G4V9Y8_SCHMA Loading...

Putative DNA mismatch repair protein MLH1

AlphaFold DB , UniProt , Accession G4V9Y8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 918 aa.

						>G4V9Y8_SCHMA|G4V9Y8
MDKLNSDDNSKSSANLPLLTPDKSMPQTIKRLPKEVINRIAAGEVIQRPVNAIKELLENSIDAGSTMIKITVKDGGLKLIQVQDNGCGIHQSDLPILCERFTTSKLKEFSDLSKISTFGFRGEALSSLSHVALVTVTTRTANQNCAFKVKYRAGVAESKPVPCAGNPGTTIVAENLFYNAPIRKSALKNGREELSKVTEVVAQYAIHYAQQCGFHLHSESATGKSSIEQDLRTSAGWSRMDAIRAVIGSSIEQNLISFTSSQCSSSESTRLAIERYGLRYEGLLTAPNQVSSGCSPSLKLNLFINNRLVSCTPIKRIVECAYSSVISRGLSSNSTDHQAVLTNKKFKISTNSNIMYKSSTFNSLYVYLNIQLPVHTLDVNVHPTKAEVNFLHEDEIVNGLQDAVEQALLSSAQIQTFVRNCLPTPITFKNPKELNTHNDRSTDRPNEKVRIDLREQQLERFLSPQSNYMNNNMACSKLERLHNNSLKKSIGEMSPDIEVDSDEADEILKSNLLQENSSWNNSELDRSKIKATTEQSHLFYDQQEKDFDENELTTTAQNHSQSYTNSNATIDNNDTTVSLTSKPIIRTDTSLSSLQNTTTINDLLSKSNTLLAYSNNDMIESISSKPRHRTVYLMSILALKRNLECDLDQSIKNTLRSCKFIGFIDETRCLAQHHTELLLIRLKPLSQALFYQLLLTNFGNHGEIILREPAPLADLLSIGHEYLRKSSRYLSNLSSIEFIKEATATLVKHASMLWDYFSIKITTDSNGNQVLTGIPLIIADYIPELNQLPIYVTKLATQVSWSVESICFENICCITANFYAVSSSLFNDCSSSPISSSTSIIDDKSDKENTVSSSSLSPREWMIQHILWPILCSSLLPSRRYPNFDLDHNENDNKSFSLQSCFIRLTSLTDLYKVFERC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.3	Very low	35.8	Very low	242 Å²	242	151.9 Å²	151.9	100%	1.192	79%	0.792	S	S	*	*				0	139.1	0	-70.6	168.2	173.9	0	0	107.1
2	D	37.2	Very low	35.7	Very low	140 Å²	140	148.9 Å²	148.9	75%	0.749	79%	0.794	S	S	*	*			trans	33.8	102.1	168.5	-62.3	-31.6	0	0	0	121.8
3	K	37.9	Very low	35.5	Very low	182 Å²	182	146.8 Å²	146.8	79%	0.791	80%	0.798	S	S	*	*				79.4	134.1	117.7	-76.9	179.5	179.1	175.2	0	123
4	L	38.7	Very low	35.8	Very low	143 Å²	143	142.8 Å²	142.8	75%	0.749	79%	0.794	S	S	*	*			trans	83.3	108	145.3	-68.4	161.1	0	0	0	120.2
5	N	36.7	Very low	36.1	Very low	139 Å²	139	143.7 Å²	143.7	74%	0.743	80%	0.797	S	S	*	*				34.1	125.3	112.8	-63.2	45.4	0	0	0	118.2
6	S	35.4	Very low	36.3	Very low	82 Å²	82	144.4 Å²	144.4	57%	0.573	80%	0.798	S	S	*	*			cis	103.4	118.3	33.6	72.8	0	0	0	0	113.9
7	D	35.5	Very low	36.4	Very low	154 Å²	154	142.2 Å²	142.2	82%	0.824	79%	0.792	S	S	*	*			trans	80	149.8	143.8	-48.9	-16.2	0	0	0	122.6
8	D	32.8	Very low	36.4	Very low	141 Å²	141	143.4 Å²	143.4	75%	0.754	80%	0.796	S	S	*	*			trans	-41	152.6	-179	-59.1	-47.1	0	0	0	117.7
9	N	35.7	Very low	36.8	Very low	161 Å²	161	144.2 Å²	144.2	86%	0.861	80%	0.797	S	S	*	*				-169.7	173.2	103.5	-110.4	-79.1	0	0	0	117.3
10	S	32.1	Very low	37.3	Very low	86 Å²	86	143.4 Å²	143.4	60%	0.601	80%	0.797	S	S	*	*			trans	-89.5	166.4	-173.2	77	0	0	0	0	115.5
11	K	34.1	Very low	37.8	Very low	201 Å²	201	140.4 Å²	140.4	87%	0.874	78%	0.784	S	S	*	*			trans	54.2	108.3	156	-65.6	174.9	179	175.8	0	118.6
12	S	34.5	Very low	38.2	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	76%	0.759	S	S	*	*			trans	-149.9	135.7	141.8	63.4	0	0	0	0	112.1	A14	S12-A14 PolarHBondContact O-N 3.16Å
13	S	32.9	Very low	39	Very low	122 Å²	122	137.6 Å²	137.6	85%	0.853	76%	0.764	S	S	*	*			trans	-85.3	104.8	173	-55.3	0	0	0	0	109.1	N15	S13-N15 PolarHBondContact O-N 2.56Å
14	A	40.2	Very low	40	Very low	90 Å²	90	132.9 Å²	132.9	74%	0.744	75%	0.754	S	S	*	*			trans	-85.3	104.4	-179.7	0	0	0	0	0	111.4	S12 L16	S12-A14 PolarHBondContact O-N 3.16Å; A14-L16 PolarHBondContact O-N 3.33Å
15	N	40	Very low	40.8	Very low	156 Å²	156	133.1 Å²	133.1	83%	0.834	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-62.4	125	166.7	-72.3	-38	0	0	0	109.7	S13 P17	S13-N15 PolarHBondContact O-N 2.56Å; N15-P17 WeakPolarHBondContact O-CD 3.35Å
16	L	38.6	Very low	42.1	Very low	156 Å²	156	132.1 Å²	132.1	82%	0.817	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-73.2	126.5	161.4	-116.3	75.1	0	0	0	108.3	A14 L18	A14-L16 PolarHBondContact O-N 3.33Å; L16-L18 PolarHBondContact O-N 2.89Å
17	P	38	Very low	44.1	Very low	107 Å²	107	136.4 Å²	136.4	70%	0.695	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-63.7	128.6	172.3	-19.5	32.1	0	0	0	109.9	N15 L19	N15-P17 WeakPolarHBondContact O-CD 3.35Å; P17-L19 PolarHBondContact O-N 3.4Å; P17-L19 VanDerWaalsContact O-N 3.15Å
18	L	37.1	Very low	46.4	Very low	164 Å²	164	134.8 Å²	134.8	86%	0.859	76%	0.761	S	S	*	*			trans	-65.1	114.2	160.3	-84.8	76.1	0	0	0	107	L16 T20	L16-L18 PolarHBondContact O-N 2.89Å; L18-T20 PolarHBondContact O-N 3.45Å
19	L	43.4	Very low	49	Very low	158 Å²	158	136.2 Å²	136.2	83%	0.827	77%	0.767	S	S	*	*			trans	-64.4	105.8	163.1	-87	76.8	0	0	0	107.3	P17 P21	P17-L19 PolarHBondContact O-N 3.4Å; P17-L19 VanDerWaalsContact O-N 3.15Å; L19-P21 VanDerWaalsContact O-CD 3.27Å; L19-P21 WeakPolarHBondContact O-CD 3.24Å
20	T	47.2	Very low	51.6	Low	127 Å²	127	137 Å²	137	78%	0.779	76%	0.763	S	S	*	*			trans	-59.1	114.8	161.1	47.7	0	0	0	0	107.4	L18 D22	L18-T20 PolarHBondContact O-N 3.45Å; T20-D22 PolarHBondContact O-N 2.89Å
21	P	47.3	Very low	54.3	Low	81 Å²	81	144.8 Å²	144.8	53%	0.526	78%	0.779	S	S	.	*			trans	-65.1	129.3	176.3	27.3	-32.9	0	0	0	108.2	L19 K23	L19-P21 VanDerWaalsContact O-CD 3.27Å; L19-P21 WeakPolarHBondContact O-CD 3.24Å; P21-K23 PolarHBondContact O-N 2.92Å
22	D	46.4	Very low	56.9	Low	127 Å²	127	140 Å²	140	68%	0.679	76%	0.763	S	S	*	*			trans	-62.1	105.1	172.7	-169.3	-22.3	0	0	0	108.4	T20 S24	T20-D22 PolarHBondContact O-N 2.89Å; D22-S24 PolarHBondContact O-N 3.2Å; D22-S24 WeakPolarHBondContact OD1-CB 3.44Å; D22-S24 PolarHBondContact OD1-N 3.33Å; D22-S24 PolarHBondContact OD1-OG 2.93Å
23	K	54.8	Low	59.5	Low	196 Å²	196	138.4 Å²	138.4	85%	0.852	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	5.2	-169.8	-88.9	-177.8	173	-177.3	0	113.4	P21	P21-K23 PolarHBondContact O-N 2.92Å
24	S	57.7	Low	62	Low	83 Å²	83	141 Å²	141	58%	0.58	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-16.8	-170.4	61.4	0	0	0	0	115.4	D22	D22-S24 PolarHBondContact O-N 3.2Å; D22-S24 WeakPolarHBondContact OD1-CB 3.44Å; D22-S24 PolarHBondContact OD1-N 3.33Å; D22-S24 PolarHBondContact OD1-OG 2.93Å
25	M	57.3	Low	64.1	Low	148 Å²	148	142 Å²	142	73%	0.729	74%	0.735	S	S	*	*	S	Bend	trans	-134	138.7	-178.2	-77.7	-82.7	101.2	0	0	112	Q27	M25-Q27 PolarHBondContact O-N 3.15Å
26	P	63.6	Low	66.1	Low	118 Å²	118	137.2 Å²	137.2	77%	0.766	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-67	123.6	173.3	28.1	-33.3	0	0	0	110.5	T28	P26-T28 PolarHBondContact O-N 3.31Å
27	Q	77.8	Confident	68.3	Low	172 Å²	172	133.8 Å²	133.8	80%	0.804	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-65.7	128.9	-179.9	-67.3	-169.2	-1.1	0	0	111.4	M25 I29	M25-Q27 PolarHBondContact O-N 3.15Å; Q27-I29 PolarHBondContact O-N 3.24Å
28	T	83.1	Confident	70.5	Confident	121 Å²	121	130.8 Å²	130.8	74%	0.742	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-67.2	123.8	179.2	-23.5	0	0	0	0	110.7	P26 K30	P26-T28 PolarHBondContact O-N 3.31Å; T28-K30 PolarHBondContact O-N 3.44Å
29	I	87.4	Confident	72.7	Confident	170 Å²	170	128.1 Å²	128.1	87%	0.872	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-62.9	127.6	177.9	-59.2	175.2	0	0	0	109.7	Q27	Q27-I29 PolarHBondContact O-N 3.24Å
30	K	89.3	Confident	74.6	Confident	178 Å²	178	124.7 Å²	124.7	77%	0.774	63%	0.631	S	S	*	*			trans	-116.6	141.4	179.6	-67.7	171.8	-172.2	175.4	0	110.2	T28	T28-K30 PolarHBondContact O-N 3.44Å
31	R	89.2	Confident	76.2	Confident	249 Å²	249	119.6 Å²	119.6	94%	0.94	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-66.8	132.5	172.2	-67.3	-179	177.9	174.8	-1	109.6
32	L	88.6	Confident	77.9	Confident	102 Å²	102	115.7 Å²	115.7	53%	0.534	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-66.6	146	174.1	-68.3	176.5	0	0	0	111	V36 I37 I40	L32-V36 HydrophobicContact CD1-CG1 4.47Å; L32-V36 HydrophobicContact CD2-CG1 4.45Å; L32-I37 HydrophobicContact CB-CD1 4.09Å; L32-I37 HydrophobicContact CB-CG1 3.72Å; L32-I37 HydrophobicContact CD1-CG1 4.43Å; L32-I40 HydrophobicContact CD1-CD1 4.37Å
