A0A077ZB32_TRITR Loading...

LIM homeobox 2

AlphaFold DB , UniProt , Accession A0A077ZB32, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 367 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.9	Very low	39.9	Very low	229 Å²	229	144.9 Å²	144.9	100%	1.128	86%	0.858	S	S	*	*				0	82	0	-76.6	-170.1	-173.4	0	0	104.7
2	D	38.8	Very low	39.4	Very low	154 Å²	154	139.8 Å²	139.8	82%	0.824	84%	0.844	S	S	*	*			trans	-91.3	126.1	-160.2	-64.4	-112.6	0	0	0	108.4
3	L	44.6	Very low	39.1	Very low	170 Å²	170	140.2 Å²	140.2	89%	0.89	85%	0.848	S	S	*	*			trans	-109.4	112.9	175.4	-90.6	151.2	0	0	0	107.7
4	Q	36.3	Very low	39.1	Very low	181 Å²	181	138.2 Å²	138.2	85%	0.846	84%	0.836	S	S	*	*			trans	-105.2	119.6	174.7	-72.4	174.5	-22.3	0	0	109.1
5	D	44.9	Very low	39.3	Very low	164 Å²	164	136.4 Å²	136.4	88%	0.877	83%	0.832	S	S	*	*			trans	-135.5	143.4	153	-87	-50.6	0	0	0	105.3
6	G	37.9	Very low	39.9	Very low	77 Å²	77	136.9 Å²	136.9	79%	0.794	83%	0.828	S	S	*	*			cis	124.5	101.5	16.1	0	0	0	0	0	108.2
7	G	36.3	Very low	41	Very low	84 Å²	84	140.2 Å²	140.2	87%	0.866	83%	0.828	S	S	*	*			trans	158.1	95.6	-179.7	0	0	0	0	0	114.8
8	S	33.3	Very low	42.4	Very low	112 Å²	112	142.9 Å²	142.9	78%	0.783	82%	0.822	S	S	*	*			trans	-94.6	129.6	173.9	179.6	0	0	0	0	111.2
9	S	39.3	Very low	44.4	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	79%	0.794	S	S	*	*			trans	-147.1	88.3	167.4	-54	0	0	0	0	111.2	E11	S9-E11 PolarHBondContact O-N 2.94Å
10	T	36.9	Very low	46.8	Very low	135 Å²	135	134.8 Å²	134.8	83%	0.828	78%	0.775	S	S	*	*			trans	-80.7	90.9	168.5	49.4	0	0	0	0	110.2
11	E	41.2	Very low	48.9	Very low	179 Å²	179	128.4 Å²	128.4	84%	0.836	74%	0.738	S	S	*	*			trans	-79	141.5	177.6	-67.6	-160.8	118	0	0	113	S9 T13	S9-E11 PolarHBondContact O-N 2.94Å; E11-T13 PolarHBondContact O-N 3.16Å
12	A	34.9	Very low	50.9	Low	84 Å²	84	122.2 Å²	122.2	69%	0.694	71%	0.705	S	S	*	*			trans	-83	116.8	-163.8	0	0	0	0	0	113.8	T14	A12-T14 PolarHBondContact O-N 3.37Å
13	T	35.4	Very low	53.3	Low	145 Å²	145	117.4 Å²	117.4	89%	0.89	69%	0.686	S	S	*	*			trans	-70.1	69.3	172.4	-43	0	0	0	0	112.4	E11 S15	E11-T13 PolarHBondContact O-N 3.16Å; T13-S15 PolarHBondContact O-N 3.17Å
14	T	39.2	Very low	55.6	Low	112 Å²	112	111.7 Å²	111.7	69%	0.687	66%	0.66	S	S	*	*			trans	-70.2	112.5	171.7	48.5	0	0	0	0	110	A12 L16	A12-T14 PolarHBondContact O-N 3.37Å; T14-L16 VanDerWaalsContact C-N 3.35Å; T14-L16 PolarHBondContact O-N 3.26Å
15	S	41	Very low	58.3	Low	111 Å²	111	113.2 Å²	113.2	78%	0.776	66%	0.658	S	S	*	*			trans	-68	84.4	-174	-169.3	0	0	0	0	112.6	T13 K17	T13-S15 PolarHBondContact O-N 3.17Å; S15-K17 PolarHBondContact O-N 3.19Å
16	L	49.7	Very low	60.5	Low	145 Å²	145	111.3 Å²	111.3	76%	0.759	64%	0.644	S	S	*	*			trans	-62.8	101.4	165.4	-82.8	145.5	0	0	0	108.9	T14 R18	T14-L16 VanDerWaalsContact C-N 3.35Å; T14-L16 PolarHBondContact O-N 3.26Å; L16-R18 VanDerWaalsContact C-N 3.27Å; L16-R18 PolarHBondContact O-N 3Å
17	K	57.6	Low	63	Low	192 Å²	192	111.1 Å²	111.1	84%	0.835	63%	0.625	S	S	*	*			trans	-62.9	88	169.7	-74.6	-177.7	177.2	176.8	0	109.5	S15 N19	S15-K17 PolarHBondContact O-N 3.19Å; K17-N19 PolarHBondContact O-N 3.06Å
18	R	66.5	Low	65.4	Low	190 Å²	190	108.1 Å²	108.1	72%	0.717	59%	0.589	S	S	*	*			trans	-61.7	126.5	178	-56.2	-179	-175.6	150.8	2.3	108.9	L16 V20 N27	L16-R18 VanDerWaalsContact C-N 3.27Å; L16-R18 PolarHBondContact O-N 3Å; R18-V20 PolarHBondContact O-N 2.72Å; R18-N27 WeakPolarHBondContact CB-ND2 3.44Å
19	N	81.7	Confident	68	Low	54 Å²	54	108.9 Å²	108.9	29%	0.289	59%	0.589	S	S	.	*			trans	-67.5	127	171.2	-59.1	-63.7	0	0	0	107.9	K17 I28 Y33 C40	K17-N19 PolarHBondContact O-N 3.06Å; N19-I28 HydrophobicContact CB-CB 4.19Å; N19-I28 HydrophobicContact CB-CD1 4.11Å; N19-I28 HydrophobicContact CB-CG1 4.45Å; N19-I28 PolarHBondContact O-N 2.85Å; N19-Y33 HydrophobicContact CB-CE2 4.48Å; N19-Y33 PolarHBondContact ND2-OH 2.91Å; N19-Y33 PolarHBondContact OD1-OH 3.46Å; N19-C40 HydrophobicContact CB-CB 4.26Å
20	V	91.5	Very high	70	Confident	69 Å²	69	107.1 Å²	107.1	42%	0.418	57%	0.571	S	S	.	*	B	Isolated β-bridge	trans	-109.4	134.9	176.6	176	0	0	0	0	108.1	R18 F22 R25 E26 N27	R18-V20 PolarHBondContact O-N 2.72Å; V20-F22 PolarHBondContact O-N 3.47Å; V20-R25 WeakPolarHBondContact CG1-O 3.34Å; V20-E26 CarbonylContact C-O 3.58Å; V20-E26 WeakPolarHBondContact CA-O 3.23Å; V20-N27 WeakPolarHBondContact CG2-ND2 3.32Å
21	C	91.8	Very high	72.1	Confident	0 Å²	0	108.3 Å²	108.3	0%	0	57%	0.567	C	S	.	*	B	Isolated β-bridge	trans	-72.7	123.8	178.1	-177.7	0	0	0	0	110	A23 C24 R25 E26 I28 C40 H42 C45	C21-A23 PolarHBondContact O-N 2.74Å; C21-C24 VanDerWaalsContact CB-SG 3.57Å; C21-R25 WeakPolarHBondContact O-CA 3.32Å; C21-R25 PolarHBondContact O-N 3.37Å; C21-E26 PolarHBondContact N-O 3.5Å; C21-I28 HydrophobicContact CB-CD1 4.25Å; C21-I28 HydrophobicContact CB-CG1 3.92Å; C21-C40 CarbonylContact C-O 3.58Å; C21-C40 WeakPolarHBondContact CA-O 3.41Å; C21-H42 PolarHBondContact SG-N 2.99Å; C21-C45 VanDerWaalsContact SG-CB 3.59Å; C21-C45 VanDerWaalsContact SG-SG 3.63Å
22	F	89.8	Confident	73.9	Confident	100 Å²	100	103.5 Å²	103.5	44%	0.439	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.2	-177.5	-171.4	-93.9	0	0	0	113.7	V20 Q39 C40 W41	V20-F22 PolarHBondContact O-N 3.47Å; F22-Q39 HydrophobicContact CB-CB 3.98Å; F22-Q39 HydrophobicContact CB-CG 4.5Å; F22-Q39 HydrophobicContact CD2-CB 3.99Å; F22-Q39 VanDerWaalsContact CD2-CD 3.44Å; F22-Q39 HydrophobicContact CD2-CG 3.57Å; F22-Q39 HydrophobicContact CE2-CG 3.89Å; F22-Q39 HydrophobicContact CG-CB 4.05Å; F22-Q39 HydrophobicContact CG-CG 4.05Å; F22-C40 PolarHBondContact N-O 2.8Å; F22-W41 HydrophobicContact CB-CD2 4.22Å; F22-W41 HydrophobicContact CB-CE3 4.42Å; F22-W41 HydrophobicContact CB-CH2 4.3Å; F22-W41 HydrophobicContact CB-CZ2 4.07Å; F22-W41 HydrophobicContact CB-CZ3 4.47Å; F22-W41 AromaticContact CD1-CH2 3.4Å; F22-W41 HydrophobicContact CD1-CH2 3.4Å; F22-W41 VanDerWaalsContact CD1-CH2 3.4Å; F22-W41 AromaticContact CD1-CZ2 3.61Å; F22-W41 HydrophobicContact CD1-CZ2 3.61Å; F22-W41 HydrophobicContact CD1-CZ3 4.06Å; F22-W41 HydrophobicContact CE1-CH2 4.12Å; F22-W41 HydrophobicContact CE1-CZ2 4.37Å; F22-W41 HydrophobicContact CG-CH2 4.22Å; F22-W41 HydrophobicContact CG-CZ2 4.07Å
23	A	89.5	Confident	76.3	Confident	52 Å²	52	100.3 Å²	100.3	43%	0.43	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-59.9	180	0	0	0	0	0	112.8	C21 W41 C45	C21-A23 PolarHBondContact O-N 2.74Å; A23-W41 HydrophobicContact CB-CE3 4.05Å; A23-W41 HydrophobicContact CB-CZ3 4.03Å; A23-C45 HydrophobicContact CB-CB 3.77Å
24	C	93.2	Very high	78.5	Confident	50 Å²	50	95.1 Å²	95.1	34%	0.338	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-10.7	-176	66.9	0	0	0	0	114.5	C21 E26 H42	C21-C24 VanDerWaalsContact CB-SG 3.57Å; C24-E26 HydrophobicContact CB-CG 4.5Å; C24-E26 PolarHBondContact O-N 2.88Å; C24-E26 PolarHBondContact SG-OE2 2.97Å; C24-E26 VanDerWaalsContact SG-OE2 3.32Å; C24-H42 PolarHBondContact SG-CE1 2.97Å; C24-H42 PolarHBondContact SG-ND1 3.05Å
25	R	92.1	Very high	80.7	Confident	214 Å²	214	93.6 Å²	93.6	81%	0.808	47%	0.465	S	S	*	.			trans	66.2	8	-178	-50.2	-177.7	177.1	-150.6	-0.6	116	V20 C21	V20-R25 WeakPolarHBondContact CG1-O 3.34Å; C21-R25 WeakPolarHBondContact O-CA 3.32Å; C21-R25 PolarHBondContact O-N 3.37Å
26	E	91.1	Very high	82.6	Confident	123 Å²	123	89.1 Å²	89.1	58%	0.575	43%	0.433	S	S	*	.			trans	-83.9	162.4	176	-62.9	167.5	154.7	0	0	111.8	V20 C21 C24	V20-E26 CarbonylContact C-O 3.58Å; V20-E26 WeakPolarHBondContact CA-O 3.23Å; C21-E26 PolarHBondContact N-O 3.5Å; C24-E26 HydrophobicContact CB-CG 4.5Å; C24-E26 PolarHBondContact O-N 2.88Å; C24-E26 PolarHBondContact SG-OE2 2.97Å; C24-E26 VanDerWaalsContact SG-OE2 3.32Å
27	N	91.6	Very high	84	Confident	73 Å²	73	85.7 Å²	85.7	39%	0.39	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-73.2	129.4	173	-73.3	118	0	0	0	110.8	R18 V20 T29	R18-N27 WeakPolarHBondContact CB-ND2 3.44Å; V20-N27 WeakPolarHBondContact CG2-ND2 3.32Å; N27-T29 PolarHBondContact O-N 2.93Å; N27-T29 VanDerWaalsContact O-N 3.11Å
28	I	87.1	Confident	85.2	Confident	21 Å²	21	79 Å²	79	11%	0.108	41%	0.411	C	S	.	.			trans	-73.3	104.4	176	-57.8	178.3	0	0	0	108.5	N19 C21 D30 Y33 C40 H42	N19-I28 HydrophobicContact CB-CB 4.19Å; N19-I28 HydrophobicContact CB-CD1 4.11Å; N19-I28 HydrophobicContact CB-CG1 4.45Å; N19-I28 PolarHBondContact O-N 2.85Å; C21-I28 HydrophobicContact CB-CD1 4.25Å; C21-I28 HydrophobicContact CB-CG1 3.92Å; I28-D30 HydrophobicContact CG2-CB 4.2Å; I28-Y33 HydrophobicContact CD1-CD2 4.13Å; I28-Y33 HydrophobicContact CD1-CG 4.34Å; I28-Y33 HydrophobicContact CG2-CD1 4.29Å; I28-Y33 HydrophobicContact CG2-CG 4.01Å; I28-C40 HydrophobicContact CD1-CB 3.52Å; I28-H42 WeakPolarHBondContact CA-NE2 3.43Å
29	T	86.8	Confident	86.1	Confident	128 Å²	128	74 Å²	74	79%	0.785	40%	0.396	S	S	*	.			trans	-93.9	-15	172.1	50.9	0	0	0	0	112.5	N27	N27-T29 PolarHBondContact O-N 2.93Å; N27-T29 VanDerWaalsContact O-N 3.11Å
30	D	81.6	Confident	86.4	Confident	73 Å²	73	72.2 Å²	72.2	39%	0.39	39%	0.388	S	S	.	.	S	Bend	trans	-54.6	138.3	177.2	-64.6	-28.2	0	0	0	112.2	I28 F32 H42	I28-D30 HydrophobicContact CG2-CB 4.2Å; D30-F32 VanDerWaalsContact CB-O 3.32Å; D30-F32 WeakPolarHBondContact CB-O 3.41Å; D30-F32 PolarHBondContact O-N 3.38Å; D30-F32 VanDerWaalsContact O-N 3.16Å; D30-H42 IonicContact OD2-CD2 3.21Å; D30-H42 PolarHBondContact OD2-CD2 3.45Å; D30-H42 IonicContact OD2-CG 3.81Å
31	Q	81.6	Confident	86.2	Confident	160 Å²	160	69.8 Å²	69.8	75%	0.748	37%	0.371	S	S	*	.	S	Bend	trans	-57.8	-27.9	171.3	-173.4	-179.7	29.2	0	0	112.4
32	F	78.5	Confident	86	Confident	77 Å²	77	70.8 Å²	70.8	34%	0.338	38%	0.376	S	S	.	.	S	Bend	trans	-132.1	132.3	-176.4	-61	-59.3	0	0	0	110.7	D30 I43 C223 R225	D30-F32 VanDerWaalsContact CB-O 3.32Å; D30-F32 WeakPolarHBondContact CB-O 3.41Å; D30-F32 PolarHBondContact O-N 3.38Å; D30-F32 VanDerWaalsContact O-N 3.16Å; F32-I43 HydrophobicContact CB-CD1 3.96Å; F32-C223 HydrophobicContact CB-CB 4.04Å; F32-C223 HydrophobicContact CD1-CB 3.56Å; F32-C223 HydrophobicContact CE1-CB 4.44Å; F32-C223 HydrophobicContact CG-CB 4.17Å; F32-R225 HydrophobicContact CE1-CG 4.38Å
33	Y	84.8	Confident	85.9	Confident	17 Å²	17	67.7 Å²	67.7	7%	0.067	36%	0.363	C	S	.	.			trans	-145.5	157.9	-179	70	-84.3	0	0	0	111.5	N19 I28 C40	N19-Y33 HydrophobicContact CB-CE2 4.48Å; N19-Y33 PolarHBondContact ND2-OH 2.91Å; N19-Y33 PolarHBondContact OD1-OH 3.46Å; I28-Y33 HydrophobicContact CD1-CD2 4.13Å; I28-Y33 HydrophobicContact CD1-CG 4.34Å; I28-Y33 HydrophobicContact CG2-CD1 4.29Å; I28-Y33 HydrophobicContact CG2-CG 4.01Å; Y33-C40 HydrophobicContact CD2-CB 4.1Å; Y33-C40 HydrophobicContact CE2-CB 4.14Å
34	L	82.6	Confident	85.8	Confident	36 Å²	36	72.3 Å²	72.3	19%	0.188	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	142.8	-176.7	-57.5	177.3	0	0	0	110.1	C40 W41 I43 L46	L34-C40 CarbonylContact O-C 3.6Å; L34-C40 WeakPolarHBondContact O-CA 3.41Å; L34-W41 HydrophobicContact CB-CB 4.36Å; L34-W41 PolarHBondContact N-O 3.45Å; L34-W41 PolarHBondContact O-N 3.12Å; L34-I43 HydrophobicContact CG-CG1 4.27Å; L34-L46 HydrophobicContact CB-CD2 4.41Å; L34-L46 HydrophobicContact CD1-CB 3.81Å; L34-L46 HydrophobicContact CD1-CD2 3.64Å; L34-L46 HydrophobicContact CD1-CG 4.37Å
35	H	84.5	Confident	85.7	Confident	80 Å²	80	71.5 Å²	71.5	37%	0.37	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	102.8	179.6	-178.5	-84	0	0	0	110.4	Q39	H35-Q39 CarbonylContact C-O 3.5Å; H35-Q39 WeakPolarHBondContact CA-O 3.44Å
36	V	80.7	Confident	85.5	Confident	17 Å²	17	61.6 Å²	61.6	10%	0.103	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.3	-170.2	177.7	0	0	0	0	109.5	G38 Q39 W41 L46 C61 T63 I68	V36-G38 PolarHBondContact O-N 2.97Å; V36-G38 VanDerWaalsContact O-N 3.14Å; V36-Q39 PolarHBondContact N-O 3.28Å; V36-Q39 PolarHBondContact O-N 3.25Å; V36-W41 PolarHBondContact O-NE1 3.19Å; V36-L46 HydrophobicContact CB-CD1 4.13Å; V36-L46 HydrophobicContact CG1-CD1 4.36Å; V36-L46 HydrophobicContact CG2-CD1 3.89Å; V36-L46 HydrophobicContact CG2-CD2 3.76Å; V36-C61 VanDerWaalsContact CG1-SG 3.52Å; V36-T63 HydrophobicContact CG1-CG2 3.8Å; V36-I68 HydrophobicContact CG1-CD1 4.13Å
37	A	80.3	Confident	85.5	Confident	73 Å²	73	59.7 Å²	59.7	60%	0.603	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	33.6	-179.8	0	0	0	0	0	115.1	Q39 T63	A37-Q39 VanDerWaalsContact C-N 3.31Å; A37-T63 HydrophobicContact CB-CG2 3.91Å
38	G	82.1	Confident	85.5	Confident	52 Å²	52	56.2 Å²	56.2	54%	0.536	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	4.5	-178.8	0	0	0	0	0	114.9	V36	V36-G38 PolarHBondContact O-N 2.97Å; V36-G38 VanDerWaalsContact O-N 3.14Å
39	Q	84.7	Confident	85.8	Confident	84 Å²	84	57.6 Å²	57.6	39%	0.393	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	150.7	-179.4	-59.5	-60.5	-18	0	0	111.1	F22 H35 V36 A37 W41	F22-Q39 HydrophobicContact CB-CB 3.98Å; F22-Q39 HydrophobicContact CB-CG 4.5Å; F22-Q39 HydrophobicContact CD2-CB 3.99Å; F22-Q39 VanDerWaalsContact CD2-CD 3.44Å; F22-Q39 HydrophobicContact CD2-CG 3.57Å; F22-Q39 HydrophobicContact CE2-CG 3.89Å; F22-Q39 HydrophobicContact CG-CB 4.05Å; F22-Q39 HydrophobicContact CG-CG 4.05Å; H35-Q39 CarbonylContact C-O 3.5Å; H35-Q39 WeakPolarHBondContact CA-O 3.44Å; V36-Q39 PolarHBondContact N-O 3.28Å; V36-Q39 PolarHBondContact O-N 3.25Å; A37-Q39 VanDerWaalsContact C-N 3.31Å; Q39-W41 HydrophobicContact CB-CZ2 4.4Å; Q39-W41 VanDerWaalsContact O-CD1 3.23Å; Q39-W41 PolarHBondContact O-NE1 3.44Å
40	C	88.5	Confident	86	Confident	17 Å²	17	54.3 Å²	54.3	12%	0.115	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	145.3	175.4	-56.7	0	0	0	0	110.5	N19 C21 F22 I28 Y33 L34	N19-C40 HydrophobicContact CB-CB 4.26Å; C21-C40 CarbonylContact C-O 3.58Å; C21-C40 WeakPolarHBondContact CA-O 3.41Å; F22-C40 PolarHBondContact N-O 2.8Å; I28-C40 HydrophobicContact CD1-CB 3.52Å; Y33-C40 HydrophobicContact CD2-CB 4.1Å; Y33-C40 HydrophobicContact CE2-CB 4.14Å; L34-C40 CarbonylContact O-C 3.6Å; L34-C40 WeakPolarHBondContact O-CA 3.41Å
41	W	87.9	Confident	86.5	Confident	18 Å²	18	53.8 Å²	53.8	7%	0.068	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	137.6	-176.5	-51.6	73.9	0	0	0	109.4	F22 A23 L34 V36 Q39 L46 I68	F22-W41 HydrophobicContact CB-CD2 4.22Å; F22-W41 HydrophobicContact CB-CE3 4.42Å; F22-W41 HydrophobicContact CB-CH2 4.3Å; F22-W41 HydrophobicContact CB-CZ2 4.07Å; F22-W41 HydrophobicContact CB-CZ3 4.47Å; F22-W41 AromaticContact CD1-CH2 3.4Å; F22-W41 HydrophobicContact CD1-CH2 3.4Å; F22-W41 VanDerWaalsContact CD1-CH2 3.4Å; F22-W41 AromaticContact CD1-CZ2 3.61Å; F22-W41 HydrophobicContact CD1-CZ2 3.61Å; F22-W41 HydrophobicContact CD1-CZ3 4.06Å; F22-W41 HydrophobicContact CE1-CH2 4.12Å; F22-W41 HydrophobicContact CE1-CZ2 4.37Å; F22-W41 HydrophobicContact CG-CH2 4.22Å; F22-W41 HydrophobicContact CG-CZ2 4.07Å; A23-W41 HydrophobicContact CB-CE3 4.05Å; A23-W41 HydrophobicContact CB-CZ3 4.03Å; L34-W41 HydrophobicContact CB-CB 4.36Å; L34-W41 PolarHBondContact N-O 3.45Å; L34-W41 PolarHBondContact O-N 3.12Å; V36-W41 PolarHBondContact O-NE1 3.19Å; Q39-W41 HydrophobicContact CB-CZ2 4.4Å; Q39-W41 VanDerWaalsContact O-CD1 3.23Å; Q39-W41 PolarHBondContact O-NE1 3.44Å; W41-L46 HydrophobicContact CB-CB 4.33Å; W41-L46 HydrophobicContact CD2-CD1 3.73Å; W41-L46 HydrophobicContact CE3-CD1 4.02Å; W41-L46 HydrophobicContact CG-CD1 3.96Å; W41-I68 HydrophobicContact CH2-CD1 4.07Å; W41-I68 HydrophobicContact CH2-CG1 3.56Å; W41-I68 HydrophobicContact CZ2-CD1 3.87Å; W41-I68 HydrophobicContact CZ2-CG1 3.87Å; W41-I68 HydrophobicContact CZ3-CG1 4.24Å
42	H	87.9	Confident	87	Confident	22 Å²	22	52.2 Å²	52.2	10%	0.102	29%	0.29	C	S	.	.			trans	-57.8	151	158.4	-58.7	136.3	0	0	0	109	C21 C24 I28 D30 Q44 C45 L46	C21-H42 PolarHBondContact SG-N 2.99Å; C24-H42 PolarHBondContact SG-CE1 2.97Å; C24-H42 PolarHBondContact SG-ND1 3.05Å; I28-H42 WeakPolarHBondContact CA-NE2 3.43Å; D30-H42 IonicContact OD2-CD2 3.21Å; D30-H42 PolarHBondContact OD2-CD2 3.45Å; D30-H42 IonicContact OD2-CG 3.81Å; H42-Q44 VanDerWaalsContact C-N 3.31Å; H42-Q44 PolarHBondContact O-N 2.97Å; H42-C45 HydrophobicContact CB-CB 3.94Å; H42-C45 WeakPolarHBondContact O-CB 3.45Å; H42-C45 PolarHBondContact O-N 3.11Å; H42-L46 PolarHBondContact O-N 3.12Å
43	I	87.2	Confident	87.6	Confident	34 Å²	34	50.8 Å²	50.8	17%	0.174	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-54.4	-49.5	-178.8	-67.1	176.9	0	0	0	110.7	F32 L34 C45 L46 N54 E56	F32-I43 HydrophobicContact CB-CD1 3.96Å; L34-I43 HydrophobicContact CG-CG1 4.27Å; I43-C45 VanDerWaalsContact C-N 3.29Å; I43-C45 PolarHBondContact O-N 3.32Å; I43-L46 PolarHBondContact O-N 3.01Å; I43-N54 PolarHBondContact O-OD1 3.14Å; I43-E56 HydrophobicContact CG2-CB 3.83Å; I43-E56 HydrophobicContact CG2-CG 3.58Å; I43-E56 WeakPolarHBondContact CG2-OE1 3.49Å; I43-E56 WeakPolarHBondContact CG2-OE2 3.32Å
44	Q	87.9	Confident	87.7	Confident	150 Å²	150	52.7 Å²	52.7	70%	0.701	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-71.1	-20.4	179.9	-60.3	-178.5	1.4	0	0	114	H42 Q47	H42-Q44 VanDerWaalsContact C-N 3.31Å; H42-Q44 PolarHBondContact O-N 2.97Å; Q44-Q47 WeakPolarHBondContact O-CG 3.37Å; Q44-Q47 PolarHBondContact O-NE2 2.98Å
45	C	90.1	Very high	87.8	Confident	32 Å²	32	51.1 Å²	51.1	22%	0.216	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-81.3	-17.2	-179	-76.6	0	0	0	0	113.7	C21 A23 H42 I43 Q47	C21-C45 VanDerWaalsContact SG-CB 3.59Å; C21-C45 VanDerWaalsContact SG-SG 3.63Å; A23-C45 HydrophobicContact CB-CB 3.77Å; H42-C45 HydrophobicContact CB-CB 3.94Å; H42-C45 WeakPolarHBondContact O-CB 3.45Å; H42-C45 PolarHBondContact O-N 3.11Å; I43-C45 VanDerWaalsContact C-N 3.29Å; I43-C45 PolarHBondContact O-N 3.32Å; C45-Q47 PolarHBondContact O-N 3.43Å
46	L	88.9	Confident	87.6	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.031	30%	0.298	C	S	.	.			trans	-81.9	83.7	177.7	-171.4	75.5	0	0	0	110.3	L34 V36 W41 H42 I43 L55 I68	L34-L46 HydrophobicContact CB-CD2 4.41Å; L34-L46 HydrophobicContact CD1-CB 3.81Å; L34-L46 HydrophobicContact CD1-CD2 3.64Å; L34-L46 HydrophobicContact CD1-CG 4.37Å; V36-L46 HydrophobicContact CB-CD1 4.13Å; V36-L46 HydrophobicContact CG1-CD1 4.36Å; V36-L46 HydrophobicContact CG2-CD1 3.89Å; V36-L46 HydrophobicContact CG2-CD2 3.76Å; W41-L46 HydrophobicContact CB-CB 4.33Å; W41-L46 HydrophobicContact CD2-CD1 3.73Å; W41-L46 HydrophobicContact CE3-CD1 4.02Å; W41-L46 HydrophobicContact CG-CD1 3.96Å; H42-L46 PolarHBondContact O-N 3.12Å; I43-L46 PolarHBondContact O-N 3.01Å; L46-L55 HydrophobicContact CD2-CB 4.15Å; L46-L55 HydrophobicContact CG-CB 4.25Å; L46-L55 WeakPolarHBondContact O-CB 3.44Å; L46-L55 PolarHBondContact O-N 3.39Å; L46-I68 HydrophobicContact CD1-CG1 4.31Å; L46-I68 HydrophobicContact CD1-CG2 4.08Å
47	Q	90.9	Very high	87.2	Confident	83 Å²	83	57.1 Å²	57.1	39%	0.388	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-112.7	155.6	-177.4	-62.8	177.9	4.7	0	0	112.4	Q44 C45 S53	Q44-Q47 WeakPolarHBondContact O-CG 3.37Å; Q44-Q47 PolarHBondContact O-NE2 2.98Å; C45-Q47 PolarHBondContact O-N 3.43Å; Q47-S53 WeakPolarHBondContact CA-O 3.42Å
48	C	92.2	Very high	86.7	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	32%	0.317	C	S	.	.			trans	-70.9	129.1	169.1	-176.2	0	0	0	0	111.3	V50 C51 H52 S53 L55 I68 C70	C48-V50 PolarHBondContact O-N 3.47Å; C48-C51 VanDerWaalsContact CB-SG 3.54Å; C48-C51 VanDerWaalsContact SG-SG 3.64Å; C48-H52 WeakPolarHBondContact O-CA 3.46Å; C48-H52 PolarHBondContact O-N 2.97Å; C48-S53 PolarHBondContact N-O 3.38Å; C48-L55 HydrophobicContact CB-CD1 4.45Å; C48-L55 HydrophobicContact CB-CD2 4.4Å; C48-I68 WeakPolarHBondContact CA-O 3.23Å; C48-C70 HydrophobicContact CB-CB 3.87Å; C48-C70 PolarHBondContact SG-N 3.15Å
