG1 4.44Å; W369-V424 HydrophobicContact CB-CG2 4.42Å; W369-V424 HydrophobicContact CD2-CG1 4.39Å; W369-V424 HydrophobicContact CE3-CG1 3.82Å; W369-V424 HydrophobicContact CZ3-CG1 4.5Å; W369-T426 HydrophobicContact CE3-CG2 4.42Å; W369-T426 HydrophobicContact CH2-CG2 3.66Å; W369-T426 HydrophobicContact CZ2-CG2 4.02Å; W369-T426 HydrophobicContact CZ3-CG2 3.89Å; W369-L429 HydrophobicContact CE3-CD2 3.95Å; W369-L429 HydrophobicContact CZ3-CD2 4.26Å; W369-I430 HydrophobicContact CH2-CD1 4.33Å
370	Y	98.4	Very high	97.5	Very high	22 Å²	22	26.1 Å²	26.1	9%	0.086	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-40.8	174.5	-71.2	-60.6	0	0	0	112.2	P221 C224 T366 I367 K373 H374 P421	P221-Y370 HydrophobicContact CG-CD1 4.12Å; P221-Y370 HydrophobicContact CG-CE1 3.57Å; P221-Y370 HydrophobicContact CG-CE2 4.21Å; C224-Y370 PolarHBondContact SG-OH 3.23Å; C224-Y370 VanDerWaalsContact SG-OH 3.37Å; T366-Y370 HydrophobicContact CG2-CD2 4.48Å; T366-Y370 HydrophobicContact CG2-CE2 4.01Å; T366-Y370 VanDerWaalsContact O-CD2 3.25Å; T366-Y370 WeakPolarHBondContact O-CD2 3.38Å; T366-Y370 PolarHBondContact O-N 3.14Å; I367-Y370 PolarHBondContact O-N 2.87Å; Y370-K373 WeakPolarHBondContact O-CB 3.43Å; Y370-K373 PolarHBondContact O-N 2.83Å; Y370-H374 PolarHBondContact O-N 2.6Å; Y370-P421 HydrophobicContact CD2-CG 4.18Å; Y370-P421 HydrophobicContact CE1-CB 4.03Å; Y370-P421 HydrophobicContact CE1-CG 4.21Å; Y370-P421 HydrophobicContact CE2-CB 4.13Å; Y370-P421 HydrophobicContact CE2-CG 3.76Å
371	V	98.6	Very high	97.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-42.9	174.8	171.8	0	0	0	0	111.5	W215 L219 I367 C368 K373 H374 I375 L400	W215-V371 HydrophobicContact CB-CG2 3.99Å; W215-V371 HydrophobicContact CD2-CB 4.4Å; W215-V371 HydrophobicContact CD2-CG1 4.36Å; W215-V371 HydrophobicContact CD2-CG2 3.33Å; W215-V371 HydrophobicContact CE3-CG2 3.64Å; W215-V371 HydrophobicContact CG-CG2 3.52Å; W215-V371 HydrophobicContact CH2-CG1 4.2Å; W215-V371 HydrophobicContact CH2-CG2 4.36Å; W215-V371 HydrophobicContact CZ2-CB 4.4Å; W215-V371 HydrophobicContact CZ2-CG1 3.68Å; W215-V371 HydrophobicContact CZ2-CG2 4.14Å; W215-V371 HydrophobicContact CZ3-CG2 4.14Å; L219-V371 HydrophobicContact CD1-CB 4.41Å; L219-V371 HydrophobicContact CD1-CG2 3.69Å; I367-V371 HydrophobicContact CD1-CG2 4.27Å; I367-V371 HydrophobicContact CG1-CG2 4.24Å; I367-V371 WeakPolarHBondContact O-CG2 3.44Å; I367-V371 PolarHBondContact O-N 2.67Å; C368-V371 PolarHBondContact O-N 3.27Å; V371-K373 VanDerWaalsContact C-N 3.33Å; V371-K373 PolarHBondContact O-N 3.24Å; V371-H374 PolarHBondContact O-N 2.68Å; V371-I375 HydrophobicContact CG1-CD1 3.67Å; V371-I375 HydrophobicContact CG1-CG1 4.21Å; V371-I375 WeakPolarHBondContact O-CG1 3.43Å; V371-I375 PolarHBondContact O-N 2.79Å; V371-L400 HydrophobicContact CB-CD2 4.38Å; V371-L400 HydrophobicContact CG1-CD2 3.91Å
372	G	98.4	Very high	97.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.6	-41.1	178	0	0	0	0	0	112.9	C368 W369 L376	C368-G372 PolarHBondContact O-N 2.88Å; W369-G372 PolarHBondContact O-N 2.74Å; G372-L376 PolarHBondContact O-N 2.74Å; G372-L376 VanDerWaalsContact O-N 3.12Å
373	K	98.1	Very high	97.7	Very high	80 Å²	80	29 Å²	29	35%	0.348	14%	0.14	S	C	.	.	H	α-helix	trans	-60.7	-48.3	172.8	-178.2	176.4	175.5	177.5	0	111	W369 Y370 V371 L376 D377 T423 V424 L429	W369-K373 PolarHBondContact O-N 2.83Å; W369-K373 VanDerWaalsContact O-N 3.14Å; Y370-K373 WeakPolarHBondContact O-CB 3.43Å; Y370-K373 PolarHBondContact O-N 2.83Å; V371-K373 VanDerWaalsContact C-N 3.33Å; V371-K373 PolarHBondContact O-N 3.24Å; K373-L376 WeakPolarHBondContact O-CB 3.2Å; K373-L376 PolarHBondContact O-N 3.14Å; K373-D377 PolarHBondContact O-N 3.33Å; K373-T423 PolarHBondContact NZ-O 2.68Å; K373-V424 HydrophobicContact CD-CG2 4.33Å; K373-L429 HydrophobicContact CB-CD2 4.42Å
374	H	98.2	Very high	97.7	Very high	77 Å²	77	33.4 Å²	33.4	36%	0.356	16%	0.159	S	C	.	.	H	α-helix	trans	-63.9	-41	178.2	-177.1	-127.1	0	0	0	113.5	L219 Y370 V371 L376 D377 I378	L219-H374 HydrophobicContact CD1-CB 4.26Å; L219-H374 HydrophobicContact CD2-CB 3.92Å; L219-H374 VanDerWaalsContact CD2-CG 3.47Å; L219-H374 VanDerWaalsContact CD2-ND1 3.34Å; L219-H374 WeakPolarHBondContact CD2-ND1 3.49Å; Y370-H374 PolarHBondContact O-N 2.6Å; V371-H374 PolarHBondContact O-N 2.68Å; H374-L376 VanDerWaalsContact C-N 3.33Å; H374-L376 PolarHBondContact O-N 3.26Å; H374-D377 PolarHBondContact O-N 3.14Å; H374-I378 VanDerWaalsContact CE1-CD1 3.48Å; H374-I378 WeakPolarHBondContact CE1-CD1 3.34Å; H374-I378 WeakPolarHBondContact O-CG1 3.46Å; H374-I378 PolarHBondContact O-N 3.34Å
375	I	98.3	Very high	97.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-38.1	176.6	-70.2	174.5	0	0	0	111.4	I340 V371 D377 I378 F379 L393 L400 L433	I340-I375 HydrophobicContact CD1-CD1 3.58Å; V371-I375 HydrophobicContact CG1-CD1 3.67Å; V371-I375 HydrophobicContact CG1-CG1 4.21Å; V371-I375 WeakPolarHBondContact O-CG1 3.43Å; V371-I375 PolarHBondContact O-N 2.79Å; I375-D377 VanDerWaalsContact C-N 3.33Å; I375-D377 PolarHBondContact O-N 2.77Å; I375-I378 PolarHBondContact O-N 2.88Å; I375-F379 HydrophobicContact CG2-CD1 4.38Å; I375-F379 HydrophobicContact CG2-CD2 4.1Å; I375-F379 HydrophobicContact CG2-CE1 3.94Å; I375-F379 HydrophobicContact CG2-CE2 3.61Å; I375-F379 HydrophobicContact CG2-CG 4.47Å; I375-F379 HydrophobicContact CG2-CZ 3.52Å; I375-F379 WeakPolarHBondContact O-CG 3.3Å; I375-F379 PolarHBondContact O-N 3.21Å; I375-L393 HydrophobicContact CD1-CD1 4.15Å; I375-L393 HydrophobicContact CG1-CD1 4.18Å; I375-L400 HydrophobicContact CD1-CD2 4.24Å; I375-L433 HydrophobicContact CG2-CD1 4.05Å
376	L	98.2	Very high	97.3	Very high	9 Å²	9	49.7 Å²	49.7	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-60	-43.9	173.7	172.4	58.6	0	0	0	111.5	G372 K373 H374 F379 R380 L429 D432 L433 E436	G372-L376 PolarHBondContact O-N 2.74Å; G372-L376 VanDerWaalsContact O-N 3.12Å; K373-L376 WeakPolarHBondContact O-CB 3.2Å; K373-L376 PolarHBondContact O-N 3.14Å; H374-L376 VanDerWaalsContact C-N 3.33Å; H374-L376 PolarHBondContact O-N 3.26Å; L376-F379 PolarHBondContact O-N 3.09Å; L376-R380 HydrophobicContact CD1-CG 4.39Å; L376-R380 WeakPolarHBondContact O-CG 3.37Å; L376-R380 PolarHBondContact O-N 2.85Å; L376-L429 HydrophobicContact CB-CD1 4.12Å; L376-L429 HydrophobicContact CD2-CD1 3.7Å; L376-D432 HydrophobicContact CD1-CB 3.95Å; L376-D432 HydrophobicContact CD2-CB 3.75Å; L376-L433 HydrophobicContact CB-CD1 4.43Å; L376-E436 HydrophobicContact CD1-CB 4.46Å; L376-E436 HydrophobicContact CD1-CG 3.59Å
377	D	97.8	Very high	97	Very high	83 Å²	83	57.6 Å²	57.6	44%	0.444	26%	0.259	S	S	.	.	H	α-helix	trans	-73	-33.8	-179.7	-65.5	-29.5	0	0	0	112.2	K373 H374 I375 R380 G381	K373-D377 PolarHBondContact O-N 3.33Å; H374-D377 PolarHBondContact O-N 3.14Å; I375-D377 VanDerWaalsContact C-N 3.33Å; I375-D377 PolarHBondContact O-N 2.77Å; D377-R380 PolarHBondContact O-N 3.2Å; D377-R380 IonicContact OD1-NH1 2.67Å; D377-G381 PolarHBondContact O-N 3.46Å
378	I	97.5	Very high	96.7	Very high	50 Å²	50	61.9 Å²	61.9	26%	0.256	28%	0.279	S	S	.	.	H	α-helix	trans	-58.7	-49.5	167.6	-70.5	165.1	0	0	0	111	H374 I375 R380 G381 L382 L393	H374-I378 VanDerWaalsContact CE1-CD1 3.48Å; H374-I378 WeakPolarHBondContact CE1-CD1 3.34Å; H374-I378 WeakPolarHBondContact O-CG1 3.46Å; H374-I378 PolarHBondContact O-N 3.34Å; I375-I378 PolarHBondContact O-N 2.88Å; I378-R380 VanDerWaalsContact C-N 3.32Å; I378-R380 PolarHBondContact O-N 3.39Å; I378-G381 PolarHBondContact O-N 2.88Å; I378-L382 HydrophobicContact CG2-CD1 3.65Å; I378-L382 HydrophobicContact CG2-CG 4.2Å; I378-L382 WeakPolarHBondContact O-CB 3.49Å; I378-L382 WeakPolarHBondContact O-CG 3.46Å; I378-L382 PolarHBondContact O-N 3.42Å; I378-L393 HydrophobicContact CG2-CD2 3.94Å
379	F	97.6	Very high	96.4	Very high	3 Å²	3	62.3 Å²	62.3	1%	0.013	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-40.1	-179	-69.8	-13.2	0	0	0	112	I375 L376 R383 P389 L393 L433 E436 I437	I375-F379 HydrophobicContact CG2-CD1 4.38Å; I375-F379 HydrophobicContact CG2-CD2 4.1Å; I375-F379 HydrophobicContact CG2-CE1 3.94Å; I375-F379 HydrophobicContact CG2-CE2 3.61Å; I375-F379 HydrophobicContact CG2-CG 4.47Å; I375-F379 HydrophobicContact CG2-CZ 3.52Å; I375-F379 WeakPolarHBondContact O-CG 3.3Å; I375-F379 PolarHBondContact O-N 3.21Å; L376-F379 PolarHBondContact O-N 3.09Å; F379-R383 VanDerWaalsContact O-CB 3.31Å; F379-R383 WeakPolarHBondContact O-CB 3.19Å; F379-R383 PolarHBondContact O-N 3.12Å; F379-P389 HydrophobicContact CD1-CB 3.76Å; F379-P389 HydrophobicContact CD1-CG 3.73Å; F379-P389 HydrophobicContact CE1-CB 3.59Å; F379-P389 HydrophobicContact CE1-CG 3.69Å; F379-L393 HydrophobicContact CE1-CB 4.48Å; F379-L393 HydrophobicContact CE1-CD2 3.88Å; F379-L393 HydrophobicContact CE1-CG 3.85Å; F379-L393 HydrophobicContact CZ-CG 4.34Å; F379-L433 HydrophobicContact CD2-CD1 3.98Å; F379-L433 HydrophobicContact CE2-CD1 3.85Å; F379-E436 HydrophobicContact CB-CB 3.92Å; F379-E436 HydrophobicContact CB-CG 4.36Å; F379-E436 HydrophobicContact CD2-CB 3.96Å; F379-E436 HydrophobicContact CG-CB 4.44Å; F379-I437 HydrophobicContact CD2-CG1 4.42Å; F379-I437 HydrophobicContact CE2-CG1 3.74Å
380	R	97.2	Very high	96.2	Very high	68 Å²	68	64.3 Å²	64.3	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-54.6	173.9	-73.9	170.1	167.8	166.2	-4.3	111.7	L376 D377 I378 L382 R383 E384 D432 E436	L376-R380 HydrophobicContact CD1-CG 4.39Å; L376-R380 WeakPolarHBondContact O-CG 3.37Å; L376-R380 PolarHBondContact O-N 2.85Å; D377-R380 PolarHBondContact O-N 3.2Å; D377-R380 IonicContact OD1-NH1 2.67Å; I378-R380 VanDerWaalsContact C-N 3.32Å; I378-R380 PolarHBondContact O-N 3.39Å; R380-L382 VanDerWaalsContact C-N 3.34Å; R380-L382 PolarHBondContact O-N 3.31Å; R380-R383 PolarHBondContact O-N 3.11Å; R380-E384 WeakPolarHBondContact O-CB 3.46Å; R380-E384 WeakPolarHBondContact O-CG 3.32Å; R380-E384 PolarHBondContact O-N 3.4Å; R380-D432 IonicContact CZ-OD2 2.78Å; R380-D432 VanDerWaalsContact NH2-CG 3.26Å; R380-D432 IonicContact NH2-OD2 3.72Å; R380-D432 PolarHBondContact NH2-OD2 3.45Å; R380-E436 HydrophobicContact CG-CG 4.32Å
381	G	97.4	Very high	95.9	Very high	26 Å²	26	66.4 Å²	66.4	27%	0.268	32%	0.316	S	S	.	.	H	α-helix	trans	-60.3	-40	-179.1	0	0	0	0	0	113	D377 I378 N385	D377-G381 PolarHBondContact O-N 3.46Å; I378-G381 PolarHBondContact O-N 2.88Å; G381-N385 WeakPolarHBondContact O-CB 3.11Å; G381-N385 PolarHBondContact O-N 3.06Å; G381-N385 PolarHBondContact O-ND2 3.14Å
382	L	95.9	Very high	95.8	Very high	45 Å²	45	68.6 Å²	68.6	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-65.4	-46.8	174.4	-71.8	174.2	0	0	0	111.8	I378 R380 E384 N385 R386 R387 P389	I378-L382 HydrophobicContact CG2-CD1 3.65Å; I378-L382 HydrophobicContact CG2-CG 4.2Å; I378-L382 WeakPolarHBondContact O-CB 3.49Å; I378-L382 WeakPolarHBondContact O-CG 3.46Å; I378-L382 PolarHBondContact O-N 3.42Å; R380-L382 VanDerWaalsContact C-N 3.34Å; R380-L382 PolarHBondContact O-N 3.31Å; L382-E384 PolarHBondContact O-N 3.01Å; L382-N385 CarbonylContact O-C 3.55Å; L382-N385 PolarHBondContact O-N 2.74Å; L382-R386 PolarHBondContact O-N 3.02Å; L382-R386 VanDerWaalsContact O-N 3.1Å; L382-R387 CarbonylContact C-O 3.36Å; L382-R387 HydrophobicContact CB-CB 4.33Å; L382-R387 HydrophobicContact CD2-CB 3.9Å; L382-R387 PolarHBondContact O-N 3.26Å; L382-P389 HydrophobicContact CD1-CB 3.83Å
383	R	94.3	Very high	95.6	Very high	97 Å²	97	69.2 Å²	69.2	37%	0.366	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-43	178	-178.6	-170.1	63.6	-162.8	-18	112	F379 R380 N385 R386 E436	F379-R383 VanDerWaalsContact O-CB 3.31Å; F379-R383 WeakPolarHBondContact O-CB 3.19Å; F379-R383 PolarHBondContact O-N 3.12Å; R380-R383 PolarHBondContact O-N 3.11Å; R383-N385 VanDerWaalsContact C-N 3.32Å; R383-N385 PolarHBondContact O-N 2.68Å; R383-R386 WeakPolarHBondContact O-CA 3.45Å; R383-R386 PolarHBondContact O-N 3.39Å; R383-E436 IonicContact CZ-OE1 3.79Å; R383-E436 IonicContact CZ-OE2 3.99Å; R383-E436 IonicContact NE-OE2 2.68Å; R383-E436 IonicContact NH1-OE1 2.95Å; R383-E436 PolarHBondContact NH1-OE1 3.08Å; R383-E436 IonicContact NH1-OE2 3.56Å; R383-E436 PolarHBondContact NH1-OE2 3.01Å; R383-E436 IonicContact NH2-OE1 3.2Å; R383-E436 PolarHBondContact NH2-OE1 3.4Å; R383-E436 IonicContact NH2-OE2 3.11Å
384	E	95.3	Very high	95.6	Very high	138 Å²	138	65.6 Å²	65.6	65%	0.645	31%	0.312	S	S	*	.	H	α-helix	trans	-62.8	-40.1	177.6	-74.7	162.9	-152.4	0	0	111.4	R380 L382 R386	R380-E384 WeakPolarHBondContact O-CB 3.46Å; R380-E384 WeakPolarHBondContact O-CG 3.32Å; R380-E384 PolarHBondContact O-N 3.4Å; L382-E384 PolarHBondContact O-N 3.01Å; E384-R386 PolarHBondContact O-N 2.79Å
385	N	95.4	Very high	95.5	Very high	117 Å²	117	67 Å²	67	63%	0.626	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	10.7	171	-72	-71.7	0	0	0	114.2	G381 L382 R383 R387	G381-N385 WeakPolarHBondContact O-CB 3.11Å; G381-N385 PolarHBondContact O-N 3.06Å; G381-N385 PolarHBondContact O-ND2 3.14Å; L382-N385 CarbonylContact O-C 3.55Å; L382-N385 PolarHBondContact O-N 2.74Å; R383-N385 VanDerWaalsContact C-N 3.32Å; R383-N385 PolarHBondContact O-N 2.68Å; N385-R387 PolarHBondContact O-N 2.98Å; N385-R387 VanDerWaalsContact O-N 3.16Å
386	R	92.3	Very high	95.4	Very high	229 Å²	229	67.2 Å²	67.2	86%	0.864	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	24.3	-179.2	-53.3	-177.7	-179	-174.1	0.3	115	L382 R383 E384	L382-R386 PolarHBondContact O-N 3.02Å; L382-R386 VanDerWaalsContact O-N 3.1Å; R383-R386 WeakPolarHBondContact O-CA 3.45Å; R383-R386 PolarHBondContact O-N 3.39Å; E384-R386 PolarHBondContact O-N 2.79Å
387	R	93.8	Very high	95.4	Very high	166 Å²	166	66.8 Å²	66.8	63%	0.626	32%	0.319	S	S	*	.			trans	-96.4	170.9	172	-61.9	-176.8	-176.3	-168.2	0	110.1	L382 N385	L382-R387 CarbonylContact C-O 3.36Å; L382-R387 HydrophobicContact CB-CB 4.33Å; L382-R387 HydrophobicContact CD2-CB 3.9Å; L382-R387 PolarHBondContact O-N 3.26Å; N385-R387 PolarHBondContact O-N 2.98Å; N385-R387 VanDerWaalsContact O-N 3.16Å
388	H	90.2	Very high	95.4	Very high	90 Å²	90	67.1 Å²	67.1	42%	0.417	32%	0.316	S	S	.	.			trans	-125.4	143	175.1	-53.1	-35.4	0	0	0	109.1	F444	H388-F444 HydrophobicContact CB-CE1 4.11Å