33	P	89.7	Confident	79.6	Confident	82 Å²	82	110.1 Å²	110.1	53%	0.532	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-59.7	144	170.4	-22	33	0	0	0	111.6	E35 V36 I37	P33-E35 PolarHBondContact O-N 3.31Å; P33-V36 HydrophobicContact CB-CG2 4.17Å; P33-V36 HydrophobicContact CG-CG2 4.15Å; P33-V36 WeakPolarHBondContact O-CB 3.28Å; P33-V36 PolarHBondContact O-N 2.68Å; P33-I37 PolarHBondContact O-N 3.11Å; P33-I37 VanDerWaalsContact O-N 3.13Å
34	K	85.7	Confident	81	Confident	177 Å²	177	105.1 Å²	105.1	77%	0.77	53%	0.528	S	S	*	.	H	α-helix	trans	-54.7	-37.3	-179.3	-70.8	-171.5	177	-174.7	0	113.1	V36 I37 N38	K34-V36 VanDerWaalsContact C-N 3.35Å; K34-V36 PolarHBondContact O-N 3.44Å; K34-I37 PolarHBondContact O-N 2.87Å; K34-N38 WeakPolarHBondContact O-CB 3.37Å; K34-N38 PolarHBondContact O-N 2.99Å; K34-N38 PolarHBondContact O-OD1 2.88Å
35	E	83.8	Confident	82.3	Confident	110 Å²	110	101.5 Å²	101.5	51%	0.514	50%	0.503	S	S	.	.	H	α-helix	trans	-60.8	-42.6	176.3	-165.7	-147.7	128.6	0	0	112.1	P33 N38 R39	P33-E35 PolarHBondContact O-N 3.31Å; E35-N38 PolarHBondContact O-N 3.17Å; E35-R39 WeakPolarHBondContact O-CB 3.24Å; E35-R39 VanDerWaalsContact O-CG 3.24Å; E35-R39 WeakPolarHBondContact O-CG 3.1Å; E35-R39 PolarHBondContact O-N 2.94Å; E35-R39 WeakPolarHBondContact OE1-CD 3.32Å; E35-R39 IonicContact OE1-CZ 3.1Å; E35-R39 IonicContact OE1-NE 2.71Å; E35-R39 IonicContact OE1-NH1 2.67Å; E35-R39 PolarHBondContact OE1-NH1 2.93Å
36	V	82.5	Confident	83.9	Confident	56 Å²	56	94.5 Å²	94.5	34%	0.339	47%	0.468	S	S	.	.	H	α-helix	trans	-65.6	-46.9	179.2	178.3	0	0	0	0	110.2	L32 P33 K34 N38 R39 I40	L32-V36 HydrophobicContact CD1-CG1 4.47Å; L32-V36 HydrophobicContact CD2-CG1 4.45Å; P33-V36 HydrophobicContact CB-CG2 4.17Å; P33-V36 HydrophobicContact CG-CG2 4.15Å; P33-V36 WeakPolarHBondContact O-CB 3.28Å; P33-V36 PolarHBondContact O-N 2.68Å; K34-V36 VanDerWaalsContact C-N 3.35Å; K34-V36 PolarHBondContact O-N 3.44Å; V36-N38 PolarHBondContact O-N 2.81Å; V36-R39 PolarHBondContact O-N 2.95Å; V36-I40 HydrophobicContact CG1-CD1 3.79Å; V36-I40 HydrophobicContact CG1-CG1 4.47Å; V36-I40 VanDerWaalsContact O-CG1 3.29Å; V36-I40 WeakPolarHBondContact O-CG1 3.11Å; V36-I40 PolarHBondContact O-N 2.87Å
37	I	85	Confident	85.1	Confident	84 Å²	84	93.1 Å²	93.1	43%	0.431	45%	0.451	S	S	.	.	H	α-helix	trans	-57.3	-50	175.3	-60.9	170.8	0	0	0	110.3	L32 P33 K34 R39 I40 A41	L32-I37 HydrophobicContact CB-CD1 4.09Å; L32-I37 HydrophobicContact CB-CG1 3.72Å; L32-I37 HydrophobicContact CD1-CG1 4.43Å; P33-I37 PolarHBondContact O-N 3.11Å; P33-I37 VanDerWaalsContact O-N 3.13Å; K34-I37 PolarHBondContact O-N 2.87Å; I37-R39 VanDerWaalsContact C-N 3.32Å; I37-R39 PolarHBondContact O-N 3.2Å; I37-I40 PolarHBondContact O-N 2.99Å; I37-A41 PolarHBondContact O-N 3.27Å
38	N	84.5	Confident	85.8	Confident	43 Å²	43	88 Å²	88	23%	0.23	42%	0.424	C	S	.	.	H	α-helix	trans	-61.4	-39.4	-179	-74.8	7.9	0	0	0	112.6	K34 E35 V36 A42 R100 H130	K34-N38 WeakPolarHBondContact O-CB 3.37Å; K34-N38 PolarHBondContact O-N 2.99Å; K34-N38 PolarHBondContact O-OD1 2.88Å; E35-N38 PolarHBondContact O-N 3.17Å; V36-N38 PolarHBondContact O-N 2.81Å; N38-A42 WeakPolarHBondContact O-CB 3.26Å; N38-A42 PolarHBondContact O-N 3.47Å; N38-R100 PolarHBondContact O-NH2 3.15Å; N38-R100 WeakPolarHBondContact OD1-CD 3.31Å; N38-R100 PolarHBondContact OD1-NE 2.85Å; N38-H130 WeakPolarHBondContact CB-NE2 3.29Å; N38-H130 PolarHBondContact ND2-NE2 2.79Å; N38-H130 VanDerWaalsContact ND2-NE2 3.19Å
39	R	82	Confident	86.4	Confident	109 Å²	109	82.2 Å²	82.2	41%	0.411	39%	0.389	S	S	.	.	H	α-helix	trans	-71.8	-36.3	178.9	-74.7	171.4	68.4	-178.3	0.1	112.7	E35 V36 I37 G43 N179	E35-R39 WeakPolarHBondContact O-CB 3.24Å; E35-R39 VanDerWaalsContact O-CG 3.24Å; E35-R39 WeakPolarHBondContact O-CG 3.1Å; E35-R39 PolarHBondContact O-N 2.94Å; E35-R39 WeakPolarHBondContact OE1-CD 3.32Å; E35-R39 IonicContact OE1-CZ 3.1Å; E35-R39 IonicContact OE1-NE 2.71Å; E35-R39 IonicContact OE1-NH1 2.67Å; E35-R39 PolarHBondContact OE1-NH1 2.93Å; V36-R39 PolarHBondContact O-N 2.95Å; I37-R39 VanDerWaalsContact C-N 3.32Å; I37-R39 PolarHBondContact O-N 3.2Å; R39-G43 PolarHBondContact O-N 3.2Å; R39-G43 VanDerWaalsContact O-N 3.07Å; R39-N179 PolarHBondContact NH2-O 3.44Å
40	I	83.3	Confident	86.6	Confident	86 Å²	86	75.2 Å²	75.2	44%	0.441	35%	0.354	S	S	.	.	H	α-helix	trans	-63.5	-58.4	173.5	-70	166.7	0	0	0	109.5	L32 V36 I37 A42 G43 E44	L32-I40 HydrophobicContact CD1-CD1 4.37Å; V36-I40 HydrophobicContact CG1-CD1 3.79Å; V36-I40 HydrophobicContact CG1-CG1 4.47Å; V36-I40 VanDerWaalsContact O-CG1 3.29Å; V36-I40 WeakPolarHBondContact O-CG1 3.11Å; V36-I40 PolarHBondContact O-N 2.87Å; I37-I40 PolarHBondContact O-N 2.99Å; I40-A42 VanDerWaalsContact C-N 3.32Å; I40-A42 PolarHBondContact O-N 3.47Å; I40-G43 CarbonylContact O-C 3.5Å; I40-G43 VanDerWaalsContact O-CA 3.29Å; I40-G43 WeakPolarHBondContact O-CA 3.44Å; I40-G43 PolarHBondContact O-N 2.92Å; I40-E44 WeakPolarHBondContact CG2-OE1 3.48Å; I40-E44 PolarHBondContact O-N 3.47Å; I40-E44 VanDerWaalsContact O-N 3.08Å
41	A	82.2	Confident	86.8	Confident	19 Å²	19	67.8 Å²	67.8	16%	0.157	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-33.7	-178.6	0	0	0	0	0	113	I37 G43 E44 V45	I37-A41 PolarHBondContact O-N 3.27Å; A41-G43 VanDerWaalsContact C-N 3.27Å; A41-G43 PolarHBondContact O-N 3.44Å; A41-E44 PolarHBondContact O-N 2.98Å; A41-V45 PolarHBondContact O-N 2.83Å
42	A	82.8	Confident	87	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-34.7	170.8	0	0	0	0	0	112.4	N38 I40 E44 I46 H130 V131	N38-A42 WeakPolarHBondContact O-CB 3.26Å; N38-A42 PolarHBondContact O-N 3.47Å; I40-A42 VanDerWaalsContact C-N 3.32Å; I40-A42 PolarHBondContact O-N 3.47Å; A42-E44 VanDerWaalsContact C-N 3.33Å; A42-I46 PolarHBondContact O-N 3.11Å; A42-H130 HydrophobicContact CB-CB 3.69Å; A42-V131 HydrophobicContact CB-CG1 4.42Å
43	G	81	Confident	87.3	Confident	9 Å²	9	51.2 Å²	51.2	9%	0.093	25%	0.254	C	S	.	.	H	α-helix	trans	-75.1	-14.6	175.4	0	0	0	0	0	114.8	R39 I40 A41 R183	R39-G43 PolarHBondContact O-N 3.2Å; R39-G43 VanDerWaalsContact O-N 3.07Å; I40-G43 CarbonylContact O-C 3.5Å; I40-G43 VanDerWaalsContact O-CA 3.29Å; I40-G43 WeakPolarHBondContact O-CA 3.44Å; I40-G43 PolarHBondContact O-N 2.92Å; A41-G43 VanDerWaalsContact C-N 3.27Å; A41-G43 PolarHBondContact O-N 3.44Å; G43-R183 PolarHBondContact O-NH1 3.08Å; G43-R183 PolarHBondContact O-NH2 2.83Å
44	E	84.5	Confident	87.4	Confident	91 Å²	91	48.2 Å²	48.2	43%	0.425	23%	0.233	S	C	.	.	H	α-helix	trans	-82.3	-41.7	171.1	-69.2	161.9	-166.5	0	0	111.2	I40 A41 A42 Q47	I40-E44 WeakPolarHBondContact CG2-OE1 3.48Å; I40-E44 PolarHBondContact O-N 3.47Å; I40-E44 VanDerWaalsContact O-N 3.08Å; A41-E44 PolarHBondContact O-N 2.98Å; A42-E44 VanDerWaalsContact C-N 3.33Å; E44-Q47 WeakPolarHBondContact O-CG 3.5Å; E44-Q47 PolarHBondContact O-NE2 3.27Å
45	V	85.4	Confident	87.7	Confident	8 Å²	8	40.4 Å²	40.4	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-73.3	-51.2	177.8	179.6	0	0	0	0	111.4	A41 N51 P383	A41-V45 PolarHBondContact O-N 2.83Å; V45-N51 PolarHBondContact O-ND2 3.5Å; V45-P383 HydrophobicContact CG2-CB 4.12Å
46	I	90.7	Very high	88.3	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.175	C	C	.	.			trans	-103.9	89.2	-176.7	-52.1	-61.3	0	0	0	110	A42 N51 A52 V131 L176 F177 R183	A42-I46 PolarHBondContact O-N 3.11Å; I46-N51 HydrophobicContact CD1-CB 4.37Å; I46-A52 HydrophobicContact CD1-CB 4.28Å; I46-A52 HydrophobicContact CG2-CB 4.32Å; I46-V131 HydrophobicContact CB-CG2 4.06Å; I46-V131 HydrophobicContact CG2-CG2 3.85Å; I46-L176 HydrophobicContact CG2-CD1 4.17Å; I46-F177 HydrophobicContact CG2-CE1 4.24Å; I46-F177 HydrophobicContact CG2-CZ 4.11Å; I46-F177 VanDerWaalsContact O-CE1 3.3Å; I46-F177 WeakPolarHBondContact O-CE1 3.4Å; I46-F177 WeakPolarHBondContact O-CZ 3.21Å; I46-R183 PolarHBondContact O-NH1 3.26Å
47	Q	89.6	Confident	88.8	Confident	88 Å²	88	32.7 Å²	32.7	41%	0.411	16%	0.159	S	C	.	.	S	Bend	trans	-91.3	-41	-178.4	-56	-178.4	10.1	0	0	112.7	E44 N51 F177	E44-Q47 WeakPolarHBondContact O-CG 3.5Å; E44-Q47 PolarHBondContact O-NE2 3.27Å; Q47-N51 PolarHBondContact N-ND2 3.27Å; Q47-F177 VanDerWaalsContact O-CZ 3.3Å; Q47-F177 WeakPolarHBondContact O-CZ 3.28Å