49	C	91.7	Very high	86.2	Confident	50 Å²	50	61.9 Å²	61.9	34%	0.338	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	14.3	177.4	72.6	0	0	0	0	115.4	L67 I68 F69	C49-L67 HydrophobicContact CB-CD2 4.46Å; C49-I68 PolarHBondContact N-O 2.95Å; C49-I68 PolarHBondContact SG-O 3.36Å; C49-I68 VanDerWaalsContact SG-O 3.33Å; C49-F69 WeakPolarHBondContact SG-CE1 3.16Å
50	V	91.8	Very high	85.8	Confident	59 Å²	59	60.5 Å²	60.5	36%	0.358	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.7	-60	-176.2	-179.6	0	0	0	0	109.8	C48 F69 D73	C48-V50 PolarHBondContact O-N 3.47Å; V50-F69 HydrophobicContact CG2-CD1 3.87Å; V50-F69 HydrophobicContact CG2-CE1 3.86Å; V50-D73 HydrophobicContact CB-CB 4.01Å; V50-D73 HydrophobicContact CG1-CB 4.09Å; V50-D73 HydrophobicContact CG2-CB 4.28Å
51	C	93.1	Very high	85.6	Confident	62 Å²	62	61 Å²	61	42%	0.419	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-1.7	176.7	59.8	0	0	0	0	114.8	C48 S53 D73	C48-C51 VanDerWaalsContact CB-SG 3.54Å; C48-C51 VanDerWaalsContact SG-SG 3.64Å; C51-S53 PolarHBondContact O-N 2.88Å; C51-S53 PolarHBondContact SG-OG 2.89Å; C51-D73 WeakPolarHBondContact CB-OD2 3.36Å; C51-D73 PolarHBondContact N-OD2 3.41Å; C51-D73 PolarHBondContact SG-OD2 2.96Å
52	H	91.5	Very high	85.5	Confident	126 Å²	126	61.7 Å²	61.7	58%	0.583	34%	0.335	S	S	*	.			trans	55.5	10	-177.5	-59	-80.4	0	0	0	116.1	C48 N54	C48-H52 WeakPolarHBondContact O-CA 3.46Å; C48-H52 PolarHBondContact O-N 2.97Å; H52-N54 PolarHBondContact O-N 3.11Å
53	S	89.7	Confident	85.4	Confident	48 Å²	48	63 Å²	63	34%	0.336	35%	0.345	S	S	.	.			trans	-61.3	135.7	174.1	57.8	0	0	0	0	111.4	Q47 C48 C51	Q47-S53 WeakPolarHBondContact CA-O 3.42Å; C48-S53 PolarHBondContact N-O 3.38Å; C51-S53 PolarHBondContact O-N 2.88Å; C51-S53 PolarHBondContact SG-OG 2.89Å
54	N	88	Confident	85.3	Confident	56 Å²	56	66.5 Å²	66.5	30%	0.299	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-64.1	130.2	170	179.4	-5.1	0	0	0	109.2	I43 H52 E56	I43-N54 PolarHBondContact O-OD1 3.14Å; H52-N54 PolarHBondContact O-N 3.11Å; N54-E56 PolarHBondContact ND2-OE2 3.48Å; N54-E56 VanDerWaalsContact OD1-CB 3.24Å; N54-E56 WeakPolarHBondContact OD1-CB 3.36Å; N54-E56 PolarHBondContact OD1-N 3.33Å
55	L	85	Confident	85.2	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.016	36%	0.361	C	S	.	.			trans	-98.9	5.1	-175.6	-56.5	-178.8	0	0	0	113.9	L46 C48 T57 N58 C61 I68 C70	L46-L55 HydrophobicContact CD2-CB 4.15Å; L46-L55 HydrophobicContact CG-CB 4.25Å; L46-L55 WeakPolarHBondContact O-CB 3.44Å; L46-L55 PolarHBondContact O-N 3.39Å; C48-L55 HydrophobicContact CB-CD1 4.45Å; C48-L55 HydrophobicContact CB-CD2 4.4Å; L55-T57 VanDerWaalsContact C-N 3.35Å; L55-T57 PolarHBondContact O-N 3.29Å; L55-N58 HydrophobicContact CB-CB 4.44Å; L55-N58 WeakPolarHBondContact O-CA 3.16Å; L55-N58 WeakPolarHBondContact O-CB 3.34Å; L55-N58 PolarHBondContact O-N 3.19Å; L55-C61 HydrophobicContact CD1-CB 3.75Å; L55-I68 HydrophobicContact CD1-CG2 3.61Å; L55-C70 HydrophobicContact CD2-CB 3.62Å
56	E	78.8	Confident	84.9	Confident	103 Å²	103	67.8 Å²	67.8	48%	0.481	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46	-52.7	173	173.6	-177.5	-168.8	0	0	113.3	I43 N54 N58	I43-E56 HydrophobicContact CG2-CB 3.83Å; I43-E56 HydrophobicContact CG2-CG 3.58Å; I43-E56 WeakPolarHBondContact CG2-OE1 3.49Å; I43-E56 WeakPolarHBondContact CG2-OE2 3.32Å; N54-E56 PolarHBondContact ND2-OE2 3.48Å; N54-E56 VanDerWaalsContact OD1-CB 3.24Å; N54-E56 WeakPolarHBondContact OD1-CB 3.36Å; N54-E56 PolarHBondContact OD1-N 3.33Å; E56-N58 PolarHBondContact O-N 3.11Å
57	T	73.7	Confident	84.8	Confident	120 Å²	120	71.8 Å²	71.8	74%	0.736	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-11.7	-178.9	57.9	0	0	0	0	113.2	L55 L59	L55-T57 VanDerWaalsContact C-N 3.35Å; L55-T57 PolarHBondContact O-N 3.29Å; T57-L59 PolarHBondContact O-N 3.49Å
58	N	70.3	Confident	84.6	Confident	67 Å²	67	68.3 Å²	68.3	36%	0.358	38%	0.384	S	S	.	.			trans	-91.5	103.3	-179.8	-76.4	-87	0	0	0	110.4	L55 E56 T60	L55-N58 HydrophobicContact CB-CB 4.44Å; L55-N58 WeakPolarHBondContact O-CA 3.16Å; L55-N58 WeakPolarHBondContact O-CB 3.34Å; L55-N58 PolarHBondContact O-N 3.19Å; E56-N58 PolarHBondContact O-N 3.11Å; N58-T60 PolarHBondContact O-N 3.42Å
59	L	70.2	Confident	84.4	Confident	159 Å²	159	68.5 Å²	68.5	83%	0.832	38%	0.384	S	S	*	.	S	Bend	trans	-50	-14.7	176.4	-62.1	174.6	0	0	0	116	T57	T57-L59 PolarHBondContact O-N 3.49Å
60	T	77.1	Confident	84.3	Confident	54 Å²	54	66.5 Å²	66.5	33%	0.331	37%	0.371	S	S	.	.			trans	-147	128	175.1	57.5	0	0	0	0	110.7	N58	N58-T60 PolarHBondContact O-N 3.42Å
61	C	84.3	Confident	83.9	Confident	27 Å²	27	68 Å²	68	18%	0.182	37%	0.373	C	S	.	.			trans	-108	166.8	163.7	60.9	0	0	0	0	110.6	V36 L55 I68	V36-C61 VanDerWaalsContact CG1-SG 3.52Å; L55-C61 HydrophobicContact CD1-CB 3.75Å; C61-I68 HydrophobicContact CB-CG2 4.17Å
62	F	84.9	Confident	83.6	Confident	34 Å²	34	71.3 Å²	71.3	15%	0.149	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134	177.9	-68.1	-99.9	0	0	0	110.9	F69 K71 Y74 F75	F62-F69 HydrophobicContact CB-CB 4.33Å; F62-F69 PolarHBondContact N-O 3.36Å; F62-F69 PolarHBondContact O-N 2.74Å; F62-K71 HydrophobicContact CD2-CB 4.41Å; F62-K71 HydrophobicContact CE2-CB 3.91Å; F62-K71 HydrophobicContact CE2-CG 3.91Å; F62-Y74 HydrophobicContact CB-CD1 4.07Å; F62-Y74 HydrophobicContact CB-CD2 3.31Å; F62-Y74 HydrophobicContact CB-CE2 3.83Å; F62-Y74 HydrophobicContact CB-CG 3.44Å; F62-Y74 VanDerWaalsContact CB-CG 3.44Å; F62-Y74 AromaticContact CD1-CD1 3.35Å; F62-Y74 HydrophobicContact CD1-CD1 3.35Å; F62-Y74 HydrophobicContact CD1-CD2 4.08Å; F62-Y74 AromaticContact CD1-CE1 3.45Å; F62-Y74 HydrophobicContact CD1-CE1 3.45Å; F62-Y74 VanDerWaalsContact CD1-CE1 3.45Å; F62-Y74 HydrophobicContact CD1-CE2 4.15Å; F62-Y74 AromaticContact CD1-CG 3.68Å; F62-Y74 HydrophobicContact CD1-CG 3.68Å; F62-Y74 AromaticContact CD1-CZ 3.85Å; F62-Y74 HydrophobicContact CD2-CD1 4.26Å; F62-Y74 HydrophobicContact CD2-CG 4.1Å; F62-Y74 AromaticContact CE1-CD1 3.79Å; F62-Y74 HydrophobicContact CE1-CD1 3.79Å; F62-Y74 AromaticContact CE1-CE1 3.89Å; F62-Y74 HydrophobicContact CE1-CE1 3.89Å; F62-Y74 HydrophobicContact CE1-CG 4.48Å; F62-Y74 AromaticContact CG-CD1 3.62Å; F62-Y74 HydrophobicContact CG-CD1 3.62Å; F62-Y74 AromaticContact CG-CD2 3.85Å; F62-Y74 HydrophobicContact CG-CD2 3.85Å; F62-Y74 HydrophobicContact CG-CE1 4.14Å; F62-Y74 HydrophobicContact CG-CE2 4.32Å; F62-Y74 AromaticContact CG-CG 3.46Å; F62-Y74 HydrophobicContact CG-CG 3.46Å; F62-Y74 VanDerWaalsContact CG-CG 3.46Å; F62-Y74 HydrophobicContact CZ-CD1 4.42Å; F62-F75 HydrophobicContact CE1-CZ 4.17Å; F62-F75 HydrophobicContact CE2-CE2 4.31Å; F62-F75 AromaticContact CZ-CE2 3.9Å; F62-F75 HydrophobicContact CZ-CE2 3.9Å; F62-F75 AromaticContact CZ-CZ 3.83Å; F62-F75 HydrophobicContact CZ-CZ 3.83Å
63	T	87.3	Confident	83.4	Confident	49 Å²	49	65.8 Å²	65.8	30%	0.301	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.8	-178.9	62.8	0	0	0	0	111	V36 A37 L67 I68	V36-T63 HydrophobicContact CG1-CG2 3.8Å; A37-T63 HydrophobicContact CB-CG2 3.91Å; T63-L67 WeakPolarHBondContact CA-O 3.25Å; T63-I68 HydrophobicContact CG2-CD1 3.45Å; T63-I68 VanDerWaalsContact CG2-CD1 3.45Å
64	R	84.8	Confident	83.4	Confident	107 Å²	107	64.6 Å²	64.6	40%	0.404	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	127.3	177.6	-176.2	175.4	-177	151.9	1.8	110.2	G66 L67 F69 Y74	R64-G66 PolarHBondContact O-N 2.89Å; R64-L67 PolarHBondContact N-O 2.66Å; R64-L67 WeakPolarHBondContact O-CB 3.41Å; R64-L67 PolarHBondContact O-N 3.47Å; R64-F69 HydrophobicContact CB-CD2 4.49Å; R64-F69 HydrophobicContact CB-CE2 4.01Å; R64-Y74 HydrophobicContact CB-CE2 4.39Å
65	N	85.3	Confident	83.2	Confident	151 Å²	151	63.6 Å²	63.6	81%	0.807	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	36.5	-178.6	-55.7	6	0	0	0	113.1	L67	N65-L67 PolarHBondContact O-N 3.03Å
66	G	82.6	Confident	83.2	Confident	58 Å²	58	69 Å²	69	60%	0.598	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	-13.5	-175.6	0	0	0	0	0	115.5	R64	R64-G66 PolarHBondContact O-N 2.89Å
67	L	87.1	Confident	83.3	Confident	91 Å²	91	69 Å²	69	48%	0.476	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	143.4	177.6	-60.9	176	0	0	0	111.9	C49 T63 R64 N65 F69	C49-L67 HydrophobicContact CB-CD2 4.46Å; T63-L67 WeakPolarHBondContact CA-O 3.25Å; R64-L67 PolarHBondContact N-O 2.66Å; R64-L67 WeakPolarHBondContact O-CB 3.41Å; R64-L67 PolarHBondContact O-N 3.47Å; N65-L67 PolarHBondContact O-N 3.03Å; L67-F69 HydrophobicContact CB-CD2 4.44Å; L67-F69 HydrophobicContact CB-CE2 3.6Å; L67-F69 HydrophobicContact CB-CZ 3.89Å; L67-F69 HydrophobicContact CD1-CZ 4.15Å
68	I	87.9	Confident	83.9	Confident	9 Å²	9	66.3 Å²	66.3	5%	0.046	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.8	177.8	-50.8	-58.8	0	0	0	109.7	V36 W41 L46 C48 C49 L55 C61 T63	V36-I68 HydrophobicContact CG1-CD1 4.13Å; W41-I68 HydrophobicContact CH2-CD1 4.07Å; W41-I68 HydrophobicContact CH2-CG1 3.56Å; W41-I68 HydrophobicContact CZ2-CD1 3.87Å; W41-I68 HydrophobicContact CZ2-CG1 3.87Å; W41-I68 HydrophobicContact CZ3-CG1 4.24Å; L46-I68 HydrophobicContact CD1-CG1 4.31Å; L46-I68 HydrophobicContact CD1-CG2 4.08Å; C48-I68 WeakPolarHBondContact CA-O 3.23Å; C49-I68 PolarHBondContact N-O 2.95Å; C49-I68 PolarHBondContact SG-O 3.36Å; C49-I68 VanDerWaalsContact SG-O 3.33Å; L55-I68 HydrophobicContact CD1-CG2 3.61Å; C61-I68 HydrophobicContact CB-CG2 4.17Å; T63-I68 HydrophobicContact CG2-CD1 3.45Å; T63-I68 VanDerWaalsContact CG2-CD1 3.45Å
69	F	88.2	Confident	84.5	Confident	5 Å²	5	63.9 Å²	63.9	2%	0.022	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	141.5	179.1	-60.1	-94	0	0	0	110.8	C49 V50 F62 R64 L67 Y74 Q77 F78	C49-F69 WeakPolarHBondContact SG-CE1 3.16Å; V50-F69 HydrophobicContact CG2-CD1 3.87Å; V50-F69 HydrophobicContact CG2-CE1 3.86Å; F62-F69 HydrophobicContact CB-CB 4.33Å; F62-F69 PolarHBondContact N-O 3.36Å; F62-F69 PolarHBondContact O-N 2.74Å; R64-F69 HydrophobicContact CB-CD2 4.49Å; R64-F69 HydrophobicContact CB-CE2 4.01Å; L67-F69 HydrophobicContact CB-CD2 4.44Å; L67-F69 HydrophobicContact CB-CE2 3.6Å; L67-F69 HydrophobicContact CB-CZ 3.89Å; L67-F69 HydrophobicContact CD1-CZ 4.15Å; F69-Y74 HydrophobicContact CB-CD2 4.2Å; F69-Y74 HydrophobicContact CD2-CD2 4.23Å; F69-Y74 HydrophobicContact CG-CD2 4.29Å; F69-Q77 VanDerWaalsContact CE1-OE1 3.29Å; F69-F78 HydrophobicContact CD1-CE2 4.15Å; F69-F78 HydrophobicContact CD2-CE2 4.32Å; F69-F78 AromaticContact CE1-CE2 3.75Å; F69-F78 HydrophobicContact CE1-CE2 3.75Å; F69-F78 HydrophobicContact CE1-CZ 4.19Å; F69-F78 AromaticContact CE2-CE2 3.94Å; F69-F78 HydrophobicContact CE2-CE2 3.94Å; F69-F78 HydrophobicContact CE2-CZ 4.43Å; F69-F78 HydrophobicContact CG-CE2 4.43Å; F69-F78 AromaticContact CZ-CE2 3.64Å; F69-F78 HydrophobicContact CZ-CE2 3.64Å; F69-F78 AromaticContact CZ-CZ 3.88Å; F69-F78 HydrophobicContact CZ-CZ 3.88Å
70	C	88.2	Confident	85.2	Confident	9 Å²	9	61.5 Å²	61.5	6%	0.061	31%	0.312	C	S	.	.			trans	-63.6	160.6	160.7	84.3	0	0	0	0	109.1	C48 L55 E72 D73 Y74	C48-C70 HydrophobicContact CB-CB 3.87Å; C48-C70 PolarHBondContact SG-N 3.15Å; L55-C70 HydrophobicContact CD2-CB 3.62Å; C70-E72 VanDerWaalsContact C-N 3.26Å; C70-E72 PolarHBondContact O-N 3.42Å; C70-E72 PolarHBondContact SG-N 3.14Å; C70-D73 VanDerWaalsContact SG-CG 3.54Å; C70-D73 PolarHBondContact SG-N 2.98Å; C70-D73 PolarHBondContact SG-OD2 3.2Å; C70-D73 VanDerWaalsContact SG-OD2 3.39Å; C70-Y74 VanDerWaalsContact O-CB 3.29Å; C70-Y74 WeakPolarHBondContact O-CB 3.44Å; C70-Y74 PolarHBondContact O-N 3.29Å
71	K	84.2	Confident	85.8	Confident	89 Å²	89	65.1 Å²	65.1	39%	0.387	32%	0.323	S	S	.	.	H	α-helix	trans	-55.8	-41.6	179	179.8	179.7	172.2	-167.7	0	112.8	F62 F75	F62-K71 HydrophobicContact CD2-CB 4.41Å; F62-K71 HydrophobicContact CE2-CB 3.91Å; F62-K71 HydrophobicContact CE2-CG 3.91Å; K71-F75 HydrophobicContact CG-CD2 3.96Å; K71-F75 HydrophobicContact CG-CE2 3.78Å; K71-F75 WeakPolarHBondContact O-CD2 3.36Å; K71-F75 PolarHBondContact O-N 3.44Å
72	E	86.1	Confident	86.2	Confident	132 Å²	132	63.9 Å²	63.9	62%	0.617	32%	0.315	S	S	*	.	H	α-helix	trans	-70.6	-50.1	-174.4	-58.6	-169.6	176.1	0	0	112	C70 Y74 F75 K76	C70-E72 VanDerWaalsContact C-N 3.26Å; C70-E72 PolarHBondContact O-N 3.42Å; C70-E72 PolarHBondContact SG-N 3.14Å; E72-Y74 VanDerWaalsContact C-N 3.34Å; E72-Y74 PolarHBondContact O-N 3.43Å; E72-F75 CarbonylContact O-C 3.6Å; E72-F75 PolarHBondContact O-N 3.09Å; E72-F75 VanDerWaalsContact O-N 3.1Å; E72-K76 WeakPolarHBondContact O-CG 3.26Å; E72-K76 PolarHBondContact O-N 3.29Å; E72-K76 IonicContact OE2-NZ 3.88Å
73	D	88.5	Confident	86.6	Confident	11 Å²	11	63.1 Å²	63.1	6%	0.059	31%	0.313	C	S	.	.	H	α-helix	trans	-70.4	-33.9	-177.5	-61.6	-24.4	0	0	0	111.6	V50 C51 C70 F75 K76 Q77	V50-D73 HydrophobicContact CB-CB 4.01Å; V50-D73 HydrophobicContact CG1-CB 4.09Å; V50-D73 HydrophobicContact CG2-CB 4.28Å; C51-D73 WeakPolarHBondContact CB-OD2 3.36Å; C51-D73 PolarHBondContact N-OD2 3.41Å; C51-D73 PolarHBondContact SG-OD2 2.96Å; C70-D73 VanDerWaalsContact SG-CG 3.54Å; C70-D73 PolarHBondContact SG-N 2.98Å; C70-D73 PolarHBondContact SG-OD2 3.2Å; C70-D73 VanDerWaalsContact SG-OD2 3.39Å; D73-F75 VanDerWaalsContact C-N 3.3Å; D73-F75 PolarHBondContact O-N 2.8Å; D73-K76 PolarHBondContact O-N 3.45Å; D73-K76 WeakPolarHBondContact OD1-CD 3.49Å; D73-K76 IonicContact OD1-NZ 3.82Å; D73-K76 PolarHBondContact OD1-NZ 3.18Å; D73-Q77 WeakPolarHBondContact O-CB 3.35Å; D73-Q77 WeakPolarHBondContact O-CG 3.4Å; D73-Q77 PolarHBondContact O-N 2.86Å
74	Y	88.4	Confident	86.9	Confident	22 Å²	22	66.2 Å²	66.2	9%	0.086	32%	0.319	C	S	.	.	H	α-helix	trans	-57.2	-44.5	168.4	-173.8	-94.7	0	0	0	111.7	F62 R64 F69 C70 E72 F78 M213	F62-Y74 HydrophobicContact CB-CD1 4.07Å; F62-Y74 HydrophobicContact CB-CD2 3.31Å; F62-Y74 HydrophobicContact CB-CE2 3.83Å; F62-Y74 HydrophobicContact CB-CG 3.44Å; F62-Y74 VanDerWaalsContact CB-CG 3.44Å; F62-Y74 AromaticContact CD1-CD1 3.35Å; F62-Y74 HydrophobicContact CD1-CD1 3.35Å; F62-Y74 HydrophobicContact CD1-CD2 4.08Å; F62-Y74 AromaticContact CD1-CE1 3.45Å; F62-Y74 HydrophobicContact CD1-CE1 3.45Å; F62-Y74 VanDerWaalsContact CD1-CE1 3.45Å; F62-Y74 HydrophobicContact CD1-CE2 4.15Å; F62-Y74 AromaticContact CD1-CG 3.68Å; F62-Y74 HydrophobicContact CD1-CG 3.68Å; F62-Y74 AromaticContact CD1-CZ 3.85Å; F62-Y74 HydrophobicContact CD2-CD1 4.26Å; F62-Y74 HydrophobicContact CD2-CG 4.1Å; F62-Y74 AromaticContact CE1-CD1 3.79Å; F62-Y74 HydrophobicContact CE1-CD1 3.79Å; F62-Y74 AromaticContact CE1-CE1 3.89Å; F62-Y74 HydrophobicContact CE1-CE1 3.89Å; F62-Y74 HydrophobicContact CE1-CG 4.48Å; F62-Y74 AromaticContact CG-CD1 3.62Å; F62-Y74 HydrophobicContact CG-CD1 3.62Å; F62-Y74 AromaticContact CG-CD2 3.85Å; F62-Y74 HydrophobicContact CG-CD2 3.85Å; F62-Y74 HydrophobicContact CG-CE1 4.14Å; F62-Y74 HydrophobicContact CG-CE2 4.32Å; F62-Y74 AromaticContact CG-CG 3.46Å; F62-Y74 HydrophobicContact CG-CG 3.46Å; F62-Y74 VanDerWaalsContact CG-CG 3.46Å; F62-Y74 HydrophobicContact CZ-CD1 4.42Å; R64-Y74 HydrophobicContact CB-CE2 4.39Å; F69-Y74 HydrophobicContact CB-CD2 4.2Å; F69-Y74 HydrophobicContact CD2-CD2 4.23Å; F69-Y74 HydrophobicContact CG-CD2 4.29Å; C70-Y74 VanDerWaalsContact O-CB 3.29Å; C70-Y74 WeakPolarHBondContact O-CB 3.44Å; C70-Y74 PolarHBondContact O-N 3.29Å; E72-Y74 VanDerWaalsContact C-N 3.34Å; E72-Y74 PolarHBondContact O-N 3.43Å; Y74-F78 AromaticContact CD2-CD2 3.5Å; Y74-F78 HydrophobicContact CD2-CD2 3.5Å; Y74-F78 HydrophobicContact CD2-CE2 4.09Å; Y74-F78 HydrophobicContact CE1-CB 4.44Å; Y74-F78 HydrophobicContact CE2-CB 4.41Å; Y74-F78 AromaticContact CE2-CD2 3.66Å; Y74-F78 HydrophobicContact CE2-CD2 3.66Å; Y74-F78 HydrophobicContact CE2-CE2 4.36Å; Y74-F78 HydrophobicContact CE2-CG 4.34Å; Y74-F78 HydrophobicContact CG-CD2 4.11Å; Y74-F78 WeakPolarHBondContact O-CA 3.29Å; Y74-F78 WeakPolarHBondContact O-CB 3.48Å; Y74-F78 WeakPolarHBondContact O-CD2 3.25Å; Y74-F78 PolarHBondContact O-N 3.43Å; Y74-M213 HydrophobicContact CE1-SD 3.99Å; Y74-M213 PolarHBondContact OH-SD 3.29Å
75	F	84.6	Confident	87.3	Confident	36 Å²	36	63.3 Å²	63.3	16%	0.158	32%	0.315	C	S	.	.	H	α-helix	trans	-71.1	-41.6	176.1	-74.1	-55.3	0	0	0	112.3	F62 K71 E72 D73 Q77 A79 M88 P91	F62-F75 HydrophobicContact CE1-CZ 4.17Å; F62-F75 HydrophobicContact CE2-CE2 4.31Å; F62-F75 AromaticContact CZ-CE2 3.9Å; F62-F75 HydrophobicContact CZ-CE2 3.9Å; F62-F75 AromaticContact CZ-CZ 3.83Å; F62-F75 HydrophobicContact CZ-CZ 3.83Å; K71-F75 HydrophobicContact CG-CD2 3.96Å; K71-F75 HydrophobicContact CG-CE2 3.78Å; K71-F75 WeakPolarHBondContact O-CD2 3.36Å; K71-F75 PolarHBondContact O-N 3.44Å; E72-F75 CarbonylContact O-C 3.6Å; E72-F75 PolarHBondContact O-N 3.09Å; E72-F75 VanDerWaalsContact O-N 3.1Å; D73-F75 VanDerWaalsContact C-N 3.3Å; D73-F75 PolarHBondContact O-N 2.8Å; F75-Q77 VanDerWaalsContact C-N 3.3Å; F75-Q77 PolarHBondContact O-N 3Å; F75-A79 HydrophobicContact CB-CB 4.3Å; F75-A79 HydrophobicContact CD1-CB 4.1Å; F75-A79 WeakPolarHBondContact O-CB 3Å; F75-A79 PolarHBondContact O-N 2.98Å; F75-M88 HydrophobicContact CB-CE 4.49Å; F75-M88 VanDerWaalsContact O-CE 3.3Å; F75-M88 WeakPolarHBondContact O-CE 3.34Å; F75-P91 HydrophobicContact CD1-CG 3.94Å; F75-P91 HydrophobicContact CD2-CG 3.8Å; F75-P91 HydrophobicContact CE1-CB 4.38Å; F75-P91 HydrophobicContact CE1-CG 3.53Å; F75-P91 HydrophobicContact CE2-CB 4.38Å; F75-P91 HydrophobicContact CE2-CG 3.38Å; F75-P91 HydrophobicContact CG-CG 4.11Å; F75-P91 HydrophobicContact CZ-CB 3.99Å; F75-P91 HydrophobicContact CZ-CG 3.26Å
76	K	84.2	Confident	87.6	Confident	116 Å²	116	64.4 Å²	64.4	50%	0.504	31%	0.307	S	S	.	.	H	α-helix	trans	-55.4	-43.6	175.8	-68.5	168.5	-159.7	157.6	0	111.9	E72 D73	E72-K76 WeakPolarHBondContact O-CG 3.26Å; E72-K76 PolarHBondContact O-N 3.29Å; E72-K76 IonicContact OE2-NZ 3.88Å; D73-K76 PolarHBondContact O-N 3.45Å; D73-K76 WeakPolarHBondContact OD1-CD 3.49Å; D73-K76 IonicContact OD1-NZ 3.82Å; D73-K76 PolarHBondContact OD1-NZ 3.18Å
77	Q	82.5	Confident	87.9	Confident	102 Å²	102	70.8 Å²	70.8	48%	0.477	31%	0.314	S	S	.	.	H	α-helix	trans	-84.3	-38.7	-178.2	-65.7	-171.9	-3.4	0	0	113.8	F69 D73 F75	F69-Q77 VanDerWaalsContact CE1-OE1 3.29Å; D73-Q77 WeakPolarHBondContact O-CB 3.35Å; D73-Q77 WeakPolarHBondContact O-CG 3.4Å; D73-Q77 PolarHBondContact O-N 2.86Å; F75-Q77 VanDerWaalsContact C-N 3.3Å; F75-Q77 PolarHBondContact O-N 3Å
78	F	84.4	Confident	88	Confident	64 Å²	64	70.2 Å²	70.2	28%	0.281	31%	0.309	S	S	.	.	H	α-helix	trans	-122.3	1.1	-166.2	-49.6	-63	0	0	0	115.8	F69 Y74 K80	F69-F78 HydrophobicContact CD1-CE2 4.15Å; F69-F78 HydrophobicContact CD2-CE2 4.32Å; F69-F78 AromaticContact CE1-CE2 3.75Å; F69-F78 HydrophobicContact CE1-CE2 3.75Å; F69-F78 HydrophobicContact CE1-CZ 4.19Å; F69-F78 AromaticContact CE2-CE2 3.94Å; F69-F78 HydrophobicContact CE2-CE2 3.94Å; F69-F78 HydrophobicContact CE2-CZ 4.43Å; F69-F78 HydrophobicContact CG-CE2 4.43Å; F69-F78 AromaticContact CZ-CE2 3.64Å; F69-F78 HydrophobicContact CZ-CE2 3.64Å; F69-F78 AromaticContact CZ-CZ 3.88Å; F69-F78 HydrophobicContact CZ-CZ 3.88Å; Y74-F78 AromaticContact CD2-CD2 3.5Å; Y74-F78 HydrophobicContact CD2-CD2 3.5Å; Y74-F78 HydrophobicContact CD2-CE2 4.09Å; Y74-F78 HydrophobicContact CE1-CB 4.44Å; Y74-F78 HydrophobicContact CE2-CB 4.41Å; Y74-F78 AromaticContact CE2-CD2 3.66Å; Y74-F78 HydrophobicContact CE2-CD2 3.66Å; Y74-F78 HydrophobicContact CE2-CE2 4.36Å; Y74-F78 HydrophobicContact CE2-CG 4.34Å; Y74-F78 HydrophobicContact CG-CD2 4.11Å; Y74-F78 WeakPolarHBondContact O-CA 3.29Å; Y74-F78 WeakPolarHBondContact O-CB 3.48Å; Y74-F78 WeakPolarHBondContact O-CD2 3.25Å; Y74-F78 PolarHBondContact O-N 3.43Å; F78-K80 PolarHBondContact O-N 2.89Å