389	P	94.1	Very high	95.5	Very high	8 Å²	8	65.5 Å²	65.5	5%	0.052	31%	0.31	C	S	.	.			trans	-67.4	154.8	175.5	29.7	-35.9	0	0	0	111.5	F379 L382 L393 V394 V440	F379-P389 HydrophobicContact CD1-CB 3.76Å; F379-P389 HydrophobicContact CD1-CG 3.73Å; F379-P389 HydrophobicContact CE1-CB 3.59Å; F379-P389 HydrophobicContact CE1-CG 3.69Å; L382-P389 HydrophobicContact CD1-CB 3.83Å; P389-L393 HydrophobicContact CB-CD2 4.22Å; P389-V394 HydrophobicContact CB-CG2 4.32Å; P389-V394 HydrophobicContact CG-CG2 3.68Å; P389-V440 HydrophobicContact CG-CG1 3.92Å; P389-V440 HydrophobicContact CG-CG2 3.92Å
390	A	92.9	Very high	95.5	Very high	42 Å²	42	65.4 Å²	65.4	35%	0.347	31%	0.31	S	S	.	.			trans	-62.4	149.3	173.2	0	0	0	0	0	111.5	Y392 L393 V394	A390-Y392 VanDerWaalsContact C-N 3.32Å; A390-Y392 HydrophobicContact CB-CD1 3.7Å; A390-Y392 HydrophobicContact CB-CE1 3.31Å; A390-Y392 PolarHBondContact O-N 2.88Å; A390-L393 WeakPolarHBondContact O-CB 3.37Å; A390-L393 PolarHBondContact O-N 2.84Å; A390-V394 PolarHBondContact O-N 3.29Å
391	S	93.7	Very high	95.6	Very high	67 Å²	67	62.4 Å²	62.4	47%	0.469	30%	0.299	S	S	.	.	H	α-helix	trans	-56.7	-42.2	-173.8	-174	0	0	0	0	113	L393 V394 H395	S391-L393 PolarHBondContact O-N 3.45Å; S391-V394 PolarHBondContact O-N 3.45Å; S391-H395 PolarHBondContact O-N 2.85Å; S391-H395 VanDerWaalsContact O-N 3.13Å; S391-H395 PolarHBondContact O-ND1 3.03Å; S391-H395 PolarHBondContact OG-CE1 2.86Å; S391-H395 PolarHBondContact OG-ND1 2.66Å
392	Y	94.6	Very high	95.6	Very high	46 Å²	46	66.1 Å²	66.1	18%	0.18	31%	0.312	C	S	.	.	H	α-helix	trans	-58.9	-36.6	178.9	72.2	-99.7	0	0	0	111.8	E117 S337 L338 A390 H395 G396	E117-Y392 HydrophobicContact CB-CE1 4.11Å; E117-Y392 HydrophobicContact CG-CE1 3.76Å; E117-Y392 PolarHBondContact OE1-OH 2.66Å; S337-Y392 WeakPolarHBondContact O-CD2 3.45Å; L338-Y392 HydrophobicContact CD2-CD2 4.21Å; L338-Y392 HydrophobicContact CD2-CE1 4.27Å; L338-Y392 HydrophobicContact CD2-CE2 3.86Å; A390-Y392 VanDerWaalsContact C-N 3.32Å; A390-Y392 HydrophobicContact CB-CD1 3.7Å; A390-Y392 HydrophobicContact CB-CE1 3.31Å; A390-Y392 PolarHBondContact O-N 2.88Å; Y392-H395 PolarHBondContact O-N 2.71Å; Y392-G396 PolarHBondContact O-N 3.45Å
393	L	95.8	Very high	95.7	Very high	12 Å²	12	64.7 Å²	64.7	6%	0.063	31%	0.307	C	S	.	.	H	α-helix	trans	-73	-33.5	-177.8	-166.9	65.9	0	0	0	111.6	I375 I378 F379 P389 A390 S391 G397	I375-L393 HydrophobicContact CD1-CD1 4.15Å; I375-L393 HydrophobicContact CG1-CD1 4.18Å; I378-L393 HydrophobicContact CG2-CD2 3.94Å; F379-L393 HydrophobicContact CE1-CB 4.48Å; F379-L393 HydrophobicContact CE1-CD2 3.88Å; F379-L393 HydrophobicContact CE1-CG 3.85Å; F379-L393 HydrophobicContact CZ-CG 4.34Å; P389-L393 HydrophobicContact CB-CD2 4.22Å; A390-L393 WeakPolarHBondContact O-CB 3.37Å; A390-L393 PolarHBondContact O-N 2.84Å; S391-L393 PolarHBondContact O-N 3.45Å; L393-G397 PolarHBondContact O-N 2.9Å
394	V	96.5	Very high	96	Very high	5 Å²	5	60 Å²	60	3%	0.03	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-46.2	172.4	-175.8	0	0	0	0	110.6	P389 A390 S391 K398 I437 V440 E441 F444	P389-V394 HydrophobicContact CB-CG2 4.32Å; P389-V394 HydrophobicContact CG-CG2 3.68Å; A390-V394 PolarHBondContact O-N 3.29Å; S391-V394 PolarHBondContact O-N 3.45Å; V394-K398 VanDerWaalsContact O-CB 3.25Å; V394-K398 WeakPolarHBondContact O-CB 3.45Å; V394-K398 PolarHBondContact O-N 2.81Å; V394-I437 HydrophobicContact CG1-CG2 4.39Å; V394-V440 HydrophobicContact CG2-CG1 3.72Å; V394-E441 HydrophobicContact CG1-CG 4.41Å; V394-F444 HydrophobicContact CG2-CE2 4.13Å; V394-F444 HydrophobicContact CG2-CZ 4.5Å
395	H	96.1	Very high	96.1	Very high	107 Å²	107	58.9 Å²	58.9	50%	0.495	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-46.1	176.8	-70.3	80.6	0	0	0	111.4	S391 Y392 K398 A399	S391-H395 PolarHBondContact O-N 2.85Å; S391-H395 VanDerWaalsContact O-N 3.13Å; S391-H395 PolarHBondContact O-ND1 3.03Å; S391-H395 PolarHBondContact OG-CE1 2.86Å; S391-H395 PolarHBondContact OG-ND1 2.66Å; Y392-H395 PolarHBondContact O-N 2.71Å; H395-K398 WeakPolarHBondContact O-CB 3.45Å; H395-K398 PolarHBondContact O-N 2.68Å; H395-A399 PolarHBondContact O-N 2.85Å
396	G	97.1	Very high	96.2	Very high	4 Å²	4	55.2 Å²	55.2	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-46.3	177.8	0	0	0	0	0	113.3	Y392 K398 A399 L400	Y392-G396 PolarHBondContact O-N 3.45Å; G396-K398 VanDerWaalsContact C-N 3.25Å; G396-K398 PolarHBondContact O-N 3.24Å; G396-A399 PolarHBondContact O-N 2.81Å; G396-L400 WeakPolarHBondContact O-CB 3.39Å; G396-L400 PolarHBondContact O-N 2.87Å
397	G	98	Very high	96.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-32.1	174.3	0	0	0	0	0	113	L393 N401	L393-G397 PolarHBondContact O-N 2.9Å; G397-N401 WeakPolarHBondContact O-CB 2.98Å; G397-N401 PolarHBondContact O-N 2.97Å
398	K	98.3	Very high	96.7	Very high	90 Å²	90	38.4 Å²	38.4	39%	0.391	21%	0.206	S	C	.	.	H	α-helix	trans	-71	-43.2	174.3	-172.2	173.3	-177.9	172.8	0	112.4	V394 H395 G396 N401 L402 I437 E441	V394-K398 VanDerWaalsContact O-CB 3.25Å; V394-K398 WeakPolarHBondContact O-CB 3.45Å; V394-K398 PolarHBondContact O-N 2.81Å; H395-K398 WeakPolarHBondContact O-CB 3.45Å; H395-K398 PolarHBondContact O-N 2.68Å; G396-K398 VanDerWaalsContact C-N 3.25Å; G396-K398 PolarHBondContact O-N 3.24Å; K398-N401 PolarHBondContact O-N 3.04Å; K398-L402 WeakPolarHBondContact O-CG 3.49Å; K398-L402 PolarHBondContact O-N 3.28Å; K398-L402 VanDerWaalsContact O-N 3.12Å; K398-I437 HydrophobicContact CB-CD1 4.28Å; K398-I437 HydrophobicContact CB-CG2 4.38Å; K398-I437 HydrophobicContact CD-CG2 4.43Å; K398-I437 HydrophobicContact CG-CG2 4.5Å; K398-E441 IonicContact NZ-OE1 2.68Å; K398-E441 PolarHBondContact NZ-OE1 2.94Å; K398-E441 IonicContact NZ-OE2 3.77Å
399	A	98.5	Very high	97	Very high	16 Å²	16	39.8 Å²	39.8	13%	0.132	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-46.9	173.4	0	0	0	0	0	111.5	E341 L344 H395 G396 N401 L402 A403	E341-A399 HydrophobicContact CB-CB 3.95Å; E341-A399 HydrophobicContact CG-CB 4.07Å; L344-A399 HydrophobicContact CD1-CB 4.05Å; H395-A399 PolarHBondContact O-N 2.85Å; G396-A399 PolarHBondContact O-N 2.81Å; A399-N401 PolarHBondContact O-N 2.92Å; A399-L402 WeakPolarHBondContact O-CB 3.46Å; A399-L402 PolarHBondContact O-N 3.3Å; A399-A403 PolarHBondContact O-N 3.35Å
400	L	98.4	Very high	97.1	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.5	-41.7	178.3	-169.9	61.9	0	0	0	112.6	I340 L344 C368 V371 I375 G396 L402 A403 F404	I340-L400 HydrophobicContact CG2-CB 4.19Å; I340-L400 HydrophobicContact CG2-CD1 4.43Å; L344-L400 HydrophobicContact CD1-CD1 4.45Å; C368-L400 HydrophobicContact CB-CD1 3.83Å; V371-L400 HydrophobicContact CB-CD2 4.38Å; V371-L400 HydrophobicContact CG1-CD2 3.91Å; I375-L400 HydrophobicContact CD1-CD2 4.24Å; G396-L400 WeakPolarHBondContact O-CB 3.39Å; G396-L400 PolarHBondContact O-N 2.87Å; L400-L402 VanDerWaalsContact C-N 3.25Å; L400-L402 PolarHBondContact O-N 3.28Å; L400-A403 PolarHBondContact O-N 3.49Å; L400-F404 HydrophobicContact CD1-CE1 3.9Å; L400-F404 HydrophobicContact CD1-CZ 3.93Å; L400-F404 HydrophobicContact CD2-CE2 4.29Å; L400-F404 HydrophobicContact CD2-CZ 3.94Å; L400-F404 HydrophobicContact CG-CE1 4.03Å; L400-F404 HydrophobicContact CG-CE2 3.88Å; L400-F404 HydrophobicContact CG-CZ 3.59Å; L400-F404 VanDerWaalsContact O-CG 3.3Å; L400-F404 WeakPolarHBondContact O-CG 3.33Å; L400-F404 PolarHBondContact O-N 3.02Å
401	N	98.6	Very high	97.2	Very high	6 Å²	6	55.4 Å²	55.4	3%	0.032	27%	0.273	C	S	.	.	H	α-helix	trans	-70.4	-18.7	175.3	-164.9	12.6	0	0	0	113.4	G397 K398 A399 R405 I430 L433 A434 I437	G397-N401 WeakPolarHBondContact O-CB 2.98Å; G397-N401 PolarHBondContact O-N 2.97Å; K398-N401 PolarHBondContact O-N 3.04Å; A399-N401 PolarHBondContact O-N 2.92Å; N401-R405 WeakPolarHBondContact O-CD 3.29Å; N401-R405 WeakPolarHBondContact O-CG 3.22Å; N401-R405 PolarHBondContact O-NE 3.18Å; N401-I430 PolarHBondContact OD1-O 3.15Å; N401-L433 HydrophobicContact CB-CD2 3.83Å; N401-L433 HydrophobicContact CB-CG 4.13Å; N401-A434 VanDerWaalsContact ND2-CA 3.3Å; N401-A434 WeakPolarHBondContact ND2-CA 3.39Å; N401-A434 WeakPolarHBondContact ND2-CB 3.43Å; N401-A434 PolarHBondContact ND2-N 3.24Å; N401-I437 HydrophobicContact CB-CD1 4.28Å
402	L	98.6	Very high	97.3	Very high	104 Å²	104	53.3 Å²	53.3	55%	0.545	26%	0.259	S	S	.	.	H	α-helix	trans	-79.8	-40.3	169	-71.2	168.2	0	0	0	111.1	K398 A399 L400 R405 A406	K398-L402 WeakPolarHBondContact O-CG 3.49Å; K398-L402 PolarHBondContact O-N 3.28Å; K398-L402 VanDerWaalsContact O-N 3.12Å; A399-L402 WeakPolarHBondContact O-CB 3.46Å; A399-L402 PolarHBondContact O-N 3.3Å; L400-L402 VanDerWaalsContact C-N 3.25Å; L400-L402 PolarHBondContact O-N 3.28Å; L402-R405 PolarHBondContact O-N 2.9Å; L402-A406 PolarHBondContact O-N 3.26Å; L402-A406 VanDerWaalsContact O-N 3.11Å
403	A	98.5	Very high	97.4	Very high	14 Å²	14	53.8 Å²	53.8	12%	0.116	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-52.6	174.1	0	0	0	0	0	111.5	L344 A399 L400 R405 A406 W407	L344-A403 HydrophobicContact CD1-CB 4.15Å; L344-A403 HydrophobicContact CD2-CB 3.95Å; A399-A403 PolarHBondContact O-N 3.35Å; L400-A403 PolarHBondContact O-N 3.49Å; A403-R405 PolarHBondContact O-N 2.71Å; A403-R405 VanDerWaalsContact O-N 3.13Å; A403-A406 WeakPolarHBondContact O-CA 3.37Å; A403-A406 WeakPolarHBondContact O-CB 3.2Å; A403-A406 PolarHBondContact O-N 2.99Å; A403-W407 HydrophobicContact CB-CD2 4.4Å; A403-W407 HydrophobicContact CB-CH2 4.13Å; A403-W407 HydrophobicContact CB-CZ2 3.79Å; A403-W407 VanDerWaalsContact O-CG 3.24Å; A403-W407 PolarHBondContact O-N 3.47Å
404	F	98.6	Very high	97.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-51.3	-40.5	174.6	-65.4	-24.5	0	0	0	113.3	C368 W369 L400 A406 W407 T408 L429 I430 L433	C368-F404 HydrophobicContact CB-CE1 4.33Å; C368-F404 VanDerWaalsContact O-CZ 3.3Å; C368-F404 WeakPolarHBondContact O-CZ 3.43Å; W369-F404 AromaticContact CD2-CD1 3.84Å; W369-F404 HydrophobicContact CD2-CD1 3.84Å; W369-F404 AromaticContact CD2-CE1 3.65Å; W369-F404 HydrophobicContact CD2-CE1 3.65Å; W369-F404 HydrophobicContact CD2-CZ 4.29Å; W369-F404 AromaticContact CE2-CD1 3.96Å; W369-F404 AromaticContact CE3-CD1 3.58Å; W369-F404 HydrophobicContact CE3-CD1 3.58Å; W369-F404 HydrophobicContact CE3-CD2 4.2Å; W369-F404 AromaticContact CE3-CE1 3.47Å; W369-F404 HydrophobicContact CE3-CE1 3.47Å; W369-F404 VanDerWaalsContact CE3-CE1 3.47Å; W369-F404 HydrophobicContact CE3-CE2 4.12Å; W369-F404 AromaticContact CE3-CG 3.95Å; W369-F404 HydrophobicContact CE3-CG 3.95Å; W369-F404 AromaticContact CE3-CZ 3.75Å; W369-F404 HydrophobicContact CE3-CZ 3.75Å; W369-F404 HydrophobicContact CG-CE1 4.16Å; W369-F404 HydrophobicContact CH2-CB 3.64Å; W369-F404 AromaticContact CH2-CD1 3.65Å; W369-F404 HydrophobicContact CH2-CD1 3.65Å; W369-F404 HydrophobicContact CH2-CD2 4.47Å; W369-F404 HydrophobicContact CH2-CE1 4.4Å; W369-F404 AromaticContact CH2-CG 3.69Å; W369-F404 HydrophobicContact CH2-CG 3.69Å; W369-F404 HydrophobicContact CZ2-CB 4.41Å; W369-F404 AromaticContact CZ2-CD1 3.89Å; W369-F404 HydrophobicContact CZ2-CD1 3.89Å; W369-F404 HydrophobicContact CZ2-CG 4.37Å; W369-F404 HydrophobicContact CZ3-CB 3.84Å; W369-F404 AromaticContact CZ3-CD1 3.49Å; W369-F404 HydrophobicContact CZ3-CD1 3.49Å; W369-F404 VanDerWaalsContact CZ3-CD1 3.49Å; W369-F404 AromaticContact CZ3-CD2 3.81Å; W369-F404 HydrophobicContact CZ3-CD2 3.81Å; W369-F404 AromaticContact CZ3-CE1 3.88Å; W369-F404 HydrophobicContact CZ3-CE1 3.88Å; W369-F404 HydrophobicContact CZ3-CE2 4.18Å; W369-F404 AromaticContact CZ3-CG 3.45Å; W369-F404 HydrophobicContact CZ3-CG 3.45Å; W369-F404 VanDerWaalsContact CZ3-CG 3.45Å; W369-F404 HydrophobicContact CZ3-CZ 4.2Å; L400-F404 HydrophobicContact CD1-CE1 3.9Å; L400-F404 HydrophobicContact CD1-CZ 3.93Å; L400-F404 HydrophobicContact CD2-CE2 4.29Å; L400-F404 HydrophobicContact CD2-CZ 3.94Å; L400-F404 HydrophobicContact CG-CE1 4.03Å; L400-F404 HydrophobicContact CG-CE2 3.88Å; L400-F404 HydrophobicContact CG-CZ 3.59Å; L400-F404 VanDerWaalsContact O-CG 3.3Å; L400-F404 WeakPolarHBondContact O-CG 3.33Å; L400-F404 PolarHBondContact O-N 3.02Å; F404-A406 VanDerWaalsContact C-N 3.32Å; F404-W407 AromaticContact CD1-CE3 3.92Å; F404-W407 HydrophobicContact CD1-CE3 3.92Å; F404-W407 AromaticContact CD1-CZ3 3.85Å; F404-W407 HydrophobicContact CD1-CZ3 3.85Å; F404-W407 HydrophobicContact CE1-CZ3 4.08Å; F404-T408 WeakPolarHBondContact O-CG2 3.35Å; F404-T408 PolarHBondContact O-N 3.14Å; F404-T408 PolarHBondContact O-OG1 2.96Å; F404-T408 VanDerWaalsContact O-OG1 3.09Å; F404-L429 HydrophobicContact CE2-CD2 4.13Å; F404-L429 HydrophobicContact CE2-CG 4.44Å; F404-I430 HydrophobicContact CB-CD1 3.93Å; F404-I430 HydrophobicContact CB-CG1 3.78Å; F404-I430 HydrophobicContact CD2-CG1 4.38Å; F404-L433 HydrophobicContact CE2-CD2 4.21Å
405	R	98.3	Very high	97.3	Very high	114 Å²	114	63.3 Å²	63.3	43%	0.43	32%	0.32	S	S	.	.	H	α-helix	trans	-71.9	-23.6	177.9	-72.8	169.1	-174.8	-158.9	-0.8	113.9	N401 L402 A403 K409 I430	N401-R405 WeakPolarHBondContact O-CD 3.29Å; N401-R405 WeakPolarHBondContact O-CG 3.22Å; N401-R405 PolarHBondContact O-NE 3.18Å; L402-R405 PolarHBondContact O-N 2.9Å; A403-R405 PolarHBondContact O-N 2.71Å; A403-R405 VanDerWaalsContact O-N 3.13Å; R405-K409 WeakPolarHBondContact O-CG 3.43Å; R405-I430 HydrophobicContact CG-CG2 3.59Å
406	A	98	Very high	97.4	Very high	39 Å²	39	59.1 Å²	59.1	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-77.6	-50.5	173.3	0	0	0	0	0	109.8	L402 A403 F404 T408 K409	L402-A406 PolarHBondContact O-N 3.26Å; L402-A406 VanDerWaalsContact O-N 3.11Å; A403-A406 WeakPolarHBondContact O-CA 3.37Å; A403-A406 WeakPolarHBondContact O-CB 3.2Å; A403-A406 PolarHBondContact O-N 2.99Å; F404-A406 VanDerWaalsContact C-N 3.32Å; A406-T408 VanDerWaalsContact C-N 3.33Å; A406-T408 PolarHBondContact O-N 3.11Å; A406-K409 WeakPolarHBondContact O-CB 3.42Å; A406-K409 WeakPolarHBondContact O-CG 3.28Å; A406-K409 PolarHBondContact O-N 3.03Å; A406-K409 VanDerWaalsContact O-N 3.1Å