48	R	92.3	Very high	89.2	Confident	64 Å²	64	28.7 Å²	28.7	24%	0.242	14%	0.139	C	C	.	.	S	Bend	trans	-137.4	164.2	179.3	-68	179.6	84.4	143.1	5	110.6	V50 N51 L187 E192 E193	R48-V50 HydrophobicContact CB-CG1 4.03Å; R48-V50 PolarHBondContact O-N 3.22Å; R48-N51 PolarHBondContact N-OD1 3.09Å; R48-N51 WeakPolarHBondContact O-CB 3.49Å; R48-N51 PolarHBondContact O-N 3.46Å; R48-L187 HydrophobicContact CG-CD1 4.24Å; R48-L187 HydrophobicContact CG-CD2 4.03Å; R48-E192 IonicContact CZ-OE1 2.85Å; R48-E192 IonicContact NH1-OE1 3.65Å; R48-E192 IonicContact NH2-OE1 3.86Å; R48-E192 PolarHBondContact NH2-OE1 3.01Å; R48-E192 IonicContact NH2-OE2 3.78Å; R48-E193 IonicContact CZ-OE1 2.79Å; R48-E193 IonicContact CZ-OE2 3.19Å; R48-E193 IonicContact NE-OE1 3.4Å; R48-E193 PolarHBondContact NE-OE1 3.14Å; R48-E193 IonicContact NE-OE2 2.72Å; R48-E193 PolarHBondContact NE-OE2 2.97Å; R48-E193 IonicContact NH2-OE1 2.71Å; R48-E193 PolarHBondContact NH2-OE1 3.15Å; R48-E193 IonicContact NH2-OE2 3.71Å
49	P	94	Very high	89.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-46.1	-40.6	171.1	-31	34.8	0	0	0	114.6	N51 A52 I53 G75 L77 I80 L176 E193 V197	P49-N51 VanDerWaalsContact C-N 3.29Å; P49-N51 PolarHBondContact O-N 2.88Å; P49-A52 WeakPolarHBondContact O-CB 3.38Å; P49-A52 PolarHBondContact O-N 3.46Å; P49-A52 VanDerWaalsContact O-N 3.1Å; P49-I53 PolarHBondContact O-N 2.98Å; P49-G75 VanDerWaalsContact CB-O 3.25Å; P49-G75 WeakPolarHBondContact CB-O 3.15Å; P49-G75 WeakPolarHBondContact CG-O 3.35Å; P49-L77 HydrophobicContact CG-CD2 3.86Å; P49-L77 HydrophobicContact CG-CG 4.4Å; P49-I80 HydrophobicContact CB-CD1 4.22Å; P49-L176 HydrophobicContact CB-CD2 4.27Å; P49-L176 HydrophobicContact CG-CD2 3.86Å; P49-E193 WeakPolarHBondContact CD-OE2 3.46Å; P49-E193 HydrophobicContact CG-CB 4.24Å; P49-E193 HydrophobicContact CG-CG 4.14Å; P49-V197 HydrophobicContact CB-CG2 4.33Å
50	V	93.3	Very high	90.1	Very high	23 Å²	23	23.7 Å²	23.7	14%	0.139	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-32.2	-179.8	68.9	0	0	0	0	113.4	R48 I53 K54 K196 V197 V200	R48-V50 HydrophobicContact CB-CG1 4.03Å; R48-V50 PolarHBondContact O-N 3.22Å; V50-I53 PolarHBondContact O-N 3.27Å; V50-K54 PolarHBondContact O-N 3.17Å; V50-K196 WeakPolarHBondContact CG2-O 3.18Å; V50-V197 HydrophobicContact CB-CG2 4.25Å; V50-V200 HydrophobicContact CG2-CB 3.87Å; V50-V200 HydrophobicContact CG2-CG1 4.46Å; V50-V200 HydrophobicContact CG2-CG2 3.44Å; V50-V200 VanDerWaalsContact CG2-CG2 3.44Å
51	N	92.4	Very high	90.6	Very high	23 Å²	23	20.7 Å²	20.7	12%	0.123	11%	0.105	C	C	.	.	H	α-helix	trans	-63.4	-45.4	173.5	-60	46.1	0	0	0	110.9	V45 I46 Q47 R48 P49 I53 K54 E55 T384	V45-N51 PolarHBondContact O-ND2 3.5Å; I46-N51 HydrophobicContact CD1-CB 4.37Å; Q47-N51 PolarHBondContact N-ND2 3.27Å; R48-N51 PolarHBondContact N-OD1 3.09Å; R48-N51 WeakPolarHBondContact O-CB 3.49Å; R48-N51 PolarHBondContact O-N 3.46Å; P49-N51 VanDerWaalsContact C-N 3.29Å; P49-N51 PolarHBondContact O-N 2.88Å; N51-I53 VanDerWaalsContact C-N 3.34Å; N51-K54 PolarHBondContact O-N 3.31Å; N51-E55 WeakPolarHBondContact O-CG 3.38Å; N51-E55 PolarHBondContact O-N 2.87Å; N51-T384 WeakPolarHBondContact ND2-CG2 3.34Å
52	A	93.9	Very high	90.9	Very high	2 Å²	2	21.8 Å²	21.8	2%	0.017	11%	0.108	C	C	.	.	H	α-helix	trans	-65.1	-40.1	179.2	0	0	0	0	0	111.1	I46 P49 L56 I80 L128	I46-A52 HydrophobicContact CD1-CB 4.28Å; I46-A52 HydrophobicContact CG2-CB 4.32Å; P49-A52 WeakPolarHBondContact O-CB 3.38Å; P49-A52 PolarHBondContact O-N 3.46Å; P49-A52 VanDerWaalsContact O-N 3.1Å; A52-L56 WeakPolarHBondContact O-CB 3.15Å; A52-L56 WeakPolarHBondContact O-CD1 3.18Å; A52-L56 WeakPolarHBondContact O-CG 3.49Å; A52-L56 PolarHBondContact O-N 2.95Å; A52-I80 HydrophobicContact CB-CD1 4.02Å; A52-L128 HydrophobicContact CB-CD1 3.82Å
53	I	94.8	Very high	91.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-51.7	172.4	-64.6	-68.6	0	0	0	110.8	P49 V50 N51 E55 L56 L57 I70 I80 V82 V197 V201	P49-I53 PolarHBondContact O-N 2.98Å; V50-I53 PolarHBondContact O-N 3.27Å; N51-I53 VanDerWaalsContact C-N 3.34Å; I53-E55 PolarHBondContact O-N 2.84Å; I53-L56 PolarHBondContact O-N 3.17Å; I53-L56 VanDerWaalsContact O-N 3.14Å; I53-L57 HydrophobicContact CG2-CD1 3.93Å; I53-L57 HydrophobicContact CG2-CG 4.1Å; I53-L57 WeakPolarHBondContact O-CG 3.4Å; I53-L57 PolarHBondContact O-N 3.25Å; I53-I70 HydrophobicContact CD1-CG2 3.77Å; I53-I80 HydrophobicContact CD1-CD1 4.41Å; I53-I80 HydrophobicContact CD1-CG1 4.34Å; I53-I80 HydrophobicContact CD1-CG2 3.54Å; I53-I80 HydrophobicContact CG1-CD1 4.42Å; I53-V82 HydrophobicContact CD1-CG2 4.41Å; I53-V197 HydrophobicContact CD1-CG1 4.32Å; I53-V197 HydrophobicContact CG1-CG1 3.9Å; I53-V197 HydrophobicContact CG1-CG2 4.02Å; I53-V197 HydrophobicContact CG2-CG1 4.36Å; I53-V201 HydrophobicContact CG2-CG2 3.95Å
54	K	92.7	Very high	91.9	Very high	20 Å²	20	25.3 Å²	25.3	9%	0.087	14%	0.142	C	C	.	.	H	α-helix	trans	-54.3	-50.8	179.8	-177.6	175.7	180	-74	0	112	V50 N51 L56 L57 E58 V200 Y204 T384 K385	V50-K54 PolarHBondContact O-N 3.17Å; N51-K54 PolarHBondContact O-N 3.31Å; K54-L56 VanDerWaalsContact C-N 3.34Å; K54-L56 PolarHBondContact O-N 2.96Å; K54-L57 PolarHBondContact O-N 3.03Å; K54-E58 IonicContact NZ-OE1 3.4Å; K54-E58 PolarHBondContact NZ-OE1 3.33Å; K54-E58 WeakPolarHBondContact O-CB 3.35Å; K54-E58 WeakPolarHBondContact O-CG 3.5Å; K54-E58 PolarHBondContact O-N 2.99Å; K54-V200 HydrophobicContact CB-CG1 4.44Å; K54-Y204 HydrophobicContact CG-CE2 4.26Å; K54-T384 PolarHBondContact NZ-O 3.38Å; K54-T384 VanDerWaalsContact NZ-O 3.14Å; K54-K385 PolarHBondContact NZ-O 3.4Å
55	E	91.9	Very high	92.4	Very high	12 Å²	12	21.3 Å²	21.3	6%	0.056	12%	0.124	C	C	.	.	H	α-helix	trans	-65.5	-33.7	179.3	-66.2	-63.4	136.2	0	0	112.8	N51 I53 N59 A124 K385	N51-E55 WeakPolarHBondContact O-CG 3.38Å; N51-E55 PolarHBondContact O-N 2.87Å; I53-E55 PolarHBondContact O-N 2.84Å; E55-N59 PolarHBondContact O-N 3.27Å; E55-N59 VanDerWaalsContact O-N 3.12Å; E55-N59 PolarHBondContact O-ND2 3.2Å; E55-A124 HydrophobicContact CB-CB 4.1Å; E55-A124 HydrophobicContact CG-CB 4.32Å; E55-K385 IonicContact OE1-NZ 3.59Å; E55-K385 PolarHBondContact OE1-NZ 3.33Å; E55-K385 IonicContact OE2-NZ 2.74Å; E55-K385 PolarHBondContact OE2-NZ 3.31Å
56	L	94.6	Very high	92.9	Very high	5 Å²	5	24.5 Å²	24.5	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-71.9	-42.8	176.1	-70.2	170.8	0	0	0	111.9	A52 I53 K54 N59 S60 I80 V82 L125 L128 I171	A52-L56 WeakPolarHBondContact O-CB 3.15Å; A52-L56 WeakPolarHBondContact O-CD1 3.18Å; A52-L56 WeakPolarHBondContact O-CG 3.49Å; A52-L56 PolarHBondContact O-N 2.95Å; I53-L56 PolarHBondContact O-N 3.17Å; I53-L56 VanDerWaalsContact O-N 3.14Å; K54-L56 VanDerWaalsContact C-N 3.34Å; K54-L56 PolarHBondContact O-N 2.96Å; L56-N59 PolarHBondContact O-N 2.9Å; L56-S60 PolarHBondContact O-N 2.93Å; L56-S60 PolarHBondContact O-OG 2.82Å; L56-I80 HydrophobicContact CD1-CG2 3.96Å; L56-V82 HydrophobicContact CB-CB 4.23Å; L56-V82 HydrophobicContact CB-CG1 4.4Å; L56-V82 HydrophobicContact CB-CG2 3.86Å; L56-V82 HydrophobicContact CD1-CB 4.35Å; L56-V82 HydrophobicContact CD1-CG2 3.81Å; L56-V82 HydrophobicContact CG-CG2 4.46Å; L56-L125 HydrophobicContact CD2-CD2 3.92Å; L56-L128 HydrophobicContact CD1-CD2 4.16Å; L56-L128 HydrophobicContact CD2-CD2 4.28Å; L56-L128 HydrophobicContact CG-CD2 4.43Å; L56-I171 HydrophobicContact CD2-CB 4.04Å; L56-I171 HydrophobicContact CD2-CD1 3.77Å; L56-I171 HydrophobicContact CD2-CG1 4.42Å; L56-I171 HydrophobicContact CD2-CG2 3.85Å