79	A	82.9	Confident	87.9	Confident	16 Å²	16	70.1 Å²	70.1	13%	0.132	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-61.4	139	174.8	0	0	0	0	0	111.5	F75 K81 M88	F75-A79 HydrophobicContact CB-CB 4.3Å; F75-A79 HydrophobicContact CD1-CB 4.1Å; F75-A79 WeakPolarHBondContact O-CB 3Å; F75-A79 PolarHBondContact O-N 2.98Å; A79-K81 PolarHBondContact O-N 3.36Å; A79-M88 HydrophobicContact CB-CB 4.49Å; A79-M88 HydrophobicContact CB-CE 4.15Å; A79-M88 HydrophobicContact CB-CG 4.49Å
80	K	85.3	Confident	87.6	Confident	109 Å²	109	71.8 Å²	71.8	47%	0.474	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-60.6	129.7	168.3	-69	-163.8	172.9	-162.8	0	109.3	F78 L89 V102	F78-K80 PolarHBondContact O-N 2.89Å; K80-L89 HydrophobicContact CB-CD1 4.38Å; K80-L89 WeakPolarHBondContact O-CB 3.24Å; K80-L89 WeakPolarHBondContact O-CD1 3.37Å; K80-L89 PolarHBondContact O-N 3.08Å; K80-L89 VanDerWaalsContact O-N 3.11Å; K80-V102 HydrophobicContact CD-CG2 4.16Å
81	K	89.6	Confident	87	Confident	131 Å²	131	73.3 Å²	73.3	57%	0.57	33%	0.331	S	S	*	.	B	Isolated β-bridge	trans	-89.1	148.7	175.3	-63.9	177.8	-176.3	179.9	0	109.7	A79 T83 R86	A79-K81 PolarHBondContact O-N 3.36Å; K81-T83 PolarHBondContact O-N 3.06Å; K81-R86 WeakPolarHBondContact CB-O 3.38Å
82	C	93.2	Very high	86.6	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-66.8	128	174.5	174.3	0	0	0	0	110.6	R84 C85 R86 R87 L89 V102 H104	C82-R84 VanDerWaalsContact C-N 3.29Å; C82-R84 PolarHBondContact O-N 3.38Å; C82-C85 VanDerWaalsContact CB-SG 3.54Å; C82-C85 VanDerWaalsContact SG-SG 3.61Å; C82-R86 WeakPolarHBondContact O-CA 3.4Å; C82-R86 PolarHBondContact O-N 3.24Å; C82-R87 PolarHBondContact N-O 3.22Å; C82-L89 HydrophobicContact CB-CD2 4.11Å; C82-L89 HydrophobicContact CB-CG 4.26Å; C82-V102 CarbonylContact C-O 3.58Å; C82-V102 WeakPolarHBondContact CA-O 3.49Å; C82-H104 WeakPolarHBondContact CB-CE1 3.3Å; C82-H104 VanDerWaalsContact CB-ND1 3.3Å; C82-H104 WeakPolarHBondContact CB-ND1 3.46Å
83	T	93.4	Very high	86.4	Confident	18 Å²	18	74.5 Å²	74.5	11%	0.11	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-40.3	-180	-58	0	0	0	0	112.5	K81 R86 N101 V102 F103	K81-T83 PolarHBondContact O-N 3.06Å; T83-R86 PolarHBondContact O-NE 3.09Å; T83-N101 HydrophobicContact CG2-CB 4.45Å; T83-N101 WeakPolarHBondContact CG2-OD1 3.26Å; T83-N101 PolarHBondContact OG1-OD1 2.88Å; T83-V102 PolarHBondContact N-O 3.37Å; T83-F103 HydrophobicContact CG2-CE1 4.11Å; T83-F103 HydrophobicContact CG2-CZ 4.17Å
84	R	92.6	Very high	86.2	Confident	114 Å²	114	78.4 Å²	78.4	43%	0.43	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-45.3	-177.1	-178.3	69.8	175.8	101.6	-5.6	115.5	C82 F103 C107	C82-R84 VanDerWaalsContact C-N 3.29Å; C82-R84 PolarHBondContact O-N 3.38Å; R84-F103 HydrophobicContact CB-CD1 3.8Å; R84-F103 HydrophobicContact CB-CE1 4.08Å; R84-C107 HydrophobicContact CB-CB 4.05Å; R84-C107 HydrophobicContact CG-CB 4.25Å
85	C	93.6	Very high	86.3	Confident	46 Å²	46	77.4 Å²	77.4	31%	0.311	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-1.7	-173.2	73.8	0	0	0	0	114.4	C82 R87 H104 C107	C82-C85 VanDerWaalsContact CB-SG 3.54Å; C82-C85 VanDerWaalsContact SG-SG 3.61Å; C85-R87 PolarHBondContact O-N 3.15Å; C85-H104 PolarHBondContact SG-CE1 2.8Å; C85-H104 PolarHBondContact SG-ND1 3.07Å; C85-H104 VanDerWaalsContact SG-ND1 3.4Å; C85-C107 VanDerWaalsContact SG-SG 3.64Å
86	R	91.4	Very high	86.5	Confident	174 Å²	174	75.9 Å²	75.9	66%	0.657	34%	0.341	S	S	*	.			trans	57.9	-3.2	-179.8	-52.1	-58.8	-176.4	173.5	-1.7	116.9	K81 C82 T83	K81-R86 WeakPolarHBondContact CB-O 3.38Å; C82-R86 WeakPolarHBondContact O-CA 3.4Å; C82-R86 PolarHBondContact O-N 3.24Å; T83-R86 PolarHBondContact O-NE 3.09Å
87	R	90.3	Very high	86.7	Confident	193 Å²	193	73.5 Å²	73.5	73%	0.728	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-67.1	152.8	170.5	-60.6	-179.2	-176.8	177.3	0.1	111.2	C82 C85 H104	C82-R87 PolarHBondContact N-O 3.22Å; C85-R87 PolarHBondContact O-N 3.15Å; R87-H104 WeakPolarHBondContact CB-CE1 3.42Å; R87-H104 PolarHBondContact O-CE1 3.22Å
88	M	87.9	Confident	86.9	Confident	79 Å²	79	68.9 Å²	68.9	39%	0.389	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-65.4	146.3	179.2	-67	162.4	52.8	0	0	111.9	F75 A79 H104	F75-M88 HydrophobicContact CB-CE 4.49Å; F75-M88 VanDerWaalsContact O-CE 3.3Å; F75-M88 WeakPolarHBondContact O-CE 3.34Å; A79-M88 HydrophobicContact CB-CB 4.49Å; A79-M88 HydrophobicContact CB-CE 4.15Å; A79-M88 HydrophobicContact CB-CG 4.49Å; M88-H104 VanDerWaalsContact C-NE2 3.26Å; M88-H104 PolarHBondContact O-CE1 3.18Å; M88-H104 PolarHBondContact O-NE2 3.06Å
89	L	86.8	Confident	87	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.031	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-97.7	124.9	174.6	-65	157.6	0	0	0	109	K80 C82 V95 V102 H104	K80-L89 HydrophobicContact CB-CD1 4.38Å; K80-L89 WeakPolarHBondContact O-CB 3.24Å; K80-L89 WeakPolarHBondContact O-CD1 3.37Å; K80-L89 PolarHBondContact O-N 3.08Å; K80-L89 VanDerWaalsContact O-N 3.11Å; C82-L89 HydrophobicContact CB-CD2 4.11Å; C82-L89 HydrophobicContact CB-CG 4.26Å; L89-V95 HydrophobicContact CB-CG1 4.31Å; L89-V95 HydrophobicContact CD2-CG1 3.69Å; L89-V95 HydrophobicContact CG-CG1 4.41Å; L89-V102 HydrophobicContact CD1-CB 3.79Å; L89-V102 HydrophobicContact CD1-CG1 3.55Å; L89-H104 WeakPolarHBondContact CA-NE2 3.38Å; L89-H104 HydrophobicContact CD2-CB 4.38Å; L89-H104 VanDerWaalsContact CD2-CD2 3.43Å; L89-H104 WeakPolarHBondContact CD2-CD2 3.49Å
90	S	82.2	Confident	87.1	Confident	40 Å²	40	78 Å²	78	28%	0.28	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-74.3	153.6	-178.5	116.8	0	0	0	0	111.9	R92 D93	S90-R92 PolarHBondContact O-N 3.16Å; S90-R92 PolarHBondContact OG-N 3.08Å; S90-R92 VanDerWaalsContact OG-N 3.07Å; S90-D93 WeakPolarHBondContact CA-OD2 3.43Å; S90-D93 WeakPolarHBondContact CB-OD1 3.46Å; S90-D93 VanDerWaalsContact CB-OD2 3.3Å; S90-D93 WeakPolarHBondContact CB-OD2 3.36Å; S90-D93 PolarHBondContact N-OD2 3.05Å; S90-D93 WeakPolarHBondContact O-CB 3.37Å; S90-D93 PolarHBondContact O-N 2.92Å; S90-D93 VanDerWaalsContact O-N 3.13Å; S90-D93 PolarHBondContact OG-N 3.46Å; S90-D93 PolarHBondContact OG-OD1 2.95Å
91	P	74.9	Confident	87.3	Confident	41 Å²	41	74.7 Å²	74.7	27%	0.266	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-16.3	177	-16.3	31.2	0	0	0	113.3	F75 K210	F75-P91 HydrophobicContact CD1-CG 3.94Å; F75-P91 HydrophobicContact CD2-CG 3.8Å; F75-P91 HydrophobicContact CE1-CB 4.38Å; F75-P91 HydrophobicContact CE1-CG 3.53Å; F75-P91 HydrophobicContact CE2-CB 4.38Å; F75-P91 HydrophobicContact CE2-CG 3.38Å; F75-P91 HydrophobicContact CG-CG 4.11Å; F75-P91 HydrophobicContact CZ-CB 3.99Å; F75-P91 HydrophobicContact CZ-CG 3.26Å; P91-K210 VanDerWaalsContact O-CE 3.24Å; P91-K210 WeakPolarHBondContact O-CE 2.97Å; P91-K210 WeakPolarHBondContact O-CG 3.3Å
92	R	75.5	Confident	87.4	Confident	196 Å²	196	68.8 Å²	68.8	74%	0.74	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-16.2	176.7	-65.9	177.7	175.1	157.1	-3.7	111.8	S90	S90-R92 PolarHBondContact O-N 3.16Å; S90-R92 PolarHBondContact OG-N 3.08Å; S90-R92 VanDerWaalsContact OG-N 3.07Å
93	D	82	Confident	87.3	Confident	51 Å²	51	68.8 Å²	68.8	27%	0.273	31%	0.31	S	S	.	.	S	Bend	trans	-72.5	144.2	-172.5	-59.3	-5.1	0	0	0	111.7	S90 V95 H104	S90-D93 WeakPolarHBondContact CA-OD2 3.43Å; S90-D93 WeakPolarHBondContact CB-OD1 3.46Å; S90-D93 VanDerWaalsContact CB-OD2 3.3Å; S90-D93 WeakPolarHBondContact CB-OD2 3.36Å; S90-D93 PolarHBondContact N-OD2 3.05Å; S90-D93 WeakPolarHBondContact O-CB 3.37Å; S90-D93 PolarHBondContact O-N 2.92Å; S90-D93 VanDerWaalsContact O-N 3.13Å; S90-D93 PolarHBondContact OG-N 3.46Å; S90-D93 PolarHBondContact OG-OD1 2.95Å; D93-V95 HydrophobicContact CB-CG1 4.27Å; D93-H104 IonicContact OD2-NE2 2.7Å
94	L	84.7	Confident	87.2	Confident	93 Å²	93	69.6 Å²	69.6	49%	0.487	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134	157.1	-68.2	170.1	0	0	0	108	V105 L206 T208	L94-V105 HydrophobicContact CB-CG2 3.91Å; L94-V105 VanDerWaalsContact O-CG2 3.23Å; L94-V105 WeakPolarHBondContact O-CG2 3.45Å; L94-L206 HydrophobicContact CB-CD2 4.35Å; L94-T208 HydrophobicContact CD2-CG2 3.66Å
95	V	89.6	Confident	87.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	147.8	178.9	-59.9	0	0	0	0	110.9	L89 D93 R97 V102 F103 I207 Q209	L89-V95 HydrophobicContact CB-CG1 4.31Å; L89-V95 HydrophobicContact CD2-CG1 3.69Å; L89-V95 HydrophobicContact CG-CG1 4.41Å; D93-V95 HydrophobicContact CB-CG1 4.27Å; V95-R97 HydrophobicContact CG2-CG 4.28Å; V95-V102 HydrophobicContact CB-CG1 3.69Å; V95-V102 HydrophobicContact CG1-CG1 4.28Å; V95-V102 HydrophobicContact CG2-CG1 3.6Å; V95-F103 WeakPolarHBondContact CA-O 3.47Å; V95-F103 WeakPolarHBondContact CB-O 3.42Å; V95-I207 WeakPolarHBondContact CG2-O 3.48Å; V95-I207 PolarHBondContact N-O 3.39Å; V95-I207 PolarHBondContact O-N 3.34Å; V95-Q209 HydrophobicContact CB-CG 4.48Å; V95-Q209 HydrophobicContact CG1-CG 3.75Å; V95-Q209 HydrophobicContact CG2-CG 3.84Å
96	M	88.6	Confident	87.1	Confident	5 Å²	5	68.4 Å²	68.4	3%	0.025	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.9	168.9	-65.2	-67.7	-98.4	0	0	107.9	V102 F103 F108 L117 C203 L206	M96-V102 WeakPolarHBondContact O-CA 3.26Å; M96-F103 HydrophobicContact CB-CB 4.34Å; M96-F103 PolarHBondContact N-O 2.81Å; M96-F103 PolarHBondContact O-N 2.92Å; M96-F108 HydrophobicContact CB-CB 3.8Å; M96-F108 HydrophobicContact CB-CD1 4.16Å; M96-F108 HydrophobicContact CB-CD2 3.83Å; M96-F108 HydrophobicContact CB-CE2 4.47Å; M96-F108 HydrophobicContact CB-CG 3.65Å; M96-F108 HydrophobicContact CE-CD1 3.27Å; M96-F108 HydrophobicContact CE-CE1 3.64Å; M96-F108 HydrophobicContact CE-CG 4.05Å; M96-F108 HydrophobicContact CG-CB 3.66Å; M96-F108 HydrophobicContact CG-CD1 4.01Å; M96-F108 HydrophobicContact CG-CD2 4.48Å; M96-F108 HydrophobicContact CG-CG 3.8Å; M96-F108 HydrophobicContact SD-CD1 4.48Å; M96-L117 WeakPolarHBondContact CE-O 3.5Å; M96-C203 WeakPolarHBondContact CE-SG 3.37Å; M96-L206 HydrophobicContact CG-CD2 3.94Å; M96-L206 HydrophobicContact SD-CD2 3.26Å; M96-L206 WeakPolarHBondContact SD-CD2 3.43Å; M96-L206 HydrophobicContact SD-CG 3.73Å
97	R	88.4	Confident	87.2	Confident	66 Å²	66	61.1 Å²	61.1	25%	0.249	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.9	175.7	-70.2	-172.8	170.6	-152.2	-2.8	109	V95 N101 V102	V95-R97 HydrophobicContact CG2-CG 4.28Å; R97-N101 WeakPolarHBondContact CA-O 3.45Å; R97-V102 HydrophobicContact CG-CG1 4.09Å; R97-V102 HydrophobicContact CG-CG2 4.27Å
98	A	87.9	Confident	87.4	Confident	4 Å²	4	52 Å²	52	3%	0.033	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	109.1	177.7	0	0	0	0	0	108.6	E100 N101 F103 F108 F123 L125	A98-E100 PolarHBondContact O-N 2.85Å; A98-N101 PolarHBondContact N-O 3.47Å; A98-N101 WeakPolarHBondContact O-CB 3.39Å; A98-N101 PolarHBondContact O-N 3.03Å; A98-F103 HydrophobicContact CB-CE2 4.29Å; A98-F108 HydrophobicContact CB-CE2 4.08Å; A98-F108 HydrophobicContact CB-CZ 4.48Å; A98-F123 HydrophobicContact CB-CE2 3.81Å; A98-F123 HydrophobicContact CB-CZ 3.67Å; A98-L125 HydrophobicContact CB-CD2 3.94Å
99	K	85.9	Confident	87.7	Confident	93 Å²	93	49.4 Å²	49.4	40%	0.404	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	-125.2	-163	-61.5	-175.5	167.9	-171	0	110.3	L125 E191 T199 L201	K99-L125 HydrophobicContact CB-CD2 4.31Å; K99-L125 HydrophobicContact CD-CD2 4.29Å; K99-L125 HydrophobicContact CG-CD2 4.24Å; K99-E191 VanDerWaalsContact CE-CD 3.45Å; K99-E191 WeakPolarHBondContact CE-OE1 3.29Å; K99-E191 WeakPolarHBondContact CE-OE2 3.33Å; K99-E191 IonicContact NZ-OE1 2.75Å; K99-E191 PolarHBondContact NZ-OE1 2.79Å; K99-E191 IonicContact NZ-OE2 2.64Å; K99-T199 PolarHBondContact NZ-OG1 3.3Å; K99-L201 HydrophobicContact CD-CD1 4.42Å; K99-L201 HydrophobicContact CG-CD1 4.02Å
100	E	85.3	Confident	88.1	Confident	180 Å²	180	49.1 Å²	49.1	84%	0.841	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-17.4	179.4	-57.7	-177.3	172.6	0	0	113.1	A98	A98-E100 PolarHBondContact O-N 2.85Å
101	N	89.5	Confident	88.6	Confident	38 Å²	38	49.5 Å²	49.5	20%	0.203	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	144.8	-177.6	-73.6	-65.4	0	0	0	112.1	T83 R97 A98 F103	T83-N101 HydrophobicContact CG2-CB 4.45Å; T83-N101 WeakPolarHBondContact CG2-OD1 3.26Å; T83-N101 PolarHBondContact OG1-OD1 2.88Å; R97-N101 WeakPolarHBondContact CA-O 3.45Å; A98-N101 PolarHBondContact N-O 3.47Å; A98-N101 WeakPolarHBondContact O-CB 3.39Å; A98-N101 PolarHBondContact O-N 3.03Å; N101-F103 HydrophobicContact CB-CD2 4.47Å; N101-F103 HydrophobicContact CB-CE2 3.53Å; N101-F103 HydrophobicContact CB-CZ 3.84Å
102	V	90.6	Very high	89.4	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.042	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.9	179.3	-164.2	0	0	0	0	109.6	K80 C82 T83 L89 V95 M96 R97	K80-V102 HydrophobicContact CD-CG2 4.16Å; C82-V102 CarbonylContact C-O 3.58Å; C82-V102 WeakPolarHBondContact CA-O 3.49Å; T83-V102 PolarHBondContact N-O 3.37Å; L89-V102 HydrophobicContact CD1-CB 3.79Å; L89-V102 HydrophobicContact CD1-CG1 3.55Å; V95-V102 HydrophobicContact CB-CG1 3.69Å; V95-V102 HydrophobicContact CG1-CG1 4.28Å; V95-V102 HydrophobicContact CG2-CG1 3.6Å; M96-V102 WeakPolarHBondContact O-CA 3.26Å; R97-V102 HydrophobicContact CG-CG1 4.09Å; R97-V102 HydrophobicContact CG-CG2 4.27Å
103	F	91.8	Very high	90.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	148.4	-174.4	-53.4	-101.6	0	0	0	110.8	T83 R84 V95 M96 A98 N101 F108 L125 V131	T83-F103 HydrophobicContact CG2-CE1 4.11Å; T83-F103 HydrophobicContact CG2-CZ 4.17Å; R84-F103 HydrophobicContact CB-CD1 3.8Å; R84-F103 HydrophobicContact CB-CE1 4.08Å; V95-F103 WeakPolarHBondContact CA-O 3.47Å; V95-F103 WeakPolarHBondContact CB-O 3.42Å; M96-F103 HydrophobicContact CB-CB 4.34Å; M96-F103 PolarHBondContact N-O 2.81Å; M96-F103 PolarHBondContact O-N 2.92Å; A98-F103 HydrophobicContact CB-CE2 4.29Å; N101-F103 HydrophobicContact CB-CD2 4.47Å; N101-F103 HydrophobicContact CB-CE2 3.53Å; N101-F103 HydrophobicContact CB-CZ 3.84Å; F103-F108 HydrophobicContact CB-CB 4.19Å; F103-F108 HydrophobicContact CB-CD2 4.14Å; F103-F108 HydrophobicContact CD1-CD2 4.4Å; F103-F108 AromaticContact CD2-CD2 3.64Å; F103-F108 HydrophobicContact CD2-CD2 3.64Å; F103-F108 HydrophobicContact CD2-CE2 4.04Å; F103-F108 HydrophobicContact CE2-CD2 4.09Å; F103-F108 HydrophobicContact CE2-CE2 4.1Å; F103-F108 AromaticContact CG-CD2 3.83Å; F103-F108 HydrophobicContact CG-CD2 3.83Å; F103-L125 HydrophobicContact CZ-CD1 4.26Å; F103-V131 HydrophobicContact CE1-CG2 3.88Å; F103-V131 HydrophobicContact CE2-CG2 4.33Å; F103-V131 HydrophobicContact CZ-CG2 3.67Å
104	H	92.1	Very high	91	Very high	36 Å²	36	46.6 Å²	46.6	17%	0.167	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	150.3	159.6	-57	97.5	0	0	0	108.9	C82 C85 R87 M88 L89 D93 C106 C107 F108	C82-H104 WeakPolarHBondContact CB-CE1 3.3Å; C82-H104 VanDerWaalsContact CB-ND1 3.3Å; C82-H104 WeakPolarHBondContact CB-ND1 3.46Å; C85-H104 PolarHBondContact SG-CE1 2.8Å; C85-H104 PolarHBondContact SG-ND1 3.07Å; C85-H104 VanDerWaalsContact SG-ND1 3.4Å; R87-H104 WeakPolarHBondContact CB-CE1 3.42Å; R87-H104 PolarHBondContact O-CE1 3.22Å; M88-H104 VanDerWaalsContact C-NE2 3.26Å; M88-H104 PolarHBondContact O-CE1 3.18Å; M88-H104 PolarHBondContact O-NE2 3.06Å; L89-H104 WeakPolarHBondContact CA-NE2 3.38Å; L89-H104 HydrophobicContact CD2-CB 4.38Å; L89-H104 VanDerWaalsContact CD2-CD2 3.43Å; L89-H104 WeakPolarHBondContact CD2-CD2 3.49Å; D93-H104 IonicContact OD2-NE2 2.7Å; H104-C106 PolarHBondContact O-N 2.86Å; H104-C107 HydrophobicContact CB-CB 4.03Å; H104-C107 WeakPolarHBondContact O-CA 3.47Å; H104-C107 PolarHBondContact O-N 3.48Å; H104-F108 PolarHBondContact O-N 3.48Å; H104-F108 VanDerWaalsContact O-N 3.16Å
105	V	90.8	Very high	91.4	Very high	45 Å²	45	45.7 Å²	45.7	27%	0.273	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-57.8	-38.3	179	-166.4	0	0	0	0	111.6	L94 C107 Q116 L206	L94-V105 HydrophobicContact CB-CG2 3.91Å; L94-V105 VanDerWaalsContact O-CG2 3.23Å; L94-V105 WeakPolarHBondContact O-CG2 3.45Å; V105-C107 VanDerWaalsContact C-N 3.33Å; V105-Q116 PolarHBondContact O-NE2 3.38Å; V105-L206 HydrophobicContact CG1-CD2 4.17Å; V105-L206 HydrophobicContact CG2-CD2 3.67Å
106	C	92.3	Very high	91.5	Very high	90 Å²	90	49 Å²	49	61%	0.608	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-72.1	-20.8	174.8	55.5	0	0	0	0	114.2	H104 T109	H104-C106 PolarHBondContact O-N 2.86Å; C106-T109 WeakPolarHBondContact O-CG2 3.38Å
107	C	93.8	Very high	91.6	Very high	21 Å²	21	49.1 Å²	49.1	14%	0.142	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-93.2	-4.6	178.8	-66.1	0	0	0	0	113.5	R84 C85 H104 V105 T109	R84-C107 HydrophobicContact CB-CB 4.05Å; R84-C107 HydrophobicContact CG-CB 4.25Å; C85-C107 VanDerWaalsContact SG-SG 3.64Å; H104-C107 HydrophobicContact CB-CB 4.03Å; H104-C107 WeakPolarHBondContact O-CA 3.47Å; H104-C107 PolarHBondContact O-N 3.48Å; V105-C107 VanDerWaalsContact C-N 3.33Å; C107-T109 PolarHBondContact O-N 3.37Å; C107-T109 VanDerWaalsContact O-N 3.09Å
108	F	93.8	Very high	91.6	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.009	29%	0.29	C	S	.	.			trans	-86.8	64.7	175.6	-163.1	-106.5	0	0	0	110.4	M96 A98 F103 H104 L117 F123 V131	M96-F108 HydrophobicContact CB-CB 3.8Å; M96-F108 HydrophobicContact CB-CD1 4.16Å; M96-F108 HydrophobicContact CB-CD2 3.83Å; M96-F108 HydrophobicContact CB-CE2 4.47Å; M96-F108 HydrophobicContact CB-CG 3.65Å; M96-F108 HydrophobicContact CE-CD1 3.27Å; M96-F108 HydrophobicContact CE-CE1 3.64Å; M96-F108 HydrophobicContact CE-CG 4.05Å; M96-F108 HydrophobicContact CG-CB 3.66Å; M96-F108 HydrophobicContact CG-CD1 4.01Å; M96-F108 HydrophobicContact CG-CD2 4.48Å; M96-F108 HydrophobicContact CG-CG 3.8Å; M96-F108 HydrophobicContact SD-CD1 4.48Å; A98-F108 HydrophobicContact CB-CE2 4.08Å; A98-F108 HydrophobicContact CB-CZ 4.48Å; F103-F108 HydrophobicContact CB-CB 4.19Å; F103-F108 HydrophobicContact CB-CD2 4.14Å; F103-F108 HydrophobicContact CD1-CD2 4.4Å; F103-F108 AromaticContact CD2-CD2 3.64Å; F103-F108 HydrophobicContact CD2-CD2 3.64Å; F103-F108 HydrophobicContact CD2-CE2 4.04Å; F103-F108 HydrophobicContact CE2-CD2 4.09Å; F103-F108 HydrophobicContact CE2-CE2 4.1Å; F103-F108 AromaticContact CG-CD2 3.83Å; F103-F108 HydrophobicContact CG-CD2 3.83Å; H104-F108 PolarHBondContact O-N 3.48Å; H104-F108 VanDerWaalsContact O-N 3.16Å; F108-L117 HydrophobicContact CD1-CB 3.68Å; F108-L117 HydrophobicContact CD1-CD1 4.41Å; F108-L117 HydrophobicContact CE1-CB 3.64Å; F108-L117 HydrophobicContact CE1-CD1 4.02Å; F108-L117 HydrophobicContact CE1-CG 4.5Å; F108-L117 PolarHBondContact O-N 3.27Å; F108-F123 HydrophobicContact CE2-CE2 4.13Å; F108-F123 HydrophobicContact CE2-CZ 4.47Å; F108-F123 HydrophobicContact CZ-CD1 4.24Å; F108-F123 AromaticContact CZ-CD2 3.84Å; F108-F123 HydrophobicContact CZ-CD2 3.84Å; F108-F123 HydrophobicContact CZ-CE1 4.06Å; F108-F123 AromaticContact CZ-CE2 3.62Å; F108-F123 HydrophobicContact CZ-CE2 3.62Å; F108-F123 HydrophobicContact CZ-CG 4.15Å; F108-F123 AromaticContact CZ-CZ 3.74Å; F108-F123 HydrophobicContact CZ-CZ 3.74Å; F108-V131 HydrophobicContact CD2-CG1 4.48Å; F108-V131 HydrophobicContact CD2-CG2 4.22Å; F108-V131 HydrophobicContact CE2-CG1 4.13Å; F108-V131 HydrophobicContact CE2-CG2 3.96Å; F108-V131 HydrophobicContact CZ-CG1 4.24Å
109	T	94.9	Very high	91.4	Very high	23 Å²	23	58.9 Å²	58.9	14%	0.141	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-116.6	151.4	-176.2	51.1	0	0	0	0	111	C106 C107 V111 S114 V115 Q116	C106-T109 WeakPolarHBondContact O-CG2 3.38Å; C107-T109 PolarHBondContact O-N 3.37Å; C107-T109 VanDerWaalsContact O-N 3.09Å; T109-V111 PolarHBondContact O-N 2.84Å; T109-S114 WeakPolarHBondContact CB-O 3.45Å; T109-S114 VanDerWaalsContact CG2-O 3.28Å; T109-S114 WeakPolarHBondContact CG2-O 3.18Å; T109-V115 CarbonylContact C-O 3.55Å; T109-V115 WeakPolarHBondContact CA-O 3.41Å; T109-Q116 HydrophobicContact CG2-CB 4.06Å