407	W	98.3	Very high	97.3	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.008	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-39.6	179.6	-53	-20.3	0	0	0	111.8	L344 Y347 E365 C368 W369 A403 F404 K409 L413 H416	L344-W407 HydrophobicContact CD2-CH2 4.09Å; L344-W407 HydrophobicContact CD2-CZ2 4.06Å; Y347-W407 HydrophobicContact CD1-CZ2 4.48Å; Y347-W407 HydrophobicContact CE1-CZ2 4.24Å; E365-W407 HydrophobicContact CB-CE3 4.16Å; E365-W407 HydrophobicContact CB-CH2 4.03Å; E365-W407 HydrophobicContact CB-CZ3 3.76Å; E365-W407 HydrophobicContact CG-CD2 4.35Å; E365-W407 HydrophobicContact CG-CE3 4.17Å; E365-W407 HydrophobicContact CG-CH2 3.68Å; E365-W407 HydrophobicContact CG-CZ2 3.85Å; E365-W407 HydrophobicContact CG-CZ3 3.85Å; E365-W407 VanDerWaalsContact OE2-CD2 3.32Å; C368-W407 HydrophobicContact CB-CH2 3.93Å; C368-W407 HydrophobicContact CB-CZ3 3.94Å; W369-W407 HydrophobicContact CZ2-CE3 4.35Å; A403-W407 HydrophobicContact CB-CD2 4.4Å; A403-W407 HydrophobicContact CB-CH2 4.13Å; A403-W407 HydrophobicContact CB-CZ2 3.79Å; A403-W407 VanDerWaalsContact O-CG 3.24Å; A403-W407 PolarHBondContact O-N 3.47Å; F404-W407 AromaticContact CD1-CE3 3.92Å; F404-W407 HydrophobicContact CD1-CE3 3.92Å; F404-W407 AromaticContact CD1-CZ3 3.85Å; F404-W407 HydrophobicContact CD1-CZ3 3.85Å; F404-W407 HydrophobicContact CE1-CZ3 4.08Å; W407-K409 VanDerWaalsContact C-N 3.33Å; W407-K409 PolarHBondContact O-N 3.47Å; W407-L413 WeakPolarHBondContact O-CA 3.28Å; W407-L413 PolarHBondContact O-N 2.7Å; W407-H416 HydrophobicContact CB-CB 4.14Å; W407-H416 AromaticContact CD1-CE1 3.03Å; W407-H416 AromaticContact CD1-ND1 3.66Å; W407-H416 AromaticContact CD1-NE2 3.43Å; W407-H416 AromaticContact CG-CE1 3.49Å; W407-H416 VanDerWaalsContact CG-CE1 3.49Å; W407-H416 AromaticContact CG-ND1 3.62Å; W407-H416 AromaticContact CG-NE2 3.98Å; W407-H416 AromaticContact NE1-CE1 3.61Å
408	T	97.7	Very high	97.2	Very high	40 Å²	40	70.5 Å²	70.5	25%	0.245	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	25.1	175.5	75.1	0	0	0	0	114.9	W369 F404 A406 T426 I430	W369-T408 HydrophobicContact CH2-CG2 3.67Å; W369-T408 HydrophobicContact CZ2-CG2 3.86Å; F404-T408 WeakPolarHBondContact O-CG2 3.35Å; F404-T408 PolarHBondContact O-N 3.14Å; F404-T408 PolarHBondContact O-OG1 2.96Å; F404-T408 VanDerWaalsContact O-OG1 3.09Å; A406-T408 VanDerWaalsContact C-N 3.33Å; A406-T408 PolarHBondContact O-N 3.11Å; T408-T426 HydrophobicContact CG2-CG2 4.3Å; T408-I430 HydrophobicContact CG2-CD1 4.24Å; T408-I430 WeakPolarHBondContact OG1-CD1 3.27Å
409	K	97	Very high	97.1	Very high	119 Å²	119	68.6 Å²	68.6	52%	0.517	35%	0.349	S	S	.	.	S	Bend	trans	-75.1	144.9	166.1	-73.4	179.7	-178.1	175.7	0	109.7	R405 A406 W407 E411 A412 L413	R405-K409 WeakPolarHBondContact O-CG 3.43Å; A406-K409 WeakPolarHBondContact O-CB 3.42Å; A406-K409 WeakPolarHBondContact O-CG 3.28Å; A406-K409 PolarHBondContact O-N 3.03Å; A406-K409 VanDerWaalsContact O-N 3.1Å; W407-K409 VanDerWaalsContact C-N 3.33Å; W407-K409 PolarHBondContact O-N 3.47Å; K409-E411 PolarHBondContact O-N 2.67Å; K409-A412 HydrophobicContact CB-CB 4.36Å; K409-A412 PolarHBondContact O-N 2.97Å; K409-L413 WeakPolarHBondContact O-CB 3.43Å; K409-L413 PolarHBondContact O-N 3.32Å
410	K	95.4	Very high	97	Very high	202 Å²	202	69.3 Å²	69.3	88%	0.878	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-34.3	176.9	-173.3	-175.4	175.7	-170.9	0	113.7
411	E	95.9	Very high	96.9	Very high	177 Å²	177	69.4 Å²	69.4	83%	0.827	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-22.1	-178.3	-69	157.1	-169.2	0	0	114	K409	K409-E411 PolarHBondContact O-N 2.67Å
412	A	95.8	Very high	96.5	Very high	22 Å²	22	77.7 Å²	77.7	18%	0.182	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-24.4	-175.6	0	0	0	0	0	112.8	K409 P414 D415 H416	K409-A412 HydrophobicContact CB-CB 4.36Å; K409-A412 PolarHBondContact O-N 2.97Å; A412-P414 VanDerWaalsContact C-N 3.29Å; A412-P414 VanDerWaalsContact O-N 3.08Å; A412-D415 WeakPolarHBondContact O-CB 3Å; A412-D415 PolarHBondContact O-N 3.18Å; A412-H416 PolarHBondContact O-CD2 2.86Å; A412-H416 VanDerWaalsContact O-CD2 3.23Å
413	L	95.9	Very high	96.3	Very high	56 Å²	56	77 Å²	77	29%	0.293	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-48	-38.6	-175.3	-178.7	64.6	0	0	0	114.7	W407 K409 D415 H416 E417 I420	W407-L413 WeakPolarHBondContact O-CA 3.28Å; W407-L413 PolarHBondContact O-N 2.7Å; K409-L413 WeakPolarHBondContact O-CB 3.43Å; K409-L413 PolarHBondContact O-N 3.32Å; L413-D415 PolarHBondContact O-N 3.21Å; L413-H416 CarbonylContact O-C 3.58Å; L413-H416 PolarHBondContact O-N 2.93Å; L413-E417 HydrophobicContact CD1-CB 3.91Å; L413-E417 HydrophobicContact CG-CB 4.17Å; L413-E417 WeakPolarHBondContact O-CB 3.41Å; L413-E417 PolarHBondContact O-N 3.34Å; L413-I420 HydrophobicContact CD1-CD1 4.04Å
414	P	97.2	Very high	96.1	Very high	82 Å²	82	76.9 Å²	76.9	53%	0.532	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-62.2	-25.6	176	-24.3	36.3	0	0	0	114.9	A412 H416	A412-P414 VanDerWaalsContact C-N 3.29Å; A412-P414 VanDerWaalsContact O-N 3.08Å; P414-H416 PolarHBondContact O-N 2.95Å
415	D	93.9	Very high	96.1	Very high	135 Å²	135	87.1 Å²	87.1	72%	0.722	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-83.6	-1.7	176.5	-56	-37.9	0	0	0	112.5	A412 L413	A412-D415 WeakPolarHBondContact O-CB 3Å; A412-D415 PolarHBondContact O-N 3.18Å; L413-D415 PolarHBondContact O-N 3.21Å
416	H	96.6	Very high	96	Very high	19 Å²	19	83.1 Å²	83.1	9%	0.088	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137	-20.1	-165.1	-73.8	-74.7	0	0	0	114.4	K351 E365 W407 A412 L413 P414 D418 E419 I420	K351-H416 PolarHBondContact NZ-CE1 2.97Å; E365-H416 IonicContact OE1-CE1 2.74Å; E365-H416 PolarHBondContact OE1-CE1 2.87Å; E365-H416 IonicContact OE1-ND1 2.66Å; E365-H416 PolarHBondContact OE1-ND1 3.25Å; E365-H416 IonicContact OE2-CE1 3.35Å; E365-H416 IonicContact OE2-CG 3.79Å; E365-H416 IonicContact OE2-ND1 3.62Å; E365-H416 PolarHBondContact OE2-ND1 3.43Å; W407-H416 HydrophobicContact CB-CB 4.14Å; W407-H416 AromaticContact CD1-CE1 3.03Å; W407-H416 AromaticContact CD1-ND1 3.66Å; W407-H416 AromaticContact CD1-NE2 3.43Å; W407-H416 AromaticContact CG-CE1 3.49Å; W407-H416 VanDerWaalsContact CG-CE1 3.49Å; W407-H416 AromaticContact CG-ND1 3.62Å; W407-H416 AromaticContact CG-NE2 3.98Å; W407-H416 AromaticContact NE1-CE1 3.61Å; A412-H416 PolarHBondContact O-CD2 2.86Å; A412-H416 VanDerWaalsContact O-CD2 3.23Å; L413-H416 CarbonylContact O-C 3.58Å; L413-H416 PolarHBondContact O-N 2.93Å; P414-H416 PolarHBondContact O-N 2.95Å; H416-D418 VanDerWaalsContact C-N 3.34Å; H416-D418 PolarHBondContact O-N 3.02Å; H416-E419 PolarHBondContact O-N 3.36Å; H416-I420 WeakPolarHBondContact O-CG1 3.32Å
417	E	95.6	Very high	96	Very high	102 Å²	102	85.3 Å²	85.3	48%	0.477	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-68	-30.9	-169.7	60.8	-170.6	153.6	0	0	113.9	L413 E419 I420	L413-E417 HydrophobicContact CD1-CB 3.91Å; L413-E417 HydrophobicContact CG-CB 4.17Å; L413-E417 WeakPolarHBondContact O-CB 3.41Å; L413-E417 PolarHBondContact O-N 3.34Å; E417-E419 VanDerWaalsContact C-N 3.31Å; E417-E419 PolarHBondContact O-N 2.88Å; E417-I420 HydrophobicContact CB-CD1 4.46Å; E417-I420 WeakPolarHBondContact O-CB 3.38Å; E417-I420 WeakPolarHBondContact O-CG1 3.41Å; E417-I420 PolarHBondContact O-N 3.31Å
418	D	95.4	Very high	96	Very high	141 Å²	141	89.9 Å²	89.9	75%	0.754	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-67.5	-23	177.2	-74.5	-23.7	0	0	0	113.9	F226 H416	F226-D418 WeakPolarHBondContact CE1-O 3.28Å; F226-D418 WeakPolarHBondContact CZ-O 2.85Å; H416-D418 VanDerWaalsContact C-N 3.34Å; H416-D418 PolarHBondContact O-N 3.02Å
419	E	95.9	Very high	96	Very high	50 Å²	50	88.6 Å²	88.6	23%	0.234	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-87	-3	175.5	-81.4	-155.7	-117.6	0	0	113.4	N363 F364 E365 T366 H416 E417 P421	N363-E419 WeakPolarHBondContact CA-OE2 3.49Å; F364-E419 PolarHBondContact N-OE2 3.42Å; F364-E419 VanDerWaalsContact N-OE2 3.14Å; E365-E419 WeakPolarHBondContact CA-OE2 3.33Å; E365-E419 HydrophobicContact CB-CB 3.96Å; E365-E419 HydrophobicContact CB-CG 4.45Å; E365-E419 WeakPolarHBondContact CB-OE2 3.4Å; E365-E419 PolarHBondContact N-OE2 2.89Å; T366-E419 VanDerWaalsContact CA-O 3.27Å; T366-E419 WeakPolarHBondContact CA-O 3.48Å; T366-E419 WeakPolarHBondContact CB-O 3.28Å; T366-E419 PolarHBondContact N-OE2 3.21Å; T366-E419 PolarHBondContact OG1-O 3.26Å; T366-E419 PolarHBondContact OG1-OE2 3.33Å; H416-E419 PolarHBondContact O-N 3.36Å; E417-E419 VanDerWaalsContact C-N 3.31Å; E417-E419 PolarHBondContact O-N 2.88Å; E419-P421 WeakPolarHBondContact O-CD 3.43Å
420	I	97	Very high	96.1	Very high	32 Å²	32	83.7 Å²	83.7	16%	0.164	42%	0.416	C	S	.	.	S	Bend	trans	-83.9	119.8	-173.7	-52.3	-176.8	0	0	0	110.7	W369 L413 H416 E417 E422 T426	W369-I420 HydrophobicContact CZ2-CD1 4.3Å; W369-I420 HydrophobicContact CZ2-CG1 4.38Å; L413-I420 HydrophobicContact CD1-CD1 4.04Å; H416-I420 WeakPolarHBondContact O-CG1 3.32Å; E417-I420 HydrophobicContact CB-CD1 4.46Å; E417-I420 WeakPolarHBondContact O-CB 3.38Å; E417-I420 WeakPolarHBondContact O-CG1 3.41Å; E417-I420 PolarHBondContact O-N 3.31Å; I420-E422 PolarHBondContact O-N 2.94Å; I420-T426 HydrophobicContact CD1-CG2 4.15Å; I420-T426 HydrophobicContact CG2-CG2 3.55Å
421	P	95.6	Very high	96.3	Very high	1 Å²	1	80.3 Å²	80.3	1%	0.006	40%	0.402	C	S	.	.			trans	-66.4	130.6	178.6	-14.3	25.5	0	0	0	112.3	T366 W369 Y370 E419 T423 V424	T366-P421 HydrophobicContact CG2-CG 3.88Å; W369-P421 HydrophobicContact CB-CG 3.92Å; Y370-P421 HydrophobicContact CD2-CG 4.18Å; Y370-P421 HydrophobicContact CE1-CB 4.03Å; Y370-P421 HydrophobicContact CE1-CG 4.21Å; Y370-P421 HydrophobicContact CE2-CB 4.13Å; Y370-P421 HydrophobicContact CE2-CG 3.76Å; E419-P421 WeakPolarHBondContact O-CD 3.43Å; P421-T423 PolarHBondContact O-N 3.26Å; P421-V424 HydrophobicContact CB-CG2 4.01Å; P421-V424 HydrophobicContact CG-CG2 4.09Å; P421-V424 WeakPolarHBondContact O-CB 3.07Å; P421-V424 PolarHBondContact O-N 3.09Å
422	E	92.2	Very high	96.4	Very high	181 Å²	181	72.4 Å²	72.4	85%	0.846	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-30.8	178.6	-59.5	-174.3	168.4	0	0	113.7	I420 V424	I420-E422 PolarHBondContact O-N 2.94Å; E422-V424 PolarHBondContact O-N 3.08Å
423	T	93.1	Very high	96.5	Very high	88 Å²	88	71.4 Å²	71.4	54%	0.54	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	1.7	179	76.1	0	0	0	0	114.4	K373 P421	K373-T423 PolarHBondContact NZ-O 2.68Å; P421-T423 PolarHBondContact O-N 3.26Å
424	V	95.4	Very high	96.6	Very high	13 Å²	13	69 Å²	69	8%	0.079	35%	0.345	C	S	.	.			trans	-115.9	108.1	-174.1	177.8	0	0	0	0	111	W369 K373 P421 E422 T426 L429	W369-V424 HydrophobicContact CB-CG1 4.44Å; W369-V424 HydrophobicContact CB-CG2 4.42Å; W369-V424 HydrophobicContact CD2-CG1 4.39Å; W369-V424 HydrophobicContact CE3-CG1 3.82Å; W369-V424 HydrophobicContact CZ3-CG1 4.5Å; K373-V424 HydrophobicContact CD-CG2 4.33Å; P421-V424 HydrophobicContact CB-CG2 4.01Å; P421-V424 HydrophobicContact CG-CG2 4.09Å; P421-V424 WeakPolarHBondContact O-CB 3.07Å; P421-V424 PolarHBondContact O-N 3.09Å; E422-V424 PolarHBondContact O-N 3.08Å; V424-T426 PolarHBondContact O-N 3.04Å; V424-L429 HydrophobicContact CG1-CD2 3.67Å
425	R	97.1	Very high	96.6	Very high	215 Å²	215	71.4 Å²	71.4	81%	0.811	34%	0.343	S	S	*	.			trans	-80.4	81.8	173.5	-58.7	-176.2	-164.2	170.2	5.6	110.3	V427 Q428 L429	R425-V427 PolarHBondContact O-N 2.92Å; R425-Q428 HydrophobicContact CB-CB 4.08Å; R425-Q428 WeakPolarHBondContact O-CA 3.45Å; R425-Q428 WeakPolarHBondContact O-CB 3.07Å; R425-Q428 PolarHBondContact O-N 3.33Å; R425-L429 PolarHBondContact O-N 2.92Å
426	T	97.6	Very high	96.8	Very high	30 Å²	30	65.3 Å²	65.3	18%	0.184	31%	0.31	C	S	.	.	H	α-helix	trans	-38.3	-57.5	-174.9	57.4	0	0	0	0	114.4	W369 T408 I420 V424 Q428 L429 I430	W369-T426 HydrophobicContact CE3-CG2 4.42Å; W369-T426 HydrophobicContact CH2-CG2 3.66Å; W369-T426 HydrophobicContact CZ2-CG2 4.02Å; W369-T426 HydrophobicContact CZ3-CG2 3.89Å; T408-T426 HydrophobicContact CG2-CG2 4.3Å; I420-T426 HydrophobicContact CD1-CG2 4.15Å; I420-T426 HydrophobicContact CG2-CG2 3.55Å; V424-T426 PolarHBondContact O-N 3.04Å; T426-Q428 VanDerWaalsContact C-N 3.29Å; T426-Q428 PolarHBondContact O-N 2.7Å; T426-L429 PolarHBondContact O-N 3.3Å; T426-I430 WeakPolarHBondContact O-CB 3.41Å; T426-I430 VanDerWaalsContact O-CG1 3.31Å; T426-I430 WeakPolarHBondContact O-CG1 3.48Å; T426-I430 PolarHBondContact O-N 3.26Å
427	V	97.6	Very high	96.8	Very high	85 Å²	85	64.7 Å²	64.7	52%	0.515	31%	0.308	S	S	.	.	H	α-helix	trans	-60.5	-35.2	-178.2	178.9	0	0	0	0	112.7	R425 K431	R425-V427 PolarHBondContact O-N 2.92Å; V427-K431 HydrophobicContact CG1-CD 4.12Å; V427-K431 WeakPolarHBondContact O-CB 3.13Å; V427-K431 WeakPolarHBondContact O-CD 3.44Å; V427-K431 WeakPolarHBondContact O-CG 3.5Å; V427-K431 PolarHBondContact O-N 2.96Å
428	Q	98.3	Very high	96.8	Very high	98 Å²	98	66.6 Å²	66.6	46%	0.458	31%	0.311	S	S	.	.	H	α-helix	trans	-73.7	-46.1	176.7	-173.9	64.4	34.1	0	0	110.7	R425 T426 K431 D432	R425-Q428 HydrophobicContact CB-CB 4.08Å; R425-Q428 WeakPolarHBondContact O-CA 3.45Å; R425-Q428 WeakPolarHBondContact O-CB 3.07Å; R425-Q428 PolarHBondContact O-N 3.33Å; T426-Q428 VanDerWaalsContact C-N 3.29Å; T426-Q428 PolarHBondContact O-N 2.7Å; Q428-K431 PolarHBondContact O-N 2.62Å; Q428-D432 VanDerWaalsContact NE2-CG 3.31Å; Q428-D432 PolarHBondContact NE2-OD1 2.68Å; Q428-D432 PolarHBondContact NE2-OD2 3.28Å; Q428-D432 WeakPolarHBondContact O-CB 3.26Å; Q428-D432 PolarHBondContact O-N 2.73Å
429	L	98.4	Very high	96.8	Very high	12 Å²	12	63.1 Å²	63.1	6%	0.063	29%	0.292	C	S	.	.	H	α-helix	trans	-58.8	-50	179	175.8	55.2	0	0	0	111.4	W369 K373 L376 F404 V424 R425 T426 K431 D432 L433	W369-L429 HydrophobicContact CE3-CD2 3.95Å; W369-L429 HydrophobicContact CZ3-CD2 4.26Å; K373-L429 HydrophobicContact CB-CD2 4.42Å; L376-L429 HydrophobicContact CB-CD1 4.12Å; L376-L429 HydrophobicContact CD2-CD1 3.7Å; F404-L429 HydrophobicContact CE2-CD2 4.13Å; F404-L429 HydrophobicContact CE2-CG 4.44Å; V424-L429 HydrophobicContact CG1-CD2 3.67Å; R425-L429 PolarHBondContact O-N 2.92Å; T426-L429 PolarHBondContact O-N 3.3Å; L429-K431 VanDerWaalsContact C-N 3.33Å; L429-K431 PolarHBondContact O-N 3Å; L429-D432 PolarHBondContact O-N 3.32Å; L429-L433 WeakPolarHBondContact O-CB 3.26Å; L429-L433 PolarHBondContact O-N 2.87Å