57	L	94.2	Very high	93.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.4	-47.3	173.2	-64.8	-177.6	0	0	0	111.2	I53 K54 N59 S60 I61 I68 I70 V201 Y204 F214	I53-L57 HydrophobicContact CG2-CD1 3.93Å; I53-L57 HydrophobicContact CG2-CG 4.1Å; I53-L57 WeakPolarHBondContact O-CG 3.4Å; I53-L57 PolarHBondContact O-N 3.25Å; K54-L57 PolarHBondContact O-N 3.03Å; L57-N59 VanDerWaalsContact C-N 3.25Å; L57-N59 PolarHBondContact O-N 3.48Å; L57-S60 PolarHBondContact O-N 3.44Å; L57-I61 WeakPolarHBondContact O-CB 3.46Å; L57-I61 WeakPolarHBondContact O-CD1 3.36Å; L57-I61 VanDerWaalsContact O-CG1 3.24Å; L57-I61 WeakPolarHBondContact O-CG1 3.44Å; L57-I61 PolarHBondContact O-N 2.9Å; L57-I68 HydrophobicContact CD2-CG2 3.77Å; L57-I70 HydrophobicContact CD2-CD1 4.09Å; L57-I70 HydrophobicContact CD2-CG1 4.01Å; L57-V201 HydrophobicContact CD1-CG2 4.21Å; L57-Y204 HydrophobicContact CD1-CD2 4.09Å; L57-Y204 HydrophobicContact CD1-CG 4.18Å; L57-F214 HydrophobicContact CD1-CE1 4.49Å; L57-F214 HydrophobicContact CD2-CD1 4.34Å; L57-F214 HydrophobicContact CD2-CE1 4.13Å
58	E	92.2	Very high	93.5	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-54	-41.2	175.1	-82.6	-170.6	-171.7	0	0	111.8	K54 D62 F118 Y204 R307 K385	K54-E58 IonicContact NZ-OE1 3.4Å; K54-E58 PolarHBondContact NZ-OE1 3.33Å; K54-E58 WeakPolarHBondContact O-CB 3.35Å; K54-E58 WeakPolarHBondContact O-CG 3.5Å; K54-E58 PolarHBondContact O-N 2.99Å; E58-D62 WeakPolarHBondContact O-CB 3.46Å; E58-D62 PolarHBondContact O-N 2.84Å; E58-F118 HydrophobicContact CB-CB 3.53Å; E58-F118 HydrophobicContact CB-CG 4.2Å; E58-F118 HydrophobicContact CG-CB 3.58Å; E58-F118 HydrophobicContact CG-CD1 4.29Å; E58-F118 HydrophobicContact CG-CG 3.93Å; E58-F118 WeakPolarHBondContact OE2-CB 3.21Å; E58-Y204 HydrophobicContact CG-CE1 4.31Å; E58-Y204 PolarHBondContact OE1-OH 3.38Å; E58-R307 IonicContact OE1-NH1 2.74Å; E58-R307 PolarHBondContact OE1-NH1 3.45Å; E58-R307 IonicContact OE2-NH1 3.16Å; E58-R307 PolarHBondContact OE2-NH1 2.85Å; E58-R307 VanDerWaalsContact OE2-NH1 3.13Å; E58-K385 IonicContact OE2-NZ 2.71Å; E58-K385 PolarHBondContact OE2-NZ 3.42Å
59	N	92.2	Very high	93.7	Very high	40 Å²	40	24.3 Å²	24.3	21%	0.214	15%	0.145	C	C	.	.	H	α-helix	trans	-73	-39.6	177.9	-79.5	-64.7	0	0	0	113.9	E55 L56 L57 I61 D62 A63 K105	E55-N59 PolarHBondContact O-N 3.27Å; E55-N59 VanDerWaalsContact O-N 3.12Å; E55-N59 PolarHBondContact O-ND2 3.2Å; L56-N59 PolarHBondContact O-N 2.9Å; L57-N59 VanDerWaalsContact C-N 3.25Å; L57-N59 PolarHBondContact O-N 3.48Å; N59-I61 VanDerWaalsContact C-N 3.32Å; N59-D62 PolarHBondContact O-N 3.27Å; N59-A63 WeakPolarHBondContact O-CB 3.3Å; N59-A63 PolarHBondContact O-N 3.28Å; N59-K105 PolarHBondContact OD1-NZ 2.7Å
60	S	94.5	Very high	93.8	Very high	6 Å²	6	24.3 Å²	24.3	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-67.5	-33.1	175.5	-64.4	0	0	0	0	112	L56 L57 A63 S65 D84	L56-S60 PolarHBondContact O-N 2.93Å; L56-S60 PolarHBondContact O-OG 2.82Å; L57-S60 PolarHBondContact O-N 3.44Å; S60-A63 PolarHBondContact O-N 3.03Å; S60-S65 WeakPolarHBondContact O-CB 3.44Å; S60-S65 PolarHBondContact O-N 3.26Å; S60-S65 PolarHBondContact O-OG 3.03Å; S60-D84 WeakPolarHBondContact CB-OD2 3.49Å; S60-D84 WeakPolarHBondContact OG-CB 3.44Å; S60-D84 PolarHBondContact OG-OD2 3.32Å
61	I	93	Very high	93.9	Very high	24 Å²	24	23.7 Å²	23.7	12%	0.123	14%	0.141	C	C	.	.	H	α-helix	trans	-69.2	-47.3	173	-66.1	162	0	0	0	110.6	L57 N59 A63 G64 I68 F118 Y204 Y208 F214	L57-I61 WeakPolarHBondContact O-CB 3.46Å; L57-I61 WeakPolarHBondContact O-CD1 3.36Å; L57-I61 VanDerWaalsContact O-CG1 3.24Å; L57-I61 WeakPolarHBondContact O-CG1 3.44Å; L57-I61 PolarHBondContact O-N 2.9Å; N59-I61 VanDerWaalsContact C-N 3.32Å; I61-A63 PolarHBondContact O-N 3.24Å; I61-A63 VanDerWaalsContact O-N 3.13Å; I61-G64 PolarHBondContact O-N 2.9Å; I61-I68 HydrophobicContact CG1-CD1 4Å; I61-F118 HydrophobicContact CG2-CD2 4.15Å; I61-F118 HydrophobicContact CG2-CE2 3.76Å; I61-Y204 HydrophobicContact CD1-CD1 3.59Å; I61-Y204 HydrophobicContact CD1-CE1 4.04Å; I61-Y208 HydrophobicContact CD1-CD2 3.88Å; I61-Y208 HydrophobicContact CD1-CE2 3.73Å; I61-Y208 HydrophobicContact CD1-CG 4.4Å; I61-Y208 HydrophobicContact CG2-CD1 4.33Å; I61-Y208 HydrophobicContact CG2-CE1 3.72Å; I61-F214 HydrophobicContact CD1-CZ 4.3Å
62	D	90.1	Very high	94	Very high	41 Å²	41	22.7 Å²	22.7	22%	0.219	14%	0.136	C	C	.	.	H	α-helix	trans	-57.2	-26	172.7	-80.6	-27.7	0	0	0	112.5	E58 N59 G64 K105 T117 F118 G119	E58-D62 WeakPolarHBondContact O-CB 3.46Å; E58-D62 PolarHBondContact O-N 2.84Å; N59-D62 PolarHBondContact O-N 3.27Å; D62-G64 VanDerWaalsContact C-N 3.31Å; D62-K105 WeakPolarHBondContact OD2-CE 3.45Å; D62-K105 IonicContact OD2-NZ 3.59Å; D62-K105 PolarHBondContact OD2-NZ 3.45Å; D62-T117 VanDerWaalsContact OD1-CA 3.29Å; D62-T117 WeakPolarHBondContact OD1-CA 3.3Å; D62-T117 WeakPolarHBondContact OD1-CB 3.31Å; D62-F118 VanDerWaalsContact CG-N 3.35Å; D62-F118 VanDerWaalsContact OD1-CD2 3.31Å; D62-F118 WeakPolarHBondContact OD1-CD2 3.33Å; D62-F118 PolarHBondContact OD1-N 3.06Å; D62-F118 PolarHBondContact OD2-N 2.84Å; D62-G119 PolarHBondContact OD2-N 3.05Å; D62-G119 VanDerWaalsContact OD2-N 3.13Å
63	A	91.7	Very high	93.9	Very high	25 Å²	25	24.9 Å²	24.9	21%	0.207	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	4	175.9	0	0	0	0	0	114.6	N59 S60 I61 G86 C87	N59-A63 WeakPolarHBondContact O-CB 3.3Å; N59-A63 PolarHBondContact O-N 3.28Å; S60-A63 PolarHBondContact O-N 3.03Å; I61-A63 PolarHBondContact O-N 3.24Å; I61-A63 VanDerWaalsContact O-N 3.13Å; A63-G86 WeakPolarHBondContact O-CA 3.31Å; A63-C87 PolarHBondContact O-N 3.29Å
64	G	91.7	Very high	93.7	Very high	58 Å²	58	28.2 Å²	28.2	60%	0.598	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	25.8	176.8	0	0	0	0	0	114.9	I61 D62	I61-G64 PolarHBondContact O-N 2.9Å; D62-G64 VanDerWaalsContact C-N 3.31Å
65	S	94.7	Very high	93.4	Very high	8 Å²	8	27.4 Å²	27.4	6%	0.056	16%	0.161	C	C	.	.			trans	-71.6	138.1	-176.2	-51.6	0	0	0	0	112.7	S60 D84 N85 G86 C212	S60-S65 WeakPolarHBondContact O-CB 3.44Å; S60-S65 PolarHBondContact O-N 3.26Å; S60-S65 PolarHBondContact O-OG 3.03Å; S65-D84 WeakPolarHBondContact OG-CB 3.28Å; S65-N85 WeakPolarHBondContact CA-OD1 3.39Å; S65-G86 VanDerWaalsContact OG-CA 3.31Å; S65-G86 WeakPolarHBondContact OG-CA 3.42Å; S65-G86 PolarHBondContact OG-N 3Å; S65-C212 PolarHBondContact O-SG 3.5Å
66	T	95.6	Very high	93.4	Very high	74 Å²	74	26.9 Å²	26.9	45%	0.454	16%	0.158	S	C	.	.	S	Bend	trans	-104.6	-7.3	175.9	59.5	0	0	0	0	113.4	N85 C212 G213	T66-N85 PolarHBondContact N-OD1 3.1Å; T66-N85 PolarHBondContact OG1-ND2 2.84Å; T66-C212 VanDerWaalsContact C-SG 3.55Å; T66-C212 WeakPolarHBondContact O-CA 3.35Å; T66-G213 PolarHBondContact O-N 2.85Å
67	M	96.1	Very high	93.3	Very high	57 Å²	57	27 Å²	27	28%	0.281	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	122.9	173.2	177.6	55.2	58	0	0	109.9	N85 G213	M67-N85 PolarHBondContact N-OD1 3.43Å; M67-N85 PolarHBondContact O-OD1 3.14Å; M67-G213 WeakPolarHBondContact CA-O 3.43Å
68	I	97.2	Very high	93.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.1	175.8	-59.1	167.1	0	0	0	109.1	L57 I61 I70 V82 Q83 D84 G213 F214 H215	L57-I68 HydrophobicContact CD2-CG2 3.77Å; I61-I68 HydrophobicContact CG1-CD1 4Å; I68-I70 HydrophobicContact CG2-CD1 3.96Å; I68-I70 HydrophobicContact CG2-CG1 4.24Å; I68-V82 HydrophobicContact CG2-CG1 3.8Å; I68-Q83 CarbonylContact C-O 3.5Å; I68-Q83 WeakPolarHBondContact CA-O 3.38Å; I68-D84 HydrophobicContact CG1-CB 4.26Å; I68-G213 PolarHBondContact N-O 3.41Å; I68-F214 HydrophobicContact CB-CD1 4.42Å; I68-F214 HydrophobicContact CD1-CE1 3.97Å; I68-F214 HydrophobicContact CD1-CZ 4.19Å; I68-F214 WeakPolarHBondContact O-CA 3.38Å; I68-H215 PolarHBondContact O-N 3.25Å
69	K	96.6	Very high	93.4	Very high	93 Å²	93	33.3 Å²	33.3	40%	0.404	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.9	174.1	-175.4	-176.7	177.7	-175.6	0	110.1	V82 Q83 H215	K69-V82 WeakPolarHBondContact O-CA 3.36Å; K69-Q83 HydrophobicContact CB-CB 4.43Å; K69-Q83 PolarHBondContact N-O 3.31Å; K69-Q83 PolarHBondContact O-N 2.69Å; K69-H215 CarbonylContact C-O 3.56Å; K69-H215 WeakPolarHBondContact CA-O 3.35Å; K69-H215 HydrophobicContact CB-CB 4.4Å; K69-H215 HydrophobicContact CG-CB 4.24Å