110	C	95.1	Very high	91.3	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.307	C	S	.	.			trans	-63.6	132.3	171.7	179.3	0	0	0	0	110.7	V112 S114 V115 V131 C133	C110-V112 PolarHBondContact O-N 3.03Å; C110-V112 PolarHBondContact SG-N 2.91Å; C110-S114 WeakPolarHBondContact O-CA 3.32Å; C110-S114 PolarHBondContact O-N 2.83Å; C110-V115 HydrophobicContact CB-CG1 3.94Å; C110-V115 PolarHBondContact N-O 3.11Å; C110-V131 CarbonylContact C-O 3.58Å; C110-V131 WeakPolarHBondContact CA-O 3.3Å; C110-C133 HydrophobicContact CB-CB 3.98Å; C110-C133 PolarHBondContact SG-N 2.9Å
111	V	93.3	Very high	91.5	Very high	49 Å²	49	50.5 Å²	50.5	30%	0.297	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.3	179.2	69.4	0	0	0	0	113.6	T109 V131 Y132	T109-V111 PolarHBondContact O-N 2.84Å; V111-V131 PolarHBondContact N-O 3.49Å; V111-Y132 HydrophobicContact CG1-CD1 3.87Å; V111-Y132 HydrophobicContact CG1-CD2 4.44Å; V111-Y132 HydrophobicContact CG1-CE1 3.42Å; V111-Y132 VanDerWaalsContact CG1-CE1 3.42Å; V111-Y132 HydrophobicContact CG1-CE2 4.03Å; V111-Y132 HydrophobicContact CG1-CG 4.35Å
112	V	92.5	Very high	91.6	Very high	87 Å²	87	53.3 Å²	53.3	53%	0.527	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-60.7	-178.3	-175	0	0	0	0	111.7	C110 Y132 H136	C110-V112 PolarHBondContact O-N 3.03Å; C110-V112 PolarHBondContact SG-N 2.91Å; V112-Y132 HydrophobicContact CG2-CD1 4Å; V112-Y132 HydrophobicContact CG2-CE1 3.93Å; V112-H136 HydrophobicContact CB-CB 4.34Å; V112-H136 HydrophobicContact CG2-CB 4.13Å
113	C	95.2	Very high	91.6	Very high	61 Å²	61	53.2 Å²	53.2	41%	0.412	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	5.3	-176.3	61.6	0	0	0	0	115.2	V115 H136	C113-V115 PolarHBondContact O-N 2.85Å; C113-V115 WeakPolarHBondContact SG-CG1 3.24Å; C113-H136 PolarHBondContact SG-CE1 2.78Å; C113-H136 PolarHBondContact SG-ND1 3.47Å
114	S	94.2	Very high	91.6	Very high	79 Å²	79	53.2 Å²	53.2	55%	0.552	29%	0.291	S	S	*	.			trans	56.2	8.7	-176.8	-62.2	0	0	0	0	116.3	T109 C110 Q116	T109-S114 WeakPolarHBondContact CB-O 3.45Å; T109-S114 VanDerWaalsContact CG2-O 3.28Å; T109-S114 WeakPolarHBondContact CG2-O 3.18Å; C110-S114 WeakPolarHBondContact O-CA 3.32Å; C110-S114 PolarHBondContact O-N 2.83Å; S114-Q116 PolarHBondContact O-N 3.34Å
115	V	93.2	Very high	91.7	Very high	73 Å²	73	51.7 Å²	51.7	44%	0.442	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-62.8	131	179.2	76.1	0	0	0	0	111.1	T109 C110 C113 L117 C133	T109-V115 CarbonylContact C-O 3.55Å; T109-V115 WeakPolarHBondContact CA-O 3.41Å; C110-V115 HydrophobicContact CB-CG1 3.94Å; C110-V115 PolarHBondContact N-O 3.11Å; C113-V115 PolarHBondContact O-N 2.85Å; C113-V115 WeakPolarHBondContact SG-CG1 3.24Å; V115-L117 HydrophobicContact CG1-CD2 4.42Å; V115-L117 PolarHBondContact O-N 2.88Å; V115-C133 HydrophobicContact CG1-CB 3.87Å
116	Q	93.4	Very high	91.7	Very high	70 Å²	70	50.1 Å²	50.1	33%	0.327	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-76.4	120.6	176.8	-173.5	-176.1	38.6	0	0	110.5	V105 T109 S114	V105-Q116 PolarHBondContact O-NE2 3.38Å; T109-Q116 HydrophobicContact CG2-CB 4.06Å; S114-Q116 PolarHBondContact O-N 3.34Å
117	L	90.6	Very high	91.5	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.042	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-84.8	140.3	-178.7	-62.1	165.6	0	0	0	110.6	M96 F108 V115 D121 F123 V131 C133	M96-L117 WeakPolarHBondContact CE-O 3.5Å; F108-L117 HydrophobicContact CD1-CB 3.68Å; F108-L117 HydrophobicContact CD1-CD1 4.41Å; F108-L117 HydrophobicContact CE1-CB 3.64Å; F108-L117 HydrophobicContact CE1-CD1 4.02Å; F108-L117 HydrophobicContact CE1-CG 4.5Å; F108-L117 PolarHBondContact O-N 3.27Å; V115-L117 HydrophobicContact CG1-CD2 4.42Å; V115-L117 PolarHBondContact O-N 2.88Å; L117-D121 HydrophobicContact CD2-CB 4.35Å; L117-F123 HydrophobicContact CD1-CB 3.66Å; L117-F123 HydrophobicContact CD1-CG 4.35Å; L117-V131 HydrophobicContact CD1-CG1 3.41Å; L117-V131 VanDerWaalsContact CD1-CG1 3.41Å; L117-C133 HydrophobicContact CD2-CB 3.71Å
118	R	86.7	Confident	91.2	Very high	166 Å²	166	54.8 Å²	54.8	63%	0.626	30%	0.299	S	S	*	.			trans	-118.3	160.5	-174.2	-62.2	-176.4	179.7	-128.3	-6	110.8	G120 D121 C203	R118-G120 PolarHBondContact O-N 3.34Å; R118-G120 VanDerWaalsContact O-N 3.13Å; R118-D121 PolarHBondContact N-OD2 3.42Å; R118-D121 WeakPolarHBondContact O-CB 3.35Å; R118-D121 PolarHBondContact O-N 3.21Å; R118-C203 VanDerWaalsContact O-CB 3.32Å; R118-C203 WeakPolarHBondContact O-CB 3.48Å; R118-C203 PolarHBondContact O-SG 3.5Å
119	K	84.4	Confident	91.1	Very high	108 Å²	108	54.8 Å²	54.8	47%	0.47	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	119.2	173.5	-176.8	-156.4	168.2	-161	0	109.3	C203 F205	K119-C203 WeakPolarHBondContact CA-O 3.46Å; K119-F205 HydrophobicContact CD-CD1 4.11Å; K119-F205 HydrophobicContact CD-CE1 4.43Å; K119-F205 HydrophobicContact CD-CG 4.21Å
120	G	84.2	Confident	91	Very high	31 Å²	31	56.7 Å²	56.7	32%	0.32	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	118.4	-23.4	-172.6	0	0	0	0	0	114	R118 Y202 C203	R118-G120 PolarHBondContact O-N 3.34Å; R118-G120 VanDerWaalsContact O-N 3.13Å; G120-Y202 WeakPolarHBondContact O-CE2 3.34Å; G120-C203 PolarHBondContact N-O 2.76Å
121	D	89.3	Confident	90.9	Very high	67 Å²	67	56.9 Å²	56.9	36%	0.358	31%	0.31	S	S	.	.			trans	-79.9	149	-178	-61.5	-24.2	0	0	0	112.2	L117 R118 C203	L117-D121 HydrophobicContact CD2-CB 4.35Å; R118-D121 PolarHBondContact N-OD2 3.42Å; R118-D121 WeakPolarHBondContact O-CB 3.35Å; R118-D121 PolarHBondContact O-N 3.21Å; D121-C203 WeakPolarHBondContact O-CB 3.46Å; D121-C203 PolarHBondContact O-N 2.84Å
122	Y	90.8	Very high	90.9	Very high	97 Å²	97	55.9 Å²	55.9	38%	0.38	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	145	162.6	-71.2	-86.2	0	0	0	110.2	N134 L201 Y202	Y122-N134 WeakPolarHBondContact O-CB 3.25Å; Y122-N134 PolarHBondContact O-N 3.38Å; Y122-N134 VanDerWaalsContact O-N 3.11Å; Y122-L201 WeakPolarHBondContact CA-O 3.22Å; Y122-Y202 HydrophobicContact CD1-CD2 4.05Å; Y122-Y202 HydrophobicContact CD2-CD2 4.23Å; Y122-Y202 AromaticContact CE1-CD2 3.71Å; Y122-Y202 HydrophobicContact CE1-CD2 3.71Å; Y122-Y202 HydrophobicContact CE1-CG 4.31Å; Y122-Y202 AromaticContact CE2-CD2 3.9Å; Y122-Y202 HydrophobicContact CE2-CD2 3.9Å; Y122-Y202 HydrophobicContact CE2-CE2 4.22Å; Y122-Y202 HydrophobicContact CG-CD2 4.31Å; Y122-Y202 AromaticContact CZ-CD2 3.63Å
123	F	92.1	Very high	90.9	Very high	5 Å²	5	52.3 Å²	52.3	2%	0.022	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155.3	-178.7	70.9	-81.2	0	0	0	111.4	A98 F108 L117 L125 V131 Y132 K200 L201 C203	A98-F123 HydrophobicContact CB-CE2 3.81Å; A98-F123 HydrophobicContact CB-CZ 3.67Å; F108-F123 HydrophobicContact CE2-CE2 4.13Å; F108-F123 HydrophobicContact CE2-CZ 4.47Å; F108-F123 HydrophobicContact CZ-CD1 4.24Å; F108-F123 AromaticContact CZ-CD2 3.84Å; F108-F123 HydrophobicContact CZ-CD2 3.84Å; F108-F123 HydrophobicContact CZ-CE1 4.06Å; F108-F123 AromaticContact CZ-CE2 3.62Å; F108-F123 HydrophobicContact CZ-CE2 3.62Å; F108-F123 HydrophobicContact CZ-CG 4.15Å; F108-F123 AromaticContact CZ-CZ 3.74Å; F108-F123 HydrophobicContact CZ-CZ 3.74Å; L117-F123 HydrophobicContact CD1-CB 3.66Å; L117-F123 HydrophobicContact CD1-CG 4.35Å; F123-L125 HydrophobicContact CD2-CB 4.39Å; F123-L125 HydrophobicContact CE2-CB 4.01Å; F123-V131 HydrophobicContact CD2-CG1 4.18Å; F123-Y132 CarbonylContact C-O 3.56Å; F123-Y132 WeakPolarHBondContact CA-O 3.48Å; F123-Y132 VanDerWaalsContact CB-O 3.25Å; F123-Y132 WeakPolarHBondContact CB-O 3.41Å; F123-K200 WeakPolarHBondContact O-CA 3.47Å; F123-L201 HydrophobicContact CD1-CB 4.16Å; F123-L201 WeakPolarHBondContact CD1-O 3.39Å; F123-L201 HydrophobicContact CD2-CB 4.48Å; F123-L201 HydrophobicContact CE1-CB 3.59Å; F123-L201 HydrophobicContact CE2-CB 3.97Å; F123-L201 HydrophobicContact CE2-CD1 3.9Å; F123-L201 HydrophobicContact CZ-CB 3.48Å; F123-L201 VanDerWaalsContact CZ-CB 3.48Å; F123-L201 HydrophobicContact CZ-CD1 3.78Å; F123-L201 HydrophobicContact CZ-CG 4.29Å; F123-L201 PolarHBondContact N-O 3.3Å; F123-L201 PolarHBondContact O-N 3.37Å; F123-C203 HydrophobicContact CD1-CB 4.1Å; F123-C203 HydrophobicContact CE1-CB 4.08Å
124	G	91.8	Very high	90.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	138.6	167.5	0	0	0	0	0	110.3	V131 Y132 C137 T199	G124-V131 CarbonylContact O-C 3.47Å; G124-V131 WeakPolarHBondContact O-CA 3.41Å; G124-Y132 PolarHBondContact N-O 2.85Å; G124-Y132 PolarHBondContact O-N 2.78Å; G124-C137 VanDerWaalsContact CA-SG 3.55Å; G124-T199 CarbonylContact C-O 3.54Å; G124-T199 WeakPolarHBondContact CA-O 3.43Å
125	L	93	Very high	90.6	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.016	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.1	170.6	-178.5	70.5	0	0	0	108.5	A98 K99 F103 F123 L130 V131 T199 L201	A98-L125 HydrophobicContact CB-CD2 3.94Å; K99-L125 HydrophobicContact CB-CD2 4.31Å; K99-L125 HydrophobicContact CD-CD2 4.29Å; K99-L125 HydrophobicContact CG-CD2 4.24Å; F103-L125 HydrophobicContact CZ-CD1 4.26Å; F123-L125 HydrophobicContact CD2-CB 4.39Å; F123-L125 HydrophobicContact CE2-CB 4.01Å; L125-L130 WeakPolarHBondContact CA-O 3.32Å; L125-V131 HydrophobicContact CD1-CG2 3.89Å; L125-T199 PolarHBondContact N-O 2.81Å; L125-T199 PolarHBondContact O-N 3.41Å; L125-L201 HydrophobicContact CB-CD1 3.85Å; L125-L201 HydrophobicContact CD2-CD1 3.81Å
126	T	91.3	Very high	90.5	Very high	13 Å²	13	50.8 Å²	50.8	8%	0.08	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	160	171.7	60	0	0	0	0	111.1	S128 G129 L130 Y132 G197 L198	T126-S128 PolarHBondContact O-N 3.22Å; T126-S128 PolarHBondContact OG1-OG 3.49Å; T126-G129 WeakPolarHBondContact O-CA 3.4Å; T126-G129 PolarHBondContact O-N 3.02Å; T126-G129 PolarHBondContact OG1-N 3.24Å; T126-L130 HydrophobicContact CG2-CB 4.46Å; T126-L130 PolarHBondContact N-O 2.81Å; T126-L130 WeakPolarHBondContact OG1-CB 3.45Å; T126-L130 PolarHBondContact OG1-N 3.37Å; T126-Y132 HydrophobicContact CG2-CD2 4.46Å; T126-Y132 HydrophobicContact CG2-CE2 3.8Å; T126-G197 WeakPolarHBondContact CA-O 3.48Å; T126-L198 HydrophobicContact CG2-CD1 3.67Å
127	D	87.4	Confident	90.4	Very high	124 Å²	124	47.5 Å²	47.5	66%	0.663	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-27.9	172.4	-60.1	-39.4	0	0	0	112.3	G129 G197	D127-G129 PolarHBondContact O-N 3.35Å; D127-G197 PolarHBondContact N-O 2.81Å; D127-G197 VanDerWaalsContact N-O 3.11Å; D127-G197 WeakPolarHBondContact OD2-CA 3.47Å
128	S	89	Confident	90.1	Very high	84 Å²	84	50.4 Å²	50.4	59%	0.587	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-4.3	170.5	58.3	0	0	0	0	115.1	T126	T126-S128 PolarHBondContact O-N 3.22Å; T126-S128 PolarHBondContact OG1-OG 3.49Å
129	G	90.4	Very high	90.1	Very high	3 Å²	3	47.3 Å²	47.3	3%	0.031	25%	0.253	C	S	.	.			trans	84.3	15.2	177.1	0	0	0	0	0	115.5	T126 D127	T126-G129 WeakPolarHBondContact O-CA 3.4Å; T126-G129 PolarHBondContact O-N 3.02Å; T126-G129 PolarHBondContact OG1-N 3.24Å; D127-G129 PolarHBondContact O-N 3.35Å
130	L	92.7	Very high	89.6	Confident	62 Å²	62	45 Å²	45	33%	0.325	24%	0.241	S	C	.	.			trans	-80.1	140	173.6	-59.1	177.3	0	0	0	110.5	L125 T126 Y132	L125-L130 WeakPolarHBondContact CA-O 3.32Å; T126-L130 HydrophobicContact CG2-CB 4.46Å; T126-L130 PolarHBondContact N-O 2.81Å; T126-L130 WeakPolarHBondContact OG1-CB 3.45Å; T126-L130 PolarHBondContact OG1-N 3.37Å; L130-Y132 HydrophobicContact CB-CE2 3.84Å
131	V	92.8	Very high	88.9	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.03	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.6	-173.7	177.9	0	0	0	0	109.9	F103 F108 C110 V111 L117 F123 G124 L125	F103-V131 HydrophobicContact CE1-CG2 3.88Å; F103-V131 HydrophobicContact CE2-CG2 4.33Å; F103-V131 HydrophobicContact CZ-CG2 3.67Å; F108-V131 HydrophobicContact CD2-CG1 4.48Å; F108-V131 HydrophobicContact CD2-CG2 4.22Å; F108-V131 HydrophobicContact CE2-CG1 4.13Å; F108-V131 HydrophobicContact CE2-CG2 3.96Å; F108-V131 HydrophobicContact CZ-CG1 4.24Å; C110-V131 CarbonylContact C-O 3.58Å; C110-V131 WeakPolarHBondContact CA-O 3.3Å; V111-V131 PolarHBondContact N-O 3.49Å; L117-V131 HydrophobicContact CD1-CG1 3.41Å; L117-V131 VanDerWaalsContact CD1-CG1 3.41Å; F123-V131 HydrophobicContact CD2-CG1 4.18Å; G124-V131 CarbonylContact O-C 3.47Å; G124-V131 WeakPolarHBondContact O-CA 3.41Å; L125-V131 HydrophobicContact CD1-CG2 3.89Å
132	Y	93.2	Very high	87.7	Confident	28 Å²	28	46.5 Å²	46.5	11%	0.11	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.2	179.3	-64.6	-98.9	0	0	0	109.7	V111 V112 F123 G124 T126 L130 H136 L198	V111-Y132 HydrophobicContact CG1-CD1 3.87Å; V111-Y132 HydrophobicContact CG1-CD2 4.44Å; V111-Y132 HydrophobicContact CG1-CE1 3.42Å; V111-Y132 VanDerWaalsContact CG1-CE1 3.42Å; V111-Y132 HydrophobicContact CG1-CE2 4.03Å; V111-Y132 HydrophobicContact CG1-CG 4.35Å; V112-Y132 HydrophobicContact CG2-CD1 4Å; V112-Y132 HydrophobicContact CG2-CE1 3.93Å; F123-Y132 CarbonylContact C-O 3.56Å; F123-Y132 WeakPolarHBondContact CA-O 3.48Å; F123-Y132 VanDerWaalsContact CB-O 3.25Å; F123-Y132 WeakPolarHBondContact CB-O 3.41Å; G124-Y132 PolarHBondContact N-O 2.85Å; G124-Y132 PolarHBondContact O-N 2.78Å; T126-Y132 HydrophobicContact CG2-CD2 4.46Å; T126-Y132 HydrophobicContact CG2-CE2 3.8Å; L130-Y132 HydrophobicContact CB-CE2 3.84Å; Y132-H136 HydrophobicContact CD1-CB 4.19Å; Y132-L198 HydrophobicContact CD2-CD1 4.07Å; Y132-L198 HydrophobicContact CE2-CD1 4.48Å
133	C	93.7	Very high	86.4	Confident	12 Å²	12	46 Å²	46	8%	0.081	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	164	171.2	70	0	0	0	0	110.8	C110 V115 L117 V135 H136 C137	C110-C133 HydrophobicContact CB-CB 3.98Å; C110-C133 PolarHBondContact SG-N 2.9Å; V115-C133 HydrophobicContact CG1-CB 3.87Å; L117-C133 HydrophobicContact CD2-CB 3.71Å; C133-V135 PolarHBondContact O-N 3.41Å; C133-V135 VanDerWaalsContact O-N 3.07Å; C133-H136 PolarHBondContact O-N 3.35Å; C133-H136 PolarHBondContact SG-ND1 2.85Å; C133-C137 WeakPolarHBondContact O-CB 3.33Å; C133-C137 PolarHBondContact O-N 3.03Å
134	N	91.1	Very high	84.7	Confident	61 Å²	61	50.2 Å²	50.2	33%	0.326	27%	0.271	S	S	.	.	H	α-helix	trans	-48.1	-39.2	178.9	-168.9	36	0	0	0	113.7	Y122 N138 K200	Y122-N134 WeakPolarHBondContact O-CB 3.25Å; Y122-N134 PolarHBondContact O-N 3.38Å; Y122-N134 VanDerWaalsContact O-N 3.11Å; N134-N138 PolarHBondContact O-N 2.96Å; N134-N138 VanDerWaalsContact O-N 3.09Å; N134-N138 PolarHBondContact O-ND2 2.91Å; N134-N138 PolarHBondContact O-OD1 2.89Å; N134-K200 WeakPolarHBondContact OD1-CE 3.43Å; N134-K200 PolarHBondContact OD1-NZ 3.48Å
135	V	91.4	Very high	82.7	Confident	83 Å²	83	55.2 Å²	55.2	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-66.5	-59.4	180	-179.4	0	0	0	0	111.1	C133 C137 N138 Q139	C133-V135 PolarHBondContact O-N 3.41Å; C133-V135 VanDerWaalsContact O-N 3.07Å; V135-C137 VanDerWaalsContact C-N 3.27Å; V135-C137 PolarHBondContact O-N 3.35Å; V135-N138 PolarHBondContact O-N 3.3Å; V135-Q139 WeakPolarHBondContact O-CG 3.33Å; V135-Q139 PolarHBondContact O-N 3.32Å
136	H	92.3	Very high	80.2	Confident	37 Å²	37	60.2 Å²	60.2	17%	0.171	32%	0.32	C	S	.	.	H	α-helix	trans	-66.3	-29.3	179.6	-63.2	112.6	0	0	0	112.7	V112 C113 Y132 C133 N138 Q139 W140	V112-H136 HydrophobicContact CB-CB 4.34Å; V112-H136 HydrophobicContact CG2-CB 4.13Å; C113-H136 PolarHBondContact SG-CE1 2.78Å; C113-H136 PolarHBondContact SG-ND1 3.47Å; Y132-H136 HydrophobicContact CD1-CB 4.19Å; C133-H136 PolarHBondContact O-N 3.35Å; C133-H136 PolarHBondContact SG-ND1 2.85Å; H136-N138 VanDerWaalsContact C-N 3.33Å; H136-Q139 PolarHBondContact CD2-OE1 3.35Å; H136-Q139 PolarHBondContact O-N 3.06Å; H136-W140 WeakPolarHBondContact O-CB 3.34Å; H136-W140 PolarHBondContact O-N 3.46Å
137	C	89.4	Confident	78.1	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.2	-40.8	170.8	177.6	0	0	0	0	111.5	G124 C133 V135 L141	G124-C137 VanDerWaalsContact CA-SG 3.55Å; C133-C137 WeakPolarHBondContact O-CB 3.33Å; C133-C137 PolarHBondContact O-N 3.03Å; V135-C137 VanDerWaalsContact C-N 3.27Å; V135-C137 PolarHBondContact O-N 3.35Å; C137-L141 WeakPolarHBondContact O-CG 3.16Å
138	N	86.2	Confident	76.2	Confident	70 Å²	70	63.5 Å²	63.5	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-74.6	-42.6	177.1	-67.7	-12.7	0	0	0	111.6	N134 V135 H136 W140 L141 V142 K200	N134-N138 PolarHBondContact O-N 2.96Å; N134-N138 VanDerWaalsContact O-N 3.09Å; N134-N138 PolarHBondContact O-ND2 2.91Å; N134-N138 PolarHBondContact O-OD1 2.89Å; V135-N138 PolarHBondContact O-N 3.3Å; H136-N138 VanDerWaalsContact C-N 3.33Å; N138-W140 PolarHBondContact O-N 3.03Å; N138-L141 WeakPolarHBondContact O-CB 3.49Å; N138-L141 PolarHBondContact O-N 3.26Å; N138-V142 PolarHBondContact O-N 2.9Å; N138-K200 PolarHBondContact OD1-NZ 2.92Å
139	Q	85.2	Confident	73.9	Confident	101 Å²	101	63.2 Å²	63.2	47%	0.472	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-42.4	178.5	-71.2	170.8	-15.6	0	0	112.1	V135 H136 L141 V142 T143	V135-Q139 WeakPolarHBondContact O-CG 3.33Å; V135-Q139 PolarHBondContact O-N 3.32Å; H136-Q139 PolarHBondContact CD2-OE1 3.35Å; H136-Q139 PolarHBondContact O-N 3.06Å; Q139-L141 PolarHBondContact O-N 2.92Å; Q139-V142 WeakPolarHBondContact O-CB 3.14Å; Q139-V142 PolarHBondContact O-N 3.39Å; Q139-T143 PolarHBondContact O-N 3.36Å; Q139-T143 PolarHBondContact O-OG1 2.94Å
140	W	74.8	Confident	71	Confident	58 Å²	58	66.2 Å²	66.2	22%	0.22	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-33	177.9	-171.7	90.5	0	0	0	112.6	H136 N138 K144 G196 L198	H136-W140 WeakPolarHBondContact O-CB 3.34Å; H136-W140 PolarHBondContact O-N 3.46Å; N138-W140 PolarHBondContact O-N 3.03Å; W140-K144 HydrophobicContact CD2-CG 4.06Å; W140-K144 HydrophobicContact CE3-CB 4.45Å; W140-K144 HydrophobicContact CE3-CG 4.17Å; W140-K144 HydrophobicContact CH2-CG 3.95Å; W140-K144 HydrophobicContact CZ2-CD 4.38Å; W140-K144 HydrophobicContact CZ2-CG 3.8Å; W140-K144 HydrophobicContact CZ3-CB 4.42Å; W140-K144 HydrophobicContact CZ3-CG 4.12Å; W140-K144 WeakPolarHBondContact O-CB 3.24Å; W140-K144 PolarHBondContact O-N 2.93Å; W140-G196 WeakPolarHBondContact CH2-O 3.15Å; W140-L198 HydrophobicContact CD2-CD2 4.3Å; W140-L198 HydrophobicContact CE3-CB 4.12Å; W140-L198 HydrophobicContact CE3-CD2 3.57Å; W140-L198 HydrophobicContact CE3-CG 4.4Å; W140-L198 HydrophobicContact CH2-CB 4.22Å; W140-L198 HydrophobicContact CZ3-CB 3.62Å; W140-L198 HydrophobicContact CZ3-CD2 4Å; W140-L198 HydrophobicContact CZ3-CG 4.38Å
141	L	68.7	Low	67.8	Low	38 Å²	38	74.5 Å²	74.5	20%	0.199	40%	0.398	C	S	.	.	H	α-helix	trans	-66	-41.5	173.1	-65.3	167.3	0	0	0	112.2	C137 N138 Q139 H145 L194 L198	C137-L141 WeakPolarHBondContact O-CG 3.16Å; N138-L141 WeakPolarHBondContact O-CB 3.49Å; N138-L141 PolarHBondContact O-N 3.26Å; Q139-L141 PolarHBondContact O-N 2.92Å; L141-H145 WeakPolarHBondContact O-CB 3.06Å; L141-H145 PolarHBondContact O-N 3.04Å; L141-L194 HydrophobicContact CD1-CD1 3.74Å; L141-L194 HydrophobicContact CD1-CD2 3.81Å; L141-L194 HydrophobicContact CD1-CG 4.28Å; L141-L194 HydrophobicContact CD2-CB 3.58Å; L141-L194 HydrophobicContact CD2-CD1 3.9Å; L141-L194 HydrophobicContact CD2-CD2 4.03Å; L141-L194 HydrophobicContact CD2-CG 4.03Å; L141-L194 HydrophobicContact CG-CD1 4.28Å; L141-L198 HydrophobicContact CD2-CD2 4.37Å
142	V	65.2	Low	64.9	Low	92 Å²	92	82.1 Å²	82.1	56%	0.558	43%	0.433	S	S	*	.	H	α-helix	trans	-60.6	-53.9	175.5	-179.5	0	0	0	0	109.1	N138 Q139 K144 H145 L146	N138-V142 PolarHBondContact O-N 2.9Å; Q139-V142 WeakPolarHBondContact O-CB 3.14Å; Q139-V142 PolarHBondContact O-N 3.39Å; V142-K144 PolarHBondContact O-N 2.84Å; V142-H145 PolarHBondContact O-N 3.04Å; V142-L146 HydrophobicContact CG1-CD1 3.91Å; V142-L146 WeakPolarHBondContact O-CD1 3.13Å; V142-L146 PolarHBondContact O-N 3.42Å