430	I	98.6	Very high	96.6	Very high	17 Å²	17	61.3 Å²	61.3	9%	0.087	28%	0.284	C	S	.	.	H	α-helix	trans	-58.1	-44	177.8	-69.5	167.7	0	0	0	111.4	W369 N401 F404 R405 T408 T426 A434	W369-I430 HydrophobicContact CH2-CD1 4.33Å; N401-I430 PolarHBondContact OD1-O 3.15Å; F404-I430 HydrophobicContact CB-CD1 3.93Å; F404-I430 HydrophobicContact CB-CG1 3.78Å; F404-I430 HydrophobicContact CD2-CG1 4.38Å; R405-I430 HydrophobicContact CG-CG2 3.59Å; T408-I430 HydrophobicContact CG2-CD1 4.24Å; T408-I430 WeakPolarHBondContact OG1-CD1 3.27Å; T426-I430 WeakPolarHBondContact O-CB 3.41Å; T426-I430 VanDerWaalsContact O-CG1 3.31Å; T426-I430 WeakPolarHBondContact O-CG1 3.48Å; T426-I430 PolarHBondContact O-N 3.26Å; I430-A434 WeakPolarHBondContact O-CB 3.19Å; I430-A434 PolarHBondContact O-N 2.89Å
431	K	98.4	Very high	96.4	Very high	131 Å²	131	62.1 Å²	62.1	57%	0.57	29%	0.287	S	S	*	.	H	α-helix	trans	-68.3	-42.6	-179.7	-76.8	174.3	-177.9	175.1	0	112.5	V427 Q428 L429 R435	V427-K431 HydrophobicContact CG1-CD 4.12Å; V427-K431 WeakPolarHBondContact O-CB 3.13Å; V427-K431 WeakPolarHBondContact O-CD 3.44Å; V427-K431 WeakPolarHBondContact O-CG 3.5Å; V427-K431 PolarHBondContact O-N 2.96Å; Q428-K431 PolarHBondContact O-N 2.62Å; L429-K431 VanDerWaalsContact C-N 3.33Å; L429-K431 PolarHBondContact O-N 3Å; K431-R435 PolarHBondContact O-N 3.41Å; K431-R435 VanDerWaalsContact O-N 3.11Å
432	D	98.4	Very high	96.1	Very high	11 Å²	11	65.8 Å²	65.8	6%	0.059	31%	0.307	C	S	.	.	H	α-helix	trans	-76.5	-43	-178.7	-78.7	-17.9	0	0	0	112.4	L376 R380 Q428 L429 A434 R435 E436	L376-D432 HydrophobicContact CD1-CB 3.95Å; L376-D432 HydrophobicContact CD2-CB 3.75Å; R380-D432 IonicContact CZ-OD2 2.78Å; R380-D432 VanDerWaalsContact NH2-CG 3.26Å; R380-D432 IonicContact NH2-OD2 3.72Å; R380-D432 PolarHBondContact NH2-OD2 3.45Å; Q428-D432 VanDerWaalsContact NE2-CG 3.31Å; Q428-D432 PolarHBondContact NE2-OD1 2.68Å; Q428-D432 PolarHBondContact NE2-OD2 3.28Å; Q428-D432 WeakPolarHBondContact O-CB 3.26Å; Q428-D432 PolarHBondContact O-N 2.73Å; L429-D432 PolarHBondContact O-N 3.32Å; D432-A434 PolarHBondContact O-N 3.25Å; D432-R435 WeakPolarHBondContact O-CA 3.38Å; D432-R435 VanDerWaalsContact O-CB 3.23Å; D432-R435 WeakPolarHBondContact O-CB 3.39Å; D432-R435 PolarHBondContact O-N 2.86Å; D432-R435 IonicContact OD1-CZ 2.68Å; D432-R435 IonicContact OD1-NE 2.74Å; D432-R435 PolarHBondContact OD1-NE 3.32Å; D432-R435 IonicContact OD1-NH2 3.13Å; D432-R435 PolarHBondContact OD1-NH2 3.32Å; D432-E436 PolarHBondContact O-N 3.28Å
433	L	98.1	Very high	96	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-38.9	173.1	-176	56.6	0	0	0	110.5	I375 L376 F379 N401 F404 L429 R435 E436 I437	I375-L433 HydrophobicContact CG2-CD1 4.05Å; L376-L433 HydrophobicContact CB-CD1 4.43Å; F379-L433 HydrophobicContact CD2-CD1 3.98Å; F379-L433 HydrophobicContact CE2-CD1 3.85Å; N401-L433 HydrophobicContact CB-CD2 3.83Å; N401-L433 HydrophobicContact CB-CG 4.13Å; F404-L433 HydrophobicContact CE2-CD2 4.21Å; L429-L433 WeakPolarHBondContact O-CB 3.26Å; L429-L433 PolarHBondContact O-N 2.87Å; L433-R435 VanDerWaalsContact C-N 3.28Å; L433-R435 PolarHBondContact O-N 3.31Å; L433-E436 PolarHBondContact O-N 3.47Å; L433-I437 HydrophobicContact CD1-CD1 4.05Å; L433-I437 HydrophobicContact CD1-CG1 4.34Å; L433-I437 HydrophobicContact CG-CD1 3.91Å; L433-I437 WeakPolarHBondContact O-CB 3.41Å; L433-I437 VanDerWaalsContact O-CD1 3.32Å; L433-I437 WeakPolarHBondContact O-CD1 3.18Å; L433-I437 WeakPolarHBondContact O-CG1 3.3Å; L433-I437 PolarHBondContact O-N 2.71Å
434	A	98.2	Very high	95.6	Very high	7 Å²	7	58.3 Å²	58.3	6%	0.058	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-26.2	172.5	0	0	0	0	0	113.8	N401 I430 D432 R438	N401-A434 VanDerWaalsContact ND2-CA 3.3Å; N401-A434 WeakPolarHBondContact ND2-CA 3.39Å; N401-A434 WeakPolarHBondContact ND2-CB 3.43Å; N401-A434 PolarHBondContact ND2-N 3.24Å; I430-A434 WeakPolarHBondContact O-CB 3.19Å; I430-A434 PolarHBondContact O-N 2.89Å; D432-A434 PolarHBondContact O-N 3.25Å; A434-R438 PolarHBondContact O-NE 3.01Å; A434-R438 PolarHBondContact O-NH2 3.17Å
435	R	97.8	Very high	95.2	Very high	132 Å²	132	63.8 Å²	63.8	50%	0.498	29%	0.29	S	S	.	.	H	α-helix	trans	-74.1	-50.6	175.9	-165.4	-161.3	-48.9	-128.6	7.1	110	K431 D432 L433 R438 L439	K431-R435 PolarHBondContact O-N 3.41Å; K431-R435 VanDerWaalsContact O-N 3.11Å; D432-R435 WeakPolarHBondContact O-CA 3.38Å; D432-R435 VanDerWaalsContact O-CB 3.23Å; D432-R435 WeakPolarHBondContact O-CB 3.39Å; D432-R435 PolarHBondContact O-N 2.86Å; D432-R435 IonicContact OD1-CZ 2.68Å; D432-R435 IonicContact OD1-NE 2.74Å; D432-R435 PolarHBondContact OD1-NE 3.32Å; D432-R435 IonicContact OD1-NH2 3.13Å; D432-R435 PolarHBondContact OD1-NH2 3.32Å; L433-R435 VanDerWaalsContact C-N 3.28Å; L433-R435 PolarHBondContact O-N 3.31Å; R435-R438 PolarHBondContact O-N 2.66Å; R435-L439 WeakPolarHBondContact O-CG 3.24Å; R435-L439 PolarHBondContact O-N 3.04Å; R435-L439 VanDerWaalsContact O-N 3.16Å
436	E	97.2	Very high	94.4	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.028	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-41.3	-178	-60.5	-53.2	156.2	0	0	112.4	L376 F379 R380 R383 D432 L433 R438 L439 V440	L376-E436 HydrophobicContact CD1-CB 4.46Å; L376-E436 HydrophobicContact CD1-CG 3.59Å; F379-E436 HydrophobicContact CB-CB 3.92Å; F379-E436 HydrophobicContact CB-CG 4.36Å; F379-E436 HydrophobicContact CD2-CB 3.96Å; F379-E436 HydrophobicContact CG-CB 4.44Å; R380-E436 HydrophobicContact CG-CG 4.32Å; R383-E436 IonicContact CZ-OE1 3.79Å; R383-E436 IonicContact CZ-OE2 3.99Å; R383-E436 IonicContact NE-OE2 2.68Å; R383-E436 IonicContact NH1-OE1 2.95Å; R383-E436 PolarHBondContact NH1-OE1 3.08Å; R383-E436 IonicContact NH1-OE2 3.56Å; R383-E436 PolarHBondContact NH1-OE2 3.01Å; R383-E436 IonicContact NH2-OE1 3.2Å; R383-E436 PolarHBondContact NH2-OE1 3.4Å; R383-E436 IonicContact NH2-OE2 3.11Å; D432-E436 PolarHBondContact O-N 3.28Å; L433-E436 PolarHBondContact O-N 3.47Å; E436-R438 PolarHBondContact O-N 3.14Å; E436-L439 PolarHBondContact O-N 3.18Å; E436-V440 WeakPolarHBondContact O-CG2 3.22Å; E436-V440 PolarHBondContact O-N 2.83Å; E436-V440 VanDerWaalsContact O-N 3.13Å
437	I	96.4	Very high	93.2	Very high	7 Å²	7	60.5 Å²	60.5	4%	0.036	28%	0.284	C	S	.	.	H	α-helix	trans	-56.6	-50.2	175.4	-69.6	162.9	0	0	0	111.1	F379 V394 K398 N401 L433 L439 V440 E441	F379-I437 HydrophobicContact CD2-CG1 4.42Å; F379-I437 HydrophobicContact CE2-CG1 3.74Å; V394-I437 HydrophobicContact CG1-CG2 4.39Å; K398-I437 HydrophobicContact CB-CD1 4.28Å; K398-I437 HydrophobicContact CB-CG2 4.38Å; K398-I437 HydrophobicContact CD-CG2 4.43Å; K398-I437 HydrophobicContact CG-CG2 4.5Å; N401-I437 HydrophobicContact CB-CD1 4.28Å; L433-I437 HydrophobicContact CD1-CD1 4.05Å; L433-I437 HydrophobicContact CD1-CG1 4.34Å; L433-I437 HydrophobicContact CG-CD1 3.91Å; L433-I437 WeakPolarHBondContact O-CB 3.41Å; L433-I437 VanDerWaalsContact O-CD1 3.32Å; L433-I437 WeakPolarHBondContact O-CD1 3.18Å; L433-I437 WeakPolarHBondContact O-CG1 3.3Å; L433-I437 PolarHBondContact O-N 2.71Å; I437-L439 VanDerWaalsContact C-N 3.35Å; I437-L439 PolarHBondContact O-N 3.29Å; I437-V440 PolarHBondContact O-N 3Å; I437-V440 VanDerWaalsContact O-N 3.13Å; I437-E441 HydrophobicContact CG2-CG 4.26Å; I437-E441 WeakPolarHBondContact O-CG 3.36Å; I437-E441 PolarHBondContact O-N 3.12Å
438	R	96.1	Very high	91.7	Very high	142 Å²	142	61.2 Å²	61.2	54%	0.536	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-42.7	179.9	-80	176.3	-70.4	-177	0.4	112.2	A434 R435 E436 V440 E441 D442	A434-R438 PolarHBondContact O-NE 3.01Å; A434-R438 PolarHBondContact O-NH2 3.17Å; R435-R438 PolarHBondContact O-N 2.66Å; E436-R438 PolarHBondContact O-N 3.14Å; R438-V440 VanDerWaalsContact C-N 3.26Å; R438-V440 PolarHBondContact O-N 2.97Å; R438-E441 PolarHBondContact O-N 3.18Å; R438-D442 WeakPolarHBondContact O-CB 3.35Å; R438-D442 PolarHBondContact O-N 2.85Å
439	L	94.4	Very high	89.5	Confident	68 Å²	68	58 Å²	58	36%	0.356	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-35.2	177.1	-68.7	172.7	0	0	0	112.5	R435 E436 I437 I443	R435-L439 WeakPolarHBondContact O-CG 3.24Å; R435-L439 PolarHBondContact O-N 3.04Å; R435-L439 VanDerWaalsContact O-N 3.16Å; E436-L439 PolarHBondContact O-N 3.18Å; I437-L439 VanDerWaalsContact C-N 3.35Å; I437-L439 PolarHBondContact O-N 3.29Å; L439-I443 VanDerWaalsContact O-CD1 3.32Å; L439-I443 WeakPolarHBondContact O-CD1 3.26Å; L439-I443 VanDerWaalsContact O-CG1 3.23Å; L439-I443 WeakPolarHBondContact O-CG1 3.16Å; L439-I443 PolarHBondContact O-N 2.86Å
440	V	92.6	Very high	87.4	Confident	11 Å²	11	62.8 Å²	62.8	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-74.4	-41.8	174.6	178.9	0	0	0	0	111.5	P389 V394 E436 I437 R438 D442 I443 F444	P389-V440 HydrophobicContact CG-CG1 3.92Å; P389-V440 HydrophobicContact CG-CG2 3.92Å; V394-V440 HydrophobicContact CG2-CG1 3.72Å; E436-V440 WeakPolarHBondContact O-CG2 3.22Å; E436-V440 PolarHBondContact O-N 2.83Å; E436-V440 VanDerWaalsContact O-N 3.13Å; I437-V440 PolarHBondContact O-N 3Å; I437-V440 VanDerWaalsContact O-N 3.13Å; R438-V440 VanDerWaalsContact C-N 3.26Å; R438-V440 PolarHBondContact O-N 2.97Å; V440-D442 VanDerWaalsContact C-N 3.32Å; V440-D442 PolarHBondContact O-N 2.91Å; V440-I443 PolarHBondContact O-N 3.03Å; V440-F444 HydrophobicContact CG1-CD1 4.34Å; V440-F444 HydrophobicContact CG1-CD2 4.23Å; V440-F444 HydrophobicContact CG1-CE1 3.97Å; V440-F444 HydrophobicContact CG1-CE2 3.84Å; V440-F444 HydrophobicContact CG1-CG 4.48Å; V440-F444 HydrophobicContact CG1-CZ 3.71Å; V440-F444 WeakPolarHBondContact O-CG 3.46Å; V440-F444 PolarHBondContact O-N 2.84Å
441	E	92.1	Very high	85	Confident	50 Å²	50	66.5 Å²	66.5	23%	0.234	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-40	175.4	-69.9	-178	131	0	0	112.1	V394 K398 I437 R438 F444 Q445	V394-E441 HydrophobicContact CG1-CG 4.41Å; K398-E441 IonicContact NZ-OE1 2.68Å; K398-E441 PolarHBondContact NZ-OE1 2.94Å; K398-E441 IonicContact NZ-OE2 3.77Å; I437-E441 HydrophobicContact CG2-CG 4.26Å; I437-E441 WeakPolarHBondContact O-CG 3.36Å; I437-E441 PolarHBondContact O-N 3.12Å; R438-E441 PolarHBondContact O-N 3.18Å; E441-F444 PolarHBondContact O-N 3.44Å; E441-Q445 WeakPolarHBondContact O-CB 3.13Å; E441-Q445 VanDerWaalsContact O-CG 3.31Å; E441-Q445 WeakPolarHBondContact O-CG 3.24Å; E441-Q445 PolarHBondContact O-N 3.2Å; E441-Q445 PolarHBondContact O-NE2 3.31Å
442	D	91	Very high	82.2	Confident	78 Å²	78	64.2 Å²	64.2	42%	0.417	33%	0.326	S	S	.	.	H	α-helix	trans	-63.7	-42.2	175.3	-68.9	-27	0	0	0	111.7	R438 V440 Q445 Q446	R438-D442 WeakPolarHBondContact O-CB 3.35Å; R438-D442 PolarHBondContact O-N 2.85Å; V440-D442 VanDerWaalsContact C-N 3.32Å; V440-D442 PolarHBondContact O-N 2.91Å; D442-Q445 PolarHBondContact O-N 3.45Å; D442-Q446 WeakPolarHBondContact O-CG 3.21Å; D442-Q446 PolarHBondContact O-N 3.4Å
443	I	88.4	Confident	79.4	Confident	46 Å²	46	69.6 Å²	69.6	24%	0.236	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-42.5	177.2	-69.9	165	0	0	0	111	L439 V440 Q446 N447	L439-I443 VanDerWaalsContact O-CD1 3.32Å; L439-I443 WeakPolarHBondContact O-CD1 3.26Å; L439-I443 VanDerWaalsContact O-CG1 3.23Å; L439-I443 WeakPolarHBondContact O-CG1 3.16Å; L439-I443 PolarHBondContact O-N 2.86Å; V440-I443 PolarHBondContact O-N 3.03Å; I443-Q446 PolarHBondContact O-N 2.75Å; I443-N447 VanDerWaalsContact O-CG 3.3Å; I443-N447 PolarHBondContact O-N 3.5Å; I443-N447 PolarHBondContact O-ND2 3.26Å
444	F	86.3	Confident	76.8	Confident	66 Å²	66	76 Å²	76	29%	0.289	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-43.5	176.2	-72.2	-4.8	0	0	0	111.5	H388 V394 V440 E441 Q446 N447 V448	H388-F444 HydrophobicContact CB-CE1 4.11Å; V394-F444 HydrophobicContact CG2-CE2 4.13Å; V394-F444 HydrophobicContact CG2-CZ 4.5Å; V440-F444 HydrophobicContact CG1-CD1 4.34Å; V440-F444 HydrophobicContact CG1-CD2 4.23Å; V440-F444 HydrophobicContact CG1-CE1 3.97Å; V440-F444 HydrophobicContact CG1-CE2 3.84Å; V440-F444 HydrophobicContact CG1-CG 4.48Å; V440-F444 HydrophobicContact CG1-CZ 3.71Å; V440-F444 WeakPolarHBondContact O-CG 3.46Å; V440-F444 PolarHBondContact O-N 2.84Å; E441-F444 PolarHBondContact O-N 3.44Å; F444-Q446 PolarHBondContact O-N 2.86Å; F444-N447 PolarHBondContact O-N 3.22Å; F444-N447 VanDerWaalsContact O-N 3.16Å; F444-V448 WeakPolarHBondContact O-CG2 3.24Å; F444-V448 PolarHBondContact O-N 3.22Å
445	Q	85.7	Confident	73.9	Confident	128 Å²	128	85 Å²	85	60%	0.598	43%	0.426	S	S	*	.	H	α-helix	trans	-59.8	-44	173.5	-75.1	173.7	71.3	0	0	112.3	E441 D442 N447 V448 G449	E441-Q445 WeakPolarHBondContact O-CB 3.13Å; E441-Q445 VanDerWaalsContact O-CG 3.31Å; E441-Q445 WeakPolarHBondContact O-CG 3.24Å; E441-Q445 PolarHBondContact O-N 3.2Å; E441-Q445 PolarHBondContact O-NE2 3.31Å; D442-Q445 PolarHBondContact O-N 3.45Å; Q445-N447 VanDerWaalsContact C-N 3.27Å; Q445-N447 PolarHBondContact O-N 3.14Å; Q445-V448 PolarHBondContact O-N 2.82Å; Q445-G449 PolarHBondContact O-N 2.76Å
446	Q	81.6	Confident	70.6	Confident	107 Å²	107	81.7 Å²	81.7	50%	0.5	43%	0.433	S	S	.	.	H	α-helix	trans	-60.8	-34.3	175.3	-75.1	178.5	38.5	0	0	113	D442 I443 F444 K450	D442-Q446 WeakPolarHBondContact O-CG 3.21Å; D442-Q446 PolarHBondContact O-N 3.4Å; I443-Q446 PolarHBondContact O-N 2.75Å; F444-Q446 PolarHBondContact O-N 2.86Å; Q446-K450 WeakPolarHBondContact O-CD 3.5Å; Q446-K450 WeakPolarHBondContact O-CE 3.41Å; Q446-K450 WeakPolarHBondContact O-CG 3.48Å; Q446-K450 PolarHBondContact O-N 2.73Å; Q446-K450 VanDerWaalsContact O-N 3.08Å
447	N	72.3	Confident	67.6	Low	68 Å²	68	89.3 Å²	89.3	36%	0.364	47%	0.473	S	S	.	.	H	α-helix	trans	-75.9	-38.2	180	-69	-18.3	0	0	0	111.8	I443 F444 Q445 G449 K450 T451	I443-N447 VanDerWaalsContact O-CG 3.3Å; I443-N447 PolarHBondContact O-N 3.5Å; I443-N447 PolarHBondContact O-ND2 3.26Å; F444-N447 PolarHBondContact O-N 3.22Å; F444-N447 VanDerWaalsContact O-N 3.16Å; Q445-N447 VanDerWaalsContact C-N 3.27Å; Q445-N447 PolarHBondContact O-N 3.14Å; N447-G449 VanDerWaalsContact C-N 3.32Å; N447-K450 PolarHBondContact O-N 3.01Å; N447-K450 VanDerWaalsContact O-N 3.17Å; N447-T451 PolarHBondContact O-N 2.67Å; N447-T451 VanDerWaalsContact O-N 3.08Å; N447-T451 PolarHBondContact O-OG1 3.16Å
448	V	65.4	Low	64.5	Low	101 Å²	101	97.4 Å²	97.4	61%	0.612	51%	0.511	S	S	*	.	H	α-helix	trans	-64	-37.5	169.5	175.7	0	0	0	0	111.5	F444 Q445 K450 T451 S452	F444-V448 WeakPolarHBondContact O-CG2 3.24Å; F444-V448 PolarHBondContact O-N 3.22Å; Q445-V448 PolarHBondContact O-N 2.82Å; V448-K450 VanDerWaalsContact C-N 3.27Å; V448-K450 PolarHBondContact O-N 3.19Å; V448-T451 PolarHBondContact O-OG1 3.34Å; V448-S452 WeakPolarHBondContact O-CB 3.35Å; V448-S452 PolarHBondContact O-N 2.89Å; V448-S452 PolarHBondContact O-OG 2.69Å