70	I	96.9	Very high	93.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.4	178.6	-50	90	0	0	0	108.2	I53 L57 I68 V72 Q81 V82 V201 F214 H215 L216 H217	I53-I70 HydrophobicContact CD1-CG2 3.77Å; L57-I70 HydrophobicContact CD2-CD1 4.09Å; L57-I70 HydrophobicContact CD2-CG1 4.01Å; I68-I70 HydrophobicContact CG2-CD1 3.96Å; I68-I70 HydrophobicContact CG2-CG1 4.24Å; I70-V72 HydrophobicContact CG2-CG2 3.82Å; I70-Q81 CarbonylContact C-O 3.59Å; I70-Q81 WeakPolarHBondContact CA-O 3.37Å; I70-V82 HydrophobicContact CG1-CG2 4.44Å; I70-V82 HydrophobicContact CG2-CG2 4.29Å; I70-V201 HydrophobicContact CD1-CG1 4.17Å; I70-F214 HydrophobicContact CD1-CD1 4.46Å; I70-H215 PolarHBondContact N-O 3.26Å; I70-L216 HydrophobicContact CB-CD1 3.78Å; I70-L216 HydrophobicContact CG2-CD1 3.68Å; I70-L216 CarbonylContact O-C 3.53Å; I70-L216 WeakPolarHBondContact O-CA 3.33Å; I70-H217 PolarHBondContact O-N 2.9Å
71	T	95.5	Very high	93.8	Very high	10 Å²	10	33.8 Å²	33.8	6%	0.061	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.6	169.2	-62.8	0	0	0	0	109.1	Q81 H217 E219	T71-Q81 PolarHBondContact N-O 3.32Å; T71-Q81 PolarHBondContact O-N 2.95Å; T71-H217 WeakPolarHBondContact CA-O 3.28Å; T71-E219 HydrophobicContact CG2-CG 4.22Å
72	V	94.3	Very high	94	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.7	-174.7	-177.3	0	0	0	0	109.4	I70 L194 V197 L216 H217 S218 E219	I70-V72 HydrophobicContact CG2-CG2 3.82Å; V72-L194 HydrophobicContact CG1-CD1 4.49Å; V72-V197 HydrophobicContact CG2-CG1 4.09Å; V72-L216 HydrophobicContact CG2-CD1 3.65Å; V72-H217 PolarHBondContact N-O 3.11Å; V72-S218 CarbonylContact O-C 3.51Å; V72-S218 WeakPolarHBondContact O-CA 3.46Å; V72-E219 PolarHBondContact O-N 2.92Å
73	K	92.5	Very high	94.3	Very high	49 Å²	49	34.1 Å²	34.1	21%	0.213	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.7	173.7	-159.7	163.3	-160.6	153.6	0	110.7	G76 K78 L79 E219	K73-G76 PolarHBondContact O-N 2.97Å; K73-G76 VanDerWaalsContact O-N 3.08Å; K73-K78 HydrophobicContact CB-CB 4.38Å; K73-K78 HydrophobicContact CD-CD 4.27Å; K73-K78 HydrophobicContact CG-CB 4.5Å; K73-K78 HydrophobicContact CG-CD 4.33Å; K73-K78 PolarHBondContact O-N 3.05Å; K73-L79 HydrophobicContact CB-CB 3.63Å; K73-L79 PolarHBondContact N-O 3.42Å; K73-L79 PolarHBondContact O-N 2.87Å; K73-E219 HydrophobicContact CB-CB 4.2Å; K73-E219 HydrophobicContact CD-CB 3.99Å; K73-E219 WeakPolarHBondContact CD-OE2 3.26Å; K73-E219 VanDerWaalsContact CE-OE2 3.29Å; K73-E219 WeakPolarHBondContact CE-OE2 3.41Å; K73-E219 HydrophobicContact CG-CB 3.85Å; K73-E219 IonicContact NZ-OE2 3.14Å; K73-E219 PolarHBondContact NZ-OE2 3.26Å
74	D	88.6	Confident	94.6	Very high	69 Å²	69	33.6 Å²	33.6	37%	0.369	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	53.4	56.4	179.9	-166.1	29.8	0	0	0	112.1	G76 L77 K78	D74-G76 PolarHBondContact O-N 3.28Å; D74-L77 WeakPolarHBondContact O-CB 3.42Å; D74-L77 WeakPolarHBondContact O-CG 3.43Å; D74-L77 PolarHBondContact O-N 2.98Å; D74-K78 HydrophobicContact CB-CB 3.86Å
75	G	87.1	Confident	94.8	Very high	4 Å²	4	34 Å²	34	4%	0.041	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	64.9	2.4	-176.2	0	0	0	0	0	116	P49 G190 E193	P49-G75 VanDerWaalsContact CB-O 3.25Å; P49-G75 WeakPolarHBondContact CB-O 3.15Å; P49-G75 WeakPolarHBondContact CG-O 3.35Å; G75-G190 WeakPolarHBondContact CA-O 3.28Å; G75-E193 WeakPolarHBondContact O-CB 3.18Å
76	G	92.3	Very high	94.8	Very high	1 Å²	1	34 Å²	34	1%	0.01	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	97	1.8	-171.9	0	0	0	0	0	113.8	K73 D74	K73-G76 PolarHBondContact O-N 2.97Å; K73-G76 VanDerWaalsContact O-N 3.08Å; D74-G76 PolarHBondContact O-N 3.28Å
77	L	92.6	Very high	94.7	Very high	8 Å²	8	34.6 Å²	34.6	4%	0.042	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-28.9	176.6	-57.1	168.9	0	0	0	112.1	P49 D74 N175 L176 L187	P49-L77 HydrophobicContact CG-CD2 3.86Å; P49-L77 HydrophobicContact CG-CG 4.4Å; D74-L77 WeakPolarHBondContact O-CB 3.42Å; D74-L77 WeakPolarHBondContact O-CG 3.43Å; D74-L77 PolarHBondContact O-N 2.98Å; L77-N175 WeakPolarHBondContact O-CA 3.43Å; L77-L176 PolarHBondContact O-N 2.7Å; L77-L187 VanDerWaalsContact CD1-O 3.24Å; L77-L187 WeakPolarHBondContact CD1-O 3.3Å; L77-L187 HydrophobicContact CD2-CB 4.07Å; L77-L187 HydrophobicContact CD2-CD1 4.47Å
78	K	93	Very high	94.6	Very high	104 Å²	104	32.5 Å²	32.5	45%	0.452	17%	0.17	S	C	.	.	S	Bend	trans	-96.2	-48.1	178.8	-174.7	165.8	-176.7	168	0	112.2	K73 D74 N175	K73-K78 HydrophobicContact CB-CB 4.38Å; K73-K78 HydrophobicContact CD-CD 4.27Å; K73-K78 HydrophobicContact CG-CB 4.5Å; K73-K78 HydrophobicContact CG-CD 4.33Å; K73-K78 PolarHBondContact O-N 3.05Å; D74-K78 HydrophobicContact CB-CB 3.86Å; K78-N175 PolarHBondContact O-N 2.88Å
79	L	95.3	Very high	94.5	Very high	27 Å²	27	34.1 Å²	34.1	14%	0.141	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	131.2	-179.5	-172.9	70.5	0	0	0	110.5	K73 V172 E174	K73-L79 HydrophobicContact CB-CB 3.63Å; K73-L79 PolarHBondContact N-O 3.42Å; K73-L79 PolarHBondContact O-N 2.87Å; L79-V172 HydrophobicContact CD1-CG1 3.46Å; L79-V172 VanDerWaalsContact CD1-CG1 3.46Å; L79-E174 HydrophobicContact CD1-CG 3.92Å
80	I	97	Very high	94.4	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.2	157.2	-68.2	170.2	0	0	0	106.7	P49 A52 I53 L56 V82 V172 A173	P49-I80 HydrophobicContact CB-CD1 4.22Å; A52-I80 HydrophobicContact CB-CD1 4.02Å; I53-I80 HydrophobicContact CD1-CD1 4.41Å; I53-I80 HydrophobicContact CD1-CG1 4.34Å; I53-I80 HydrophobicContact CD1-CG2 3.54Å; I53-I80 HydrophobicContact CG1-CD1 4.42Å; L56-I80 HydrophobicContact CD1-CG2 3.96Å; I80-V82 HydrophobicContact CG2-CG2 4.29Å; I80-V172 CarbonylContact O-C 3.51Å; I80-V172 WeakPolarHBondContact O-CA 3.38Å; I80-A173 HydrophobicContact CB-CB 4.43Å; I80-A173 PolarHBondContact N-O 2.73Å; I80-A173 PolarHBondContact O-N 2.83Å
81	Q	97.3	Very high	94.3	Very high	54 Å²	54	37.9 Å²	37.9	25%	0.252	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124.7	168.8	169	172.1	-19.2	0	0	108.8	I70 T71 T170 I171 V172	I70-Q81 CarbonylContact C-O 3.59Å; I70-Q81 WeakPolarHBondContact CA-O 3.37Å; T71-Q81 PolarHBondContact N-O 3.32Å; T71-Q81 PolarHBondContact O-N 2.95Å; Q81-T170 HydrophobicContact CG-CG2 4.12Å; Q81-I171 WeakPolarHBondContact CA-O 3.45Å; Q81-V172 HydrophobicContact CB-CG2 4.27Å; Q81-V172 HydrophobicContact CG-CG2 4.04Å
82	V	97.6	Very high	94.2	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123	170.3	179.3	0	0	0	0	107.6	I53 L56 I68 K69 I70 I80 T170 I171	I53-V82 HydrophobicContact CD1-CG2 4.41Å; L56-V82 HydrophobicContact CB-CB 4.23Å; L56-V82 HydrophobicContact CB-CG1 4.4Å; L56-V82 HydrophobicContact CB-CG2 3.86Å; L56-V82 HydrophobicContact CD1-CB 4.35Å; L56-V82 HydrophobicContact CD1-CG2 3.81Å; L56-V82 HydrophobicContact CG-CG2 4.46Å; I68-V82 HydrophobicContact CG2-CG1 3.8Å; K69-V82 WeakPolarHBondContact O-CA 3.36Å; I70-V82 HydrophobicContact CG1-CG2 4.44Å; I70-V82 HydrophobicContact CG2-CG2 4.29Å; I80-V82 HydrophobicContact CG2-CG2 4.29Å; V82-T170 CarbonylContact O-C 3.58Å; V82-T170 WeakPolarHBondContact O-CA 3.47Å; V82-I171 PolarHBondContact N-O 3.3Å; V82-I171 PolarHBondContact O-N 2.59Å
83	Q	97.4	Very high	94.2	Very high	69 Å²	69	44 Å²	44	32%	0.322	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.5	176.1	170.9	173.3	22.9	0	0	108.9	I68 K69 T169 T170	I68-Q83 CarbonylContact C-O 3.5Å; I68-Q83 WeakPolarHBondContact CA-O 3.38Å; K69-Q83 HydrophobicContact CB-CB 4.43Å; K69-Q83 PolarHBondContact N-O 3.31Å; K69-Q83 PolarHBondContact O-N 2.69Å; Q83-T169 WeakPolarHBondContact CA-O 3.49Å; Q83-T170 HydrophobicContact CB-CG2 4.16Å; Q83-T170 WeakPolarHBondContact CG-OG1 3.41Å