143	T	62.6	Low	61.8	Low	88 Å²	88	88.8 Å²	88.8	54%	0.54	47%	0.465	S	S	.	.	H	α-helix	trans	-59.6	-42.3	-178.4	-40.8	0	0	0	0	112.6	Q139 L146 D147	Q139-T143 PolarHBondContact O-N 3.36Å; Q139-T143 PolarHBondContact O-OG1 2.94Å; T143-L146 PolarHBondContact O-N 2.87Å; T143-D147 PolarHBondContact O-N 3.29Å
144	K	55.9	Low	59	Low	92 Å²	92	95.6 Å²	95.6	40%	0.4	50%	0.499	S	S	.	.	H	α-helix	trans	-73.6	-24.1	179.4	-83.3	-75.8	161.1	-146.5	0	114.4	W140 V142 D147	W140-K144 HydrophobicContact CD2-CG 4.06Å; W140-K144 HydrophobicContact CE3-CB 4.45Å; W140-K144 HydrophobicContact CE3-CG 4.17Å; W140-K144 HydrophobicContact CH2-CG 3.95Å; W140-K144 HydrophobicContact CZ2-CD 4.38Å; W140-K144 HydrophobicContact CZ2-CG 3.8Å; W140-K144 HydrophobicContact CZ3-CB 4.42Å; W140-K144 HydrophobicContact CZ3-CG 4.12Å; W140-K144 WeakPolarHBondContact O-CB 3.24Å; W140-K144 PolarHBondContact O-N 2.93Å; V142-K144 PolarHBondContact O-N 2.84Å; K144-D147 IonicContact NZ-OD2 3.94Å; K144-D147 PolarHBondContact NZ-OD2 3.46Å
145	H	50.7	Low	56.2	Low	105 Å²	105	96.7 Å²	96.7	49%	0.486	52%	0.517	S	S	.	.	H	α-helix	trans	-72.6	-37.3	172.3	-133	-74.3	0	0	0	111.4	L141 V142 D147 S148 T149	L141-H145 WeakPolarHBondContact O-CB 3.06Å; L141-H145 PolarHBondContact O-N 3.04Å; V142-H145 PolarHBondContact O-N 3.04Å; H145-D147 PolarHBondContact O-N 3.48Å; H145-S148 PolarHBondContact O-N 3.25Å; H145-T149 PolarHBondContact ND1-OG1 3.25Å; H145-T149 VanDerWaalsContact ND1-OG1 3.14Å; H145-T149 PolarHBondContact O-N 3.11Å; H145-T149 PolarHBondContact O-OG1 3.47Å
146	L	41.2	Very low	53.4	Low	108 Å²	108	99.7 Å²	99.7	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-59.7	-32	174	-87.5	86.8	0	0	0	112.9	V142 T143 S148	V142-L146 HydrophobicContact CG1-CD1 3.91Å; V142-L146 WeakPolarHBondContact O-CD1 3.13Å; V142-L146 PolarHBondContact O-N 3.42Å; T143-L146 PolarHBondContact O-N 2.87Å; L146-S148 VanDerWaalsContact C-N 3.3Å; L146-S148 PolarHBondContact O-N 3.39Å
147	D	46.2	Very low	50.9	Low	105 Å²	105	103.9 Å²	103.9	56%	0.561	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-21.2	175.5	-68.6	-18.2	0	0	0	113.6	T143 K144 H145	T143-D147 PolarHBondContact O-N 3.29Å; K144-D147 IonicContact NZ-OD2 3.94Å; K144-D147 PolarHBondContact NZ-OD2 3.46Å; H145-D147 PolarHBondContact O-N 3.48Å
148	S	48.1	Very low	48.3	Very low	101 Å²	101	110.3 Å²	110.3	71%	0.706	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	-18.1	-173	-59.5	0	0	0	0	114.4	H145 L146	H145-S148 PolarHBondContact O-N 3.25Å; L146-S148 VanDerWaalsContact C-N 3.3Å; L146-S148 PolarHBondContact O-N 3.39Å
149	T	40.2	Very low	45.6	Very low	79 Å²	79	113.3 Å²	113.3	49%	0.485	62%	0.618	S	S	.	*	S	Bend	trans	-130.3	102.3	173	50.1	0	0	0	0	107.9	H145 W151	H145-T149 PolarHBondContact ND1-OG1 3.25Å; H145-T149 VanDerWaalsContact ND1-OG1 3.14Å; H145-T149 PolarHBondContact O-N 3.11Å; H145-T149 PolarHBondContact O-OG1 3.47Å; T149-W151 PolarHBondContact O-N 3.04Å
150	G	28.8	Very low	43.2	Very low	66 Å²	66	112.7 Å²	112.7	68%	0.68	63%	0.63	S	S	*	*			trans	-58.6	132	-179.4	0	0	0	0	0	111.8	H152	G150-H152 PolarHBondContact O-N 2.89Å
151	W	25.9	Very low	41.2	Very low	235 Å²	235	116.6 Å²	116.6	89%	0.89	66%	0.655	S	S	*	*	S	Bend	trans	20.4	80.1	162.2	-66.2	95.6	0	0	0	117.6	T149	T149-W151 PolarHBondContact O-N 3.04Å
152	H	31.3	Very low	39.8	Very low	166 Å²	166	122.1 Å²	122.1	77%	0.769	69%	0.685	S	S	*	*			trans	-152.8	110.2	147.1	-106.2	-86.7	0	0	0	110.9	G150	G150-H152 PolarHBondContact O-N 2.89Å
153	E	29.7	Very low	38.3	Very low	168 Å²	168	129.4 Å²	129.4	79%	0.785	70%	0.703	S	S	*	*				65.2	66.5	128.7	-156.4	171.1	-175.3	0	0	119.9
154	I	34.9	Very low	37	Very low	155 Å²	155	129.3 Å²	129.3	80%	0.795	71%	0.711	S	S	*	*			trans	-140.8	92.4	146.4	-51.8	-179.9	0	0	0	109.9	V157	I154-V157 HydrophobicContact CG2-CG2 4.21Å
155	A	31.2	Very low	36.1	Very low	84 Å²	84	130.5 Å²	130.5	69%	0.694	73%	0.731	S	S	*	*			trans	-95.4	-10.3	174.9	0	0	0	0	0	113.9
156	D	33.5	Very low	35.3	Very low	145 Å²	145	132.7 Å²	132.7	78%	0.775	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	48.3	-157.1	-61.3	-50.2	0	0	0	116
157	V	38.6	Very low	35	Very low	126 Å²	126	133.6 Å²	133.6	76%	0.764	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.9	19	169.3	-143.5	0	0	0	0	114.8	I154	I154-V157 HydrophobicContact CG2-CG2 4.21Å
158	V	34.6	Very low	34.3	Very low	134 Å²	134	135.6 Å²	135.6	81%	0.812	77%	0.767	S	S	*	*	S	Bend	trans	-121.5	17.7	-177.5	-160	0	0	0	0	113.6
159	T	30.1	Very low	34	Very low	134 Å²	134	140.2 Å²	140.2	82%	0.822	78%	0.777	S	S	*	*			trans	-148.8	92.9	172.1	42.8	0	0	0	0	111.9
160	A	34.8	Very low	33.8	Very low	88 Å²	88	145.4 Å²	145.4	73%	0.727	79%	0.793	S	S	*	*			trans	-158.9	97.7	161.9	0	0	0	0	0	111.4
161	D	33.4	Very low	34.5	Very low	139 Å²	139	151.8 Å²	151.8	74%	0.743	81%	0.805	S	S	*	*			trans	52.9	107.6	132.7	-43.5	-31.4	0	0	0	120.2
162	N	39.7	Very low	34.9	Very low	155 Å²	155	149.7 Å²	149.7	83%	0.829	80%	0.802	S	S	*	*				175.7	93.9	89.9	-92	-65.1	0	0	0	111.4
163	R	33.8	Very low	35.5	Very low	245 Å²	245	151.4 Å²	151.4	93%	0.925	81%	0.811	S	S	*	*			trans	-81.4	142.4	150.6	-108.3	178.2	170.8	171.8	-3.8	107.6
164	A	34.7	Very low	35.8	Very low	86 Å²	86	149.2 Å²	149.2	71%	0.711	81%	0.814	S	S	*	*			trans	76.4	128.4	155.2	0	0	0	0	0	120.3
165	S	36.7	Very low	36.1	Very low	117 Å²	117	145.3 Å²	145.3	82%	0.818	81%	0.812	S	S	*	*			trans	84.3	122.9	136.5	-59.7	0	0	0	0	121.6
166	I	34.8	Very low	36.5	Very low	150 Å²	150	153.5 Å²	153.5	77%	0.769	83%	0.825	S	S	*	*			trans	-79.5	144	174.3	-62.6	152.6	0	0	0	109.7
167	P	34	Very low	37.2	Very low	127 Å²	127	152.6 Å²	152.6	83%	0.825	83%	0.826	S	S	*	*			trans	-115.3	140.4	135.1	-8.9	28.3	0	0	0	113.4
168	L	31.4	Very low	37.6	Very low	148 Å²	148	156.7 Å²	156.7	78%	0.775	83%	0.834	S	S	*	*			trans	-89.2	128	177.3	-145.9	82.7	0	0	0	109.3
169	Q	41.2	Very low	37.5	Very low	198 Å²	198	154.1 Å²	154.1	93%	0.925	84%	0.835	S	S	*	*			trans	-155.3	138.6	143.8	-116.2	166.5	11.7	0	0	112.8
170	K	35.9	Very low	38.4	Very low	188 Å²	188	159.2 Å²	159.2	82%	0.817	84%	0.839	S	S	*	*			trans	-85	143.7	-179	-62.5	162.6	176.7	167.2	0	108.7
171	Q	43.3	Very low	39	Very low	200 Å²	200	160.7 Å²	160.7	94%	0.935	84%	0.841	S	S	*	*				-157.7	145.3	111	-109.5	173	11.3	0	0	114.8
172	K	35.3	Very low	39.7	Very low	191 Å²	191	165.6 Å²	165.6	83%	0.83	85%	0.849	S	S	*	*			trans	-76.6	134.9	-170.9	-179.2	-173.4	-173.4	-174.2	0	110.6
173	Q	43.4	Very low	40	Very low	202 Å²	202	169.6 Å²	169.6	94%	0.944	85%	0.853	S	S	*	*			trans	-162.8	154.9	134.8	-109	159.5	96.5	0	0	112.9
174	S	36.1	Very low	40.2	Very low	122 Å²	122	167.8 Å²	167.8	85%	0.853	85%	0.852	S	S	*	*			trans	-106	131.7	-159.8	48.1	0	0	0	0	113.1
175	G	41	Very low	40.3	Very low	73 Å²	73	175.1 Å²	175.1	75%	0.753	86%	0.861	S	S	*	*			trans	-166.6	116.3	167.6	0	0	0	0	0	111.8	P177	G175-P177 WeakPolarHBondContact O-CD 3.17Å
176	R	40.5	Very low	40.2	Very low	256 Å²	256	174.4 Å²	174.4	97%	0.966	86%	0.856	S	S	*	*			trans	-83.7	128.7	166.6	-97.2	-175.2	169.7	-164.2	-0.6	109
177	P	48.6	Very low	40.4	Very low	125 Å²	125	175 Å²	175	81%	0.812	86%	0.86	S	S	*	*			trans	-114.5	150.9	141.1	-5.4	25.5	0	0	0	113.3	G175	G175-P177 WeakPolarHBondContact O-CD 3.17Å
178	K	46.2	Very low	40.9	Very low	212 Å²	212	173.6 Å²	173.6	92%	0.922	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-62	151.4	-172.6	-64.5	162.7	178.9	174	0	113.1
179	G	32.2	Very low	41.6	Very low	81 Å²	81	172.6 Å²	172.6	84%	0.835	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-58.2	140.4	-170.3	0	0	0	0	0	116.6
180	R	48.5	Very low	42.5	Very low	240 Å²	240	167.1 Å²	167.1	91%	0.906	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-86.3	139.7	164.3	-161.7	175.6	-164	-172	6.1	109.3	R182	R180-R182 PolarHBondContact O-N 3.28Å
181	P	48.8	Very low	44.1	Very low	119 Å²	119	162 Å²	162	77%	0.773	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-56.9	125.4	179.7	-26.3	34.7	0	0	0	112	R183	P181-R183 PolarHBondContact O-N 2.9Å
182	R	47	Very low	45.5	Very low	242 Å²	242	157.6 Å²	157.6	91%	0.913	77%	0.767	S	S	*	*			trans	-68	95.6	174.7	-173.4	178	-172.2	173.1	3.6	108.3	R180 K184	R180-R182 PolarHBondContact O-N 3.28Å; R182-K184 PolarHBondContact O-N 3.14Å
183	R	46.2	Very low	47.5	Very low	240 Å²	240	156.4 Å²	156.4	91%	0.906	76%	0.762	S	S	*	*			trans	-43.5	120.5	168.3	-97.8	-174.8	169.2	-175.4	-3.7	107.7	P181 R185	P181-R183 PolarHBondContact O-N 2.9Å; R183-R185 VanDerWaalsContact C-N 3.29Å; R183-R185 PolarHBondContact O-N 2.97Å
184	K	37.9	Very low	49	Very low	206 Å²	206	148.9 Å²	148.9	90%	0.896	73%	0.727	S	S	*	*			trans	-63.5	92.9	-179.6	-165.8	176.6	-174.1	-179.5	0	106.6	R182 S186	R182-K184 PolarHBondContact O-N 3.14Å; K184-S186 PolarHBondContact O-N 2.56Å
185	R	36.8	Very low	50.6	Low	240 Å²	240	147 Å²	147	91%	0.906	71%	0.713	S	S	*	*			trans	-54	120.5	179.3	-154.6	173.3	-165.3	167.8	4.5	105.5	R183	R183-R185 VanDerWaalsContact C-N 3.29Å; R183-R185 PolarHBondContact O-N 2.97Å
186	S	35.9	Very low	51.9	Low	102 Å²	102	146.4 Å²	146.4	71%	0.713	71%	0.706	S	S	*	*			trans	-49.6	150	-174.2	33.3	0	0	0	0	110.1	K184 I188	K184-S186 PolarHBondContact O-N 2.56Å; S186-I188 PolarHBondContact O-N 3.13Å; S186-I188 VanDerWaalsContact O-N 3.09Å
187	L	37.8	Very low	53.8	Low	164 Å²	164	135.5 Å²	135.5	86%	0.859	67%	0.673	S	S	*	*	S	Bend	trans	-43.2	124	168	-106.8	126.6	0	0	0	107.8	E189	L187-E189 PolarHBondContact O-N 3.34Å; L187-E189 VanDerWaalsContact O-N 3.13Å
188	I	45.2	Very low	55.5	Low	96 Å²	96	129.6 Å²	129.6	49%	0.492	64%	0.635	S	S	.	*			trans	-50.2	125.9	-176.1	-67	165.1	0	0	0	107	S186 H190	S186-I188 PolarHBondContact O-N 3.13Å; S186-I188 VanDerWaalsContact O-N 3.09Å; I188-H190 PolarHBondContact O-CD2 2.95Å; I188-H190 PolarHBondContact O-N 3.22Å
189	E	45.4	Very low	57.4	Low	128 Å²	128	119.7 Å²	119.7	60%	0.598	59%	0.592	S	S	*	*			trans	-68	81	-179.4	-162.3	172.1	-141.3	0	0	107.5	L187 E191 K192	L187-E189 PolarHBondContact O-N 3.34Å; L187-E189 VanDerWaalsContact O-N 3.13Å; E189-E191 PolarHBondContact O-N 3.07Å; E189-E191 VanDerWaalsContact O-N 3.16Å; E189-K192 WeakPolarHBondContact OE2-CE 3.34Å; E189-K192 IonicContact OE2-NZ 2.76Å; E189-K192 PolarHBondContact OE2-NZ 2.94Å
190	H	60	Low	60	Low	82 Å²	82	117.9 Å²	117.9	38%	0.38	56%	0.561	S	S	.	*			trans	-72.7	-6.9	-165	-87.7	-64.9	0	0	0	113.5	I188 Y202	I188-H190 PolarHBondContact O-CD2 2.95Å; I188-H190 PolarHBondContact O-N 3.22Å; H190-Y202 AromaticContact CE1-CD1 3.45Å; H190-Y202 VanDerWaalsContact CE1-CD1 3.45Å; H190-Y202 WeakPolarHBondContact CE1-CD1 3.01Å; H190-Y202 AromaticContact CE1-CG 3.96Å; H190-Y202 WeakPolarHBondContact ND1-CB 3.3Å; H190-Y202 AromaticContact ND1-CD1 3.59Å; H190-Y202 AromaticContact ND1-CG 3.76Å; H190-Y202 PolarHBondContact O-N 3.33Å
191	E	69.5	Low	61.9	Low	82 Å²	82	107.2 Å²	107.2	38%	0.383	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	122.6	178.8	174.3	156.6	176.9	0	0	109.4	K99 E189 T199 K200 L201	K99-E191 VanDerWaalsContact CE-CD 3.45Å; K99-E191 WeakPolarHBondContact CE-OE1 3.29Å; K99-E191 WeakPolarHBondContact CE-OE2 3.33Å; K99-E191 IonicContact NZ-OE1 2.75Å; K99-E191 PolarHBondContact NZ-OE1 2.79Å; K99-E191 IonicContact NZ-OE2 2.64Å; E189-E191 PolarHBondContact O-N 3.07Å; E189-E191 VanDerWaalsContact O-N 3.16Å; E191-T199 HydrophobicContact CG-CG2 3.51Å; E191-K200 WeakPolarHBondContact CA-O 3.23Å; E191-L201 HydrophobicContact CB-CD2 3.95Å; E191-L201 HydrophobicContact CG-CD2 4.09Å
192	K	74.1	Confident	63.6	Low	107 Å²	107	105 Å²	105	47%	0.465	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	113.4	163.8	-64	-170.9	-179	-117	0	108.2	E189 K200	E189-K192 WeakPolarHBondContact OE2-CE 3.34Å; E189-K192 IonicContact OE2-NZ 2.76Å; E189-K192 PolarHBondContact OE2-NZ 2.94Å; K192-K200 HydrophobicContact CB-CB 4.44Å; K192-K200 PolarHBondContact N-O 3.04Å; K192-K200 PolarHBondContact O-N 3.49Å
193	K	76.7	Confident	65.2	Low	166 Å²	166	93.7 Å²	93.7	72%	0.722	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	138.6	168.3	-67.1	-174.6	179.3	-176	0	108.7
194	L	74.2	Confident	66.3	Low	43 Å²	43	85.6 Å²	85.6	23%	0.225	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	156	-177.3	-62.4	155.9	0	0	0	109	L141 L198 K200	L141-L194 HydrophobicContact CD1-CD1 3.74Å; L141-L194 HydrophobicContact CD1-CD2 3.81Å; L141-L194 HydrophobicContact CD1-CG 4.28Å; L141-L194 HydrophobicContact CD2-CB 3.58Å; L141-L194 HydrophobicContact CD2-CD1 3.9Å; L141-L194 HydrophobicContact CD2-CD2 4.03Å; L141-L194 HydrophobicContact CD2-CG 4.03Å; L141-L194 HydrophobicContact CG-CD1 4.28Å; L194-L198 WeakPolarHBondContact CA-O 3.49Å; L194-L198 HydrophobicContact CB-CB 4.45Å; L194-L198 VanDerWaalsContact CB-O 3.29Å; L194-L198 WeakPolarHBondContact CB-O 3.45Å; L194-L198 HydrophobicContact CD1-CD2 4.28Å; L194-L198 HydrophobicContact CD1-CG 4.41Å; L194-L198 PolarHBondContact N-O 3.2Å; L194-K200 HydrophobicContact CD1-CB 3.68Å
195	P	70.2	Confident	67.3	Low	84 Å²	84	82.4 Å²	82.4	55%	0.545	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	148.8	174.8	22.4	-33.4	0	0	0	111.8
196	G	68.8	Low	68.4	Low	60 Å²	60	74.3 Å²	74.3	62%	0.619	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	14.8	-179.3	0	0	0	0	0	116.2	W140 L198	W140-G196 WeakPolarHBondContact CH2-O 3.15Å; G196-L198 VanDerWaalsContact C-N 3.33Å; G196-L198 PolarHBondContact O-N 3.1Å
197	G	79	Confident	69.5	Low	26 Å²	26	73 Å²	73	27%	0.268	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	20.7	176.8	0	0	0	0	0	114	T126 D127	T126-G197 WeakPolarHBondContact CA-O 3.48Å; D127-G197 PolarHBondContact N-O 2.81Å; D127-G197 VanDerWaalsContact N-O 3.11Å; D127-G197 WeakPolarHBondContact OD2-CA 3.47Å
198	L	84.4	Confident	70.4	Confident	1 Å²	1	68 Å²	68	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.5	171.5	-171.2	69.2	0	0	0	109.5	T126 Y132 W140 L141 L194 G196	T126-L198 HydrophobicContact CG2-CD1 3.67Å; Y132-L198 HydrophobicContact CD2-CD1 4.07Å; Y132-L198 HydrophobicContact CE2-CD1 4.48Å; W140-L198 HydrophobicContact CD2-CD2 4.3Å; W140-L198 HydrophobicContact CE3-CB 4.12Å; W140-L198 HydrophobicContact CE3-CD2 3.57Å; W140-L198 HydrophobicContact CE3-CG 4.4Å; W140-L198 HydrophobicContact CH2-CB 4.22Å; W140-L198 HydrophobicContact CZ3-CB 3.62Å; W140-L198 HydrophobicContact CZ3-CD2 4Å; W140-L198 HydrophobicContact CZ3-CG 4.38Å; L141-L198 HydrophobicContact CD2-CD2 4.37Å; L194-L198 WeakPolarHBondContact CA-O 3.49Å; L194-L198 HydrophobicContact CB-CB 4.45Å; L194-L198 VanDerWaalsContact CB-O 3.29Å; L194-L198 WeakPolarHBondContact CB-O 3.45Å; L194-L198 HydrophobicContact CD1-CD2 4.28Å; L194-L198 HydrophobicContact CD1-CG 4.41Å; L194-L198 PolarHBondContact N-O 3.2Å; G196-L198 VanDerWaalsContact C-N 3.33Å; G196-L198 PolarHBondContact O-N 3.1Å
199	T	87.1	Confident	70.8	Confident	5 Å²	5	64.4 Å²	64.4	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.9	170.2	-50.4	0	0	0	0	110	K99 G124 L125 E191 L201	K99-T199 PolarHBondContact NZ-OG1 3.3Å; G124-T199 CarbonylContact C-O 3.54Å; G124-T199 WeakPolarHBondContact CA-O 3.43Å; L125-T199 PolarHBondContact N-O 2.81Å; L125-T199 PolarHBondContact O-N 3.41Å; E191-T199 HydrophobicContact CG-CG2 3.51Å; T199-L201 HydrophobicContact CG2-CD2 3.77Å; T199-L201 HydrophobicContact CG2-CG 3.94Å
200	K	87.3	Confident	71	Confident	43 Å²	43	62.8 Å²	62.8	19%	0.187	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.4	169.1	-170.1	164.1	-169.5	165.6	0	110	F123 N134 N138 E191 K192 L194	F123-K200 WeakPolarHBondContact O-CA 3.47Å; N134-K200 WeakPolarHBondContact OD1-CE 3.43Å; N134-K200 PolarHBondContact OD1-NZ 3.48Å; N138-K200 PolarHBondContact OD1-NZ 2.92Å; E191-K200 WeakPolarHBondContact CA-O 3.23Å; K192-K200 HydrophobicContact CB-CB 4.44Å; K192-K200 PolarHBondContact N-O 3.04Å; K192-K200 PolarHBondContact O-N 3.49Å; L194-K200 HydrophobicContact CD1-CB 3.68Å
201	L	87.2	Confident	70.2	Confident	15 Å²	15	61.8 Å²	61.8	8%	0.079	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	157.8	-174.1	-65.8	173.6	0	0	0	110.4	K99 Y122 F123 L125 E191 T199	K99-L201 HydrophobicContact CD-CD1 4.42Å; K99-L201 HydrophobicContact CG-CD1 4.02Å; Y122-L201 WeakPolarHBondContact CA-O 3.22Å; F123-L201 HydrophobicContact CD1-CB 4.16Å; F123-L201 WeakPolarHBondContact CD1-O 3.39Å; F123-L201 HydrophobicContact CD2-CB 4.48Å; F123-L201 HydrophobicContact CE1-CB 3.59Å; F123-L201 HydrophobicContact CE2-CB 3.97Å; F123-L201 HydrophobicContact CE2-CD1 3.9Å; F123-L201 HydrophobicContact CZ-CB 3.48Å; F123-L201 VanDerWaalsContact CZ-CB 3.48Å; F123-L201 HydrophobicContact CZ-CD1 3.78Å; F123-L201 HydrophobicContact CZ-CG 4.29Å; F123-L201 PolarHBondContact N-O 3.3Å; F123-L201 PolarHBondContact O-N 3.37Å; L125-L201 HydrophobicContact CB-CD1 3.85Å; L125-L201 HydrophobicContact CD2-CD1 3.81Å; E191-L201 HydrophobicContact CB-CD2 3.95Å; E191-L201 HydrophobicContact CG-CD2 4.09Å; T199-L201 HydrophobicContact CG2-CD2 3.77Å; T199-L201 HydrophobicContact CG2-CG 3.94Å
202	Y	85.9	Confident	68.8	Low	73 Å²	73	63.5 Å²	63.5	29%	0.286	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	133.1	170.7	179.4	-99.2	0	0	0	110.5	G120 Y122 H190 S204	G120-Y202 WeakPolarHBondContact O-CE2 3.34Å; Y122-Y202 HydrophobicContact CD1-CD2 4.05Å; Y122-Y202 HydrophobicContact CD2-CD2 4.23Å; Y122-Y202 AromaticContact CE1-CD2 3.71Å; Y122-Y202 HydrophobicContact CE1-CD2 3.71Å; Y122-Y202 HydrophobicContact CE1-CG 4.31Å; Y122-Y202 AromaticContact CE2-CD2 3.9Å; Y122-Y202 HydrophobicContact CE2-CD2 3.9Å; Y122-Y202 HydrophobicContact CE2-CE2 4.22Å; Y122-Y202 HydrophobicContact CG-CD2 4.31Å; Y122-Y202 AromaticContact CZ-CD2 3.63Å; H190-Y202 AromaticContact CE1-CD1 3.45Å; H190-Y202 VanDerWaalsContact CE1-CD1 3.45Å; H190-Y202 WeakPolarHBondContact CE1-CD1 3.01Å; H190-Y202 AromaticContact CE1-CG 3.96Å; H190-Y202 WeakPolarHBondContact ND1-CB 3.3Å; H190-Y202 AromaticContact ND1-CD1 3.59Å; H190-Y202 AromaticContact ND1-CG 3.76Å; H190-Y202 PolarHBondContact O-N 3.33Å; Y202-S204 PolarHBondContact O-N 3Å
203	C	79.8	Confident	66.8	Low	5 Å²	5	62.7 Å²	62.7	3%	0.034	35%	0.349	C	S	.	.			trans	-73	91.6	-178.9	-167.8	0	0	0	0	111.1	M96 R118 K119 G120 D121 F123	M96-C203 WeakPolarHBondContact CE-SG 3.37Å; R118-C203 VanDerWaalsContact O-CB 3.32Å; R118-C203 WeakPolarHBondContact O-CB 3.48Å; R118-C203 PolarHBondContact O-SG 3.5Å; K119-C203 WeakPolarHBondContact CA-O 3.46Å; G120-C203 PolarHBondContact N-O 2.76Å; D121-C203 WeakPolarHBondContact O-CB 3.46Å; D121-C203 PolarHBondContact O-N 2.84Å; F123-C203 HydrophobicContact CD1-CB 4.1Å; F123-C203 HydrophobicContact CE1-CB 4.08Å
204	S	69.7	Low	64.7	Low	69 Å²	69	61.1 Å²	61.1	48%	0.483	34%	0.34	S	S	.	.			trans	-77	-175.4	169.9	73.7	0	0	0	0	111.5	Y202	Y202-S204 PolarHBondContact O-N 3Å
205	F	59.2	Low	63	Low	139 Å²	139	67.1 Å²	67.1	61%	0.61	36%	0.364	S	S	*	.			trans	-60.6	145	-161.4	-76.9	-104.9	0	0	0	115.2	K119 I207	K119-F205 HydrophobicContact CD-CD1 4.11Å; K119-F205 HydrophobicContact CD-CE1 4.43Å; K119-F205 HydrophobicContact CD-CG 4.21Å; F205-I207 PolarHBondContact O-N 3.35Å
206	L	59.9	Low	61.2	Low	70 Å²	70	69.5 Å²	69.5	37%	0.366	37%	0.368	S	S	.	.			trans	-53.4	128.8	154.6	-78.3	160.6	0	0	0	110	L94 M96 V105	L94-L206 HydrophobicContact CB-CD2 4.35Å; M96-L206 HydrophobicContact CG-CD2 3.94Å; M96-L206 HydrophobicContact SD-CD2 3.26Å; M96-L206 WeakPolarHBondContact SD-CD2 3.43Å; M96-L206 HydrophobicContact SD-CG 3.73Å; V105-L206 HydrophobicContact CG1-CD2 4.17Å; V105-L206 HydrophobicContact CG2-CD2 3.67Å
207	I	58.2	Low	59.5	Low	76 Å²	76	73.3 Å²	73.3	39%	0.39	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.2	177.5	-66.5	167.5	0	0	0	107.6	V95 F205	V95-I207 WeakPolarHBondContact CG2-O 3.48Å; V95-I207 PolarHBondContact N-O 3.39Å; V95-I207 PolarHBondContact O-N 3.34Å; F205-I207 PolarHBondContact O-N 3.35Å