449	G	51.2	Low	61.3	Low	31 Å²	31	100.2 Å²	100.2	32%	0.32	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-23	172.9	0	0	0	0	0	114.3	Q445 N447 S452 N453	Q445-G449 PolarHBondContact O-N 2.76Å; N447-G449 VanDerWaalsContact C-N 3.32Å; G449-S452 WeakPolarHBondContact CA-OG 3.49Å; G449-S452 PolarHBondContact O-OG 2.95Å; G449-N453 PolarHBondContact O-ND2 2.81Å
450	K	56	Low	58.3	Low	111 Å²	111	104 Å²	104	48%	0.483	54%	0.54	S	S	.	.	H	α-helix	trans	-85.3	-44.5	176.2	-72.7	159.9	-163.2	162.9	0	111.9	Q446 N447 V448 S452 N453	Q446-K450 WeakPolarHBondContact O-CD 3.5Å; Q446-K450 WeakPolarHBondContact O-CE 3.41Å; Q446-K450 WeakPolarHBondContact O-CG 3.48Å; Q446-K450 PolarHBondContact O-N 2.73Å; Q446-K450 VanDerWaalsContact O-N 3.08Å; N447-K450 PolarHBondContact O-N 3.01Å; N447-K450 VanDerWaalsContact O-N 3.17Å; V448-K450 VanDerWaalsContact C-N 3.27Å; V448-K450 PolarHBondContact O-N 3.19Å; K450-S452 VanDerWaalsContact C-N 3.31Å; K450-S452 PolarHBondContact O-N 2.78Å; K450-N453 PolarHBondContact O-N 2.78Å; K450-N453 VanDerWaalsContact O-N 3.17Å
451	T	47	Very low	55.1	Low	96 Å²	96	111.2 Å²	111.2	59%	0.589	57%	0.571	S	S	*	*	H	α-helix	trans	-64.9	-35.1	178.8	51	0	0	0	0	112.6	N447 V448 N453	N447-T451 PolarHBondContact O-N 2.67Å; N447-T451 VanDerWaalsContact O-N 3.08Å; N447-T451 PolarHBondContact O-OG1 3.16Å; V448-T451 PolarHBondContact O-OG1 3.34Å; T451-N453 VanDerWaalsContact C-N 3.31Å; T451-N453 PolarHBondContact O-N 2.87Å
452	S	40	Very low	52.3	Low	82 Å²	82	114.5 Å²	114.5	57%	0.573	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-23.4	174.4	49.4	0	0	0	0	114.5	V448 G449 K450	V448-S452 WeakPolarHBondContact O-CB 3.35Å; V448-S452 PolarHBondContact O-N 2.89Å; V448-S452 PolarHBondContact O-OG 2.69Å; G449-S452 WeakPolarHBondContact CA-OG 3.49Å; G449-S452 PolarHBondContact O-OG 2.95Å; K450-S452 VanDerWaalsContact C-N 3.31Å; K450-S452 PolarHBondContact O-N 2.78Å
453	N	40.7	Very low	49.4	Very low	125 Å²	125	116.1 Å²	116.1	67%	0.668	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-9.6	179.5	-88.9	-68.3	0	0	0	114.6	G449 K450 T451 F455 G456	G449-N453 PolarHBondContact O-ND2 2.81Å; K450-N453 PolarHBondContact O-N 2.78Å; K450-N453 VanDerWaalsContact O-N 3.17Å; T451-N453 VanDerWaalsContact C-N 3.31Å; T451-N453 PolarHBondContact O-N 2.87Å; N453-F455 PolarHBondContact O-N 3.37Å; N453-G456 PolarHBondContact O-N 3.47Å
454	I	42.6	Very low	46.5	Very low	135 Å²	135	117.5 Å²	117.5	69%	0.692	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-11.2	-176.9	-72.9	170	0	0	0	113.3
455	F	36.9	Very low	43.7	Very low	194 Å²	194	119.4 Å²	119.4	85%	0.851	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	11.3	174.5	-81.8	-83.9	0	0	0	115	N453 L457	N453-F455 PolarHBondContact O-N 3.37Å; F455-L457 PolarHBondContact O-N 2.84Å
456	G	29.6	Very low	41	Very low	63 Å²	63	120.8 Å²	120.8	65%	0.649	68%	0.678	S	S	*	*			trans	-82.3	84.6	175.1	0	0	0	0	0	113.5	N453 Q458	N453-G456 PolarHBondContact O-N 3.47Å; G456-Q458 PolarHBondContact O-N 3.15Å
457	L	33.1	Very low	39	Very low	166 Å²	166	120.7 Å²	120.7	87%	0.869	69%	0.687	S	S	*	*			trans	-68.4	105.4	-176.9	-165.6	79.6	0	0	0	112.9	F455 R459	F455-L457 PolarHBondContact O-N 2.84Å; L457-R459 PolarHBondContact O-N 3.22Å
458	Q	31.4	Very low	36.8	Very low	177 Å²	177	124.7 Å²	124.7	83%	0.827	71%	0.708	S	S	*	*			trans	-66	125.6	178.8	-162.8	176.9	27.1	0	0	111.5	G456	G456-Q458 PolarHBondContact O-N 3.15Å
459	R	29.1	Very low	34.8	Very low	202 Å²	202	126.5 Å²	126.5	76%	0.762	72%	0.719	S	S	*	*			trans	-125.3	98.5	-176.5	-153.4	-179.9	-153.5	175.1	8.4	112.1	L457 F461	L457-R459 PolarHBondContact O-N 3.22Å; R459-F461 HydrophobicContact CG-CE2 4.28Å
460	I	30.4	Very low	33.6	Very low	146 Å²	146	134.3 Å²	134.3	75%	0.749	74%	0.744	S	S	*	*			trans	-77	135.3	176.2	-59.4	172.8	0	0	0	109.5
461	F	25.6	Very low	32.9	Very low	163 Å²	163	134.4 Å²	134.4	72%	0.715	76%	0.756	S	S	*	*			trans	-123.6	122.4	171.6	-80.3	-82.1	0	0	0	110.4	R459	R459-F461 HydrophobicContact CG-CE2 4.28Å
462	P	34.1	Very low	31.9	Very low	119 Å²	119	133.7 Å²	133.7	77%	0.773	76%	0.76	S	S	*	*			trans	-80.3	151.1	158.5	-7.4	25.8	0	0	0	110.7
463	A	29.3	Very low	31.4	Very low	112 Å²	112	138.1 Å²	138.1	93%	0.926	77%	0.771	S	S	*	*			trans	-95.4	147.7	175	0	0	0	0	0	112.2
464	G	28.5	Very low	30.9	Very low	75 Å²	75	136.9 Å²	136.9	77%	0.773	77%	0.773	S	S	*	*			trans	176.3	148.3	176.6	0	0	0	0	0	110.6
465	S	27.3	Very low	30.3	Very low	106 Å²	106	136.3 Å²	136.3	74%	0.741	78%	0.775	S	S	*	*			trans	-147.6	143.4	-158.7	50.1	0	0	0	0	115.6
466	I	30.1	Very low	29.9	Very low	158 Å²	158	132.4 Å²	132.4	81%	0.81	77%	0.772	S	S	*	*			trans	71.4	141.4	150.7	-66	160	0	0	0	116.5
467	P	39.4	Very low	29.9	Very low	104 Å²	104	135.6 Å²	135.6	68%	0.675	78%	0.779	S	S	*	*			cis	-142.8	-168.1	-31.4	42.1	-21.5	0	0	0	115.1
468	L	25.5	Very low	29.7	Very low	153 Å²	153	132.8 Å²	132.8	80%	0.801	77%	0.773	S	S	*	*			trans	23.2	132.7	151.5	-88.6	66.7	0	0	0	121.2
469	T	23.8	Very low	29.8	Very low	138 Å²	138	132.4 Å²	132.4	85%	0.847	77%	0.773	S	S	*	*				-169.3	172.2	81.9	25.2	0	0	0	0	114.5
470	K	25.6	Very low	30.2	Very low	195 Å²	195	127.5 Å²	127.5	85%	0.848	77%	0.77	S	S	*	*			trans	-113.2	-165.2	170.1	-58.1	-178.1	177.5	176.9	0	108.8
471	P	41	Very low	30	Very low	114 Å²	114	129.6 Å²	129.6	74%	0.74	77%	0.774	S	S	*	*			cis	-144.5	-164.2	-0.6	42.6	-20.6	0	0	0	116.8
472	A	25.7	Very low	30.2	Very low	81 Å²	81	129.2 Å²	129.2	67%	0.669	78%	0.778	S	S	*	*			trans	74.9	154.1	143.9	0	0	0	0	0	120
473	H	30.1	Very low	29.9	Very low	174 Å²	174	128.6 Å²	128.6	81%	0.806	78%	0.777	S	S	*	*			cis	-170.9	145.3	-29.2	-113.4	-67.7	0	0	0	110.3
474	S	29.1	Very low	30	Very low	100 Å²	100	131 Å²	131	70%	0.699	77%	0.773	S	S	*	*			trans	61.8	157.7	146	-112.9	0	0	0	0	120.5
475	T	31.8	Very low	30.8	Very low	122 Å²	122	132.8 Å²	132.8	75%	0.748	77%	0.771	S	S	*	*			cis	-161	179.4	-14.3	-6.9	0	0	0	0	110.8
476	S	27.6	Very low	30.9	Very low	112 Å²	112	132.2 Å²	132.2	78%	0.783	77%	0.767	S	S	*	*			trans	102.6	143.7	157.4	87.7	0	0	0	0	116.3
477	V	29.4	Very low	31	Very low	130 Å²	130	133.2 Å²	133.2	79%	0.788	77%	0.766	S	S	*	*			cis	-157	149.1	-9.6	103.5	0	0	0	0	112.1
478	S	28.7	Very low	30.6	Very low	108 Å²	108	136 Å²	136	76%	0.755	78%	0.775	S	S	*	*			trans	37.3	156.1	149.5	-129.8	0	0	0	0	123.1
479	M	34.5	Very low	30.7	Very low	169 Å²	169	131.9 Å²	131.9	83%	0.833	77%	0.769	S	S	*	*			cis	171.4	167.2	-41.2	-88.1	-100.8	-164.4	0	0	106.8
480	S	35.9	Very low	31.2	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	77%	0.773	S	S	*	*			cis	-168.6	161	-49.7	66.3	0	0	0	0	108.4
481	K	27	Very low	31.5	Very low	190 Å²	190	131.6 Å²	131.6	83%	0.826	77%	0.773	S	S	*	*			trans	-156.9	115.5	164.8	-122.5	-179.3	-177.5	-179.5	0	112.8
482	L	29.8	Very low	31	Very low	154 Å²	154	135.7 Å²	135.7	81%	0.806	78%	0.779	S	S	*	*			trans	41.4	136.4	144.8	-55.1	170.7	0	0	0	120.1
483	S	28.3	Very low	31.1	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	79%	0.789	S	S	*	*			cis	178.5	153	-2.4	44.2	0	0	0	0	109.8
484	L	31.5	Very low	30.8	Very low	161 Å²	161	136.8 Å²	136.8	84%	0.843	79%	0.787	S	S	*	*			cis	-161.9	-50	-12.2	170.3	66	0	0	0	115.1
485	P	45.3	Very low	30.6	Very low	113 Å²	113	140.5 Å²	140.5	73%	0.734	80%	0.799	S	S	*	*			trans	-127.8	-179.6	-159.6	42.4	-24.9	0	0	0	114.9
486	S	29	Very low	30.3	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	80%	0.803	S	S	*	*			cis	-148.3	126.1	2.7	-166.6	0	0	0	0	114.7
487	K	32.8	Very low	31.3	Very low	179 Å²	179	143.5 Å²	143.5	78%	0.778	80%	0.798	S	S	*	*			trans	51.6	119	143.9	-63.7	175.1	-175.2	177.1	0	119.7
488	N	29.3	Very low	31.1	Very low	163 Å²	163	145.8 Å²	145.8	87%	0.872	80%	0.797	S	S	*	*				109.4	137.8	53.4	-82.3	4.1	0	0	0	110
489	G	28.4	Very low	31.1	Very low	65 Å²	65	147.2 Å²	147.2	67%	0.67	80%	0.797	S	S	*	*			cis	163	159.4	-12.1	0	0	0	0	0	115.4
490	S	34.7	Very low	30.8	Very low	132 Å²	132	146.9 Å²	146.9	92%	0.923	80%	0.796	S	S	*	*			trans	80.5	165.6	162	82.1	0	0	0	0	120.8
491	K	32.5	Very low	30.4	Very low	196 Å²	196	149.9 Å²	149.9	85%	0.852	80%	0.797	S	S	*	*			trans	-130.9	149.9	-163.7	-47.2	170.6	-179.5	178.7	0	112
492	K	29.8	Very low	30.5	Very low	199 Å²	199	148.8 Å²	148.8	87%	0.865	79%	0.792	S	S	*	*			trans	173.4	161.5	130.6	-101	166.4	-177.5	174.1	0	115.2
493	K	27.8	Very low	30.4	Very low	203 Å²	203	150.1 Å²	150.1	88%	0.883	79%	0.792	S	S	*	*			trans	11.2	141.5	153.3	-62	-173.2	172.6	-168.6	0	120.1
494	G	23.6	Very low	30.4	Very low	75 Å²	75	148.7 Å²	148.7	77%	0.773	79%	0.787	S	S	*	*			trans	-113.2	-179	162.5	0	0	0	0	0	114.2
495	L	24.9	Very low	30.3	Very low	179 Å²	179	149.4 Å²	149.4	94%	0.937	79%	0.785	S	S	*	*			trans	-165.7	163.9	164.9	-105.8	164.4	0	0	0	109.3
496	K	26.3	Very low	29.6	Very low	192 Å²	192	155.3 Å²	155.3	84%	0.835	79%	0.793	S	S	*	*			trans	-88	-168	171.7	-42.2	-178.9	178.6	-177.6	0	110
497	P	47.9	Very low	29.7	Very low	105 Å²	105	160.9 Å²	160.9	68%	0.682	81%	0.805	S	S	*	*			cis	-137.1	-162.9	-14.4	40.1	-20.3	0	0	0	114.1
498	K	26.1	Very low	29.6	Very low	178 Å²	178	155.8 Å²	155.8	77%	0.774	80%	0.804	S	S	*	*			trans	74.9	125.3	159.6	-70.3	-179.7	177.2	-171.4	0	116.9
499	D	27.2	Very low	29.6	Very low	138 Å²	138	158.6 Å²	158.6	74%	0.738	81%	0.808	S	S	*	*				77.1	121	57.2	-66.5	-52.3	0	0	0	113.8
500	I	29.1	Very low	29.9	Very low	161 Å²	161	164.4 Å²	164.4	83%	0.826	82%	0.818	S	S	*	*			trans	-176.3	102.8	131.5	-97.6	159.1	0	0	0	114.6
501	F	27.5	Very low	29.8	Very low	162 Å²	162	163.2 Å²	163.2	71%	0.711	81%	0.809	S	S	*	*				57.8	133.7	125.9	-82.5	-124.2	0	0	0	125.4
502	K	29.6	Very low	29.7	Very low	167 Å²	167	158.9 Å²	158.9	73%	0.726	80%	0.804	S	S	*	*			trans	75.8	154.4	139.1	-75.4	178.4	-179.3	154.8	0	119.2
503	K	27.1	Very low	29.7	Very low	183 Å²	183	153.7 Å²	153.7	80%	0.796	80%	0.798	S	S	*	*			cis	-157.2	162.6	3.9	-140	-177.5	177	-170.2	0	113.1
504	A	28.7	Very low	29.7	Very low	77 Å²	77	152.5 Å²	152.5	64%	0.636	80%	0.8	S	S	*	*			trans	63	125.8	154.3	0	0	0	0	0	118.4
505	E	29.6	Very low	29.9	Very low	175 Å²	175	152 Å²	152	82%	0.818	80%	0.796	S	S	*	*			cis	91.4	116.4	46	-83.7	-163.7	88.1	0	0	115.5
506	R	29.6	Very low	30.7	Very low	238 Å²	238	150.3 Å²	150.3	90%	0.898	80%	0.795	S	S	*	*				177.8	143.9	111.8	-96.6	175.8	176.6	-165.3	-2.6	115.3
507	K	32.4	Very low	30.8	Very low	211 Å²	211	146 Å²	146	92%	0.917	80%	0.796	S	S	*	*			trans	-24.5	140.5	169.6	-53	178.1	177.7	-174.5	0	116.1
508	G	30.1	Very low	29.8	Very low	73 Å²	73	144.6 Å²	144.6	75%	0.753	80%	0.8	S	S	*	*			cis	117.2	136.9	25.9	0	0	0	0	0	112
509	K	29.5	Very low	29.8	Very low	222 Å²	222	144 Å²	144	97%	0.965	80%	0.8	S	S	*	*			trans	-172.5	157.4	156.8	-111.9	177	-177.2	-176	0	112.8
510	Q	33.3	Very low	29.7	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	80%	0.802	S	S	*	*			trans	-105.7	159.3	176	-61.9	174.7	-13.8	0	0	111.6
511	S	32.5	Very low	29.5	Very low	106 Å²	106	140.4 Å²	140.4	74%	0.741	79%	0.788	S	S	*	*				172.2	125.5	119.2	62.1	0	0	0	0	116
512	S	30.9	Very low	29.5	Very low	105 Å²	105	142.8 Å²	142.8	73%	0.734	79%	0.793	S	S	*	*			trans	50	114.1	135.9	67.3	0	0	0	0	124.4
513	A	30.8	Very low	29.6	Very low	90 Å²	90	141.4 Å²	141.4	74%	0.744	79%	0.794	S	S	*	*				83	151.2	108.4	0	0	0	0	0	124.2
514	L	27.8	Very low	29.6	Very low	178 Å²	178	139.5 Å²	139.5	93%	0.932	79%	0.792	S	S	*	*			trans	71.1	143.4	162.5	-66.4	162.5	0	0	0	118.9
515	G	26.4	Very low	29.5	Very low	66 Å²	66	143.4 Å²	143.4	68%	0.68	80%	0.799	S	S	*	*			trans	-125.9	-167.3	170.1	0	0	0	0	0	111
516	P	41.6	Very low	29.2	Very low	142 Å²	142	142.1 Å²	142.1	92%	0.922	80%	0.797	S	S	*	*			trans	-138.6	-172.6	143.5	38	-23.7	0	0	0	113.2
517	A	28.8	Very low	30.1	Very low	103 Å²	103	135.3 Å²	135.3	85%	0.851	78%	0.784	S	S	*	*			trans	-137.4	164.8	-168.5	0	0	0	0	0	114.1
518	G	27.6	Very low	30.2	Very low	74 Å²	74	135 Å²	135	76%	0.763	78%	0.779	S	S	*	*			trans	81.7	170.8	167.7	0	0	0	0	0	115.9
519	Q	26.3	Very low	30.3	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	78%	0.775	S	S	*	*			cis	-168.3	152.7	-17	-143.7	-168.9	-35.2	0	0	109.2
520	L	24.9	Very low	30.4	Very low	146 Å²	146	132 Å²	132	76%	0.764	76%	0.759	S	S	*	*			trans	65.3	166.4	161.6	-59.3	168.9	0	0	0	117.6
521	S	25.3	Very low	30.3	Very low	76 Å²	76	130.2 Å²	130.2	53%	0.531	75%	0.75	S	S	.	*			cis	-174.6	151.8	-42.4	59.8	0	0	0	0	111.1
522	Y	26.7	Very low	30	Very low	212 Å²	212	129 Å²	129	83%	0.831	75%	0.747	S	S	*	*			trans	67.4	156.7	168.3	-65.3	-71.4	0	0	0	116.4
523	N	30.8	Very low	29.8	Very low	139 Å²	139	130.8 Å²	130.8	74%	0.743	75%	0.747	S	S	*	*			cis	-154.4	170.3	8.1	-137.1	-22.4	0	0	0	112.9
524	L	27.5	Very low	29.6	Very low	143 Å²	143	134.7 Å²	134.7	75%	0.749	75%	0.748	S	S	*	*			trans	136.5	108.9	130.9	-158	70.8	0	0	0	118.2
525	M	26.3	Very low	29.5	Very low	159 Å²	159	132.6 Å²	132.6	78%	0.783	74%	0.743	S	S	*	*			trans	61.1	109.5	150.5	-60.1	-58.9	170.7	0	0	124
526	D	24.9	Very low	29.4	Very low	147 Å²	147	133 Å²	133	79%	0.786	75%	0.747	S	S	*	*				-2.8	165.4	114.7	-102.1	-30.6	0	0	0	119.8
527	P	47.2	Very low	28.9	Very low	96 Å²	96	132.6 Å²	132.6	62%	0.623	74%	0.744	S	S	*	*			cis	-146.8	166.6	32	44.6	-25.9	0	0	0	120.3
528	Y	34.9	Very low	29	Very low	205 Å²	205	133.4 Å²	133.4	80%	0.804	74%	0.744	S	S	*	*			trans	59.7	140.5	157	-64.4	-58.2	0	0	0	117.8
529	S	31.6	Very low	28.9	Very low	96 Å²	96	137.6 Å²	137.6	67%	0.671	74%	0.743	S	S	*	*			cis	-168.8	158.7	5.4	-115.5	0	0	0	0	109.4
530	H	33.2	Very low	28.9	Very low	136 Å²	136	138.7 Å²	138.7	63%	0.63	75%	0.745	S	S	*	*			cis	-156.6	-175.7	-4.8	-144.4	-138.2	0	0	0	114.3
531	Q	29.6	Very low	28.8	Very low	148 Å²	148	136.5 Å²	136.5	69%	0.692	75%	0.749	S	S	*	*			trans	-49.9	167.6	177.4	-65.6	166.6	-3.4	0	0	118.4
532	A	27.7	Very low	28.9	Very low	82 Å²	82	142.2 Å²	142.2	68%	0.678	76%	0.764	S	S	*	*			cis	-150	144.1	8.1	0	0	0	0	0	111.1
533	L	26.2	Very low	28.8	Very low	141 Å²	141	142 Å²	142	74%	0.738	77%	0.768	S	S	*	*				66.3	148.6	76.6	-60.7	174.7	0	0	0	115.9
534	K	26.1	Very low	28.5	Very low	172 Å²	172	142.2 Å²	142.2	75%	0.748	77%	0.769	S	S	*	*			cis	-175.2	147.6	-38.6	-126	-169.5	-175.6	174.8	0	109.4
535	T	26.7	Very low	28.5	Very low	135 Å²	135	143 Å²	143	83%	0.828	77%	0.77	S	S	*	*			trans	44.1	123.9	152.5	55.1	0	0	0	0	121.9
536	G	23.9	Very low	28.5	Very low	74 Å²	74	140.3 Å²	140.3	76%	0.763	77%	0.768	S	S	*	*			trans	-151.4	154.8	162	0	0	0	0	0	112.2