84	D	97.2	Very high	94.3	Very high	15 Å²	15	41.7 Å²	41.7	8%	0.08	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	175	177	71.3	50.9	0	0	0	112.4	S60 S65 I68 G86 T169	S60-D84 WeakPolarHBondContact CB-OD2 3.49Å; S60-D84 WeakPolarHBondContact OG-CB 3.44Å; S60-D84 PolarHBondContact OG-OD2 3.32Å; S65-D84 WeakPolarHBondContact OG-CB 3.28Å; I68-D84 HydrophobicContact CG1-CB 4.26Å; D84-G86 PolarHBondContact OD1-N 3.26Å; D84-T169 PolarHBondContact N-O 2.86Å; D84-T169 PolarHBondContact OD1-N 2.85Å
85	N	96.2	Very high	94.6	Very high	67 Å²	67	41.3 Å²	41.3	36%	0.358	23%	0.226	S	C	.	.			trans	-121.7	29.1	175.8	70.1	-21.5	0	0	0	112.2	S65 T66 M67	S65-N85 WeakPolarHBondContact CA-OD1 3.39Å; T66-N85 PolarHBondContact N-OD1 3.1Å; T66-N85 PolarHBondContact OG1-ND2 2.84Å; M67-N85 PolarHBondContact N-OD1 3.43Å; M67-N85 PolarHBondContact O-OD1 3.14Å
86	G	94.1	Very high	94.8	Very high	8 Å²	8	44.9 Å²	44.9	8%	0.082	24%	0.244	C	C	.	.	S	Bend	trans	-73.6	-164.6	-178.5	0	0	0	0	0	113.8	A63 S65 D84 G88 G168	A63-G86 WeakPolarHBondContact O-CA 3.31Å; S65-G86 VanDerWaalsContact OG-CA 3.31Å; S65-G86 WeakPolarHBondContact OG-CA 3.42Å; S65-G86 PolarHBondContact OG-N 3Å; D84-G86 PolarHBondContact OD1-N 3.26Å; G86-G88 PolarHBondContact O-N 2.83Å; G86-G88 VanDerWaalsContact O-N 3.14Å; G86-G168 VanDerWaalsContact O-CA 3.29Å; G86-G168 WeakPolarHBondContact O-CA 3.46Å; G86-G168 PolarHBondContact O-N 3.04Å
87	C	94.4	Very high	94.9	Very high	86 Å²	86	46.3 Å²	46.3	58%	0.581	25%	0.251	S	S	*	.	S	Bend	trans	-62.8	-19.9	-177.5	60.5	0	0	0	0	115.3	A63 T140	A63-C87 PolarHBondContact O-N 3.29Å; C87-T140 WeakPolarHBondContact O-CA 3.23Å
88	G	94.2	Very high	94.9	Very high	12 Å²	12	45.9 Å²	45.9	12%	0.124	25%	0.249	C	C	.	.			trans	78.4	174.7	-174.2	0	0	0	0	0	113.4	G86	G86-G88 PolarHBondContact O-N 2.83Å; G86-G88 VanDerWaalsContact O-N 3.14Å
89	I	95.4	Very high	94.8	Very high	35 Å²	35	45.6 Å²	45.6	18%	0.179	25%	0.249	C	C	.	.			trans	-116.3	136.3	180	-58.5	164.1	0	0	0	108.6	D93 L97 T138 T169	I89-D93 HydrophobicContact CG2-CB 4.11Å; I89-L97 HydrophobicContact CD1-CD1 3.94Å; I89-L97 HydrophobicContact CD1-CD2 3.72Å; I89-L97 HydrophobicContact CG2-CD1 4.39Å; I89-L97 HydrophobicContact CG2-CD2 4.47Å; I89-T138 HydrophobicContact CB-CG2 4.02Å; I89-T138 PolarHBondContact N-OG1 3.37Å; I89-T138 WeakPolarHBondContact O-CG2 3.39Å; I89-T169 HydrophobicContact CD1-CG2 4.15Å
90	H	94.4	Very high	94.3	Very high	91 Å²	91	46.2 Å²	46.2	42%	0.421	25%	0.25	S	C	.	.			trans	-75	152.3	-175.5	-167.7	-113.3	0	0	0	112.2	S92 D93 T140	H90-S92 PolarHBondContact ND1-OG 3.31Å; H90-S92 PolarHBondContact O-N 3.17Å; H90-D93 WeakPolarHBondContact CB-OD2 3.41Å; H90-D93 PolarHBondContact O-N 3.18Å; H90-T140 HydrophobicContact CB-CG2 4.45Å
91	Q	93.7	Very high	93.7	Very high	81 Å²	81	53 Å²	53	38%	0.379	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.7	-173.2	-175	-172.9	0	0	0	113	D93 F147 P160	Q91-D93 PolarHBondContact O-N 3.2Å; Q91-F147 HydrophobicContact CB-CD2 4.08Å; Q91-F147 HydrophobicContact CB-CE2 4.17Å; Q91-F147 HydrophobicContact CG-CD1 4.14Å; Q91-F147 HydrophobicContact CG-CD2 4.03Å; Q91-F147 HydrophobicContact CG-CE1 4.2Å; Q91-F147 HydrophobicContact CG-CE2 4.08Å; Q91-F147 HydrophobicContact CG-CG 4.06Å; Q91-F147 HydrophobicContact CG-CZ 4.17Å; Q91-F147 VanDerWaalsContact NE2-CE1 3.28Å; Q91-P160 HydrophobicContact CG-CB 4.19Å; Q91-P160 HydrophobicContact CG-CG 4.35Å
92	S	93.8	Very high	93.2	Very high	72 Å²	72	52.5 Å²	52.5	50%	0.503	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.8	175.5	47.5	0	0	0	0	113.7	H90 P95	H90-S92 PolarHBondContact ND1-OG 3.31Å; H90-S92 PolarHBondContact O-N 3.17Å; S92-P95 WeakPolarHBondContact O-CD 3.43Å
93	D	94.5	Very high	92.7	Very high	68 Å²	68	55 Å²	55	36%	0.364	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-21.3	-166	-44.8	-17.9	0	0	0	110.6	I89 H90 Q91 P95 I96 L97	I89-D93 HydrophobicContact CG2-CB 4.11Å; H90-D93 WeakPolarHBondContact CB-OD2 3.41Å; H90-D93 PolarHBondContact O-N 3.18Å; Q91-D93 PolarHBondContact O-N 3.2Å; D93-P95 VanDerWaalsContact C-CD 3.45Å; D93-I96 WeakPolarHBondContact O-CG1 3.38Å; D93-I96 PolarHBondContact O-N 3.34Å; D93-I96 VanDerWaalsContact O-N 3.12Å; D93-L97 PolarHBondContact O-N 3.13Å
94	L	94.3	Very high	92.3	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-51	-44	175.6	-74.8	171.6	0	0	0	114.2	I96 L97 V136 T138 F147 V149 Y151 P160	L94-I96 PolarHBondContact O-N 3.43Å; L94-L97 HydrophobicContact CD2-CD2 4Å; L94-L97 PolarHBondContact O-N 2.97Å; L94-V136 HydrophobicContact CD2-CG1 4.39Å; L94-T138 HydrophobicContact CD1-CG2 4.19Å; L94-T138 HydrophobicContact CD2-CG2 3.9Å; L94-T138 HydrophobicContact CG-CG2 4.37Å; L94-F147 HydrophobicContact CD1-CB 3.57Å; L94-V149 HydrophobicContact CB-CG2 4.12Å; L94-V149 HydrophobicContact CD1-CG2 4.27Å; L94-Y151 WeakPolarHBondContact CD2-OH 3.31Å; L94-Y151 VanDerWaalsContact O-CE1 3.26Å; L94-Y151 WeakPolarHBondContact O-CE1 3.31Å; L94-Y151 PolarHBondContact O-OH 2.7Å; L94-P160 HydrophobicContact CB-CG 4Å; L94-P160 HydrophobicContact CD1-CB 3.97Å; L94-P160 HydrophobicContact CD1-CG 4.08Å
95	P	93.9	Very high	91.5	Very high	60 Å²	60	58.7 Å²	58.7	39%	0.39	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-57.1	-35.7	178.2	-25.2	35.9	0	0	0	113.9	S92 D93	S92-P95 WeakPolarHBondContact O-CD 3.43Å; D93-P95 VanDerWaalsContact C-CD 3.45Å
96	I	93.2	Very high	90.7	Very high	80 Å²	80	57.3 Å²	57.3	41%	0.41	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-99	-6.4	-175.8	62.5	170.9	0	0	0	113.7	D93 L94 C98 E99 T102	D93-I96 WeakPolarHBondContact O-CG1 3.38Å; D93-I96 PolarHBondContact O-N 3.34Å; D93-I96 VanDerWaalsContact O-N 3.12Å; L94-I96 PolarHBondContact O-N 3.43Å; I96-C98 PolarHBondContact O-N 2.97Å; I96-E99 WeakPolarHBondContact O-CB 3.04Å; I96-E99 PolarHBondContact O-N 3.02Å; I96-T102 HydrophobicContact CB-CG2 4.31Å; I96-T102 PolarHBondContact O-OG1 3.29Å
97	L	93.2	Very high	90	Very high	30 Å²	30	66.3 Å²	66.3	16%	0.157	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.6	-168.9	179.5	62.3	0	0	0	115.3	I89 D93 L94 L125 V136 Y151	I89-L97 HydrophobicContact CD1-CD1 3.94Å; I89-L97 HydrophobicContact CD1-CD2 3.72Å; I89-L97 HydrophobicContact CG2-CD1 4.39Å; I89-L97 HydrophobicContact CG2-CD2 4.47Å; D93-L97 PolarHBondContact O-N 3.13Å; L94-L97 HydrophobicContact CD2-CD2 4Å; L94-L97 PolarHBondContact O-N 2.97Å; L97-L125 HydrophobicContact CD1-CD1 3.73Å; L97-L125 HydrophobicContact CD2-CD1 4.32Å; L97-L125 HydrophobicContact CG-CD1 3.86Å; L97-V136 HydrophobicContact CD2-CB 4.35Å; L97-V136 HydrophobicContact CD2-CG1 4.05Å; L97-V136 HydrophobicContact CD2-CG2 4.03Å; L97-Y151 HydrophobicContact CB-CE1 4.37Å
98	C	92.7	Very high	89.2	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	7.9	177.6	-65.2	0	0	0	0	113.4	I96 S126 Y151 G154	I96-C98 PolarHBondContact O-N 2.97Å; C98-S126 VanDerWaalsContact O-CA 3.23Å; C98-S126 WeakPolarHBondContact O-CA 3.11Å; C98-S126 WeakPolarHBondContact O-CB 3.4Å; C98-S126 PolarHBondContact O-OG 2.81Å; C98-Y151 HydrophobicContact CB-CD1 3.61Å; C98-Y151 HydrophobicContact CB-CE1 4.18Å; C98-Y151 HydrophobicContact CB-CG 3.99Å; C98-Y151 VanDerWaalsContact SG-CD1 3.57Å; C98-Y151 VanDerWaalsContact SG-CG 3.5Å; C98-G154 CarbonylContact C-O 3.55Å; C98-G154 VanDerWaalsContact C-O 3.23Å; C98-G154 WeakPolarHBondContact CB-O 3.41Å; C98-G154 WeakPolarHBondContact O-CA 3.44Å
99	E	90.1	Very high	88.1	Confident	98 Å²	98	76.4 Å²	76.4	46%	0.458	39%	0.385	S	S	.	.	S	Bend	trans	-67.2	164.5	169.2	-65	-172.8	-170.8	0	0	110.5	I96 T102 S126	I96-E99 WeakPolarHBondContact O-CB 3.04Å; I96-E99 PolarHBondContact O-N 3.02Å; E99-T102 HydrophobicContact CB-CG2 3.91Å; E99-T102 PolarHBondContact O-OG1 3.19Å; E99-S126 WeakPolarHBondContact O-CB 3.24Å; E99-S126 PolarHBondContact O-OG 2.75Å