208	T	55.8	Low	57.6	Low	58 Å²	58	77.1 Å²	77.1	36%	0.356	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.8	167.9	52.3	0	0	0	0	109.1	L94 K210 G211	L94-T208 HydrophobicContact CD2-CG2 3.66Å; T208-K210 PolarHBondContact O-N 2.91Å; T208-G211 PolarHBondContact O-N 2.94Å
209	Q	53.6	Low	55.2	Low	21 Å²	21	81.4 Å²	81.4	10%	0.098	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-52.1	-25.9	178.9	-76.9	-77.9	37.3	0	0	113.8	V95 G211 Q212	V95-Q209 HydrophobicContact CB-CG 4.48Å; V95-Q209 HydrophobicContact CG1-CG 3.75Å; V95-Q209 HydrophobicContact CG2-CG 3.84Å; Q209-G211 PolarHBondContact O-N 3.45Å; Q209-Q212 PolarHBondContact O-N 2.83Å
210	K	49.9	Very low	52.7	Low	93 Å²	93	90.1 Å²	90.1	40%	0.404	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-46.2	-33.3	179.9	-59.9	-171	177.5	-179.8	0	114.4	P91 T208 Q212 M213 Y214	P91-K210 VanDerWaalsContact O-CE 3.24Å; P91-K210 WeakPolarHBondContact O-CE 2.97Å; P91-K210 WeakPolarHBondContact O-CG 3.3Å; T208-K210 PolarHBondContact O-N 2.91Å; K210-Q212 PolarHBondContact O-N 3.5Å; K210-M213 PolarHBondContact O-N 3.18Å; K210-Y214 HydrophobicContact CB-CE2 4.05Å; K210-Y214 WeakPolarHBondContact O-CD2 3.44Å; K210-Y214 WeakPolarHBondContact O-CE2 3.34Å
211	G	43.1	Very low	50.1	Low	61 Å²	61	93 Å²	93	63%	0.629	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-61.5	-4.1	-173.4	0	0	0	0	0	117.7	T208 Q209	T208-G211 PolarHBondContact O-N 2.94Å; Q209-G211 PolarHBondContact O-N 3.45Å
212	Q	41.6	Very low	47.6	Very low	119 Å²	119	97.6 Å²	97.6	56%	0.556	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-133.8	4.2	179.2	-80.1	-177.6	-52.5	0	0	115.4	Q209 K210	Q209-Q212 PolarHBondContact O-N 2.83Å; K210-Q212 PolarHBondContact O-N 3.5Å
213	M	31.3	Very low	45.2	Very low	89 Å²	89	96.2 Å²	96.2	44%	0.438	49%	0.488	S	S	.	.			trans	-129.4	72.5	178.5	-67.9	-86.6	84.7	0	0	109.8	Y74 K210	Y74-M213 HydrophobicContact CE1-SD 3.99Å; Y74-M213 PolarHBondContact OH-SD 3.29Å; K210-M213 PolarHBondContact O-N 3.18Å
214	Y	33.5	Very low	43.2	Very low	133 Å²	133	101.5 Å²	101.5	52%	0.522	51%	0.511	S	S	.	.			trans	-127.5	97	169.7	-78.5	-71	0	0	0	109.1	K210 H217	K210-Y214 HydrophobicContact CB-CE2 4.05Å; K210-Y214 WeakPolarHBondContact O-CD2 3.44Å; K210-Y214 WeakPolarHBondContact O-CE2 3.34Å; Y214-H217 AromaticContact CD1-CD2 3.98Å; Y214-H217 AromaticContact CE1-CD2 3.53Å; Y214-H217 AromaticContact CE1-NE2 3.9Å
215	F	38.3	Very low	41.5	Very low	170 Å²	170	106.4 Å²	106.4	75%	0.746	52%	0.518	S	S	*	.	S	Bend	trans	-94.9	127.9	145.6	-79.4	-81.8	0	0	0	106.9
216	Q	32.6	Very low	40.4	Very low	133 Å²	133	104.6 Å²	104.6	62%	0.621	51%	0.514	S	S	*	.			trans	20.2	97.7	179.2	-71.1	172.1	-34.4	0	0	115.8	F218	Q216-F218 HydrophobicContact CB-CD2 4.23Å; Q216-F218 HydrophobicContact CB-CE1 4.45Å; Q216-F218 HydrophobicContact CB-CE2 3.93Å; Q216-F218 HydrophobicContact CB-CZ 4.05Å; Q216-F218 VanDerWaalsContact O-CD2 3.3Å; Q216-F218 WeakPolarHBondContact O-CD2 3.45Å; Q216-F218 PolarHBondContact O-N 2.95Å
217	H	32.9	Very low	39	Very low	140 Å²	140	108.4 Å²	108.4	65%	0.648	53%	0.533	S	S	*	.			trans	-51	113.7	138	-112.9	-73.6	0	0	0	105.9	Y214 P219	Y214-H217 AromaticContact CD1-CD2 3.98Å; Y214-H217 AromaticContact CE1-CD2 3.53Å; Y214-H217 AromaticContact CE1-NE2 3.9Å; H217-P219 VanDerWaalsContact O-CD 3.22Å; H217-P219 WeakPolarHBondContact O-CD 3.26Å
218	F	38.2	Very low	37.7	Very low	106 Å²	106	108 Å²	108	47%	0.465	54%	0.542	S	S	.	.			trans	-83.1	108.2	165	-68.9	-87.7	0	0	0	107	Q216 Y220	Q216-F218 HydrophobicContact CB-CD2 4.23Å; Q216-F218 HydrophobicContact CB-CE1 4.45Å; Q216-F218 HydrophobicContact CB-CE2 3.93Å; Q216-F218 HydrophobicContact CB-CZ 4.05Å; Q216-F218 VanDerWaalsContact O-CD2 3.3Å; Q216-F218 WeakPolarHBondContact O-CD2 3.45Å; Q216-F218 PolarHBondContact O-N 2.95Å; F218-Y220 VanDerWaalsContact C-N 3.27Å
219	P	33.5	Very low	36.5	Very low	92 Å²	92	113.3 Å²	113.3	60%	0.597	56%	0.562	S	S	*	*			trans	-99.6	31.5	176.3	40.8	-28.8	0	0	0	110.2	H217	H217-P219 VanDerWaalsContact O-CD 3.22Å; H217-P219 WeakPolarHBondContact O-CD 3.26Å
220	Y	35.6	Very low	35.4	Very low	188 Å²	188	122.4 Å²	122.4	74%	0.737	60%	0.602	S	S	*	*			trans	-134.1	129.7	179.8	-60.6	-65.1	0	0	0	108.4	F218	F218-Y220 VanDerWaalsContact C-N 3.27Å
221	P	31.6	Very low	34.6	Very low	104 Å²	104	122.8 Å²	122.8	68%	0.675	62%	0.622	S	S	*	*			trans	-68.1	176.9	160.2	35.2	-34.1	0	0	0	108.5
222	L	35.7	Very low	34.2	Very low	110 Å²	110	124.8 Å²	124.8	58%	0.576	63%	0.633	S	S	*	*	S	Bend	trans	73.6	120.1	169.8	-45.3	171.2	0	0	0	114.6
223	C	35.7	Very low	33.6	Very low	45 Å²	45	129.5 Å²	129.5	30%	0.304	65%	0.647	S	S	.	*	S	Bend	trans	-23.3	144.3	134.8	-46.5	0	0	0	0	112.1	F32 R225	F32-C223 HydrophobicContact CB-CB 4.04Å; F32-C223 HydrophobicContact CD1-CB 3.56Å; F32-C223 HydrophobicContact CE1-CB 4.44Å; F32-C223 HydrophobicContact CG-CB 4.17Å; C223-R225 PolarHBondContact O-N 3.23Å
224	K	37.6	Very low	33.9	Very low	115 Å²	115	130.5 Å²	130.5	50%	0.5	66%	0.66	S	S	.	*			trans	-58.2	105.3	168.4	-73.6	-178.5	178.2	176.1	0	108.9	I226	K224-I226 HydrophobicContact CB-CG1 4.3Å; K224-I226 PolarHBondContact O-N 2.27Å
225	R	34.3	Very low	33.8	Very low	172 Å²	172	129.5 Å²	129.5	65%	0.649	67%	0.673	S	S	*	*			trans	-67.7	83.1	159.3	-74.8	-179.2	96.7	161.2	4.6	107.3	F32 C223 I227	F32-R225 HydrophobicContact CE1-CG 4.38Å; C223-R225 PolarHBondContact O-N 3.23Å; R225-I227 VanDerWaalsContact C-N 3.27Å; R225-I227 HydrophobicContact CB-CG1 4.32Å; R225-I227 PolarHBondContact O-N 3.11Å
226	I	36.1	Very low	33.6	Very low	102 Å²	102	126.6 Å²	126.6	52%	0.523	67%	0.673	S	S	.	*			trans	-75.9	93.3	155.3	-61.7	-178.7	0	0	0	105	K224 A228	K224-I226 HydrophobicContact CB-CG1 4.3Å; K224-I226 PolarHBondContact O-N 2.27Å; I226-A228 VanDerWaalsContact C-N 3.3Å; I226-A228 HydrophobicContact CG2-CB 3.95Å; I226-A228 PolarHBondContact O-N 3.34Å; I226-A228 VanDerWaalsContact O-N 3.08Å
227	I	31	Very low	33.7	Very low	149 Å²	149	126.8 Å²	126.8	76%	0.764	67%	0.674	S	S	*	*			trans	-75.4	90.5	166.7	-59.7	175.4	0	0	0	106.4	R225	R225-I227 VanDerWaalsContact C-N 3.27Å; R225-I227 HydrophobicContact CB-CG1 4.32Å; R225-I227 PolarHBondContact O-N 3.11Å
228	A	30.1	Very low	33.7	Very low	69 Å²	69	128 Å²	128	57%	0.57	68%	0.678	S	S	*	*			trans	-167.4	123.6	171.3	0	0	0	0	0	106.7	I226	I226-A228 VanDerWaalsContact C-N 3.3Å; I226-A228 HydrophobicContact CG2-CB 3.95Å; I226-A228 PolarHBondContact O-N 3.34Å; I226-A228 VanDerWaalsContact O-N 3.08Å
229	H	30.4	Very low	33.4	Very low	169 Å²	169	127.6 Å²	127.6	78%	0.782	69%	0.688	S	S	*	*	S	Bend	cis	-135.8	178.3	9.8	-107.2	-106.4	0	0	0	110
230	F	30.5	Very low	33.4	Very low	212 Å²	212	128 Å²	128	93%	0.93	69%	0.693	S	S	*	*	S	Bend	trans	104.7	57.6	172.4	-55.3	-62.4	0	0	0	117.9
231	A	32.5	Very low	33.3	Very low	100 Å²	100	126.8 Å²	126.8	83%	0.826	69%	0.694	S	S	*	*	S	Bend	trans	-165.5	139.3	143.6	0	0	0	0	0	109.6
232	A	34.4	Very low	33.3	Very low	104 Å²	104	129.5 Å²	129.5	86%	0.86	70%	0.698	S	S	*	*			trans	-62.3	142.3	-168.4	0	0	0	0	0	116.2
233	Y	31	Very low	33.2	Very low	218 Å²	218	131.2 Å²	131.2	86%	0.855	71%	0.705	S	S	*	*			trans	-70.5	162.4	150.2	-98.8	-86.2	0	0	0	109.2
234	P	36.7	Very low	33.2	Very low	110 Å²	110	134.1 Å²	134.1	71%	0.714	73%	0.725	S	S	*	*				-151.3	159.8	52.6	41.1	-20.2	0	0	0	120.2
235	S	31.5	Very low	33	Very low	112 Å²	112	137.8 Å²	137.8	78%	0.783	74%	0.744	S	S	*	*			trans	63.6	151.7	153	-54.2	0	0	0	0	117.3
236	S	34.3	Very low	32.9	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	75%	0.752	S	S	*	*			cis	-159.2	171.1	12.1	66	0	0	0	0	107.6
237	E	34.2	Very low	32.8	Very low	138 Å²	138	133.4 Å²	133.4	65%	0.645	76%	0.762	S	S	*	*			cis	-168.5	169.4	-13.6	-121.1	-166.6	139.9	0	0	109.5
238	K	32	Very low	33	Very low	165 Å²	165	133.7 Å²	133.7	72%	0.717	77%	0.765	S	S	*	*			trans	54.3	143.1	149.6	-70	163.4	-178.3	144.8	0	119.9
239	S	33.9	Very low	33.4	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	78%	0.778	S	S	*	*			cis	-163.1	138.7	-0.5	51.8	0	0	0	0	108.5
240	S	31.6	Very low	33.5	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	78%	0.78	S	S	*	*				74.2	145.8	110.2	82.7	0	0	0	0	114.8
241	E	34	Very low	33.4	Very low	163 Å²	163	133.5 Å²	133.5	76%	0.762	77%	0.774	S	S	*	*			cis	-146.7	152.1	13.9	-66.4	173.8	140.4	0	0	111
242	E	31.9	Very low	33.5	Very low	160 Å²	160	133.4 Å²	133.4	75%	0.748	77%	0.773	S	S	*	*				35.1	153.5	126	-50.7	-164.9	155.3	0	0	121.2
243	M	34.3	Very low	33.5	Very low	147 Å²	147	136.4 Å²	136.4	72%	0.724	77%	0.773	S	S	*	*			cis	-156.9	-173.1	-11.7	-136.9	82.3	89.8	0	0	106.4
244	S	35.6	Very low	33.9	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	76%	0.759	S	S	*	*			cis	-145.8	-102	-2.6	53.6	0	0	0	0	113.2
245	Q	32.6	Very low	34.1	Very low	192 Å²	192	131.7 Å²	131.7	90%	0.897	77%	0.768	S	S	*	*			trans	-149.8	156.7	-161.1	-67.3	168.6	-21.8	0	0	110.5
246	G	33	Very low	34.6	Very low	79 Å²	79	137.2 Å²	137.2	81%	0.814	77%	0.771	S	S	*	*			trans	174.2	100.6	170.4	0	0	0	0	0	111.8
247	S	34.3	Very low	35.2	Very low	104 Å²	104	137.5 Å²	137.5	73%	0.727	77%	0.771	S	S	*	*			trans	-79.1	156.8	174.8	54.6	0	0	0	0	111.6
248	D	35	Very low	35.6	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	78%	0.784	S	S	*	*				174.7	158.6	112.3	-86.2	-10.1	0	0	0	114.4
249	M	38.4	Very low	36.3	Very low	174 Å²	174	144.8 Å²	144.8	86%	0.857	79%	0.794	S	S	*	*			trans	-55	152.8	174.7	-80	178.4	52.1	0	0	112.6
250	C	32.3	Very low	37.3	Very low	122 Å²	122	149.1 Å²	149.1	82%	0.824	81%	0.806	S	S	*	*				-174.7	169.5	69.6	54.5	0	0	0	0	114.4
251	N	28.8	Very low	39.1	Very low	150 Å²	150	155.5 Å²	155.5	80%	0.802	81%	0.814	S	S	*	*			trans	-102.3	127.5	-167.5	-169.3	6.5	0	0	0	110.8
252	A	34.6	Very low	40.9	Very low	97 Å²	97	151.5 Å²	151.5	80%	0.802	80%	0.801	S	S	*	*			trans	-154.2	98.2	169.6	0	0	0	0	0	113.5	G254	A252-G254 PolarHBondContact O-N 2.92Å
253	I	34.3	Very low	43.4	Very low	167 Å²	167	149.4 Å²	149.4	86%	0.856	80%	0.804	S	S	*	*			trans	-36.1	122.3	168	-61.6	159.3	0	0	0	113.2
254	G	39.6	Very low	46.1	Very low	55 Å²	55	145 Å²	145	57%	0.567	78%	0.781	S	S	*	*			trans	-154.3	113.6	169.7	0	0	0	0	0	111.9	A252 R256	A252-G254 PolarHBondContact O-N 2.92Å; G254-R256 VanDerWaalsContact C-N 3.29Å; G254-R256 PolarHBondContact O-N 3.33Å
255	I	39.7	Very low	48.8	Very low	175 Å²	175	147.5 Å²	147.5	90%	0.897	78%	0.779	S	S	*	*			trans	-69.4	86.3	177.5	-57	174.9	0	0	0	108.8
256	R	43.4	Very low	51.6	Low	227 Å²	227	144.1 Å²	144.1	86%	0.857	76%	0.763	S	S	*	*			trans	-75.5	136.1	176.1	-67.3	-174.2	179.9	-166.7	0.2	109.7	G254 K258	G254-R256 VanDerWaalsContact C-N 3.29Å; G254-R256 PolarHBondContact O-N 3.33Å; R256-K258 PolarHBondContact O-N 2.87Å
257	P	46.4	Very low	54.6	Low	115 Å²	115	146.8 Å²	146.8	75%	0.747	75%	0.754	S	S	*	*			trans	-58.1	140.5	-179	23	-33.3	0	0	0	111.1	R259	P257-R259 PolarHBondContact O-N 2.83Å
258	K	42.8	Very low	57.5	Low	213 Å²	213	143.3 Å²	143.3	93%	0.926	73%	0.726	S	S	*	*			trans	-57.6	110.4	174.9	-83.1	-177	176.1	177.1	0	108.9	R256 M260	R256-K258 PolarHBondContact O-N 2.87Å; K258-M260 PolarHBondContact O-N 3.43Å
259	R	45.5	Very low	60.4	Low	242 Å²	242	137.4 Å²	137.4	91%	0.913	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-57.6	125.4	178	-74.2	-176.4	-83.6	-175	-5.5	109.6	P257 R261	P257-R259 PolarHBondContact O-N 2.83Å; R259-R261 PolarHBondContact O-N 3.42Å
260	M	55.8	Low	63.1	Low	188 Å²	188	136.8 Å²	136.8	93%	0.926	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-61.2	129.5	175.1	-166	173.7	-167.9	0	0	109.1	K258	K258-M260 PolarHBondContact O-N 3.43Å
261	R	68.3	Low	66.2	Low	235 Å²	235	133 Å²	133	89%	0.887	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-77.9	127.1	179.1	-173.5	176.5	-177.3	123.8	0	108.9	R259 S263	R259-R261 PolarHBondContact O-N 3.42Å; R261-S263 PolarHBondContact O-N 3.32Å
262	T	73.1	Confident	69.4	Low	79 Å²	79	125.9 Å²	125.9	49%	0.485	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-64.1	126	173.7	51.8	0	0	0	0	110.2	I300	T262-I300 HydrophobicContact CG2-CD1 4.39Å
263	S	83.9	Confident	72.3	Confident	117 Å²	117	128.1 Å²	128.1	82%	0.818	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-92.8	140.8	170.5	-166.9	0	0	0	0	110	R261	R261-S263 PolarHBondContact O-N 3.32Å
264	F	91	Very high	75.3	Confident	54 Å²	54	122.6 Å²	122.6	24%	0.237	59%	0.585	C	S	.	*	P	Polyproline II helix	trans	-102.5	135.2	-179.8	-60.8	-71.9	0	0	0	110.2	L269 M272 L296 I300 W304	F264-L269 HydrophobicContact CB-CD1 4.28Å; F264-L269 HydrophobicContact CB-CD2 3.81Å; F264-L269 HydrophobicContact CB-CG 3.79Å; F264-L269 HydrophobicContact CD2-CD2 4.16Å; F264-L269 HydrophobicContact CG-CD2 4.15Å; F264-M272 HydrophobicContact CD1-CE 4Å; F264-M272 HydrophobicContact CE1-CE 4.33Å; F264-M272 HydrophobicContact CG-CE 4.32Å; F264-L296 HydrophobicContact CD1-CD1 3.79Å; F264-L296 HydrophobicContact CD1-CD2 4.12Å; F264-L296 HydrophobicContact CE1-CD1 3.8Å; F264-L296 HydrophobicContact CE1-CD2 4.16Å; F264-I300 HydrophobicContact CE1-CG2 3.55Å; F264-I300 HydrophobicContact CZ-CG2 3.88Å; F264-W304 AromaticContact CE2-CD1 3.79Å; F264-W304 AromaticContact CZ-CD1 3.85Å
265	K	91.5	Very high	78	Confident	157 Å²	157	122.1 Å²	122.1	68%	0.683	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-67.8	148.8	170.4	-64.3	-175.7	178	-176.9	0	109.9	Q267 Q268 L269	K265-Q267 PolarHBondContact O-N 2.84Å; K265-Q268 HydrophobicContact CB-CG 4.22Å; K265-Q268 WeakPolarHBondContact O-CB 3.19Å; K265-Q268 PolarHBondContact O-N 2.92Å; K265-L269 PolarHBondContact O-N 3.48Å; K265-L269 VanDerWaalsContact O-N 3.14Å
266	Q	92.9	Very high	80.7	Confident	121 Å²	121	115 Å²	115	57%	0.565	53%	0.529	S	S	*	.	H	α-helix	trans	-58.7	-33.5	-177.7	-171.9	65.6	-3.9	0	0	113.3	L269 R270	Q266-L269 PolarHBondContact O-N 2.83Å; Q266-R270 WeakPolarHBondContact O-CG 3.43Å; Q266-R270 PolarHBondContact O-N 2.92Å
267	Q	94.3	Very high	83	Confident	135 Å²	135	111.8 Å²	111.8	63%	0.631	52%	0.524	S	S	*	.	H	α-helix	trans	-62.4	-44.8	172.9	-173.4	177.6	3.1	0	0	112.4	K265 L269 R270 T271	K265-Q267 PolarHBondContact O-N 2.84Å; Q267-L269 VanDerWaalsContact C-N 3.32Å; Q267-L269 PolarHBondContact O-N 3.25Å; Q267-R270 PolarHBondContact O-N 3.16Å; Q267-T271 PolarHBondContact O-N 2.85Å; Q267-T271 PolarHBondContact O-OG1 3.02Å
268	Q	95.6	Very high	85.2	Confident	31 Å²	31	113.6 Å²	113.6	15%	0.145	53%	0.526	C	S	.	.	H	α-helix	trans	-61	-42.7	177.3	-61.4	170.6	-37.8	0	0	110.9	K265 T271 M272 T294 L296	K265-Q268 HydrophobicContact CB-CG 4.22Å; K265-Q268 WeakPolarHBondContact O-CB 3.19Å; K265-Q268 PolarHBondContact O-N 2.92Å; Q268-T271 PolarHBondContact O-N 3.31Å; Q268-M272 HydrophobicContact CB-CE 4.23Å; Q268-M272 WeakPolarHBondContact O-CB 3.39Å; Q268-M272 WeakPolarHBondContact O-CE 3.28Å; Q268-M272 WeakPolarHBondContact O-CG 3.4Å; Q268-M272 PolarHBondContact O-N 3.13Å; Q268-T294 PolarHBondContact NE2-O 2.93Å; Q268-L296 HydrophobicContact CB-CD1 4.28Å
269	L	96	Very high	87.6	Confident	31 Å²	31	105.9 Å²	105.9	16%	0.162	50%	0.495	C	S	.	.	H	α-helix	trans	-63.7	-39.7	176.2	-68.8	174.7	0	0	0	112.6	F264 K265 Q266 Q267 M272 R273	F264-L269 HydrophobicContact CB-CD1 4.28Å; F264-L269 HydrophobicContact CB-CD2 3.81Å; F264-L269 HydrophobicContact CB-CG 3.79Å; F264-L269 HydrophobicContact CD2-CD2 4.16Å; F264-L269 HydrophobicContact CG-CD2 4.15Å; K265-L269 PolarHBondContact O-N 3.48Å; K265-L269 VanDerWaalsContact O-N 3.14Å; Q266-L269 PolarHBondContact O-N 2.83Å; Q267-L269 VanDerWaalsContact C-N 3.32Å; Q267-L269 PolarHBondContact O-N 3.25Å; L269-M272 HydrophobicContact CD2-CE 4.02Å; L269-R273 WeakPolarHBondContact O-CB 3.5Å; L269-R273 VanDerWaalsContact O-CG 3.24Å; L269-R273 WeakPolarHBondContact O-CG 3.41Å; L269-R273 PolarHBondContact O-N 2.76Å
270	R	96.3	Very high	89.9	Confident	162 Å²	162	97.3 Å²	97.3	61%	0.611	47%	0.465	S	S	*	.	H	α-helix	trans	-60.8	-51.5	174.7	-75.6	-173.2	-71.3	177.8	-0.2	111.2	Q266 Q267 M272 R273 A274	Q266-R270 WeakPolarHBondContact O-CG 3.43Å; Q266-R270 PolarHBondContact O-N 2.92Å; Q267-R270 PolarHBondContact O-N 3.16Å; R270-M272 PolarHBondContact O-N 2.9Å; R270-R273 PolarHBondContact O-N 3.17Å; R270-A274 WeakPolarHBondContact O-CB 3.3Å; R270-A274 PolarHBondContact O-N 3.4Å
271	T	95.7	Very high	91.7	Very high	43 Å²	43	93.2 Å²	93.2	26%	0.264	45%	0.447	S	S	.	.	H	α-helix	trans	-60	-44.8	179	-52.2	0	0	0	0	112.5	Q267 Q268 Y275 L290 K293 T294	Q267-T271 PolarHBondContact O-N 2.85Å; Q267-T271 PolarHBondContact O-OG1 3.02Å; Q268-T271 PolarHBondContact O-N 3.31Å; T271-Y275 PolarHBondContact O-N 2.85Å; T271-Y275 VanDerWaalsContact O-N 3.11Å; T271-L290 HydrophobicContact CG2-CD2 4.25Å; T271-K293 HydrophobicContact CG2-CB 4.36Å; T271-T294 HydrophobicContact CG2-CG2 4.08Å
272	M	96.6	Very high	92.9	Very high	0 Å²	0	82.8 Å²	82.8	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-67.5	-37.1	179.4	-69.9	-175	-69.7	0	0	112.9	F264 Q268 L269 R270 F276 T294 L296 L301 W304	F264-M272 HydrophobicContact CD1-CE 4Å; F264-M272 HydrophobicContact CE1-CE 4.33Å; F264-M272 HydrophobicContact CG-CE 4.32Å; Q268-M272 HydrophobicContact CB-CE 4.23Å; Q268-M272 WeakPolarHBondContact O-CB 3.39Å; Q268-M272 WeakPolarHBondContact O-CE 3.28Å; Q268-M272 WeakPolarHBondContact O-CG 3.4Å; Q268-M272 PolarHBondContact O-N 3.13Å; L269-M272 HydrophobicContact CD2-CE 4.02Å; R270-M272 PolarHBondContact O-N 2.9Å; M272-F276 WeakPolarHBondContact O-CB 3.48Å; M272-F276 PolarHBondContact O-N 2.87Å; M272-T294 HydrophobicContact CG-CG2 4.31Å; M272-L296 HydrophobicContact CE-CD1 3.85Å; M272-L296 HydrophobicContact SD-CD1 3.81Å; M272-L301 HydrophobicContact CG-CD2 4.01Å; M272-L301 HydrophobicContact SD-CD2 3.49Å; M272-L301 WeakPolarHBondContact SD-CD2 3.21Å; M272-W304 HydrophobicContact CB-CD2 4.14Å; M272-W304 HydrophobicContact CB-CE3 3.99Å; M272-W304 HydrophobicContact CB-CH2 3.65Å; M272-W304 HydrophobicContact CB-CZ2 3.77Å; M272-W304 HydrophobicContact CB-CZ3 3.76Å; M272-W304 HydrophobicContact CE-CD2 4.22Å; M272-W304 HydrophobicContact CE-CG 4.14Å; M272-W304 HydrophobicContact SD-CB 4.24Å; M272-W304 HydrophobicContact SD-CD2 3.7Å; M272-W304 HydrophobicContact SD-CE3 4.16Å; M272-W304 HydrophobicContact SD-CG 3.7Å
273	R	96.2	Very high	93.9	Very high	144 Å²	144	83 Å²	83	54%	0.543	41%	0.408	S	S	.	.	H	α-helix	trans	-69.9	-43.3	176.5	-73.5	175.5	-173.9	179.5	3.6	112.6	L269 R270 Y275 F276 Q277 W304	L269-R273 WeakPolarHBondContact O-CB 3.5Å; L269-R273 VanDerWaalsContact O-CG 3.24Å; L269-R273 WeakPolarHBondContact O-CG 3.41Å; L269-R273 PolarHBondContact O-N 2.76Å; R270-R273 PolarHBondContact O-N 3.17Å; R273-Y275 VanDerWaalsContact C-N 3.29Å; R273-Y275 PolarHBondContact O-N 2.98Å; R273-F276 WeakPolarHBondContact O-CB 3.17Å; R273-F276 PolarHBondContact O-N 2.95Å; R273-F276 VanDerWaalsContact O-N 3.14Å; R273-Q277 PolarHBondContact O-N 3.44Å; R273-Q277 VanDerWaalsContact O-N 3.12Å; R273-W304 HydrophobicContact CG-CH2 4.15Å; R273-W304 HydrophobicContact CG-CZ2 4.14Å
274	A	96.2	Very high	94.4	Very high	51 Å²	51	80.4 Å²	80.4	42%	0.421	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-41.2	176	0	0	0	0	0	111.3	R270	R270-A274 WeakPolarHBondContact O-CB 3.3Å; R270-A274 PolarHBondContact O-N 3.4Å
275	Y	96.2	Very high	94.6	Very high	45 Å²	45	85.8 Å²	85.8	18%	0.176	42%	0.417	C	S	.	.	H	α-helix	trans	-66.9	-40.9	173.3	-168.3	-80.3	0	0	0	112.4	T271 R273 Q277 L278 N279 P282 D286 L290 F305	T271-Y275 PolarHBondContact O-N 2.85Å; T271-Y275 VanDerWaalsContact O-N 3.11Å; R273-Y275 VanDerWaalsContact C-N 3.29Å; R273-Y275 PolarHBondContact O-N 2.98Å; Y275-Q277 PolarHBondContact O-N 3.38Å; Y275-L278 PolarHBondContact O-N 2.92Å; Y275-N279 HydrophobicContact CE1-CB 3.74Å; Y275-N279 PolarHBondContact O-N 3.28Å; Y275-N279 PolarHBondContact OH-ND2 3.48Å; Y275-P282 HydrophobicContact CE1-CB 3.81Å; Y275-D286 PolarHBondContact OH-OD1 3.49Å; Y275-D286 PolarHBondContact OH-OD2 3.05Å; Y275-L290 HydrophobicContact CD1-CD1 3.86Å; Y275-L290 HydrophobicContact CD2-CD1 4.2Å; Y275-L290 HydrophobicContact CD2-CD2 4.14Å; Y275-L290 HydrophobicContact CD2-CG 4.35Å; Y275-L290 HydrophobicContact CE1-CD1 4.28Å; Y275-L290 HydrophobicContact CG-CD1 3.85Å; Y275-L290 HydrophobicContact CG-CD2 4.02Å; Y275-L290 HydrophobicContact CG-CG 4.35Å; Y275-F305 AromaticContact CD1-CE1 3.87Å; Y275-F305 HydrophobicContact CD1-CE1 3.87Å; Y275-F305 AromaticContact CD1-CZ 3.71Å; Y275-F305 HydrophobicContact CD1-CZ 3.71Å; Y275-F305 HydrophobicContact CG-CZ 4.41Å