537	P	31.1	Very low	28.6	Very low	133 Å²	133	136.5 Å²	136.5	86%	0.864	76%	0.763	S	S	*	*			trans	-95.1	168.3	-166.2	37.6	-37.1	0	0	0	115.4
538	S	30.2	Very low	27.7	Very low	121 Å²	121	138.1 Å²	138.1	85%	0.846	77%	0.771	S	S	*	*			trans	-74.7	128.6	175.1	177.7	0	0	0	0	113.1
539	Q	26.3	Very low	27.3	Very low	162 Å²	162	133.6 Å²	133.6	76%	0.757	77%	0.769	S	S	*	*			trans	-156.4	133.2	149.8	-118.1	-171.1	71.7	0	0	112.3
540	K	25.2	Very low	27.3	Very low	189 Å²	189	136.2 Å²	136.2	82%	0.822	78%	0.775	S	S	*	*			trans	40.6	135	152.5	-67.9	178.7	177.1	176.7	0	121
541	A	22.8	Very low	27.2	Very low	101 Å²	101	137 Å²	137	84%	0.835	78%	0.784	S	S	*	*			trans	133.2	138.4	134.8	0	0	0	0	0	113.4
542	K	29.2	Very low	27.4	Very low	196 Å²	196	137.1 Å²	137.1	85%	0.852	79%	0.789	S	S	*	*			trans	-64.5	152.9	171.4	-47.3	167	-178.8	179.3	0	109.4
543	F	23.1	Very low	27.7	Very low	208 Å²	208	138.2 Å²	138.2	91%	0.912	79%	0.792	S	S	*	*				-154.2	167.3	119.9	-116.8	-77.9	0	0	0	111.1
544	N	25.3	Very low	28.1	Very low	142 Å²	142	139.1 Å²	139.1	76%	0.759	80%	0.797	S	S	*	*			trans	-110	-171.4	-169	-135.6	17.1	0	0	0	110.7
545	M	27.6	Very low	28.5	Very low	159 Å²	159	137.7 Å²	137.7	78%	0.783	80%	0.798	S	S	*	*			trans	86.1	141	165.7	-52.7	-57.7	-84.5	0	0	117.1
546	S	26.3	Very low	28.8	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	80%	0.798	S	S	*	*			cis	-173.3	156.2	-14.3	47.8	0	0	0	0	113
547	G	26.7	Very low	29.4	Very low	66 Å²	66	140 Å²	140	68%	0.68	80%	0.796	S	S	*	*			trans	127.6	141	152	0	0	0	0	0	115.5
548	T	28.8	Very low	29.5	Very low	130 Å²	130	138.5 Å²	138.5	80%	0.798	80%	0.795	S	S	*	*			cis	-165.4	143.7	-11.1	-17.7	0	0	0	0	110.5
549	S	26.4	Very low	29.7	Very low	111 Å²	111	140 Å²	140	78%	0.776	79%	0.793	S	S	*	*			trans	150.2	96.7	156.2	-69.9	0	0	0	0	108
550	L	31.3	Very low	30.1	Very low	150 Å²	150	141.2 Å²	141.2	79%	0.785	80%	0.801	S	S	*	*				66.8	102.2	74	-67.1	178	0	0	0	114.7
551	N	29.9	Very low	30.5	Very low	154 Å²	154	139.7 Å²	139.7	82%	0.824	80%	0.802	S	S	*	*				-162.2	156.6	109.4	-103.8	15.6	0	0	0	110.4
552	D	34.1	Very low	30.9	Very low	150 Å²	150	142.6 Å²	142.6	80%	0.802	80%	0.803	S	S	*	*			trans	-72.5	163.9	177.4	-41	-83.1	0	0	0	110.8
553	S	34.1	Very low	31.1	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	80%	0.803	S	S	*	*			cis	-154.9	-168.4	24.6	46.6	0	0	0	0	108.4
554	D	34.8	Very low	31.5	Very low	159 Å²	159	133.5 Å²	133.5	85%	0.85	79%	0.785	S	S	*	*			cis	-155.2	-172	10.3	-144.2	-20.3	0	0	0	110.7
555	D	35.5	Very low	31.8	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	79%	0.788	S	S	*	*			trans	-108	150.5	-174.5	-161.7	9.4	0	0	0	114.7
556	D	31.3	Very low	32	Very low	155 Å²	155	133.8 Å²	133.8	83%	0.829	79%	0.793	S	S	*	*			trans	-177.9	158.7	130.8	-139.9	-28.2	0	0	0	112.1
557	S	37	Very low	32.3	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	79%	0.793	S	S	*	*			trans	-152.3	148.7	-176.6	64.1	0	0	0	0	115.4
558	A	34.7	Very low	33.5	Very low	101 Å²	101	137 Å²	137	84%	0.835	79%	0.792	S	S	*	*			trans	-159.3	120.9	167.6	0	0	0	0	0	113.1
559	D	33.4	Very low	33.6	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	79%	0.793	S	S	*	*			trans	-87.5	150.8	162.3	-73.1	-53.8	0	0	0	110.8
560	M	35.4	Very low	33.7	Very low	188 Å²	188	137.3 Å²	137.3	93%	0.926	79%	0.792	S	S	*	*			trans	-151.3	116.3	159.1	-87.2	-66	98.7	0	0	111
561	D	33.5	Very low	33.6	Very low	158 Å²	158	138.3 Å²	138.3	85%	0.845	80%	0.797	S	S	*	*			trans	-87.7	162.3	167.7	-87.6	-52.3	0	0	0	112.1
562	L	31.5	Very low	33.5	Very low	162 Å²	162	138 Å²	138	85%	0.848	80%	0.795	S	S	*	*			trans	164.5	108.3	151	-90.1	165.5	0	0	0	107.1
563	D	33.2	Very low	33.2	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	80%	0.798	S	S	*	*				62.5	129.4	79.9	-159.5	52	0	0	0	114.2
564	G	31.5	Very low	33	Very low	52 Å²	52	138.7 Å²	138.7	54%	0.536	80%	0.799	S	S	.	*			cis	177.2	-155.5	1.5	0	0	0	0	0	113.8
565	S	30.8	Very low	32.8	Very low	117 Å²	117	139.5 Å²	139.5	82%	0.818	80%	0.803	S	S	*	*			trans	72	152.4	173.9	77.8	0	0	0	0	119.7
566	E	31.6	Very low	32.4	Very low	191 Å²	191	136.4 Å²	136.4	89%	0.893	81%	0.806	S	S	*	*			cis	-158	165.5	-35	-97.4	-131	122.7	0	0	109.3
567	N	33.6	Very low	32.3	Very low	136 Å²	136	134.3 Å²	134.3	73%	0.727	80%	0.803	S	S	*	*			trans	-105.9	179.2	174.5	-161.4	22.3	0	0	0	109.9
568	P	51.4	Low	32	Very low	100 Å²	100	135.6 Å²	135.6	65%	0.649	81%	0.807	S	S	*	*				-163.8	178.7	92.5	44.6	-24.3	0	0	0	118.8
569	L	30.1	Very low	31.8	Very low	157 Å²	157	139.9 Å²	139.9	82%	0.822	81%	0.807	S	S	*	*			trans	66.4	126.6	163.4	-57.7	178.1	0	0	0	118.4
570	A	28.7	Very low	31.5	Very low	92 Å²	92	142.8 Å²	142.8	76%	0.76	81%	0.806	S	S	*	*			cis	93.7	116.3	10.1	0	0	0	0	0	118
571	L	28.9	Very low	31.1	Very low	171 Å²	171	140.5 Å²	140.5	90%	0.895	80%	0.795	S	S	*	*			trans	-156.9	176.6	160.8	-117.4	171.8	0	0	0	110.5
572	L	28.6	Very low	30.9	Very low	148 Å²	148	141 Å²	141	78%	0.775	79%	0.79	S	S	*	*			trans	-153.8	153.4	-145.1	-100	163.7	0	0	0	115.7
573	M	28.5	Very low	30.7	Very low	177 Å²	177	138 Å²	138	87%	0.872	78%	0.782	S	S	*	*			trans	74.1	162.7	167.3	-51.7	-69.4	-91.1	0	0	116.5
574	A	29.4	Very low	30.5	Very low	91 Å²	91	136.3 Å²	136.3	75%	0.752	78%	0.777	S	S	*	*			cis	-150.8	178.3	9.7	0	0	0	0	0	114.4
575	N	31	Very low	30.2	Very low	176 Å²	176	138.6 Å²	138.6	94%	0.941	79%	0.785	S	S	*	*			trans	-80.2	163.1	176.4	-71.6	-46	0	0	0	114.7
576	G	26.8	Very low	30.1	Very low	78 Å²	78	143.1 Å²	143.1	80%	0.804	79%	0.789	S	S	*	*			trans	-172.7	138.6	162.1	0	0	0	0	0	115.7
577	S	29.8	Very low	29.9	Very low	111 Å²	111	139 Å²	139	78%	0.776	78%	0.782	S	S	*	*			trans	-157.2	145.5	170.9	74.9	0	0	0	0	112.6
578	T	29.8	Very low	29.7	Very low	130 Å²	130	144.3 Å²	144.3	80%	0.798	79%	0.792	S	S	*	*			trans	161.3	131.4	134.7	38.4	0	0	0	0	116.9
579	K	30.1	Very low	28.4	Very low	191 Å²	191	150.8 Å²	150.8	83%	0.83	80%	0.803	S	S	*	*			trans	26.7	113.9	137.2	-66.2	173.6	179.9	169.2	0	123.8
580	R	27.5	Very low	28.4	Very low	213 Å²	213	148.1 Å²	148.1	80%	0.804	80%	0.804	S	S	*	*				83.5	131.5	102.9	-161.2	-173.4	-158.2	-161.4	8.8	122.9
581	M	27.2	Very low	28.3	Very low	140 Å²	140	153.1 Å²	153.1	69%	0.69	81%	0.808	S	S	*	*			trans	74.3	158.9	157.2	-88.4	176.1	169.3	0	0	117.9
582	K	29.3	Very low	28.3	Very low	169 Å²	169	153.6 Å²	153.6	74%	0.735	81%	0.81	S	S	*	*			cis	-158.1	128.1	10.6	-125.4	167.4	-177.2	-179.6	0	108.5
583	S	27.2	Very low	28.2	Very low	97 Å²	97	150.5 Å²	150.5	68%	0.678	81%	0.806	S	S	*	*				92	148.5	87.1	71.3	0	0	0	0	119.1
584	V	28	Very low	28.2	Very low	126 Å²	126	151.7 Å²	151.7	76%	0.764	81%	0.806	S	S	*	*			trans	110	93.9	154	-175.7	0	0	0	0	120.4
585	S	26.7	Very low	28	Very low	99 Å²	99	156.1 Å²	156.1	69%	0.692	81%	0.808	S	S	*	*			trans	44	143.4	134.7	83	0	0	0	0	124.7
586	K	29.1	Very low	27.9	Very low	212 Å²	212	153 Å²	153	92%	0.922	80%	0.795	S	S	*	*				-157.3	168	109.4	-111.2	166.8	-173.3	172.2	0	112.7
587	S	26.4	Very low	28	Very low	104 Å²	104	156 Å²	156	73%	0.727	79%	0.793	S	S	*	*			trans	-106.8	151.9	-166.7	170.3	0	0	0	0	113.7
588	R	28.3	Very low	27.9	Very low	249 Å²	249	156.6 Å²	156.6	94%	0.94	80%	0.797	S	S	*	*			trans	-148.9	168.4	140.5	-137.5	171.6	-75.3	-162.5	0.4	112.1
589	R	25.8	Very low	27.9	Very low	235 Å²	235	155.3 Å²	155.3	89%	0.887	80%	0.799	S	S	*	*			trans	-138	132.9	-158.6	167.5	-165.3	-175.8	-170.1	4.7	109.8
590	A	28.3	Very low	27.7	Very low	101 Å²	101	157.4 Å²	157.4	84%	0.835	80%	0.802	S	S	*	*			trans	-147.6	146	163.3	0	0	0	0	0	110.9
591	K	28	Very low	27.7	Very low	197 Å²	197	154.9 Å²	154.9	86%	0.857	80%	0.804	S	S	*	*			trans	-127.5	147.7	165	-77	-172.8	174	-171.3	0	107.1
592	I	28.1	Very low	27.6	Very low	181 Å²	181	154 Å²	154	93%	0.928	81%	0.806	S	S	*	*			trans	-156	161.9	151.3	-101.2	144.5	0	0	0	107.7
593	A	27	Very low	27.4	Very low	83 Å²	83	150.1 Å²	150.1	69%	0.686	81%	0.805	S	S	*	*			trans	-156.6	173.6	-144.7	0	0	0	0	0	115.2
594	K	28.6	Very low	27.3	Very low	203 Å²	203	152.9 Å²	152.9	88%	0.883	81%	0.807	S	S	*	*			trans	75.1	156.8	179.4	-53.1	179.2	179.6	179.9	0	112.6
595	K	25.2	Very low	27.1	Very low	184 Å²	184	154.5 Å²	154.5	80%	0.8	81%	0.807	S	S	*	*			cis	-149.6	148.3	10.9	-136.8	177.5	171.8	-164.6	0	106
596	V	29.4	Very low	27	Very low	110 Å²	110	155.4 Å²	155.4	67%	0.667	81%	0.808	S	S	*	*			cis	60.1	120.1	49.4	168.7	0	0	0	0	110.8
597	D	28.5	Very low	26.8	Very low	142 Å²	142	153.2 Å²	153.2	76%	0.759	80%	0.803	S	S	*	*			cis	-163.2	167.5	4.6	-110.5	-5.5	0	0	0	109.9
598	S	27.1	Very low	26.8	Very low	123 Å²	123	151 Å²	151	86%	0.86	80%	0.797	S	S	*	*				154.3	144.3	126.8	-69.2	0	0	0	0	114.7
599	A	29.7	Very low	26.6	Very low	102 Å²	102	146.1 Å²	146.1	84%	0.843	79%	0.789	S	S	*	*			trans	-135.3	159.2	165.9	0	0	0	0	0	109.9
600	R	26.2	Very low	26.6	Very low	236 Å²	236	141.5 Å²	141.5	89%	0.891	78%	0.778	S	S	*	*			trans	-156.5	151.2	156.6	-152.3	174.4	163.2	158.5	-3	113.3
601	L	27.5	Very low	26.5	Very low	160 Å²	160	144.5 Å²	144.5	84%	0.838	77%	0.772	S	S	*	*			trans	-109.1	-165.2	176.3	-68.1	163	0	0	0	111
602	V	25.8	Very low	26.4	Very low	121 Å²	121	141.2 Å²	141.2	73%	0.733	76%	0.764	S	S	*	*			trans	95.3	111.4	179.9	-177.3	0	0	0	0	110.7
603	A	24.9	Very low	26.4	Very low	87 Å²	87	138.8 Å²	138.8	72%	0.719	75%	0.752	S	S	*	*				74.3	149.4	54.1	0	0	0	0	0	112.4
604	E	24.6	Very low	26.3	Very low	155 Å²	155	142 Å²	142	72%	0.724	76%	0.758	S	S	*	*			cis	-162.1	179.9	11.3	-152	179.7	-132.4	0	0	110.3
605	Q	24.2	Very low	26.3	Very low	160 Å²	160	138 Å²	138	75%	0.748	76%	0.756	S	S	*	*			trans	70	162.1	156.9	-68.3	170.7	37.3	0	0	120.1
606	V	24.4	Very low	26.6	Very low	118 Å²	118	136.3 Å²	136.3	72%	0.715	76%	0.755	S	S	*	*			cis	-172	173.3	-43.8	117.7	0	0	0	0	109.7
607	M	25.4	Very low	26.7	Very low	167 Å²	167	138.3 Å²	138.3	82%	0.823	76%	0.762	S	S	*	*			trans	78.9	149.4	-178.1	-44.5	-58	-71.7	0	0	115.8
608	G	25	Very low	26.9	Very low	58 Å²	58	139.3 Å²	139.3	60%	0.598	76%	0.762	S	S	*	*			cis	162.9	143	-9.6	0	0	0	0	0	113.1
609	D	24.8	Very low	27	Very low	146 Å²	146	141.1 Å²	141.1	78%	0.781	76%	0.761	S	S	*	*			trans	63.1	157.6	156	-48.1	-17.1	0	0	0	119.4
610	E	26.2	Very low	27.1	Very low	138 Å²	138	145 Å²	145	65%	0.645	76%	0.762	S	S	*	*			cis	-171.7	170.3	-29.7	-168.5	171.7	-166.5	0	0	108.3
611	F	25.4	Very low	27.3	Very low	164 Å²	164	142.1 Å²	142.1	72%	0.719	76%	0.763	S	S	*	*			trans	71.6	154.6	164.7	-55.3	-64.1	0	0	0	121.2
612	D	26	Very low	27.4	Very low	128 Å²	128	141.4 Å²	141.4	68%	0.684	76%	0.759	S	S	*	*			cis	-169.1	169.1	-38.1	-141.4	-16.8	0	0	0	113.2
613	L	28.5	Very low	27.7	Very low	130 Å²	130	142.2 Å²	142.2	68%	0.681	76%	0.755	S	S	*	*			trans	58.4	122.7	155.6	-58	-178.4	0	0	0	125.1
614	D	25	Very low	27.9	Very low	150 Å²	150	147.4 Å²	147.4	80%	0.802	76%	0.756	S	S	*	*				43.2	133.1	122.3	-53.9	-7.2	0	0	0	125
615	S	29.4	Very low	28.1	Very low	120 Å²	120	147.8 Å²	147.8	84%	0.839	76%	0.763	S	S	*	*				-167.4	142.7	122.3	-172.4	0	0	0	0	111.9
616	D	30.1	Very low	28.2	Very low	147 Å²	147	143.1 Å²	143.1	79%	0.786	76%	0.757	S	S	*	*			trans	-93.2	175.7	174.1	-86.2	-51.2	0	0	0	113.7
617	D	31.3	Very low	28.6	Very low	152 Å²	152	146.8 Å²	146.8	81%	0.813	76%	0.764	S	S	*	*			trans	90.1	155.8	144.8	-83.9	-26.6	0	0	0	124.5
618	E	33.1	Very low	28.8	Very low	164 Å²	164	145.2 Å²	145.2	77%	0.766	75%	0.754	S	S	*	*			trans	-41.9	159.1	-166.5	-48.7	-173.6	112.5	0	0	120.6
619	L	29.5	Very low	29.1	Very low	161 Å²	161	150 Å²	150	84%	0.843	76%	0.758	S	S	*	*				-175.9	156.4	100.5	-95.2	172.6	0	0	0	115
620	Q	32.6	Very low	29.2	Very low	184 Å²	184	146.9 Å²	146.9	86%	0.86	75%	0.754	S	S	*	*			trans	-91.7	150.2	172	-61.2	173.7	-21.6	0	0	111.4
621	I	30.7	Very low	29.2	Very low	175 Å²	175	146.3 Å²	146.3	90%	0.897	76%	0.755	S	S	*	*			trans	-137.4	138.6	156.9	-58	-177.3	0	0	0	109
622	D	28.5	Very low	29.4	Very low	144 Å²	144	145.1 Å²	145.1	77%	0.77	76%	0.755	S	S	*	*			trans	-121.3	175.5	178.3	-169.9	9.9	0	0	0	109.8
623	E	31.5	Very low	29.3	Very low	139 Å²	139	145.9 Å²	145.9	65%	0.65	76%	0.758	S	S	*	*			trans	67.7	161	170.2	-71.2	-139.5	115.5	0	0	118.5
624	R	29.4	Very low	29.2	Very low	195 Å²	195	148 Å²	148	74%	0.736	77%	0.769	S	S	*	*			cis	-170.8	156.9	-46.3	-139.1	167.6	171.1	-175.5	4.3	110.6
625	L	28.5	Very low	29.2	Very low	164 Å²	164	151.6 Å²	151.6	86%	0.859	77%	0.771	S	S	*	*			trans	66.2	141.7	164.2	-53	167.8	0	0	0	117
626	G	26.8	Very low	29.1	Very low	62 Å²	62	151.4 Å²	151.4	64%	0.639	77%	0.77	S	S	*	*			cis	156.1	169.8	-11.6	0	0	0	0	0	114.4
627	K	33.3	Very low	28.9	Very low	194 Å²	194	153.7 Å²	153.7	84%	0.843	77%	0.773	S	S	*	*			trans	72.7	146	171.1	-56.2	178.5	-179.1	173.9	0	116
628	E	28.8	Very low	28.8	Very low	134 Å²	134	154.3 Å²	154.3	63%	0.626	77%	0.768	S	S	*	*			cis	-160	-179.6	-10.7	-113.2	-176.1	117.5	0	0	106.8
629	K	31.1	Very low	28.4	Very low	158 Å²	158	152.5 Å²	152.5	69%	0.687	77%	0.771	S	S	*	*			cis	-155.8	-177	15.2	-129.1	163.5	-172.3	77.7	0	105.7
630	A	28.2	Very low	28.5	Very low	82 Å²	82	154.7 Å²	154.7	68%	0.678	77%	0.768	S	S	*	*			cis	-148.2	172	6.3	0	0	0	0	0	108.1
631	N	26.3	Very low	28.2	Very low	126 Å²	126	155.9 Å²	155.9	67%	0.674	77%	0.77	S	S	*	*			cis	78.9	122.2	26.7	-81.1	-21.7	0	0	0	115.2
632	L	28.5	Very low	28.2	Very low	138 Å²	138	155 Å²	155	72%	0.723	77%	0.767	S	S	*	*			cis	-152.8	146.6	5.5	-84.7	161.6	0	0	0	115.6
633	L	25.4	Very low	28.2	Very low	144 Å²	144	154.5 Å²	154.5	75%	0.754	77%	0.771	S	S	*	*			trans	39.3	129	139.4	-63.4	172.1	0	0	0	124.3
634	I	25.5	Very low	28.2	Very low	175 Å²	175	158.9 Å²	158.9	90%	0.897	78%	0.782	S	S	*	*				-130.6	152.2	122.2	-68.7	-171.8	0	0	0	108.8
635	R	24.8	Very low	28.3	Very low	225 Å²	225	153.1 Å²	153.1	85%	0.849	78%	0.776	S	S	*	*			trans	-124.6	126.4	-173.5	176	-171.7	-176.6	-173.2	4.7	111.8
636	S	26.4	Very low	28.6	Very low	116 Å²	116	153.2 Å²	153.2	81%	0.811	77%	0.769	S	S	*	*			trans	-107	173.2	163.9	63.7	0	0	0	0	111.3
637	K	26	Very low	29	Very low	196 Å²	196	155.1 Å²	155.1	85%	0.852	77%	0.771	S	S	*	*			trans	-109.2	138.7	-166.5	-63.5	174.7	-177.4	172.2	0	112.4
638	F	29	Very low	29.4	Very low	164 Å²	164	148.4 Å²	148.4	72%	0.719	75%	0.747	S	S	*	*			trans	-58.6	154.3	159.3	-86.8	-82.5	0	0	0	111.1	R640	F638-R640 HydrophobicContact CD1-CG 3.67Å; F638-R640 HydrophobicContact CE1-CG 4.02Å; F638-R640 HydrophobicContact CG-CG 4.3Å
639	P	26.1	Very low	30.2	Very low	127 Å²	127	147.7 Å²	147.7	83%	0.825	76%	0.757	S	S	*	*				-115.1	136.5	112.4	32.6	-33.1	0	0	0	112