100	R	86.1	Confident	87	Confident	40 Å²	40	77.1 Å²	77.1	15%	0.151	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	140.7	178.1	-78.8	-174.9	158	-86.8	-4.8	110.2	N38 T102 E123 S126	N38-R100 PolarHBondContact O-NH2 3.15Å; N38-R100 WeakPolarHBondContact OD1-CD 3.31Å; N38-R100 PolarHBondContact OD1-NE 2.85Å; R100-T102 VanDerWaalsContact C-N 3.26Å; R100-T102 PolarHBondContact O-N 3Å; R100-E123 IonicContact CZ-OE1 2.66Å; R100-E123 IonicContact NH1-OE1 3.95Å; R100-E123 PolarHBondContact NH1-OE1 2.59Å; R100-S126 VanDerWaalsContact CG-OG 3.32Å; R100-S126 WeakPolarHBondContact CG-OG 3.48Å
101	F	85	Confident	86	Confident	144 Å²	144	74.9 Å²	74.9	63%	0.632	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	15.5	175.8	-39	-61.7	0	0	0	114.8	G122 E123	F101-G122 PolarHBondContact N-O 2.89Å; F101-E123 HydrophobicContact CD1-CG 4.19Å; F101-E123 HydrophobicContact CE1-CG 4.18Å
102	T	86.7	Confident	84.7	Confident	43 Å²	43	73.9 Å²	73.9	26%	0.264	38%	0.382	S	S	.	.			trans	-87.4	123.9	172.7	52.7	0	0	0	0	110.8	I96 E99 R100 G122	I96-T102 HydrophobicContact CB-CG2 4.31Å; I96-T102 PolarHBondContact O-OG1 3.29Å; E99-T102 HydrophobicContact CB-CG2 3.91Å; E99-T102 PolarHBondContact O-OG1 3.19Å; R100-T102 VanDerWaalsContact C-N 3.26Å; R100-T102 PolarHBondContact O-N 3Å; T102-G122 WeakPolarHBondContact O-CA 3.25Å
103	T	87.1	Confident	83.2	Confident	57 Å²	57	74.2 Å²	74.2	35%	0.35	38%	0.384	S	S	.	.			trans	-150.6	152.2	178.1	-174.1	0	0	0	0	111	K105 L106	T103-K105 PolarHBondContact OG1-N 3.28Å; T103-L106 HydrophobicContact CG2-CB 4.4Å
104	S	87.2	Confident	81.8	Confident	110 Å²	110	77.7 Å²	77.7	77%	0.769	40%	0.396	S	S	*	.	S	Bend	trans	-95.9	-4.8	170.1	53.3	0	0	0	0	113.3
105	K	82.3	Confident	80.4	Confident	51 Å²	51	79.1 Å²	79.1	22%	0.222	40%	0.404	C	S	.	.	S	Bend	trans	-103	-14.1	-162.7	-61.4	161.8	-175.3	179.5	0	115	N59 D62 T103 T117 G119	N59-K105 PolarHBondContact OD1-NZ 2.7Å; D62-K105 WeakPolarHBondContact OD2-CE 3.45Å; D62-K105 IonicContact OD2-NZ 3.59Å; D62-K105 PolarHBondContact OD2-NZ 3.45Å; T103-K105 PolarHBondContact OG1-N 3.28Å; K105-T117 HydrophobicContact CG-CG2 4.46Å; K105-G119 WeakPolarHBondContact CD-O 3.31Å; K105-G119 PolarHBondContact NZ-O 3.07Å
106	L	79.5	Confident	79.1	Confident	37 Å²	37	81.3 Å²	81.3	19%	0.194	42%	0.42	C	S	.	.			trans	-127.3	151.3	168.3	-58.5	-177.4	0	0	0	108.7	T103 D111 L112 I115 F120	T103-L106 HydrophobicContact CG2-CB 4.4Å; L106-D111 HydrophobicContact CB-CB 4.48Å; L106-D111 HydrophobicContact CD2-CB 3.61Å; L106-L112 HydrophobicContact CD1-CD2 4.31Å; L106-L112 HydrophobicContact CD1-CG 4.29Å; L106-I115 HydrophobicContact CD2-CD1 3.87Å; L106-I115 HydrophobicContact CD2-CG1 3.88Å; L106-F120 HydrophobicContact CD1-CB 3.92Å; L106-F120 HydrophobicContact CD1-CD2 4.28Å; L106-F120 HydrophobicContact CD2-CB 4.31Å; L106-F120 HydrophobicContact CG-CB 4.05Å
107	K	78.8	Confident	77.8	Confident	197 Å²	197	79.1 Å²	79.1	86%	0.857	41%	0.411	S	S	*	.	S	Bend	trans	-122.3	-36.7	168.8	-63.9	-179.9	-177.7	176.7	0	111.6	D111	K107-D111 PolarHBondContact N-OD2 3.15Å
108	E	78.2	Confident	76.5	Confident	129 Å²	129	78.3 Å²	78.3	60%	0.603	41%	0.406	S	S	*	.	S	Bend	trans	-127.7	160.8	-177.4	-68.5	179.6	-165.9	0	0	111.6	S110 D111	E108-S110 VanDerWaalsContact CB-OG 3.29Å; E108-S110 WeakPolarHBondContact CB-OG 3.31Å; E108-S110 PolarHBondContact O-N 2.87Å; E108-S110 PolarHBondContact OE2-OG 3.43Å; E108-D111 PolarHBondContact N-OD2 3.36Å; E108-D111 WeakPolarHBondContact O-CB 3.27Å; E108-D111 PolarHBondContact O-N 3Å; E108-D111 VanDerWaalsContact O-N 3.14Å
109	F	70.7	Confident	75.3	Confident	181 Å²	181	78.8 Å²	78.8	79%	0.794	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-61.1	-27.5	171	-173	-89.7	0	0	0	112.1	D111 L112	F109-D111 PolarHBondContact O-N 2.98Å; F109-L112 HydrophobicContact CD1-CD1 4.47Å; F109-L112 HydrophobicContact CD2-CD1 3.4Å; F109-L112 VanDerWaalsContact CD2-CD1 3.4Å; F109-L112 HydrophobicContact CE2-CD1 3.49Å; F109-L112 VanDerWaalsContact CE2-CD1 3.49Å; F109-L112 HydrophobicContact CG-CD1 3.93Å; F109-L112 HydrophobicContact CZ-CD1 4.09Å; F109-L112 WeakPolarHBondContact O-CB 3.39Å; F109-L112 PolarHBondContact O-N 2.8Å
110	S	72.3	Confident	74.3	Confident	50 Å²	50	74.6 Å²	74.6	35%	0.35	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-60	-29.4	175.9	64.5	0	0	0	0	112.8	E108 L112 S113	E108-S110 VanDerWaalsContact CB-OG 3.29Å; E108-S110 WeakPolarHBondContact CB-OG 3.31Å; E108-S110 PolarHBondContact O-N 2.87Å; E108-S110 PolarHBondContact OE2-OG 3.43Å; S110-L112 VanDerWaalsContact C-N 3.27Å; S110-L112 PolarHBondContact O-N 3.04Å; S110-S113 PolarHBondContact O-N 2.92Å; S110-S113 PolarHBondContact O-OG 2.63Å
111	D	72	Confident	73.6	Confident	44 Å²	44	76.3 Å²	76.3	24%	0.235	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-67.4	-23.8	179.3	-64.2	-38.6	0	0	0	113	L106 K107 E108 F109 S113 K114 I115	L106-D111 HydrophobicContact CB-CB 4.48Å; L106-D111 HydrophobicContact CD2-CB 3.61Å; K107-D111 PolarHBondContact N-OD2 3.15Å; E108-D111 PolarHBondContact N-OD2 3.36Å; E108-D111 WeakPolarHBondContact O-CB 3.27Å; E108-D111 PolarHBondContact O-N 3Å; E108-D111 VanDerWaalsContact O-N 3.14Å; F109-D111 PolarHBondContact O-N 2.98Å; D111-S113 PolarHBondContact O-N 3.11Å; D111-S113 VanDerWaalsContact O-N 3.16Å; D111-K114 PolarHBondContact O-N 2.87Å; D111-I115 WeakPolarHBondContact O-CG1 3.17Å; D111-I115 PolarHBondContact O-N 2.98Å
112	L	67.1	Low	73.2	Confident	60 Å²	60	70.1 Å²	70.1	31%	0.314	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-56.3	-32.6	177	-78.2	152.1	0	0	0	112.3	L106 F109 S110 K114 I115 F120	L106-L112 HydrophobicContact CD1-CD2 4.31Å; L106-L112 HydrophobicContact CD1-CG 4.29Å; F109-L112 HydrophobicContact CD1-CD1 4.47Å; F109-L112 HydrophobicContact CD2-CD1 3.4Å; F109-L112 VanDerWaalsContact CD2-CD1 3.4Å; F109-L112 HydrophobicContact CE2-CD1 3.49Å; F109-L112 VanDerWaalsContact CE2-CD1 3.49Å; F109-L112 HydrophobicContact CG-CD1 3.93Å; F109-L112 HydrophobicContact CZ-CD1 4.09Å; F109-L112 WeakPolarHBondContact O-CB 3.39Å; F109-L112 PolarHBondContact O-N 2.8Å; S110-L112 VanDerWaalsContact C-N 3.27Å; S110-L112 PolarHBondContact O-N 3.04Å; L112-K114 PolarHBondContact O-N 3.39Å; L112-I115 HydrophobicContact CB-CD1 4.47Å; L112-I115 HydrophobicContact CD2-CD1 3.79Å; L112-I115 HydrophobicContact CG-CD1 4.38Å; L112-F120 HydrophobicContact CD2-CD2 3.92Å; L112-F120 HydrophobicContact CD2-CE2 3.87Å
113	S	62.5	Low	73.2	Confident	80 Å²	80	69.6 Å²	69.6	56%	0.559	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-72.9	-7	177.1	67.4	0	0	0	0	114.8	S110 D111 V374	S110-S113 PolarHBondContact O-N 2.92Å; S110-S113 PolarHBondContact O-OG 2.63Å; D111-S113 PolarHBondContact O-N 3.11Å; D111-S113 VanDerWaalsContact O-N 3.16Å; S113-V374 WeakPolarHBondContact O-CG1 3.48Å
114	K	65	Low	73.2	Confident	141 Å²	141	67.7 Å²	67.7	61%	0.613	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-126.7	10.8	-170.9	-59.5	170.8	-170.5	161.8	0	113.2	D111 L112 S116	D111-K114 PolarHBondContact O-N 2.87Å; L112-K114 PolarHBondContact O-N 3.39Å; K114-S116 PolarHBondContact O-N 3.46Å
115	I	65.1	Low	73.5	Confident	30 Å²	30	63.5 Å²	63.5	15%	0.154	33%	0.328	C	S	.	.			trans	-64.8	109.9	-170.7	-65.5	-179	0	0	0	111.4	L106 D111 L112 T117 F120	L106-I115 HydrophobicContact CD2-CD1 3.87Å; L106-I115 HydrophobicContact CD2-CG1 3.88Å; D111-I115 WeakPolarHBondContact O-CG1 3.17Å; D111-I115 PolarHBondContact O-N 2.98Å; L112-I115 HydrophobicContact CB-CD1 4.47Å; L112-I115 HydrophobicContact CD2-CD1 3.79Å; L112-I115 HydrophobicContact CG-CD1 4.38Å; I115-T117 WeakPolarHBondContact CG2-O 3.45Å; I115-F120 HydrophobicContact CD1-CB 3.68Å; I115-F120 HydrophobicContact CD1-CD1 3.76Å; I115-F120 HydrophobicContact CD1-CD2 3.88Å; I115-F120 HydrophobicContact CD1-CE1 4.32Å; I115-F120 HydrophobicContact CD1-CE2 4.42Å; I115-F120 HydrophobicContact CD1-CG 3.52Å; I115-F120 HydrophobicContact CG2-CD1 4.23Å
116	S	65.7	Low	73.9	Confident	106 Å²	106	61.1 Å²	61.1	74%	0.741	32%	0.318	S	S	*	.			trans	-98.1	-7.2	164.4	55.8	0	0	0	0	113.3	K114	K114-S116 PolarHBondContact O-N 3.46Å