276	F	96.5	Very high	94.8	Very high	25 Å²	25	80.1 Å²	80.1	11%	0.11	39%	0.394	C	S	.	.	H	α-helix	trans	-57.9	-35.5	179.2	-168.6	-94.2	0	0	0	112.6	M272 R273 L278 N279 H280 W304 F305 A308 R309 F312	M272-F276 WeakPolarHBondContact O-CB 3.48Å; M272-F276 PolarHBondContact O-N 2.87Å; R273-F276 WeakPolarHBondContact O-CB 3.17Å; R273-F276 PolarHBondContact O-N 2.95Å; R273-F276 VanDerWaalsContact O-N 3.14Å; F276-L278 PolarHBondContact O-N 3.27Å; F276-N279 CarbonylContact O-C 3.59Å; F276-H280 AromaticContact CD1-CD2 3.52Å; F276-H280 AromaticContact CD1-NE2 3.9Å; F276-H280 AromaticContact CE1-CD2 3.23Å; F276-H280 WeakPolarHBondContact CE1-CD2 3.49Å; F276-H280 AromaticContact CE1-NE2 3.57Å; F276-H280 HydrophobicContact CE2-CB 4.4Å; F276-H280 AromaticContact CE2-CD2 3.88Å; F276-H280 AromaticContact CG-CD2 3.97Å; F276-H280 HydrophobicContact CZ-CB 4.46Å; F276-H280 AromaticContact CZ-CD2 3.42Å; F276-H280 VanDerWaalsContact CZ-CD2 3.42Å; F276-H280 WeakPolarHBondContact CZ-CD2 3.39Å; F276-H280 PolarHBondContact O-CD2 2.9Å; F276-H280 PolarHBondContact O-NE2 3.09Å; F276-W304 HydrophobicContact CB-CH2 4.35Å; F276-W304 HydrophobicContact CB-CZ3 4.25Å; F276-W304 HydrophobicContact CD2-CZ3 4.13Å; F276-W304 HydrophobicContact CG-CZ3 4.46Å; F276-F305 HydrophobicContact CB-CE1 4.19Å; F276-F305 AromaticContact CD2-CD1 3.69Å; F276-F305 HydrophobicContact CD2-CD1 3.69Å; F276-F305 AromaticContact CD2-CE1 3.81Å; F276-F305 HydrophobicContact CD2-CE1 3.81Å; F276-F305 HydrophobicContact CE2-CD1 4.31Å; F276-A308 HydrophobicContact CD2-CB 3.74Å; F276-A308 HydrophobicContact CE2-CB 3.42Å; F276-A308 VanDerWaalsContact CE2-CB 3.42Å; F276-A308 HydrophobicContact CG-CB 4.48Å; F276-A308 HydrophobicContact CZ-CB 3.92Å; F276-R309 HydrophobicContact CE2-CG 3.8Å; F276-R309 HydrophobicContact CZ-CG 4.12Å; F276-F312 HydrophobicContact CE1-CB 3.94Å; F276-F312 HydrophobicContact CE1-CD2 4.32Å; F276-F312 HydrophobicContact CE1-CG 4.03Å; F276-F312 HydrophobicContact CZ-CB 3.85Å; F276-F312 HydrophobicContact CZ-CG 4.25Å
277	Q	93.1	Very high	94.9	Very high	160 Å²	160	74.8 Å²	74.8	75%	0.748	37%	0.369	S	S	*	.	H	α-helix	trans	-66.1	-23.2	175.5	-70.4	170.4	-45.7	0	0	113.9	R273 Y275	R273-Q277 PolarHBondContact O-N 3.44Å; R273-Q277 VanDerWaalsContact O-N 3.12Å; Y275-Q277 PolarHBondContact O-N 3.38Å
278	L	92.5	Very high	95	Very high	152 Å²	152	75.2 Å²	75.2	80%	0.796	37%	0.369	S	S	*	.	H	α-helix	trans	-93.1	-43.2	178.1	-59	174.1	0	0	0	111.7	Y275 F276	Y275-L278 PolarHBondContact O-N 2.92Å; F276-L278 PolarHBondContact O-N 3.27Å
279	N	92.6	Very high	95	Very high	51 Å²	51	79.1 Å²	79.1	27%	0.273	39%	0.387	S	S	.	.			trans	-146	115.5	179.3	179	11.3	0	0	0	111.2	Y275 F276 N281 D286	Y275-N279 HydrophobicContact CE1-CB 3.74Å; Y275-N279 PolarHBondContact O-N 3.28Å; Y275-N279 PolarHBondContact OH-ND2 3.48Å; F276-N279 CarbonylContact O-C 3.59Å; N279-N281 VanDerWaalsContact C-N 3.32Å; N279-N281 PolarHBondContact ND2-O 3.04Å; N279-N281 VanDerWaalsContact ND2-O 3.12Å; N279-N281 VanDerWaalsContact OD1-C 3.25Å; N279-N281 WeakPolarHBondContact OD1-CA 3.43Å; N279-N281 PolarHBondContact OD1-N 3.47Å; N279-N281 PolarHBondContact OD1-O 3Å; N279-D286 PolarHBondContact ND2-OD2 3.49Å
280	H	93.3	Very high	95	Very high	63 Å²	63	77.9 Å²	77.9	29%	0.292	38%	0.381	S	S	.	.	S	Bend	trans	-69.9	-26.9	175.3	-62.9	139.9	0	0	0	113.3	F276 P282 R309 F312	F276-H280 AromaticContact CD1-CD2 3.52Å; F276-H280 AromaticContact CD1-NE2 3.9Å; F276-H280 AromaticContact CE1-CD2 3.23Å; F276-H280 WeakPolarHBondContact CE1-CD2 3.49Å; F276-H280 AromaticContact CE1-NE2 3.57Å; F276-H280 HydrophobicContact CE2-CB 4.4Å; F276-H280 AromaticContact CE2-CD2 3.88Å; F276-H280 AromaticContact CG-CD2 3.97Å; F276-H280 HydrophobicContact CZ-CB 4.46Å; F276-H280 AromaticContact CZ-CD2 3.42Å; F276-H280 VanDerWaalsContact CZ-CD2 3.42Å; F276-H280 WeakPolarHBondContact CZ-CD2 3.39Å; F276-H280 PolarHBondContact O-CD2 2.9Å; F276-H280 PolarHBondContact O-NE2 3.09Å; H280-P282 VanDerWaalsContact C-CD 3.48Å; H280-P282 VanDerWaalsContact O-CD 3.29Å; H280-P282 WeakPolarHBondContact O-CD 3.5Å; H280-R309 HydrophobicContact CB-CG 4.31Å; H280-R309 VanDerWaalsContact O-CD 3.25Å; H280-R309 WeakPolarHBondContact O-CD 3.32Å; H280-R309 WeakPolarHBondContact O-CG 3.31Å; H280-R309 PolarHBondContact O-NH1 2.84Å; H280-F312 AromaticContact CE1-CD1 3.86Å; H280-F312 AromaticContact CE1-CE1 3.16Å; H280-F312 WeakPolarHBondContact CE1-CE1 3.42Å; H280-F312 AromaticContact CE1-CZ 3.46Å; H280-F312 VanDerWaalsContact CE1-CZ 3.46Å; H280-F312 WeakPolarHBondContact CE1-CZ 3.38Å; H280-F312 AromaticContact ND1-CE1 3.68Å; H280-F312 AromaticContact NE2-CD1 3.99Å; H280-F312 AromaticContact NE2-CE1 3.63Å; H280-F312 AromaticContact NE2-CZ 3.77Å
281	N	93.7	Very high	95	Very high	102 Å²	102	71.3 Å²	71.3	55%	0.545	36%	0.361	S	S	.	.	S	Bend	trans	-117.7	70.5	-174	-73.5	-28.9	0	0	0	111.3	N279 D283 R309	N279-N281 VanDerWaalsContact C-N 3.32Å; N279-N281 PolarHBondContact ND2-O 3.04Å; N279-N281 VanDerWaalsContact ND2-O 3.12Å; N279-N281 VanDerWaalsContact OD1-C 3.25Å; N279-N281 WeakPolarHBondContact OD1-CA 3.43Å; N279-N281 PolarHBondContact OD1-N 3.47Å; N279-N281 PolarHBondContact OD1-O 3Å; N281-D283 PolarHBondContact O-N 2.8Å; N281-R309 WeakPolarHBondContact OD1-CD 3.47Å; N281-R309 VanDerWaalsContact OD1-CZ 3.24Å; N281-R309 PolarHBondContact OD1-NE 3.33Å; N281-R309 VanDerWaalsContact OD1-NE 3.15Å; N281-R309 PolarHBondContact OD1-NH1 3.03Å
282	P	93.6	Very high	95	Very high	16 Å²	16	75.7 Å²	75.7	10%	0.104	38%	0.379	C	S	.	.			trans	-61.5	135.3	177.4	25.9	-35.7	0	0	0	111.7	Y275 H280 D286 L287 F305	Y275-P282 HydrophobicContact CE1-CB 3.81Å; H280-P282 VanDerWaalsContact C-CD 3.48Å; H280-P282 VanDerWaalsContact O-CD 3.29Å; H280-P282 WeakPolarHBondContact O-CD 3.5Å; P282-D286 WeakPolarHBondContact CA-OD2 3.15Å; P282-D286 HydrophobicContact CB-CB 3.61Å; P282-L287 HydrophobicContact CB-CD2 4.37Å; P282-L287 HydrophobicContact CB-CG 4.23Å; P282-L287 HydrophobicContact CG-CD2 4.11Å; P282-L287 HydrophobicContact CG-CG 4.38Å; P282-F305 VanDerWaalsContact CD-CD1 3.46Å; P282-F305 HydrophobicContact CG-CB 4.22Å; P282-F305 HydrophobicContact CG-CD1 3.53Å; P282-F305 HydrophobicContact CG-CD2 3.88Å; P282-F305 HydrophobicContact CG-CE1 3.79Å; P282-F305 HydrophobicContact CG-CE2 4.14Å; P282-F305 HydrophobicContact CG-CG 3.59Å; P282-F305 HydrophobicContact CG-CZ 4.1Å
283	D	94.5	Very high	95	Very high	83 Å²	83	81.8 Å²	81.8	44%	0.444	41%	0.405	S	S	.	.			trans	-81.1	-167.3	180	86.7	-12.7	0	0	0	112.8	N281 K285 D286 L287	N281-D283 PolarHBondContact O-N 2.8Å; D283-K285 PolarHBondContact O-N 3.11Å; D283-K285 WeakPolarHBondContact OD1-CA 3.38Å; D283-K285 WeakPolarHBondContact OD1-CB 3.1Å; D283-K285 PolarHBondContact OD1-N 3.04Å; D283-D286 PolarHBondContact N-OD2 2.81Å; D283-D286 WeakPolarHBondContact OD1-CB 3.28Å; D283-D286 PolarHBondContact OD1-N 2.88Å; D283-L287 WeakPolarHBondContact O-CB 3.21Å; D283-L287 WeakPolarHBondContact O-CD1 3.42Å; D283-L287 WeakPolarHBondContact O-CG 3.34Å; D283-L287 PolarHBondContact O-N 3.49Å
284	A	94.3	Very high	94.9	Very high	62 Å²	62	75.5 Å²	75.5	51%	0.512	38%	0.383	S	S	.	.	H	α-helix	trans	-67.9	-29.5	177.7	0	0	0	0	0	114.5	K288	A284-K288 PolarHBondContact O-N 3.47Å
285	K	94.9	Very high	94.8	Very high	167 Å²	167	76.3 Å²	76.3	73%	0.726	40%	0.396	S	S	*	.	H	α-helix	trans	-82.5	-45.3	-178.7	-177.1	-176.1	178.3	-175.5	0	110.7	D283 L287 K288 H289	D283-K285 PolarHBondContact O-N 3.11Å; D283-K285 WeakPolarHBondContact OD1-CA 3.38Å; D283-K285 WeakPolarHBondContact OD1-CB 3.1Å; D283-K285 PolarHBondContact OD1-N 3.04Å; K285-L287 PolarHBondContact O-N 3.31Å; K285-K288 WeakPolarHBondContact O-CB 3.17Å; K285-K288 PolarHBondContact O-N 2.76Å; K285-H289 PolarHBondContact O-N 2.81Å
286	D	95.2	Very high	94.7	Very high	39 Å²	39	75.1 Å²	75.1	21%	0.209	39%	0.393	C	S	.	.	H	α-helix	trans	-54.7	-50.3	172.4	-65.7	-38	0	0	0	111.2	Y275 N279 P282 D283 K288 H289 L290	Y275-D286 PolarHBondContact OH-OD1 3.49Å; Y275-D286 PolarHBondContact OH-OD2 3.05Å; N279-D286 PolarHBondContact ND2-OD2 3.49Å; P282-D286 WeakPolarHBondContact CA-OD2 3.15Å; P282-D286 HydrophobicContact CB-CB 3.61Å; D283-D286 PolarHBondContact N-OD2 2.81Å; D283-D286 WeakPolarHBondContact OD1-CB 3.28Å; D283-D286 PolarHBondContact OD1-N 2.88Å; D286-K288 PolarHBondContact O-N 3.26Å; D286-H289 PolarHBondContact O-N 3.07Å; D286-L290 WeakPolarHBondContact O-CB 3.45Å; D286-L290 WeakPolarHBondContact O-CG 3.42Å; D286-L290 PolarHBondContact O-N 3.39Å
287	L	95.8	Very high	94.6	Very high	9 Å²	9	77.9 Å²	77.9	5%	0.047	41%	0.412	C	S	.	.	H	α-helix	trans	-62.2	-30.5	177.3	-73.6	170.1	0	0	0	112.6	P282 D283 K285 A291 K298 L301 Q302	P282-L287 HydrophobicContact CB-CD2 4.37Å; P282-L287 HydrophobicContact CB-CG 4.23Å; P282-L287 HydrophobicContact CG-CD2 4.11Å; P282-L287 HydrophobicContact CG-CG 4.38Å; D283-L287 WeakPolarHBondContact O-CB 3.21Å; D283-L287 WeakPolarHBondContact O-CD1 3.42Å; D283-L287 WeakPolarHBondContact O-CG 3.34Å; D283-L287 PolarHBondContact O-N 3.49Å; K285-L287 PolarHBondContact O-N 3.31Å; L287-A291 VanDerWaalsContact O-CB 3.26Å; L287-A291 WeakPolarHBondContact O-CB 3.37Å; L287-A291 PolarHBondContact O-N 2.93Å; L287-K298 HydrophobicContact CB-CD 4.43Å; L287-K298 HydrophobicContact CB-CG 4.15Å; L287-K298 HydrophobicContact CD1-CG 4.3Å; L287-L301 HydrophobicContact CD2-CB 3.74Å; L287-Q302 HydrophobicContact CD1-CG 3.58Å; L287-Q302 HydrophobicContact CD2-CG 4.24Å
288	K	95.9	Very high	94.7	Very high	143 Å²	143	74.6 Å²	74.6	62%	0.622	40%	0.395	S	S	*	.	H	α-helix	trans	-70.8	-44.6	174.9	-172.7	-179.4	179.3	-178.1	0	110.7	A284 K285 D286 A291 Q292	A284-K288 PolarHBondContact O-N 3.47Å; K285-K288 WeakPolarHBondContact O-CB 3.17Å; K285-K288 PolarHBondContact O-N 2.76Å; D286-K288 PolarHBondContact O-N 3.26Å; K288-A291 PolarHBondContact O-N 3.23Å; K288-Q292 WeakPolarHBondContact O-CG 3.47Å; K288-Q292 PolarHBondContact O-N 3.06Å; K288-Q292 VanDerWaalsContact O-N 3.11Å
289	H	95.9	Very high	94.8	Very high	114 Å²	114	74.6 Å²	74.6	53%	0.528	39%	0.385	S	S	.	.	H	α-helix	trans	-67.2	-41	178.4	-166.8	58.7	0	0	0	112.4	K285 D286 Q292 K293	K285-H289 PolarHBondContact O-N 2.81Å; D286-H289 PolarHBondContact O-N 3.07Å; H289-Q292 PolarHBondContact CE1-OE1 3.38Å; H289-Q292 VanDerWaalsContact CE1-OE1 3.26Å; H289-Q292 PolarHBondContact O-N 3.09Å; H289-K293 PolarHBondContact O-N 3.13Å
290	L	96.3	Very high	94.9	Very high	4 Å²	4	74.4 Å²	74.4	2%	0.021	38%	0.383	C	S	.	.	H	α-helix	trans	-65.5	-36	173.4	-74	167.3	0	0	0	112.4	T271 Y275 D286 K293 T294 L301 F305	T271-L290 HydrophobicContact CG2-CD2 4.25Å; Y275-L290 HydrophobicContact CD1-CD1 3.86Å; Y275-L290 HydrophobicContact CD2-CD1 4.2Å; Y275-L290 HydrophobicContact CD2-CD2 4.14Å; Y275-L290 HydrophobicContact CD2-CG 4.35Å; Y275-L290 HydrophobicContact CE1-CD1 4.28Å; Y275-L290 HydrophobicContact CG-CD1 3.85Å; Y275-L290 HydrophobicContact CG-CD2 4.02Å; Y275-L290 HydrophobicContact CG-CG 4.35Å; D286-L290 WeakPolarHBondContact O-CB 3.45Å; D286-L290 WeakPolarHBondContact O-CG 3.42Å; D286-L290 PolarHBondContact O-N 3.39Å; L290-K293 PolarHBondContact O-N 3.09Å; L290-T294 WeakPolarHBondContact O-CB 3.19Å; L290-T294 WeakPolarHBondContact O-CG2 3.45Å; L290-T294 PolarHBondContact O-N 2.72Å; L290-T294 PolarHBondContact O-OG1 3.16Å; L290-L301 HydrophobicContact CB-CD1 3.77Å; L290-F305 HydrophobicContact CD1-CE2 3.77Å; L290-F305 HydrophobicContact CD1-CZ 3.79Å
291	A	96.9	Very high	95.1	Very high	25 Å²	25	71.4 Å²	71.4	21%	0.207	37%	0.369	C	S	.	.	H	α-helix	trans	-62.4	-45.8	174.5	0	0	0	0	0	111.2	L287 K288 T294 G295 L296 L301	L287-A291 VanDerWaalsContact O-CB 3.26Å; L287-A291 WeakPolarHBondContact O-CB 3.37Å; L287-A291 PolarHBondContact O-N 2.93Å; K288-A291 PolarHBondContact O-N 3.23Å; A291-T294 PolarHBondContact O-N 2.7Å; A291-G295 WeakPolarHBondContact O-CA 3.41Å; A291-G295 PolarHBondContact O-N 2.77Å; A291-L296 WeakPolarHBondContact CA-O 3.25Å; A291-L296 VanDerWaalsContact CB-O 3.25Å; A291-L296 WeakPolarHBondContact CB-O 3.42Å; A291-L301 HydrophobicContact CB-CD1 3.91Å; A291-L301 VanDerWaalsContact N-CD1 3.33Å
292	Q	95.9	Very high	95.2	Very high	134 Å²	134	70 Å²	70	63%	0.626	36%	0.359	S	S	*	.	H	α-helix	trans	-61.1	-45.8	174.9	-70.6	173.4	-37.9	0	0	112.1	K288 H289 T294	K288-Q292 WeakPolarHBondContact O-CG 3.47Å; K288-Q292 PolarHBondContact O-N 3.06Å; K288-Q292 VanDerWaalsContact O-N 3.11Å; H289-Q292 PolarHBondContact CE1-OE1 3.38Å; H289-Q292 VanDerWaalsContact CE1-OE1 3.26Å; H289-Q292 PolarHBondContact O-N 3.09Å; Q292-T294 PolarHBondContact O-N 3.4Å
293	K	94.7	Very high	95.2	Very high	128 Å²	128	71.7 Å²	71.7	56%	0.557	37%	0.369	S	S	*	.	H	α-helix	trans	-69.9	-28	-179.8	-79.3	178.9	166	169	0	114.8	T271 H289 L290	T271-K293 HydrophobicContact CG2-CB 4.36Å; H289-K293 PolarHBondContact O-N 3.13Å; L290-K293 PolarHBondContact O-N 3.09Å
294	T	94.6	Very high	95.3	Very high	12 Å²	12	69.4 Å²	69.4	7%	0.074	36%	0.355	C	S	.	.	H	α-helix	trans	-108.3	-15.9	-173.9	61.9	0	0	0	0	114.5	Q268 T271 M272 L290 A291 Q292 L296	Q268-T294 PolarHBondContact NE2-O 2.93Å; T271-T294 HydrophobicContact CG2-CG2 4.08Å; M272-T294 HydrophobicContact CG-CG2 4.31Å; L290-T294 WeakPolarHBondContact O-CB 3.19Å; L290-T294 WeakPolarHBondContact O-CG2 3.45Å; L290-T294 PolarHBondContact O-N 2.72Å; L290-T294 PolarHBondContact O-OG1 3.16Å; A291-T294 PolarHBondContact O-N 2.7Å; Q292-T294 PolarHBondContact O-N 3.4Å; T294-L296 PolarHBondContact O-N 2.84Å; T294-L296 WeakPolarHBondContact OG1-CB 3.43Å; T294-L296 PolarHBondContact OG1-N 2.81Å
295	G	95	Very high	95.5	Very high	69 Å²	69	66.5 Å²	66.5	71%	0.711	33%	0.33	S	S	*	.			trans	68.4	15.2	-170.3	0	0	0	0	0	113.9	A291	A291-G295 WeakPolarHBondContact O-CA 3.41Å; A291-G295 PolarHBondContact O-N 2.77Å
296	L	94	Very high	95.5	Very high	20 Å²	20	63.9 Å²	63.9	11%	0.105	32%	0.321	C	S	.	.			trans	-97.1	144.8	179.3	-61	173.6	0	0	0	110.6	F264 Q268 M272 A291 T294 I300 L301	F264-L296 HydrophobicContact CD1-CD1 3.79Å; F264-L296 HydrophobicContact CD1-CD2 4.12Å; F264-L296 HydrophobicContact CE1-CD1 3.8Å; F264-L296 HydrophobicContact CE1-CD2 4.16Å; Q268-L296 HydrophobicContact CB-CD1 4.28Å; M272-L296 HydrophobicContact CE-CD1 3.85Å; M272-L296 HydrophobicContact SD-CD1 3.81Å; A291-L296 WeakPolarHBondContact CA-O 3.25Å; A291-L296 VanDerWaalsContact CB-O 3.25Å; A291-L296 WeakPolarHBondContact CB-O 3.42Å; T294-L296 PolarHBondContact O-N 2.84Å; T294-L296 WeakPolarHBondContact OG1-CB 3.43Å; T294-L296 PolarHBondContact OG1-N 2.81Å; L296-I300 HydrophobicContact CB-CG2 4.33Å; L296-I300 HydrophobicContact CD1-CG2 4.46Å; L296-I300 HydrophobicContact CD2-CG2 4.29Å; L296-L301 HydrophobicContact CB-CD2 4.08Å; L296-L301 HydrophobicContact CB-CG 4.04Å; L296-L301 HydrophobicContact CD1-CD2 3.94Å
297	T	95	Very high	95.5	Very high	83 Å²	83	66.8 Å²	66.8	51%	0.509	34%	0.336	S	S	.	.			trans	-68.2	150	177.2	70.2	0	0	0	0	111.3	R299 I300 L301	T297-R299 PolarHBondContact O-N 3.15Å; T297-R299 VanDerWaalsContact O-N 3.08Å; T297-I300 HydrophobicContact CG2-CD1 4.46Å; T297-I300 PolarHBondContact O-N 2.87Å; T297-I300 WeakPolarHBondContact OG1-CD1 3.33Å; T297-I300 WeakPolarHBondContact OG1-CG1 3.19Å; T297-I300 PolarHBondContact OG1-N 3.34Å; T297-L301 PolarHBondContact O-N 2.8Å
298	K	94.6	Very high	95.5	Very high	91 Å²	91	67.1 Å²	67.1	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-48.8	-38.8	175.9	179.7	167	-178.2	175.3	0	112.3	L287 L301 Q302	L287-K298 HydrophobicContact CB-CD 4.43Å; L287-K298 HydrophobicContact CB-CG 4.15Å; L287-K298 HydrophobicContact CD1-CG 4.3Å; K298-L301 PolarHBondContact O-N 3.26Å; K298-Q302 WeakPolarHBondContact O-CB 3.47Å; K298-Q302 VanDerWaalsContact O-CG 3.26Å; K298-Q302 WeakPolarHBondContact O-CG 3.45Å; K298-Q302 PolarHBondContact O-N 3.07Å
299	R	94.4	Very high	95.5	Very high	152 Å²	152	63.4 Å²	63.4	57%	0.574	32%	0.322	S	S	*	.	H	α-helix	trans	-68.4	-40.3	178	-175	58.1	-177.6	142.5	0.1	113.2	T297 L301 Q302 V303	T297-R299 PolarHBondContact O-N 3.15Å; T297-R299 VanDerWaalsContact O-N 3.08Å; R299-L301 VanDerWaalsContact C-N 3.35Å; R299-Q302 PolarHBondContact O-N 2.86Å; R299-V303 WeakPolarHBondContact O-CG2 3.37Å; R299-V303 PolarHBondContact O-N 3.23Å
300	I	95	Very high	95.3	Very high	47 Å²	47	59 Å²	59	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-43.7	175.9	-69.8	169.2	0	0	0	110	T262 F264 L296 T297 V303 W304	T262-I300 HydrophobicContact CG2-CD1 4.39Å; F264-I300 HydrophobicContact CE1-CG2 3.55Å; F264-I300 HydrophobicContact CZ-CG2 3.88Å; L296-I300 HydrophobicContact CB-CG2 4.33Å; L296-I300 HydrophobicContact CD1-CG2 4.46Å; L296-I300 HydrophobicContact CD2-CG2 4.29Å; T297-I300 HydrophobicContact CG2-CD1 4.46Å; T297-I300 PolarHBondContact O-N 2.87Å; T297-I300 WeakPolarHBondContact OG1-CD1 3.33Å; T297-I300 WeakPolarHBondContact OG1-CG1 3.19Å; T297-I300 PolarHBondContact OG1-N 3.34Å; I300-V303 PolarHBondContact O-N 3.28Å; I300-W304 WeakPolarHBondContact O-CB 3.12Å; I300-W304 PolarHBondContact O-N 2.81Å
301	L	96.3	Very high	95.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-49.1	175.8	-67.9	172.1	0	0	0	111.8	M272 L287 L290 A291 L296 T297 K298 R299 V303 W304 F305	M272-L301 HydrophobicContact CG-CD2 4.01Å; M272-L301 HydrophobicContact SD-CD2 3.49Å; M272-L301 WeakPolarHBondContact SD-CD2 3.21Å; L287-L301 HydrophobicContact CD2-CB 3.74Å; L290-L301 HydrophobicContact CB-CD1 3.77Å; A291-L301 HydrophobicContact CB-CD1 3.91Å; A291-L301 VanDerWaalsContact N-CD1 3.33Å; L296-L301 HydrophobicContact CB-CD2 4.08Å; L296-L301 HydrophobicContact CB-CG 4.04Å; L296-L301 HydrophobicContact CD1-CD2 3.94Å; T297-L301 PolarHBondContact O-N 2.8Å; K298-L301 PolarHBondContact O-N 3.26Å; R299-L301 VanDerWaalsContact C-N 3.35Å; L301-V303 VanDerWaalsContact C-N 3.3Å; L301-V303 PolarHBondContact O-N 2.83Å; L301-W304 WeakPolarHBondContact O-CA 3.12Å; L301-W304 WeakPolarHBondContact O-CB 3.44Å; L301-W304 PolarHBondContact O-N 3Å; L301-F305 WeakPolarHBondContact O-CD2 3.32Å; L301-F305 PolarHBondContact O-N 3.11Å
302	Q	95.6	Very high	94.8	Very high	71 Å²	71	67.7 Å²	67.7	33%	0.332	34%	0.339	S	S	.	.	H	α-helix	trans	-53.3	-46.1	175.4	-76.2	170.7	-24.7	0	0	112.5	L287 K298 R299 F305 Q306	L287-Q302 HydrophobicContact CD1-CG 3.58Å; L287-Q302 HydrophobicContact CD2-CG 4.24Å; K298-Q302 WeakPolarHBondContact O-CB 3.47Å; K298-Q302 VanDerWaalsContact O-CG 3.26Å; K298-Q302 WeakPolarHBondContact O-CG 3.45Å; K298-Q302 PolarHBondContact O-N 3.07Å; R299-Q302 PolarHBondContact O-N 2.86Å; Q302-F305 PolarHBondContact O-N 2.99Å; Q302-Q306 VanDerWaalsContact O-CB 3.3Å; Q302-Q306 WeakPolarHBondContact O-CB 3.42Å; Q302-Q306 PolarHBondContact O-N 2.89Å
303	V	95.2	Very high	94.5	Very high	52 Å²	52	68.3 Å²	68.3	32%	0.315	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-37.3	177.1	172.9	0	0	0	0	111.3	R299 I300 L301 N307	R299-V303 WeakPolarHBondContact O-CG2 3.37Å; R299-V303 PolarHBondContact O-N 3.23Å; I300-V303 PolarHBondContact O-N 3.28Å; L301-V303 VanDerWaalsContact C-N 3.3Å; L301-V303 PolarHBondContact O-N 2.83Å; V303-N307 WeakPolarHBondContact CG1-ND2 3.12Å; V303-N307 WeakPolarHBondContact O-CB 3.36Å; V303-N307 VanDerWaalsContact O-CG 3.3Å; V303-N307 PolarHBondContact O-N 2.69Å; V303-N307 PolarHBondContact O-ND2 3.1Å