640	R	31.1	Very low	31.3	Very low	207 Å²	207	144.6 Å²	144.6	78%	0.781	75%	0.748	S	S	*	*			trans	-102.3	122.1	163.9	-68.5	179.7	178.1	175.9	-4.5	108.8	F638	F638-R640 HydrophobicContact CD1-CG 3.67Å; F638-R640 HydrophobicContact CE1-CG 4.02Å; F638-R640 HydrophobicContact CG-CG 4.3Å
641	K	26.5	Very low	32.4	Very low	209 Å²	209	146.5 Å²	146.5	91%	0.909	75%	0.753	S	S	*	*			trans	-145.4	114	149.2	-74.1	-165.9	179.8	175.5	0	108.9
642	L	29.9	Very low	33.4	Very low	157 Å²	157	146.8 Å²	146.8	82%	0.822	76%	0.755	S	S	*	*			trans	-75.1	158.8	159.5	-68.2	163	0	0	0	108.4
643	P	28.5	Very low	34.9	Very low	133 Å²	133	146.7 Å²	146.7	86%	0.864	75%	0.745	S	S	*	*			trans	-51.9	140.6	166.9	-24.7	34.8	0	0	0	110.6
644	R	32	Very low	36.1	Very low	230 Å²	230	147.8 Å²	147.8	87%	0.868	75%	0.75	S	S	*	*			trans	-130.3	102.9	-176.5	-175.9	175	-177	156.9	1.9	109.4
645	A	31.3	Very low	37.4	Very low	74 Å²	74	143.2 Å²	143.2	61%	0.612	72%	0.722	S	S	*	*			trans	-50.5	142.5	172.2	0	0	0	0	0	111.1	F662	A645-F662 HydrophobicContact CB-CD1 4.42Å
646	K	35.5	Very low	38.4	Very low	166 Å²	166	140.4 Å²	140.4	72%	0.722	72%	0.718	S	S	*	*			trans	-119.1	149.9	171.6	-66.7	177	-175.1	165.3	0	108.4
647	P	34.6	Very low	38.8	Very low	103 Å²	103	141.8 Å²	141.8	67%	0.669	72%	0.724	S	S	*	*			trans	-60.3	152	167.4	-21	33.5	0	0	0	111.7
648	C	42.8	Very low	39.8	Very low	52 Å²	52	135.9 Å²	135.9	35%	0.351	72%	0.719	S	S	.	*			trans	-58.5	146.5	175.1	-166.8	0	0	0	0	111.3	R655 D663	C648-R655 PolarHBondContact SG-NH1 2.9Å; C648-D663 PolarHBondContact SG-OD2 3.25Å
649	S	45.4	Very low	40.5	Very low	119 Å²	119	133.1 Å²	133.1	83%	0.832	71%	0.708	S	S	*	*	S	Bend	trans	-101.4	-2.8	-169.8	-62	0	0	0	0	115.5
650	D	54.3	Low	41.6	Very low	93 Å²	93	132 Å²	132	50%	0.497	70%	0.699	S	S	.	*			trans	-116.1	112.6	176.6	-175.5	-8.2	0	0	0	111.1	N652	D650-N652 VanDerWaalsContact C-N 3.26Å; D650-N652 PolarHBondContact OD1-N 3Å; D650-N652 PolarHBondContact O-N 3.03Å
651	P	50.2	Low	42.4	Very low	122 Å²	122	129.6 Å²	129.6	79%	0.792	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-1.8	-178.9	32.4	-35.7	0	0	0	114.8
652	N	48.4	Very low	43.1	Very low	132 Å²	132	125.2 Å²	125.2	71%	0.706	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-2.4	-174.8	-62	-70.1	0	0	0	115	D650 I654	D650-N652 VanDerWaalsContact C-N 3.26Å; D650-N652 PolarHBondContact OD1-N 3Å; D650-N652 PolarHBondContact O-N 3.03Å; N652-I654 PolarHBondContact O-N 2.9Å; N652-I654 VanDerWaalsContact O-N 3.13Å
653	R	59	Low	43.4	Very low	136 Å²	136	121.8 Å²	121.8	51%	0.513	66%	0.661	S	S	.	*			trans	-74.8	103.4	179	-176.8	179	162.5	-174.8	-9.9	111.5	R655 E659	R653-R655 HydrophobicContact CG-CG 4.13Å; R653-R655 VanDerWaalsContact CZ-CZ 3.42Å; R653-E659 IonicContact NH2-OE1 2.82Å; R653-E659 IonicContact NH2-OE2 3.57Å
654	I	51.7	Low	43.9	Very low	167 Å²	167	122.3 Å²	122.3	86%	0.856	65%	0.654	S	S	*	*			trans	-67	133.2	167.8	-54.7	176.6	0	0	0	109	N652	N652-I654 PolarHBondContact O-N 2.9Å; N652-I654 VanDerWaalsContact O-N 3.13Å
655	R	51	Low	44	Very low	80 Å²	80	120.7 Å²	120.7	30%	0.302	66%	0.657	S	S	.	*			trans	-133.1	153.8	-178.1	-80.5	156.9	130.3	149.7	-10.7	109.8	C648 R653 E659 D663	C648-R655 PolarHBondContact SG-NH1 2.9Å; R653-R655 HydrophobicContact CG-CG 4.13Å; R653-R655 VanDerWaalsContact CZ-CZ 3.42Å; R655-E659 PolarHBondContact NH2-OE2 3.13Å; R655-E659 IonicContact NH2-OE2 3.21Å; R655-E659 IonicContact NE-OE2 2.7Å; R655-E659 IonicContact NE-OE1 3.66Å; R655-E659 IonicContact CZ-OE2 3.38Å; R655-E659 PolarHBondContact NE-OE2 2.8Å; R655-D663 IonicContact CZ-OD1 3.67Å; R655-D663 IonicContact NH1-OD1 3.54Å; R655-D663 IonicContact NH2-OD1 2.86Å; R655-D663 PolarHBondContact NH2-OD1 2.99Å
656	E	46.1	Very low	44.2	Very low	165 Å²	165	124.3 Å²	124.3	77%	0.771	66%	0.661	S	S	*	*			trans	-82.5	161.5	-177.9	-67.8	-158.1	163.9	0	0	113.1	G658	E656-G658 PolarHBondContact O-N 2.87Å
657	P	36.4	Very low	43.8	Very low	145 Å²	145	123.7 Å²	123.7	94%	0.942	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	91.9	-173.4	-19	33.8	0	0	0	113.3
658	G	46.3	Very low	43.5	Very low	73 Å²	73	127.4 Å²	127.4	75%	0.753	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	165.5	-22.4	174.1	0	0	0	0	0	115.7	E656	E656-G658 PolarHBondContact O-N 2.87Å
659	E	42.9	Very low	42.8	Very low	105 Å²	105	130.4 Å²	130.4	49%	0.491	68%	0.684	S	S	.	*			trans	-65.8	148.3	177.5	-69	-172.1	-133.7	0	0	112.5	R653 R655	R653-E659 IonicContact NH2-OE1 2.82Å; R653-E659 IonicContact NH2-OE2 3.57Å; R655-E659 PolarHBondContact NH2-OE2 3.13Å; R655-E659 IonicContact NH2-OE2 3.21Å; R655-E659 IonicContact NE-OE2 2.7Å; R655-E659 IonicContact NE-OE1 3.66Å; R655-E659 IonicContact CZ-OE2 3.38Å; R655-E659 PolarHBondContact NE-OE2 2.8Å
660	V	50.3	Low	42.1	Very low	105 Å²	105	130.5 Å²	130.5	64%	0.636	68%	0.68	S	S	*	*			trans	-100.6	152.8	178	-74.8	0	0	0	0	112.1	F662	V660-F662 HydrophobicContact CB-CD2 4.5Å; V660-F662 PolarHBondContact O-N 2.86Å
661	E	46.8	Very low	40.8	Very low	155 Å²	155	133.5 Å²	133.5	72%	0.724	70%	0.696	S	S	*	*	S	Bend	trans	-78.8	29.4	-163.4	-150.9	-173	155.2	0	0	115.5
662	F	40.9	Very low	39.9	Very low	118 Å²	118	136 Å²	136	52%	0.518	70%	0.698	S	S	.	*			trans	-139.7	119.3	-179.1	-30.6	-74.5	0	0	0	109.9	A645 V660	A645-F662 HydrophobicContact CB-CD1 4.42Å; V660-F662 HydrophobicContact CB-CD2 4.5Å; V660-F662 PolarHBondContact O-N 2.86Å
663	D	37.6	Very low	39	Very low	85 Å²	85	136.6 Å²	136.6	46%	0.455	70%	0.7	S	S	.	*			trans	-78.4	125.8	166.8	-52.3	-64.2	0	0	0	108	C648 R655	C648-D663 PolarHBondContact SG-OD2 3.25Å; R655-D663 IonicContact CZ-OD1 3.67Å; R655-D663 IonicContact NH1-OD1 3.54Å; R655-D663 IonicContact NH2-OD1 2.86Å; R655-D663 PolarHBondContact NH2-OD1 2.99Å
664	I	38.4	Very low	37.5	Very low	143 Å²	143	138.9 Å²	138.9	73%	0.733	72%	0.719	S	S	*	*			trans	-105.3	127.3	177.4	-60	176.1	0	0	0	107.5	E666	I664-E666 PolarHBondContact O-N 3.42Å
665	E	33.4	Very low	36.6	Very low	197 Å²	197	136.5 Å²	136.5	92%	0.921	71%	0.712	S	S	*	*			trans	-75.9	106.6	170.3	-71.9	173.7	136.4	0	0	108.8
666	E	35.2	Very low	35.5	Very low	150 Å²	150	142 Å²	142	70%	0.701	74%	0.741	S	S	*	*			trans	-84.1	107.8	168.8	-63.6	-172.9	153.7	0	0	109	I664 Y668	I664-E666 PolarHBondContact O-N 3.42Å; E666-Y668 HydrophobicContact CB-CD2 3.81Å; E666-Y668 PolarHBondContact O-N 2.78Å; E666-Y668 HydrophobicContact CB-CE2 4.12Å
667	D	28.1	Very low	34.6	Very low	153 Å²	153	137.9 Å²	137.9	82%	0.818	74%	0.743	S	S	*	*			trans	-80.9	67.7	-175.9	-157	8	0	0	0	111.3	T669	D667-T669 PolarHBondContact O-N 2.9Å
668	Y	29	Very low	34.2	Very low	180 Å²	180	137.9 Å²	137.9	71%	0.706	74%	0.74	S	S	*	*			trans	-92	83.3	174.9	-79.5	-70.4	0	0	0	111.6	E666 T670	E666-Y668 HydrophobicContact CB-CD2 3.81Å; E666-Y668 PolarHBondContact O-N 2.78Å; E666-Y668 HydrophobicContact CB-CE2 4.12Å; Y668-T670 PolarHBondContact O-N 3.22Å; Y668-T670 VanDerWaalsContact O-N 3.08Å
669	T	28.3	Very low	33.3	Very low	115 Å²	115	143 Å²	143	71%	0.706	75%	0.745	S	S	*	*			trans	-75.5	85.9	164	56.3	0	0	0	0	111.3	D667	D667-T669 PolarHBondContact O-N 2.9Å
670	T	30	Very low	32.7	Very low	122 Å²	122	143.4 Å²	143.4	75%	0.748	76%	0.759	S	S	*	*			trans	-91.2	97.8	164.2	51.1	0	0	0	0	110	Y668 E672	Y668-T670 PolarHBondContact O-N 3.22Å; Y668-T670 VanDerWaalsContact O-N 3.08Å; T670-E672 PolarHBondContact O-N 2.85Å
671	D	27.7	Very low	31.7	Very low	155 Å²	155	147.3 Å²	147.3	83%	0.829	77%	0.768	S	S	*	*			trans	-85	94.8	173	-76.3	-44.1	0	0	0	110.7
672	E	30.4	Very low	30.8	Very low	176 Å²	176	147.8 Å²	147.8	82%	0.822	77%	0.774	S	S	*	*			trans	-133.5	115.3	160.3	-79.5	-86.6	126.4	0	0	108.4	T670	T670-E672 PolarHBondContact O-N 2.85Å
673	D	29.8	Very low	30	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	79%	0.786	S	S	*	*			trans	36.8	119.2	164.1	-72.4	-6.9	0	0	0	121.8
674	M	27.7	Very low	29.5	Very low	184 Å²	184	149.3 Å²	149.3	91%	0.906	81%	0.805	S	S	*	*				-141.9	136.1	117.4	-116.7	-165.9	77	0	0	112.8
675	V	31.8	Very low	28.9	Very low	118 Å²	118	145.9 Å²	145.9	72%	0.715	81%	0.805	S	S	*	*			trans	-86.5	120.5	177.6	177	0	0	0	0	110.1
676	E	28.3	Very low	28.7	Very low	194 Å²	194	142.7 Å²	142.7	91%	0.907	80%	0.804	S	S	*	*			trans	-175.1	137.3	131.4	-106.1	179	-176.1	0	0	111.2
677	G	26.2	Very low	28.3	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	81%	0.81	S	S	*	*			trans	-170.2	87.1	-176.7	0	0	0	0	0	113.1
678	V	28.3	Very low	28.6	Very low	145 Å²	145	137 Å²	137	88%	0.879	81%	0.812	S	S	*	*			trans	-81.9	145.7	173.7	178.3	0	0	0	0	110.4
679	E	29.1	Very low	28.5	Very low	182 Å²	182	132 Å²	132	85%	0.85	82%	0.815	S	S	*	*			trans	-55.2	146.8	-169.4	-48.6	176.3	113	0	0	115.8
680	S	28.6	Very low	28.5	Very low	112 Å²	112	130 Å²	130	78%	0.783	82%	0.817	S	S	*	*				-164.2	105.9	127.9	23.3	0	0	0	0	116.1
681	K	29.7	Very low	28.5	Very low	188 Å²	188	132 Å²	132	82%	0.817	82%	0.822	S	S	*	*			trans	58	114.1	130.4	-67.4	-176.9	176.9	176.6	0	122.2
682	L	27.4	Very low	28.5	Very low	164 Å²	164	131.6 Å²	131.6	86%	0.859	82%	0.819	S	S	*	*				67.6	122.2	124.7	-71.5	156.8	0	0	0	120.8
683	G	25.4	Very low	28.5	Very low	74 Å²	74	129.4 Å²	129.4	76%	0.763	81%	0.813	S	S	*	*			trans	174.3	95.9	160.7	0	0	0	0	0	114.9
684	N	26.3	Very low	28.4	Very low	162 Å²	162	129.9 Å²	129.9	87%	0.866	82%	0.815	S	S	*	*			trans	-56.1	146.9	173.7	-59.3	-4.5	0	0	0	111.2
685	G	25.9	Very low	28.4	Very low	71 Å²	71	129.2 Å²	129.2	73%	0.732	81%	0.814	S	S	*	*				99.8	146.6	61.1	0	0	0	0	0	109.5
686	S	29.4	Very low	28.2	Very low	129 Å²	129	133.5 Å²	133.5	90%	0.902	82%	0.823	S	S	*	*			cis	-147	151.6	9.7	-59.7	0	0	0	0	108.9
687	G	26.6	Very low	28.2	Very low	80 Å²	80	129 Å²	129	83%	0.825	82%	0.819	S	S	*	*				123.7	160.2	80.2	0	0	0	0	0	108.6
688	A	33.9	Very low	28.2	Very low	103 Å²	103	130.7 Å²	130.7	85%	0.851	82%	0.818	S	S	*	*			cis	-134.5	169.8	-4.9	0	0	0	0	0	107.4
689	G	27.5	Very low	28.3	Very low	75 Å²	75	133.6 Å²	133.6	77%	0.773	81%	0.813	S	S	*	*			cis	94.2	122.6	27.3	0	0	0	0	0	110.7
690	G	28.4	Very low	28.3	Very low	73 Å²	73	132 Å²	132	75%	0.753	81%	0.806	S	S	*	*			cis	-97.5	-130.8	-13.5	0	0	0	0	0	111.7
691	I	30.2	Very low	28.4	Very low	164 Å²	164	133.9 Å²	133.9	84%	0.841	81%	0.812	S	S	*	*			cis	-171.7	156.1	-13.9	-121.4	164.1	0	0	0	106.2
692	L	28.6	Very low	28.3	Very low	148 Å²	148	128.9 Å²	128.9	78%	0.775	81%	0.814	S	S	*	*			cis	-128	139.7	13	-175.1	65.5	0	0	0	111.2
693	D	29.1	Very low	28.2	Very low	129 Å²	129	124.7 Å²	124.7	69%	0.69	81%	0.81	S	S	*	*			trans	-81.4	143.1	169.7	163.6	34.8	0	0	0	111.5
694	L	28.1	Very low	29	Very low	154 Å²	154	126.5 Å²	126.5	81%	0.806	81%	0.809	S	S	*	*			trans	-175.8	94.4	148.3	-106.3	166.8	0	0	0	112
695	L	27.5	Very low	29.1	Very low	170 Å²	170	125.7 Å²	125.7	89%	0.89	80%	0.804	S	S	*	*			trans	174.6	58.9	143.6	-98.2	168.7	0	0	0	112.4
696	K	28	Very low	29.1	Very low	208 Å²	208	133.8 Å²	133.8	90%	0.904	82%	0.815	S	S	*	*			trans	-143.3	48.5	171.9	-148.3	172.1	-175.1	174.9	0	116.3
697	A	27.5	Very low	29	Very low	99 Å²	99	131.8 Å²	131.8	82%	0.818	81%	0.806	S	S	*	*			trans	-142	140.3	153.8	0	0	0	0	0	107.2
698	S	26.1	Very low	29.2	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	80%	0.804	S	S	*	*			cis	-137.3	162	28.2	-178.4	0	0	0	0	113.2
699	R	30.3	Very low	29	Very low	205 Å²	205	135.7 Å²	135.7	77%	0.774	81%	0.806	S	S	*	*			trans	-116.1	133.6	165.1	-101.6	-176.6	173.9	-121.2	10.6	109.8
700	Q	30.7	Very low	29.2	Very low	150 Å²	150	137.6 Å²	137.6	70%	0.701	80%	0.803	S	S	*	*			trans	57.2	110.4	146.4	-61.4	169.8	-97.1	0	0	119.3
701	V	30.8	Very low	29.2	Very low	150 Å²	150	143.4 Å²	143.4	91%	0.909	81%	0.81	S	S	*	*			trans	-152.1	133.1	147.9	-106.5	0	0	0	0	110.3
702	G	26.1	Very low	29.4	Very low	84 Å²	84	140 Å²	140	87%	0.866	81%	0.807	S	S	*	*			trans	86.2	121.4	154.8	0	0	0	0	0	119.5
703	G	25.1	Very low	29.5	Very low	75 Å²	75	139.3 Å²	139.3	77%	0.773	81%	0.811	S	S	*	*			trans	-131.8	-167.9	141.8	0	0	0	0	0	107.8
704	P	43.6	Very low	29.6	Very low	113 Å²	113	137.9 Å²	137.9	73%	0.734	82%	0.817	S	S	*	*			cis	-127	-169.5	0	42.9	-27.3	0	0	0	113.6
705	D	27	Very low	30	Very low	144 Å²	144	136 Å²	136	77%	0.77	82%	0.817	S	S	*	*			trans	41.7	115.6	154.3	-54.8	-22.8	0	0	0	122
706	Y	26.7	Very low	30.4	Very low	242 Å²	242	133.4 Å²	133.4	95%	0.949	81%	0.81	S	S	*	*				-159	169.1	112.5	-128.2	-98.8	0	0	0	111.5
707	A	27.8	Very low	31.1	Very low	86 Å²	86	127.4 Å²	127.4	71%	0.711	79%	0.794	S	S	*	*			trans	-111.9	160.7	-155.1	0	0	0	0	0	117.5
708	A	29.8	Very low	32	Very low	97 Å²	97	129 Å²	129	80%	0.802	79%	0.794	S	S	*	*			trans	69.2	115.7	155.9	0	0	0	0	0	120
709	L	30.5	Very low	32.6	Very low	169 Å²	169	131.1 Å²	131.1	89%	0.885	79%	0.791	S	S	*	*				-154.8	157.8	120.5	-106.6	169.3	0	0	0	111.2
710	T	31.3	Very low	33.3	Very low	115 Å²	115	128.4 Å²	128.4	71%	0.706	79%	0.787	S	S	*	*			trans	-70.7	172.1	-160.1	43.3	0	0	0	0	118.7
711	E	27.6	Very low	33.6	Very low	195 Å²	195	125 Å²	125	91%	0.911	79%	0.785	S	S	*	*			trans	85.3	142.3	159.3	-72.3	176.8	172	0	0	119.7
712	A	34.6	Very low	34.3	Very low	92 Å²	92	123.1 Å²	123.1	76%	0.76	77%	0.769	S	S	*	*			trans	-127	136.4	178.1	0	0	0	0	0	109.2
713	P	32.2	Very low	35	Very low	134 Å²	134	125.4 Å²	125.4	87%	0.87	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-76.2	131.5	178	30.3	-33	0	0	0	111.1
714	A	30.5	Very low	35.6	Very low	98 Å²	98	124.9 Å²	124.9	81%	0.81	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-78.9	164.7	174.8	0	0	0	0	0	112.4
715	S	37	Very low	35	Very low	115 Å²	115	127.1 Å²	127.1	80%	0.804	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-57.3	138.3	177.9	-42.1	0	0	0	0	112.7
716	P	35.6	Very low	35.4	Very low	115 Å²	115	126.1 Å²	126.1	75%	0.747	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-67.1	149.8	171.3	29.4	-34.5	0	0	0	111.2
717	S	43	Very low	35.7	Very low	82 Å²	82	119.6 Å²	119.6	57%	0.573	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-87.8	161.5	-176.3	67	0	0	0	0	112.8	Q719	S717-Q719 PolarHBondContact O-N 3.28Å
718	T	45.4	Very low	35.9	Very low	132 Å²	132	124.2 Å²	124.2	81%	0.81	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	10.4	-173.3	30.3	0	0	0	0	116.1
719	Q	39	Very low	36.2	Very low	160 Å²	160	124 Å²	124	75%	0.748	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-27.1	-176.6	-166.1	163.9	-16	0	0	113.8	S717	S717-Q719 PolarHBondContact O-N 3.28Å