304	W	96.6	Very high	94	Very high	36 Å²	36	70.4 Å²	70.4	14%	0.136	34%	0.34	C	S	.	.	H	α-helix	trans	-62.9	-50.2	175	-171.6	98.3	0	0	0	111.3	F264 M272 R273 F276 I300 L301 Q306 N307 A308	F264-W304 AromaticContact CE2-CD1 3.79Å; F264-W304 AromaticContact CZ-CD1 3.85Å; M272-W304 HydrophobicContact CB-CD2 4.14Å; M272-W304 HydrophobicContact CB-CE3 3.99Å; M272-W304 HydrophobicContact CB-CH2 3.65Å; M272-W304 HydrophobicContact CB-CZ2 3.77Å; M272-W304 HydrophobicContact CB-CZ3 3.76Å; M272-W304 HydrophobicContact CE-CD2 4.22Å; M272-W304 HydrophobicContact CE-CG 4.14Å; M272-W304 HydrophobicContact SD-CB 4.24Å; M272-W304 HydrophobicContact SD-CD2 3.7Å; M272-W304 HydrophobicContact SD-CE3 4.16Å; M272-W304 HydrophobicContact SD-CG 3.7Å; R273-W304 HydrophobicContact CG-CH2 4.15Å; R273-W304 HydrophobicContact CG-CZ2 4.14Å; F276-W304 HydrophobicContact CB-CH2 4.35Å; F276-W304 HydrophobicContact CB-CZ3 4.25Å; F276-W304 HydrophobicContact CD2-CZ3 4.13Å; F276-W304 HydrophobicContact CG-CZ3 4.46Å; I300-W304 WeakPolarHBondContact O-CB 3.12Å; I300-W304 PolarHBondContact O-N 2.81Å; L301-W304 WeakPolarHBondContact O-CA 3.12Å; L301-W304 WeakPolarHBondContact O-CB 3.44Å; L301-W304 PolarHBondContact O-N 3Å; W304-Q306 PolarHBondContact O-N 2.64Å; W304-N307 PolarHBondContact O-N 2.82Å; W304-A308 HydrophobicContact CE3-CB 4.01Å; W304-A308 HydrophobicContact CH2-CB 4.1Å; W304-A308 HydrophobicContact CZ3-CB 3.76Å; W304-A308 WeakPolarHBondContact O-CB 3.03Å; W304-A308 PolarHBondContact O-N 2.87Å
305	F	97.2	Very high	93.4	Very high	1 Å²	1	73.6 Å²	73.6	0%	0.004	36%	0.357	C	S	.	.	H	α-helix	trans	-64.9	-38.6	178.8	-84.7	-89.3	0	0	0	112.5	Y275 F276 P282 L290 L301 Q302 N307 A308 R309	Y275-F305 AromaticContact CD1-CE1 3.87Å; Y275-F305 HydrophobicContact CD1-CE1 3.87Å; Y275-F305 AromaticContact CD1-CZ 3.71Å; Y275-F305 HydrophobicContact CD1-CZ 3.71Å; Y275-F305 HydrophobicContact CG-CZ 4.41Å; F276-F305 HydrophobicContact CB-CE1 4.19Å; F276-F305 AromaticContact CD2-CD1 3.69Å; F276-F305 HydrophobicContact CD2-CD1 3.69Å; F276-F305 AromaticContact CD2-CE1 3.81Å; F276-F305 HydrophobicContact CD2-CE1 3.81Å; F276-F305 HydrophobicContact CE2-CD1 4.31Å; P282-F305 VanDerWaalsContact CD-CD1 3.46Å; P282-F305 HydrophobicContact CG-CB 4.22Å; P282-F305 HydrophobicContact CG-CD1 3.53Å; P282-F305 HydrophobicContact CG-CD2 3.88Å; P282-F305 HydrophobicContact CG-CE1 3.79Å; P282-F305 HydrophobicContact CG-CE2 4.14Å; P282-F305 HydrophobicContact CG-CG 3.59Å; P282-F305 HydrophobicContact CG-CZ 4.1Å; L290-F305 HydrophobicContact CD1-CE2 3.77Å; L290-F305 HydrophobicContact CD1-CZ 3.79Å; L301-F305 WeakPolarHBondContact O-CD2 3.32Å; L301-F305 PolarHBondContact O-N 3.11Å; Q302-F305 PolarHBondContact O-N 2.99Å; F305-N307 VanDerWaalsContact C-N 3.34Å; F305-N307 PolarHBondContact O-N 3.45Å; F305-A308 PolarHBondContact O-N 3.3Å; F305-R309 WeakPolarHBondContact O-CB 3.37Å; F305-R309 WeakPolarHBondContact O-CG 3.46Å; F305-R309 PolarHBondContact O-N 2.76Å
306	Q	94.9	Very high	92.4	Very high	112 Å²	112	72.8 Å²	72.8	52%	0.523	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-43.7	173.4	-171.8	176.2	25	0	0	111.7	Q302 W304 A310	Q302-Q306 VanDerWaalsContact O-CB 3.3Å; Q302-Q306 WeakPolarHBondContact O-CB 3.42Å; Q302-Q306 PolarHBondContact O-N 2.89Å; W304-Q306 PolarHBondContact O-N 2.64Å; Q306-A310 WeakPolarHBondContact O-CB 3.49Å; Q306-A310 PolarHBondContact O-N 3.25Å
307	N	96.4	Very high	90.6	Very high	100 Å²	100	78.7 Å²	78.7	54%	0.535	36%	0.364	S	S	.	.	H	α-helix	trans	-69.9	-37.3	175.7	-73.7	-46.4	0	0	0	112.8	V303 W304 F305 A310 K311	V303-N307 WeakPolarHBondContact CG1-ND2 3.12Å; V303-N307 WeakPolarHBondContact O-CB 3.36Å; V303-N307 VanDerWaalsContact O-CG 3.3Å; V303-N307 PolarHBondContact O-N 2.69Å; V303-N307 PolarHBondContact O-ND2 3.1Å; W304-N307 PolarHBondContact O-N 2.82Å; F305-N307 VanDerWaalsContact C-N 3.34Å; F305-N307 PolarHBondContact O-N 3.45Å; N307-A310 PolarHBondContact O-N 3.02Å; N307-K311 PolarHBondContact O-N 2.8Å
308	A	95.5	Very high	88.8	Confident	16 Å²	16	77.7 Å²	77.7	13%	0.132	36%	0.364	C	S	.	.	H	α-helix	trans	-64.8	-46.7	176.7	0	0	0	0	0	111	F276 W304 F305 A310 K311 F312	F276-A308 HydrophobicContact CD2-CB 3.74Å; F276-A308 HydrophobicContact CE2-CB 3.42Å; F276-A308 VanDerWaalsContact CE2-CB 3.42Å; F276-A308 HydrophobicContact CG-CB 4.48Å; F276-A308 HydrophobicContact CZ-CB 3.92Å; W304-A308 HydrophobicContact CE3-CB 4.01Å; W304-A308 HydrophobicContact CH2-CB 4.1Å; W304-A308 HydrophobicContact CZ3-CB 3.76Å; W304-A308 WeakPolarHBondContact O-CB 3.03Å; W304-A308 PolarHBondContact O-N 2.87Å; F305-A308 PolarHBondContact O-N 3.3Å; A308-A310 VanDerWaalsContact C-N 3.35Å; A308-A310 PolarHBondContact O-N 2.91Å; A308-K311 CarbonylContact O-C 3.58Å; A308-K311 PolarHBondContact O-N 3.48Å; A308-K311 VanDerWaalsContact O-N 3.09Å; A308-F312 WeakPolarHBondContact O-CB 3.29Å; A308-F312 PolarHBondContact O-N 3.49Å
309	R	96.1	Very high	86.9	Confident	64 Å²	64	79.5 Å²	79.5	24%	0.242	37%	0.374	C	S	.	.	H	α-helix	trans	-59.5	-42.3	171.7	-71.2	-165.5	-66.4	-94.8	13.1	112.6	F276 H280 N281 F305 K311 F312 R313	F276-R309 HydrophobicContact CE2-CG 3.8Å; F276-R309 HydrophobicContact CZ-CG 4.12Å; H280-R309 HydrophobicContact CB-CG 4.31Å; H280-R309 VanDerWaalsContact O-CD 3.25Å; H280-R309 WeakPolarHBondContact O-CD 3.32Å; H280-R309 WeakPolarHBondContact O-CG 3.31Å; H280-R309 PolarHBondContact O-NH1 2.84Å; N281-R309 WeakPolarHBondContact OD1-CD 3.47Å; N281-R309 VanDerWaalsContact OD1-CZ 3.24Å; N281-R309 PolarHBondContact OD1-NE 3.33Å; N281-R309 VanDerWaalsContact OD1-NE 3.15Å; N281-R309 PolarHBondContact OD1-NH1 3.03Å; F305-R309 WeakPolarHBondContact O-CB 3.37Å; F305-R309 WeakPolarHBondContact O-CG 3.46Å; F305-R309 PolarHBondContact O-N 2.76Å; R309-K311 VanDerWaalsContact C-N 3.27Å; R309-K311 PolarHBondContact O-N 2.95Å; R309-F312 PolarHBondContact O-N 3.05Å; R309-R313 PolarHBondContact O-N 3.47Å
310	A	92.2	Very high	84.8	Confident	22 Å²	22	79 Å²	79	18%	0.182	38%	0.378	C	S	.	.	H	α-helix	trans	-64.6	-31.5	175.5	0	0	0	0	0	112.4	Q306 N307 A308 R314	Q306-A310 WeakPolarHBondContact O-CB 3.49Å; Q306-A310 PolarHBondContact O-N 3.25Å; N307-A310 PolarHBondContact O-N 3.02Å; A308-A310 VanDerWaalsContact C-N 3.35Å; A308-A310 PolarHBondContact O-N 2.91Å; A310-R314 WeakPolarHBondContact O-CG 3.19Å; A310-R314 PolarHBondContact O-NH1 3.47Å
311	K	91.9	Very high	82.4	Confident	132 Å²	132	84 Å²	84	57%	0.574	40%	0.4	S	S	*	.	H	α-helix	trans	-73.8	-44.8	171.6	-169	-177.7	178.2	-170.9	0	111.2	N307 A308 R309 R313 R314 N315	N307-K311 PolarHBondContact O-N 2.8Å; A308-K311 CarbonylContact O-C 3.58Å; A308-K311 PolarHBondContact O-N 3.48Å; A308-K311 VanDerWaalsContact O-N 3.09Å; R309-K311 VanDerWaalsContact C-N 3.27Å; R309-K311 PolarHBondContact O-N 2.95Å; K311-R313 PolarHBondContact O-N 3.14Å; K311-R314 WeakPolarHBondContact O-CB 3.34Å; K311-R314 PolarHBondContact O-N 3.27Å; K311-R314 VanDerWaalsContact O-N 3.09Å; K311-N315 PolarHBondContact O-N 3.16Å; K311-N315 PolarHBondContact O-OD1 3.01Å
312	F	90.7	Very high	80.1	Confident	79 Å²	79	88.8 Å²	88.8	35%	0.346	43%	0.429	S	S	.	.	H	α-helix	trans	-58.4	-45.6	-179.7	-176.1	-119.1	0	0	0	112.3	F276 H280 A308 R309 R314 N315 I316	F276-F312 HydrophobicContact CE1-CB 3.94Å; F276-F312 HydrophobicContact CE1-CD2 4.32Å; F276-F312 HydrophobicContact CE1-CG 4.03Å; F276-F312 HydrophobicContact CZ-CB 3.85Å; F276-F312 HydrophobicContact CZ-CG 4.25Å; H280-F312 AromaticContact CE1-CD1 3.86Å; H280-F312 AromaticContact CE1-CE1 3.16Å; H280-F312 WeakPolarHBondContact CE1-CE1 3.42Å; H280-F312 AromaticContact CE1-CZ 3.46Å; H280-F312 VanDerWaalsContact CE1-CZ 3.46Å; H280-F312 WeakPolarHBondContact CE1-CZ 3.38Å; H280-F312 AromaticContact ND1-CE1 3.68Å; H280-F312 AromaticContact NE2-CD1 3.99Å; H280-F312 AromaticContact NE2-CE1 3.63Å; H280-F312 AromaticContact NE2-CZ 3.77Å; A308-F312 WeakPolarHBondContact O-CB 3.29Å; A308-F312 PolarHBondContact O-N 3.49Å; R309-F312 PolarHBondContact O-N 3.05Å; F312-R314 VanDerWaalsContact C-N 3.33Å; F312-R314 PolarHBondContact O-N 2.96Å; F312-N315 CarbonylContact O-C 3.6Å; F312-N315 WeakPolarHBondContact O-CA 3.33Å; F312-N315 WeakPolarHBondContact O-CB 3.42Å; F312-N315 PolarHBondContact O-N 3.33Å; F312-I316 HydrophobicContact CD1-CD1 3.65Å; F312-I316 HydrophobicContact CD1-CG1 4.48Å; F312-I316 HydrophobicContact CD2-CD1 4.43Å; F312-I316 HydrophobicContact CD2-CG1 4.46Å; F312-I316 HydrophobicContact CE1-CD1 3.2Å; F312-I316 HydrophobicContact CE1-CG1 4.14Å; F312-I316 HydrophobicContact CE2-CD1 4.06Å; F312-I316 HydrophobicContact CE2-CG1 4.11Å; F312-I316 HydrophobicContact CG-CD1 4.25Å; F312-I316 HydrophobicContact CZ-CD1 3.44Å; F312-I316 VanDerWaalsContact CZ-CD1 3.44Å; F312-I316 HydrophobicContact CZ-CG1 3.94Å; F312-I316 PolarHBondContact O-N 2.75Å
313	R	89.4	Confident	77.4	Confident	148 Å²	148	92.3 Å²	92.3	56%	0.558	45%	0.45	S	S	*	.	H	α-helix	trans	-60	-38.3	173.8	-69.6	-165.1	-57.4	-93.5	4.8	113.5	R309 K311 N315 M317	R309-R313 PolarHBondContact O-N 3.47Å; K311-R313 PolarHBondContact O-N 3.14Å; R313-N315 PolarHBondContact O-N 3.2Å; R313-M317 WeakPolarHBondContact O-CB 3.44Å; R313-M317 VanDerWaalsContact O-CG 3.26Å; R313-M317 WeakPolarHBondContact O-CG 3.38Å; R313-M317 PolarHBondContact O-N 3.18Å; R313-M317 VanDerWaalsContact O-N 3.15Å
314	R	84	Confident	75.1	Confident	172 Å²	172	96.6 Å²	96.6	65%	0.649	47%	0.47	S	S	*	.	H	α-helix	trans	-67.8	-22.1	174	-68.4	-179.2	-165.2	102.4	-8.5	113.3	A310 K311 F312	A310-R314 WeakPolarHBondContact O-CG 3.19Å; A310-R314 PolarHBondContact O-NH1 3.47Å; K311-R314 WeakPolarHBondContact O-CB 3.34Å; K311-R314 PolarHBondContact O-N 3.27Å; K311-R314 VanDerWaalsContact O-N 3.09Å; F312-R314 VanDerWaalsContact C-N 3.33Å; F312-R314 PolarHBondContact O-N 2.96Å
315	N	81.1	Confident	72.6	Confident	79 Å²	79	104 Å²	104	42%	0.422	51%	0.506	S	S	.	.	H	α-helix	trans	-88.1	-39.3	177.5	-83.7	53.7	0	0	0	111.9	K311 F312 R313 A318 H319	K311-N315 PolarHBondContact O-N 3.16Å; K311-N315 PolarHBondContact O-OD1 3.01Å; F312-N315 CarbonylContact O-C 3.6Å; F312-N315 WeakPolarHBondContact O-CA 3.33Å; F312-N315 WeakPolarHBondContact O-CB 3.42Å; F312-N315 PolarHBondContact O-N 3.33Å; R313-N315 PolarHBondContact O-N 3.2Å; N315-A318 PolarHBondContact O-N 3.29Å; N315-A318 VanDerWaalsContact O-N 3.11Å; N315-H319 PolarHBondContact O-CD2 3.04Å; N315-H319 PolarHBondContact O-N 2.98Å
316	I	74.4	Confident	69.4	Low	51 Å²	51	107.5 Å²	107.5	26%	0.262	54%	0.542	S	S	.	.	H	α-helix	trans	-61.7	-47	173.9	-68.9	166.5	0	0	0	110.3	F312 A318 H319 E320	F312-I316 HydrophobicContact CD1-CD1 3.65Å; F312-I316 HydrophobicContact CD1-CG1 4.48Å; F312-I316 HydrophobicContact CD2-CD1 4.43Å; F312-I316 HydrophobicContact CD2-CG1 4.46Å; F312-I316 HydrophobicContact CE1-CD1 3.2Å; F312-I316 HydrophobicContact CE1-CG1 4.14Å; F312-I316 HydrophobicContact CE2-CD1 4.06Å; F312-I316 HydrophobicContact CE2-CG1 4.11Å; F312-I316 HydrophobicContact CG-CD1 4.25Å; F312-I316 HydrophobicContact CZ-CD1 3.44Å; F312-I316 VanDerWaalsContact CZ-CD1 3.44Å; F312-I316 HydrophobicContact CZ-CG1 3.94Å; F312-I316 PolarHBondContact O-N 2.75Å; I316-A318 PolarHBondContact O-N 3.39Å; I316-H319 PolarHBondContact O-N 3.42Å; I316-E320 HydrophobicContact CG2-CG 3.69Å; I316-E320 VanDerWaalsContact CG2-OE1 3.23Å; I316-E320 WeakPolarHBondContact CG2-OE1 3.09Å; I316-E320 WeakPolarHBondContact CG2-OE2 3.43Å; I316-E320 PolarHBondContact O-N 3.23Å
317	M	56.7	Low	66.7	Low	144 Å²	144	108.5 Å²	108.5	71%	0.709	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	0.4	174.9	-69.1	174.7	136.7	0	0	114.2	R313	R313-M317 WeakPolarHBondContact O-CB 3.44Å; R313-M317 VanDerWaalsContact O-CG 3.26Å; R313-M317 WeakPolarHBondContact O-CG 3.38Å; R313-M317 PolarHBondContact O-N 3.18Å; R313-M317 VanDerWaalsContact O-N 3.15Å
318	A	57.2	Low	63.9	Low	62 Å²	62	111.2 Å²	111.2	51%	0.512	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.5	3.8	173.2	0	0	0	0	0	113	N315 I316	N315-A318 PolarHBondContact O-N 3.29Å; N315-A318 VanDerWaalsContact O-N 3.11Å; I316-A318 PolarHBondContact O-N 3.39Å
319	H	54.3	Low	61	Low	130 Å²	130	117.1 Å²	117.1	60%	0.602	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	-25.7	180	-86.6	-75.3	0	0	0	113.6	N315 I316 E321 V322	N315-H319 PolarHBondContact O-CD2 3.04Å; N315-H319 PolarHBondContact O-N 2.98Å; I316-H319 PolarHBondContact O-N 3.42Å; H319-E321 PolarHBondContact O-N 2.93Å; H319-E321 VanDerWaalsContact O-N 3.16Å; H319-V322 PolarHBondContact O-N 3.44Å; H319-V322 VanDerWaalsContact O-N 3.17Å
320	E	50.4	Low	58.1	Low	141 Å²	141	122.1 Å²	122.1	66%	0.659	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-9.1	173.1	-77	174.9	164.6	0	0	113.6	I316 V322	I316-E320 HydrophobicContact CG2-CG 3.69Å; I316-E320 VanDerWaalsContact CG2-OE1 3.23Å; I316-E320 WeakPolarHBondContact CG2-OE1 3.09Å; I316-E320 WeakPolarHBondContact CG2-OE2 3.43Å; I316-E320 PolarHBondContact O-N 3.23Å; E320-V322 VanDerWaalsContact C-N 3.29Å
321	E	43.4	Very low	55.3	Low	151 Å²	151	127.7 Å²	127.7	71%	0.706	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	3.7	172.5	-65.3	-173.3	148.7	0	0	113.7	H319	H319-E321 PolarHBondContact O-N 2.93Å; H319-E321 VanDerWaalsContact O-N 3.16Å
322	V	48.9	Very low	52.9	Low	101 Å²	101	126.9 Å²	126.9	61%	0.612	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	-29.6	-171.1	-176.2	0	0	0	0	114.9	H319 E320	H319-V322 PolarHBondContact O-N 3.44Å; H319-V322 VanDerWaalsContact O-N 3.17Å; E320-V322 VanDerWaalsContact C-N 3.29Å
323	D	38.4	Very low	50.2	Low	145 Å²	145	128.4 Å²	128.4	78%	0.775	69%	0.686	S	S	*	*			trans	-125.9	68.2	-170.5	-71	-60.5	0	0	0	114
324	I	48.3	Very low	48	Very low	142 Å²	142	126.2 Å²	126.2	73%	0.728	69%	0.693	S	S	*	*	S	Bend	trans	-131.2	128.9	154	-56.9	-177.7	0	0	0	107.3
325	H	42.6	Very low	45.8	Very low	193 Å²	193	125.2 Å²	125.2	89%	0.894	70%	0.701	S	S	*	*			trans	96.4	76.4	-172.7	-56	89.3	0	0	0	116.3
326	G	31.7	Very low	44.5	Very low	74 Å²	74	127 Å²	127	76%	0.763	72%	0.72	S	S	*	*			trans	177.5	140.2	158.2	0	0	0	0	0	113.8
327	P	38	Very low	42.9	Very low	132 Å²	132	130.1 Å²	130.1	86%	0.857	74%	0.743	S	S	*	*			cis	-126.6	166.6	-26.3	37.1	-21.8	0	0	0	113.8
328	I	36.7	Very low	42.3	Very low	158 Å²	158	128.5 Å²	128.5	81%	0.81	75%	0.746	S	S	*	*			trans	-58.7	138.5	-177.5	-64.5	154.7	0	0	0	113.5
329	N	33.9	Very low	41.6	Very low	139 Å²	139	130.7 Å²	130.7	74%	0.743	76%	0.757	S	S	*	*			trans	-170.1	144.6	140.8	-113.2	-43.9	0	0	0	117.5
330	K	36.9	Very low	41.2	Very low	170 Å²	170	129.1 Å²	129.1	74%	0.739	76%	0.761	S	S	*	*			trans	82	79	150.4	-64.5	167.3	-174.2	-177.9	0	121.9
331	T	32	Very low	41.1	Very low	139 Å²	139	128.9 Å²	128.9	85%	0.853	77%	0.769	S	S	*	*				44.1	107.9	117.5	55.6	0	0	0	0	122
332	S	42	Very low	41.2	Very low	114 Å²	114	126.2 Å²	126.2	80%	0.797	77%	0.767	S	S	*	*			trans	-166.6	162.9	141.6	56.2	0	0	0	0	108.7
333	C	34	Very low	41	Very low	112 Å²	112	126.5 Å²	126.5	76%	0.757	77%	0.774	S	S	*	*			cis	-163.5	163.5	-29.9	-97.5	0	0	0	0	108.2
334	S	42.2	Very low	41.2	Very low	102 Å²	102	125.3 Å²	125.3	71%	0.713	77%	0.772	S	S	*	*			trans	62	138.2	170.2	29	0	0	0	0	116.8
335	D	39.8	Very low	41	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	78%	0.776	S	S	*	*			cis	-155.6	162.9	7.6	-90.8	-36.1	0	0	0	113.7
336	S	51.9	Low	41.4	Very low	118 Å²	118	128.1 Å²	128.1	83%	0.825	78%	0.775	S	S	*	*			trans	84.9	148.6	156.2	-61	0	0	0	0	121.9
337	P	42.1	Very low	41.7	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	77%	0.772	S	S	*	*			trans	-131.3	160	-151.2	40.6	-23.3	0	0	0	117.8
338	S	42.7	Very low	41.9	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	77%	0.772	S	S	*	*			trans	171.2	138.6	131.2	41.4	0	0	0	0	114.4
339	S	43.1	Very low	42.2	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	77%	0.769	S	S	*	*			trans	34.9	142.6	151.8	53.9	0	0	0	0	123
340	S	47.1	Very low	42.6	Very low	98 Å²	98	128.1 Å²	128.1	69%	0.685	77%	0.768	S	S	*	*			cis	177.1	143.2	-8.4	51	0	0	0	0	111.4
341	V	48.2	Very low	43.2	Very low	136 Å²	136	128 Å²	128	82%	0.824	78%	0.776	S	S	*	*			trans	52.5	148.4	160	-72.9	0	0	0	0	120.6
342	S	44.1	Very low	43.7	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	77%	0.773	S	S	*	*			cis	-167.9	155	-4.7	-111.9	0	0	0	0	112.9
343	S	45.2	Very low	43.8	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	78%	0.777	S	S	*	*			trans	54.5	144.8	136.5	-62.7	0	0	0	0	123.3
344	T	43.1	Very low	44.1	Very low	119 Å²	119	130.8 Å²	130.8	73%	0.73	78%	0.775	S	S	*	*			cis	-165	152.8	-5.9	-74.7	0	0	0	0	111.8
345	R	43.8	Very low	44.1	Very low	215 Å²	215	131.5 Å²	131.5	81%	0.811	78%	0.78	S	S	*	*			trans	-15.5	158	165.8	-63.6	176.1	151.3	127.9	-4.7	123.6
346	M	50.1	Low	44.3	Very low	179 Å²	179	130 Å²	130	88%	0.882	78%	0.781	S	S	*	*				170.2	167.6	105.4	-71.6	-105.2	-160.7	0	0	109.7
347	D	39.1	Very low	43.7	Very low	131 Å²	131	129.8 Å²	129.8	70%	0.701	78%	0.78	S	S	*	*				-172.1	177.3	-59.7	-149.3	-31.9	0	0	0	107
348	L	42	Very low	44	Very low	163 Å²	163	134 Å²	134	85%	0.853	79%	0.786	S	S	*	*			trans	119.2	152.3	163.3	-62.4	173.3	0	0	0	120.1
349	T	42.5	Very low	43.9	Very low	123 Å²	123	134.7 Å²	134.7	76%	0.755	79%	0.786	S	S	*	*			trans	-135.7	152.8	-149.3	51.2	0	0	0	0	117
350	A	42.5	Very low	44.1	Very low	87 Å²	87	133.4 Å²	133.4	72%	0.719	79%	0.79	S	S	*	*			trans	42.6	144.2	132.7	0	0	0	0	0	124.9
351	D	49	Very low	43.8	Very low	168 Å²	168	137.6 Å²	137.6	90%	0.898	80%	0.799	S	S	*	*				179.2	167.4	128	-90.9	-17.4	0	0	0	114.8
352	D	42.8	Very low	43.8	Very low	150 Å²	150	136.5 Å²	136.5	80%	0.802	79%	0.794	S	S	*	*			trans	-88.2	175.1	-162.3	-83.7	-65	0	0	0	118.8
353	I	44.5	Very low	43.4	Very low	172 Å²	172	140 Å²	140	88%	0.882	80%	0.804	S	S	*	*				169.1	163.4	125.2	-83.4	158.7	0	0	0	113.8
354	S	41	Very low	43.5	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	81%	0.809	S	S	*	*			trans	-127.4	178.9	-148.7	61.3	0	0	0	0	118.1
355	S	41.4	Very low	43.6	Very low	116 Å²	116	140.1 Å²	140.1	81%	0.811	81%	0.81	S	S	*	*			trans	76.7	158.5	163.9	82.1	0	0	0	0	117.7
356	S	44.4	Very low	43.9	Very low	120 Å²	120	139.7 Å²	139.7	84%	0.839	82%	0.815	S	S	*	*			cis	-154.1	176.6	11.6	60.1	0	0	0	0	112.8
357	S	40.1	Very low	44	Very low	113 Å²	113	144.2 Å²	144.2	79%	0.79	83%	0.834	S	S	*	*			trans	-109.6	152.8	-172.4	53.2	0	0	0	0	115.5
358	F	47.1	Very low	44.3	Very low	203 Å²	203	144.9 Å²	144.9	89%	0.89	84%	0.84	S	S	*	*			trans	-145.9	153.2	164.3	-159.5	-101.5	0	0	0	113.5
359	T	41.2	Very low	44.4	Very low	125 Å²	125	143.9 Å²	143.9	77%	0.767	84%	0.84	S	S	*	*			trans	-124.2	146.9	-170.1	49.1	0	0	0	0	113.1
360	G	46.9	Very low	44.5	Very low	81 Å²	81	145.1 Å²	145.1	84%	0.835	84%	0.844	S	S	*	*			trans	-169.8	126.7	171.3	0	0	0	0	0	115.8
361	H	40.2	Very low	44.6	Very low	186 Å²	186	148.5 Å²	148.5	86%	0.861	85%	0.852	S	S	*	*			trans	-143.8	173.1	172.5	-124.5	-49.5	0	0	0	105.1
362	P	48.3	Very low	44.4	Very low	113 Å²	113	147.3 Å²	147.3	73%	0.734	85%	0.849	S	S	*	*			cis	-136.7	-153.3	-5.9	42.4	-21.6	0	0	0	113.8
363	L	37.3	Very low	44.5	Very low	167 Å²	167	147.1 Å²	147.1	87%	0.874	85%	0.852	S	S	*	*			trans	-65.8	151.8	-175.7	-60	156.1	0	0	0	116.7
364	S	46.5	Very low	44.5	Very low	122 Å²	122	145.4 Å²	145.4	85%	0.853	85%	0.85	S	S	*	*			trans	-153.6	149.7	141.1	59.9	0	0	0	0	112
365	S	44.3	Very low	44.7	Very low	107 Å²	107	148.8 Å²	148.8	75%	0.748	86%	0.861	S	S	*	*			trans	-85.2	160	-178.7	-44	0	0	0	0	112.6
366	F	49.9	Very low	45	Very low	207 Å²	207	151.5 Å²	151.5	91%	0.908	87%	0.865	S	S	*	*				173.4	110.5	129.4	-98.5	-67.4	0	0	0	111.8
367	E	53.8	Low	45.1	Very low	274 Å²	274	154.4 Å²	154.4	100%	1.28	87%	0.867	S	S	*	*				-173.5	0	128.2	-103.2	-173.7	109	0	0	109.4

Retrieved 367 of 367 residues in 411.8 ms (Link to these results)

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