720	E	44	Very low	36.2	Very low	148 Å²	148	121.6 Å²	121.6	69%	0.692	73%	0.731	S	S	*	*	S	Bend	trans	-85.3	-29.1	-176.3	-62.4	-170.7	135	0	0	113.3	I722 Q723	E720-I722 PolarHBondContact O-N 3.35Å; E720-Q723 PolarHBondContact O-N 2.99Å
721	A	38.7	Very low	36	Very low	79 Å²	79	124.6 Å²	124.6	65%	0.653	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-23	177.2	0	0	0	0	0	113.9
722	I	45.4	Very low	36.2	Very low	111 Å²	111	122.9 Å²	122.9	57%	0.569	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-25.1	-178.4	-61.9	176.2	0	0	0	111.4	E720	E720-I722 PolarHBondContact O-N 3.35Å
723	Q	39.3	Very low	35.7	Very low	132 Å²	132	123.9 Å²	123.9	62%	0.617	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-22.9	-175.2	-170.3	53.3	83.2	0	0	113.4	E720	E720-Q723 PolarHBondContact O-N 2.99Å
724	G	38.5	Very low	35.4	Very low	63 Å²	63	122.4 Å²	122.4	65%	0.649	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-74.4	-25.5	-178.3	0	0	0	0	0	115.5
725	M	32.1	Very low	35.2	Very low	161 Å²	161	122.8 Å²	122.8	79%	0.793	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-90.9	-4	-174.1	-66.6	-168.8	-70.1	0	0	114.7
726	L	35.3	Very low	34.7	Very low	123 Å²	123	122.8 Å²	122.8	64%	0.644	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-97.5	12.5	-175.3	-74.7	169.3	0	0	0	114.7
727	C	31.7	Very low	34.3	Very low	104 Å²	104	122.3 Å²	122.3	70%	0.703	72%	0.724	S	S	*	*	S	Bend	trans	-93.1	-1.7	-176	-73.5	0	0	0	0	116.2
728	M	31.9	Very low	34.4	Very low	184 Å²	184	124.1 Å²	124.1	91%	0.906	73%	0.734	S	S	*	*	S	Bend	trans	-105.9	3.7	-176.1	-75.4	-62.3	-65.2	0	0	115.6
729	A	36.3	Very low	33.5	Very low	92 Å²	92	122.3 Å²	122.3	76%	0.76	73%	0.733	S	S	*	*			trans	-136.4	83.2	179.2	0	0	0	0	0	111.4
730	N	30.1	Very low	32.8	Very low	118 Å²	118	121.5 Å²	121.5	63%	0.631	74%	0.739	S	S	*	*			trans	-149.7	99.9	172.3	-152.9	-14	0	0	0	112.3	Q732	N730-Q732 VanDerWaalsContact OD1-CG 3.31Å; N730-Q732 WeakPolarHBondContact OD1-CG 3.27Å
731	L	28.2	Very low	31.9	Very low	179 Å²	179	119.1 Å²	119.1	94%	0.937	74%	0.738	S	S	*	*			trans	-112	119.7	151.9	-89.9	172.5	0	0	0	107.6
732	Q	30.4	Very low	31.3	Very low	159 Å²	159	119.9 Å²	119.9	74%	0.743	74%	0.739	S	S	*	*			trans	-77.1	161.6	-177.6	-64.2	170.4	4.5	0	0	108.8	N730	N730-Q732 VanDerWaalsContact OD1-CG 3.31Å; N730-Q732 WeakPolarHBondContact OD1-CG 3.27Å
733	S	24.2	Very low	30.4	Very low	113 Å²	113	122 Å²	122	79%	0.79	75%	0.751	S	S	*	*			cis	-159.5	157.2	45.9	57.1	0	0	0	0	116.3
734	S	27	Very low	29.9	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	76%	0.762	S	S	*	*			trans	-70.2	-176.6	156.1	60.9	0	0	0	0	110.8
735	S	26.8	Very low	29.4	Very low	105 Å²	105	126 Å²	126	73%	0.734	77%	0.769	S	S	*	*			cis	-167.3	162	12.9	0.8	0	0	0	0	107.8
736	S	25.8	Very low	29.1	Very low	115 Å²	115	129.8 Å²	129.8	80%	0.804	78%	0.775	S	S	*	*			cis	-163.6	-179.4	-8.9	60	0	0	0	0	109.9
737	S	27.5	Very low	28.7	Very low	105 Å²	105	135.6 Å²	135.6	73%	0.734	79%	0.788	S	S	*	*			trans	-77.3	-179.6	164.5	-33.1	0	0	0	0	111.5
738	P	45.4	Very low	28.6	Very low	121 Å²	121	136.2 Å²	136.2	79%	0.786	79%	0.789	S	S	*	*				-150.7	168	55.3	42.9	-22.4	0	0	0	120.3
739	A	25.1	Very low	28.4	Very low	94 Å²	94	131.5 Å²	131.5	78%	0.777	79%	0.787	S	S	*	*			trans	73.4	160.7	149.8	0	0	0	0	0	119.4
740	T	25.4	Very low	28	Very low	142 Å²	142	130.8 Å²	130.8	87%	0.871	79%	0.789	S	S	*	*			cis	-125.5	-146.6	3.1	58.5	0	0	0	0	112.5
741	S	25	Very low	27.9	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	80%	0.799	S	S	*	*			trans	-116.3	176.8	-155.4	62.2	0	0	0	0	117
742	S	26.1	Very low	27.9	Very low	95 Å²	95	131 Å²	131	66%	0.664	78%	0.782	S	S	*	*			trans	82.6	109.1	142.1	44.7	0	0	0	0	122.9
743	L	26.9	Very low	27.9	Very low	155 Å²	155	132.8 Å²	132.8	81%	0.812	78%	0.781	S	S	*	*				73.1	114.7	126.4	-64.6	170.2	0	0	0	123
744	Q	27.3	Very low	28.1	Very low	185 Å²	185	132 Å²	132	86%	0.864	78%	0.776	S	S	*	*			trans	83	148.9	133.8	-76.7	-160.7	-0.3	0	0	123.8
745	A	29.1	Very low	28.3	Very low	96 Å²	96	132.9 Å²	132.9	79%	0.793	78%	0.782	S	S	*	*			trans	90.3	128.2	152.6	0	0	0	0	0	120.4
746	W	25.5	Very low	28.4	Very low	239 Å²	239	131.1 Å²	131.1	91%	0.905	78%	0.78	S	S	*	*			trans	-69.3	164.8	162.9	-71.3	-56	0	0	0	112.4
747	W	26.6	Very low	28.8	Very low	246 Å²	246	131.8 Å²	131.8	93%	0.932	79%	0.785	S	S	*	*				-152.7	-173.9	121.2	-102	96.5	0	0	0	110.1
748	T	29.3	Very low	29	Very low	117 Å²	117	132.2 Å²	132.2	72%	0.718	79%	0.788	S	S	*	*			trans	-132.9	162.1	-150.2	58.6	0	0	0	0	116.8
749	G	28.3	Very low	28.3	Very low	84 Å²	84	131.9 Å²	131.9	87%	0.866	79%	0.788	S	S	*	*			trans	106.8	153.9	155.3	0	0	0	0	0	115.1
750	G	27.8	Very low	28.6	Very low	78 Å²	78	133.1 Å²	133.1	80%	0.804	79%	0.791	S	S	*	*			cis	-150.2	-149.3	-1.3	0	0	0	0	0	110.2
751	Q	28.3	Very low	28.8	Very low	178 Å²	178	129.9 Å²	129.9	83%	0.832	79%	0.787	S	S	*	*			cis	-168.1	164	5	-157.5	-177.9	-26.7	0	0	111.3
752	E	27.3	Very low	29	Very low	124 Å²	124	134.1 Å²	134.1	58%	0.579	80%	0.801	S	S	*	*			trans	79.3	147.6	161.7	-55.4	-144	123.7	0	0	119.4
753	R	31	Very low	29	Very low	195 Å²	195	133.1 Å²	133.1	74%	0.736	81%	0.805	S	S	*	*			cis	-158.1	161.7	-0.6	-127.4	174.4	-154.1	171.2	23	113.8
754	S	28.8	Very low	29.2	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	81%	0.807	S	S	*	*			trans	56.8	121.5	151.7	-53.7	0	0	0	0	120.8
755	S	32.1	Very low	29.3	Very low	121 Å²	121	129.7 Å²	129.7	85%	0.846	80%	0.803	S	S	*	*				81.2	129.8	52.3	74.6	0	0	0	0	116.1
756	G	28	Very low	29.2	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	80%	0.8	S	S	*	*			cis	165.8	166.8	-7	0	0	0	0	0	115.2
757	S	33.1	Very low	29.4	Very low	130 Å²	130	123.5 Å²	123.5	91%	0.909	79%	0.791	S	S	*	*			trans	69.8	152.6	176.1	80.8	0	0	0	0	117.2
758	S	32.7	Very low	29.3	Very low	114 Å²	114	117 Å²	117	80%	0.797	78%	0.783	S	S	*	*			cis	-146.6	-163.9	6.1	60.7	0	0	0	0	109.4
759	S	30.3	Very low	30.4	Very low	113 Å²	113	117 Å²	117	79%	0.79	79%	0.785	S	S	*	*			cis	-146	-118.6	7.2	61.4	0	0	0	0	113.3
760	S	32.8	Very low	30.4	Very low	120 Å²	120	117.5 Å²	117.5	84%	0.839	78%	0.781	S	S	*	*			trans	-163.3	156.9	-170.4	61.1	0	0	0	0	116.5
761	G	29.1	Very low	30.4	Very low	75 Å²	75	118.7 Å²	118.7	77%	0.773	78%	0.777	S	S	*	*			trans	176.5	76.3	173.2	0	0	0	0	0	118.9
762	L	29.4	Very low	30.5	Very low	186 Å²	186	117.3 Å²	117.3	97%	0.974	77%	0.77	S	S	*	*			trans	27.6	126.2	152.8	-71.4	155.6	0	0	0	122.6
763	G	26	Very low	30.5	Very low	74 Å²	74	122.2 Å²	122.2	76%	0.763	78%	0.783	S	S	*	*			trans	-179.8	150.2	164.3	0	0	0	0	0	114.5
764	T	29.7	Very low	30.8	Very low	139 Å²	139	119.1 Å²	119.1	85%	0.853	79%	0.787	S	S	*	*			trans	-150.2	177.3	-171.8	47.9	0	0	0	0	110.8
765	V	29.5	Very low	31.9	Very low	129 Å²	129	120.5 Å²	120.5	78%	0.782	79%	0.793	S	S	*	*			cis	-148.2	154.5	23	-161.3	0	0	0	0	113.3
766	S	28.5	Very low	31.7	Very low	105 Å²	105	118.1 Å²	118.1	73%	0.734	79%	0.788	S	S	*	*			trans	-43.8	165	157.7	-49.3	0	0	0	0	116.6
767	S	28.3	Very low	31.9	Very low	100 Å²	100	124.4 Å²	124.4	70%	0.699	80%	0.796	S	S	*	*			cis	177.7	157.4	-7.7	47.3	0	0	0	0	114
768	S	25.9	Very low	31.7	Very low	110 Å²	110	129.3 Å²	129.3	77%	0.769	80%	0.795	S	S	*	*			trans	70.7	168.7	141.5	-74.5	0	0	0	0	121.1
769	P	51.3	Low	32.3	Very low	117 Å²	117	128.8 Å²	128.8	76%	0.76	79%	0.788	S	S	*	*			cis	-144.2	177	-36	40	-22.2	0	0	0	117.2
770	A	28.3	Very low	32.3	Very low	94 Å²	94	130.7 Å²	130.7	78%	0.777	79%	0.788	S	S	*	*			trans	80.2	124.8	139.8	0	0	0	0	0	125.9
771	S	27.7	Very low	32.1	Very low	103 Å²	103	134.6 Å²	134.6	72%	0.72	79%	0.79	S	S	*	*				81.2	111.2	124.6	-168.9	0	0	0	0	125.5
772	Q	30.7	Very low	32.2	Very low	150 Å²	150	142.2 Å²	142.2	70%	0.701	80%	0.795	S	S	*	*			trans	65.6	131.7	135.9	-71.2	-161.3	46.2	0	0	125.5
773	R	28.1	Very low	32.7	Very low	226 Å²	226	139 Å²	139	85%	0.853	79%	0.786	S	S	*	*			trans	83.8	138	142	-73.7	175.7	-174.4	-148.3	-4.6	122.2
774	T	37.4	Very low	32.8	Very low	131 Å²	131	139.9 Å²	139.9	80%	0.804	79%	0.785	S	S	*	*			trans	-93.7	-179.6	175.2	50.3	0	0	0	0	111.4
775	P	51.1	Low	32.4	Very low	127 Å²	127	142 Å²	142	83%	0.825	78%	0.779	S	S	*	*			cis	-158.4	170	30.1	44	-21	0	0	0	123.1
776	G	28	Very low	32	Very low	71 Å²	71	144.5 Å²	144.5	73%	0.732	78%	0.775	S	S	*	*			trans	105.4	157.5	148	0	0	0	0	0	118.8
777	K	33	Very low	31.7	Very low	198 Å²	198	146.8 Å²	146.8	86%	0.861	77%	0.771	S	S	*	*			cis	-162.1	124.7	-8.9	-76.4	179.6	-177.1	168.3	0	113.3
778	R	28.5	Very low	31.5	Very low	234 Å²	234	147.9 Å²	147.9	88%	0.883	77%	0.77	S	S	*	*			trans	57.1	-175.3	147.2	-59.3	-173	174.8	-178.6	-2	118.7
779	P	45.3	Very low	31.4	Very low	102 Å²	102	150.8 Å²	150.8	66%	0.662	77%	0.771	S	S	*	*			cis	-135.2	150.5	-15.8	23.6	0.8	0	0	0	119.4
780	I	30.2	Very low	30.4	Very low	153 Å²	153	148.9 Å²	148.9	79%	0.785	76%	0.76	S	S	*	*				48.4	124.6	129	-47.7	164	0	0	0	122.8
781	K	28.1	Very low	30.5	Very low	203 Å²	203	151.2 Å²	151.2	88%	0.883	76%	0.755	S	S	*	*				-177.1	156.7	122.4	-103.5	178.1	-176	-178.9	0	116.5
782	R	32.3	Very low	30.7	Very low	235 Å²	235	154.4 Å²	154.4	89%	0.887	76%	0.758	S	S	*	*			trans	-123.5	166.1	158.7	-97	-175.8	176.2	-178	-1.2	105.9
783	P	39.7	Very low	30.8	Very low	119 Å²	119	155.8 Å²	155.8	77%	0.773	77%	0.765	S	S	*	*			cis	-154.4	-165	40.4	43.2	-19.9	0	0	0	117.8
784	A	26.5	Very low	31.1	Very low	91 Å²	91	152.6 Å²	152.6	75%	0.752	76%	0.76	S	S	*	*			trans	82.9	119.3	139.6	0	0	0	0	0	124.5
785	Y	21.5	Very low	30.9	Very low	183 Å²	183	152.5 Å²	152.5	72%	0.718	75%	0.754	S	S	*	*				77.1	105.4	119.6	-153.6	-95.2	0	0	0	123.5
786	W	21.6	Very low	29.9	Very low	182 Å²	182	149.9 Å²	149.9	69%	0.689	74%	0.744	S	S	*	*			trans	80.8	132.1	141.1	-84	38.3	0	0	0	124.8
787	K	23	Very low	30	Very low	153 Å²	153	151.3 Å²	151.3	67%	0.665	74%	0.742	S	S	*	*			trans	73.5	131.8	142	-80.9	-159.2	168.9	-164.8	0	123
788	N	23.8	Very low	30.1	Very low	124 Å²	124	149.4 Å²	149.4	66%	0.663	74%	0.741	S	S	*	*			trans	51.6	153	139.7	-59.7	41.8	0	0	0	118.3
789	E	23.7	Very low	30.3	Very low	171 Å²	171	144.8 Å²	144.8	80%	0.799	73%	0.733	S	S	*	*			cis	-109.5	166	16.8	-70.6	136.7	160.2	0	0	111.1
790	S	30.1	Very low	29.7	Very low	76 Å²	76	147.8 Å²	147.8	53%	0.531	74%	0.738	S	S	.	*			cis	62.8	162.8	34.2	81.6	0	0	0	0	113.6
791	E	29.7	Very low	29.8	Very low	143 Å²	143	149 Å²	149	67%	0.668	74%	0.741	S	S	*	*			cis	-74.7	-174.3	-14.7	-89.1	57.6	-98.8	0	0	111.2
792	E	32	Very low	29.9	Very low	170 Å²	170	146 Å²	146	79%	0.794	73%	0.734	S	S	*	*			cis	-122.8	-140.2	4.5	-146.2	96.7	-115.5	0	0	108.7
793	E	33.4	Very low	30	Very low	180 Å²	180	139.1 Å²	139.1	84%	0.841	72%	0.723	S	S	*	*			cis	-149.2	-161.4	3.1	-149.4	-177.1	154.6	0	0	109.5
794	E	35.1	Very low	29.6	Very low	159 Å²	159	142.1 Å²	142.1	74%	0.743	73%	0.731	S	S	*	*			trans	-137.7	167	-160.1	-69.7	-149.5	135.6	0	0	112.6
795	N	31.9	Very low	29.7	Very low	129 Å²	129	141 Å²	141	69%	0.69	73%	0.729	S	S	*	*			cis	-169.2	166.8	-16.1	-100.6	-21.7	0	0	0	106.8
796	A	31	Very low	30.4	Very low	72 Å²	72	137.1 Å²	137.1	60%	0.595	73%	0.734	S	S	*	*			cis	-173.1	171.9	-24.3	0	0	0	0	0	109.4
797	S	29.9	Very low	30.8	Very low	100 Å²	100	134.1 Å²	134.1	70%	0.699	74%	0.739	S	S	*	*			trans	66.1	126.4	158.9	45.1	0	0	0	0	119.9
798	L	34.9	Very low	31.1	Very low	159 Å²	159	136.9 Å²	136.9	83%	0.832	75%	0.752	S	S	*	*				77	141.1	51.7	-67.4	167	0	0	0	112.8
799	D	32.5	Very low	31.4	Very low	136 Å²	136	138.9 Å²	138.9	73%	0.727	76%	0.755	S	S	*	*			cis	-170.7	-167.5	-12.1	-162.8	-7.3	0	0	0	107.8
800	E	33.3	Very low	31.8	Very low	165 Å²	165	137.5 Å²	137.5	77%	0.771	75%	0.753	S	S	*	*			trans	72.8	136.6	166.8	-62.6	-176.1	167.5	0	0	115.6
801	Q	32	Very low	31.9	Very low	178 Å²	178	138.9 Å²	138.9	83%	0.832	77%	0.769	S	S	*	*			cis	109.3	154.6	29	-83.8	-163.4	10.3	0	0	113.6
802	D	31.2	Very low	32.1	Very low	140 Å²	140	140.7 Å²	140.7	75%	0.749	78%	0.777	S	S	*	*			trans	79	106.1	164.2	-103.3	-12.8	0	0	0	123
803	S	33.5	Very low	32.1	Very low	92 Å²	92	143.9 Å²	143.9	64%	0.643	78%	0.784	S	S	*	*				62	133.2	111	-62.7	0	0	0	0	124
804	L	31.4	Very low	32	Very low	182 Å²	182	140.2 Å²	140.2	95%	0.953	78%	0.778	S	S	*	*			trans	69.3	160.2	163.1	-54.4	169.7	0	0	0	116.4
805	G	29.1	Very low	31.7	Very low	68 Å²	68	142.5 Å²	142.5	70%	0.701	79%	0.786	S	S	*	*			cis	152.1	122.8	-12.4	0	0	0	0	0	114.5
806	A	35.2	Very low	31.7	Very low	100 Å²	100	143.5 Å²	143.5	83%	0.826	79%	0.791	S	S	*	*			trans	86.6	121	164.8	0	0	0	0	0	121.8
807	C	30.7	Very low	31.7	Very low	119 Å²	119	148.1 Å²	148.1	80%	0.804	80%	0.802	S	S	*	*			trans	51.2	109.6	134.7	-59.9	0	0	0	0	122.9
808	F	28.5	Very low	31.9	Very low	212 Å²	212	149.6 Å²	149.6	93%	0.93	80%	0.802	S	S	*	*				-144.3	168.7	124.3	-95.5	-90.9	0	0	0	108.2
809	K	31.1	Very low	32	Very low	165 Å²	165	149.6 Å²	149.6	72%	0.717	80%	0.797	S	S	*	*				-178.5	119.6	-63.3	-171	-178.6	-176	-161.6	0	106
810	D	31.2	Very low	32.3	Very low	143 Å²	143	157.4 Å²	157.4	77%	0.765	82%	0.819	S	S	*	*			trans	27.7	121.4	156.8	-36.3	-36.8	0	0	0	120.9
811	A	32.4	Very low	32.3	Very low	105 Å²	105	157.1 Å²	157.1	87%	0.868	82%	0.821	S	S	*	*			trans	-148.7	122.3	147.1	0	0	0	0	0	110.2
812	E	34.7	Very low	32.3	Very low	180 Å²	180	155.9 Å²	155.9	84%	0.841	82%	0.821	S	S	*	*			trans	-83.9	150.4	174.2	-59.1	171.1	114.3	0	0	110.9
813	Y	31.2	Very low	32.4	Very low	237 Å²	237	156.8 Å²	156.8	93%	0.929	83%	0.825	S	S	*	*			trans	-158.3	127.4	138.2	-116.4	-72.2	0	0	0	111.6
814	S	30.4	Very low	32.3	Very low	104 Å²	104	160.6 Å²	160.6	73%	0.727	84%	0.835	S	S	*	*			trans	-102.2	140.2	176.4	-44.1	0	0	0	0	110.9
815	K	30.2	Very low	32.3	Very low	207 Å²	207	159.3 Å²	159.3	90%	0.9	83%	0.828	S	S	*	*			trans	-156.2	144.1	151.9	-123.4	172.6	-175.2	-179.8	0	115.3
816	N	30.7	Very low	32.6	Very low	150 Å²	150	165.4 Å²	165.4	80%	0.802	84%	0.836	S	S	*	*			trans	-60.9	139	-170.9	-62.5	-3.7	0	0	0	115.8
817	M	32.3	Very low	32.4	Very low	168 Å²	168	170.1 Å²	170.1	83%	0.828	84%	0.837	S	S	*	*				49.9	138.7	104.8	-128.3	-169.8	-163	0	0	121.1
818	L	34.1	Very low	32.5	Very low	131 Å²	131	174 Å²	174	69%	0.686	84%	0.84	S	S	*	*			trans	97.5	131.5	150.3	-69.8	165.6	0	0	0	120.9
819	E	36.6	Very low	32.8	Very low	159 Å²	159	170.8 Å²	170.8	74%	0.743	83%	0.832	S	S	*	*			trans	61	128.7	154.7	-67	159	-163.8	0	0	117.3
820	Y	39.2	Very low	33	Very low	301 Å²	301	171.4 Å²	171.4	100%	1.18	84%	0.843	S	S	*	*			cis	-111.5	0	25.8	-84.4	-106.1	0	0	0	115.9

Retrieved 820 of 820 residues in 122.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).