117	T	66.6	Low	74.6	Confident	34 Å²	34	59.4 Å²	59.4	21%	0.209	31%	0.309	C	S	.	.	S	Bend	trans	-96.4	154.1	-176	55.7	0	0	0	0	112.8	D62 K105 I115 R307	D62-T117 VanDerWaalsContact OD1-CA 3.29Å; D62-T117 WeakPolarHBondContact OD1-CA 3.3Å; D62-T117 WeakPolarHBondContact OD1-CB 3.31Å; K105-T117 HydrophobicContact CG-CG2 4.46Å; I115-T117 WeakPolarHBondContact CG2-O 3.45Å; T117-R307 PolarHBondContact O-NH2 3.46Å
118	F	66.2	Low	75.3	Confident	12 Å²	12	50.2 Å²	50.2	5%	0.053	27%	0.269	C	S	.	.	S	Bend	trans	-79.3	-42.8	-172.2	-67.1	-66	0	0	0	113.7	E58 I61 D62 Y208 N306 R307 K385	E58-F118 HydrophobicContact CB-CB 3.53Å; E58-F118 HydrophobicContact CB-CG 4.2Å; E58-F118 HydrophobicContact CG-CB 3.58Å; E58-F118 HydrophobicContact CG-CD1 4.29Å; E58-F118 HydrophobicContact CG-CG 3.93Å; E58-F118 WeakPolarHBondContact OE2-CB 3.21Å; I61-F118 HydrophobicContact CG2-CD2 4.15Å; I61-F118 HydrophobicContact CG2-CE2 3.76Å; D62-F118 VanDerWaalsContact CG-N 3.35Å; D62-F118 VanDerWaalsContact OD1-CD2 3.31Å; D62-F118 WeakPolarHBondContact OD1-CD2 3.33Å; D62-F118 PolarHBondContact OD1-N 3.06Å; D62-F118 PolarHBondContact OD2-N 2.84Å; F118-Y208 WeakPolarHBondContact CE2-OH 3.48Å; F118-Y208 WeakPolarHBondContact CZ-OH 3.3Å; F118-N306 WeakPolarHBondContact CE1-O 3.47Å; F118-N306 HydrophobicContact CZ-CB 4.02Å; F118-N306 WeakPolarHBondContact CZ-O 3.25Å; F118-R307 HydrophobicContact CD1-CB 4.18Å; F118-R307 HydrophobicContact CD1-CG 4.33Å; F118-R307 HydrophobicContact CE1-CB 3.92Å; F118-R307 PolarHBondContact O-NH1 2.89Å; F118-R307 PolarHBondContact O-NH2 3.38Å; F118-K385 WeakPolarHBondContact O-CD 3.29Å; F118-K385 WeakPolarHBondContact O-CE 3.48Å
119	G	66.6	Low	76.1	Confident	10 Å²	10	44 Å²	44	10%	0.103	24%	0.24	C	C	.	.			trans	-114	101.8	-177.5	0	0	0	0	0	113.9	D62 K105	D62-G119 PolarHBondContact OD2-N 3.05Å; D62-G119 VanDerWaalsContact OD2-N 3.13Å; K105-G119 WeakPolarHBondContact CD-O 3.31Å; K105-G119 PolarHBondContact NZ-O 3.07Å
120	F	69.5	Low	77.1	Confident	10 Å²	10	35.7 Å²	35.7	4%	0.044	20%	0.204	C	C	.	.			trans	-104.6	-29.4	-174.9	61	-94	0	0	0	115.9	L106 L112 I115 G122 V379 N380 K385	L106-F120 HydrophobicContact CD1-CB 3.92Å; L106-F120 HydrophobicContact CD1-CD2 4.28Å; L106-F120 HydrophobicContact CD2-CB 4.31Å; L106-F120 HydrophobicContact CG-CB 4.05Å; L112-F120 HydrophobicContact CD2-CD2 3.92Å; L112-F120 HydrophobicContact CD2-CE2 3.87Å; I115-F120 HydrophobicContact CD1-CB 3.68Å; I115-F120 HydrophobicContact CD1-CD1 3.76Å; I115-F120 HydrophobicContact CD1-CD2 3.88Å; I115-F120 HydrophobicContact CD1-CE1 4.32Å; I115-F120 HydrophobicContact CD1-CE2 4.42Å; I115-F120 HydrophobicContact CD1-CG 3.52Å; I115-F120 HydrophobicContact CG2-CD1 4.23Å; F120-G122 VanDerWaalsContact C-N 3.31Å; F120-G122 PolarHBondContact O-N 2.85Å; F120-V379 HydrophobicContact CE1-CG1 4.36Å; F120-N380 HydrophobicContact CZ-CB 4.41Å; F120-K385 HydrophobicContact CD1-CD 4.48Å; F120-K385 HydrophobicContact CE1-CD 4.12Å
121	R	70.7	Confident	78	Confident	76 Å²	76	33.7 Å²	33.7	29%	0.287	19%	0.189	S	C	.	.	S	Bend	trans	-69.8	-14.8	-174.3	-62.9	-172	-179.9	179	1.4	116.1	E123 N380	R121-E123 HydrophobicContact CB-CG 4.03Å; R121-E123 VanDerWaalsContact CD-OE2 3.3Å; R121-E123 WeakPolarHBondContact CD-OE2 3.43Å; R121-E123 IonicContact NH1-OE2 3.01Å; R121-N380 PolarHBondContact NE-OD1 3.49Å; R121-N380 VanDerWaalsContact NE-OD1 3.17Å; R121-N380 PolarHBondContact NH2-O 3.44Å; R121-N380 PolarHBondContact NH2-OD1 3.45Å
122	G	77.5	Confident	79.1	Confident	15 Å²	15	31.6 Å²	31.6	16%	0.155	18%	0.178	C	C	.	.	S	Bend	trans	68.3	30.1	-175.4	0	0	0	0	0	114.6	F101 T102 F120	F101-G122 PolarHBondContact N-O 2.89Å; T102-G122 WeakPolarHBondContact O-CA 3.25Å; F120-G122 VanDerWaalsContact C-N 3.31Å; F120-G122 PolarHBondContact O-N 2.85Å
123	E	85.6	Confident	80.5	Confident	32 Å²	32	30.9 Å²	30.9	15%	0.15	17%	0.174	C	C	.	.			trans	-114.2	-16	-173.6	-64.9	-169.9	98.5	0	0	115.2	R100 F101 R121 S127	R100-E123 IonicContact CZ-OE1 2.66Å; R100-E123 IonicContact NH1-OE1 3.95Å; R100-E123 PolarHBondContact NH1-OE1 2.59Å; F101-E123 HydrophobicContact CD1-CG 4.19Å; F101-E123 HydrophobicContact CE1-CG 4.18Å; R121-E123 HydrophobicContact CB-CG 4.03Å; R121-E123 VanDerWaalsContact CD-OE2 3.3Å; R121-E123 WeakPolarHBondContact CD-OE2 3.43Å; R121-E123 IonicContact NH1-OE2 3.01Å; E123-S127 VanDerWaalsContact O-CB 3.24Å; E123-S127 WeakPolarHBondContact O-CB 3.45Å; E123-S127 PolarHBondContact O-N 3.06Å; E123-S127 PolarHBondContact O-OG 3.15Å
124	A	88.2	Confident	82.1	Confident	16 Å²	16	27.1 Å²	27.1	13%	0.132	15%	0.148	C	C	.	.	H	α-helix	trans	-64.8	-56.9	-167.9	0	0	0	0	0	113.5	E55 S126 S127 L128	E55-A124 HydrophobicContact CB-CB 4.1Å; E55-A124 HydrophobicContact CG-CB 4.32Å; A124-S126 VanDerWaalsContact C-N 3.33Å; A124-S126 PolarHBondContact O-N 2.98Å; A124-S127 PolarHBondContact O-N 3.19Å; A124-L128 PolarHBondContact O-N 3.01Å
125	L	93	Very high	83.7	Confident	22 Å²	22	20.9 Å²	20.9	12%	0.115	12%	0.122	C	C	.	.	H	α-helix	trans	-66.8	-36.8	179.3	-61.3	-178.1	0	0	0	111.7	L56 L97 L128 S129 I171	L56-L125 HydrophobicContact CD2-CD2 3.92Å; L97-L125 HydrophobicContact CD1-CD1 3.73Å; L97-L125 HydrophobicContact CD2-CD1 4.32Å; L97-L125 HydrophobicContact CG-CD1 3.86Å; L125-L128 PolarHBondContact O-N 3.04Å; L125-S129 PolarHBondContact O-N 3.33Å; L125-S129 PolarHBondContact O-OG 3.41Å; L125-I171 HydrophobicContact CD1-CD1 4.34Å; L125-I171 HydrophobicContact CD2-CD1 3.75Å
126	S	92.2	Very high	85.2	Confident	2 Å²	2	19.5 Å²	19.5	1%	0.014	11%	0.114	C	C	.	.	H	α-helix	trans	-58.2	-51.3	172.6	-160.9	0	0	0	0	111.5	C98 E99 R100 A124 L128 S129 H130	C98-S126 VanDerWaalsContact O-CA 3.23Å; C98-S126 WeakPolarHBondContact O-CA 3.11Å; C98-S126 WeakPolarHBondContact O-CB 3.4Å; C98-S126 PolarHBondContact O-OG 2.81Å; E99-S126 WeakPolarHBondContact O-CB 3.24Å; E99-S126 PolarHBondContact O-OG 2.75Å; R100-S126 VanDerWaalsContact CG-OG 3.32Å; R100-S126 WeakPolarHBondContact CG-OG 3.48Å; A124-S126 VanDerWaalsContact C-N 3.33Å; A124-S126 PolarHBondContact O-N 2.98Å; S126-L128 PolarHBondContact O-N 3.32Å; S126-S129 PolarHBondContact O-N 3.04Å; S126-S129 PolarHBondContact O-OG 2.84Å; S126-H130 PolarHBondContact O-N 3.48Å; S126-H130 VanDerWaalsContact O-N 3.16Å; S126-H130 PolarHBondContact O-ND1 2.82Å
127	S	92.4	Very high	86.7	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.8	-44.7	178	-61.5	0	0	0	0	111.9	E123 A124 S129 H130 V131	E123-S127 VanDerWaalsContact O-CB 3.24Å; E123-S127 WeakPolarHBondContact O-CB 3.45Å; E123-S127 PolarHBondContact O-N 3.06Å; E123-S127 PolarHBondContact O-OG 3.15Å; A124-S127 PolarHBondContact O-N 3.19Å; S127-S129 PolarHBondContact O-N 3.4Å; S127-H130 PolarHBondContact O-N 3.34Å; S127-H130 VanDerWaalsContact O-N 3.12Å; S127-V131 PolarHBondContact O-N 2.73Å
128	L	94.2	Very high	88.2	Confident	4 Å²	4	14.1 Å²	14.1	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-59.9	-44.8	177.3	-173.3	59.3	0	0	0	111.9	A52 L56 A124 L125 S126 H130 V131 A132 V134 A173 L176	A52-L128 HydrophobicContact CB-CD1 3.82Å; L56-L128 HydrophobicContact CD1-CD2 4.16Å; L56-L128 HydrophobicContact CD2-CD2 4.28Å; L56-L128 HydrophobicContact CG-CD2 4.43Å; A124-L128 PolarHBondContact O-N 3.01Å; L125-L128 PolarHBondContact O-N 3.04Å; S126-L128 PolarHBondContact O-N 3.32Å; L128-H130 PolarHBondContact O-N 3.42Å; L128-V131 WeakPolarHBondContact O-CG2 3.46Å; L128-V131 PolarHBondContact O-N 2.85Å; L128-V131 VanDerWaalsContact O-N 3.08Å; L128-A132 HydrophobicContact CD1-CB 4.31Å; L128-A132 PolarHBondContact O-N 2.73Å; L128-V134 HydrophobicContact CB-CG2 4.4Å; L128-V134 HydrophobicContact CD2-CG2 4.27Å; L128-V134 HydrophobicContact CG-CG2 3.83Å; L128-A173 HydrophobicContact CD1-CB 4.14Å; L128-A173 HydrophobicContact CD2-CB 4.08Å; L128-A173 HydrophobicContact CG-CB 4.2Å; L128-L176 HydrophobicContact CD1-CD1 4.15Å
129	S	94.5	Very high	89.7	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68.6	-15.3	177.2	75.1	0	0	0	0	114.6	L125 S126 S127 A153 G154	L125-S129 PolarHBondContact O-N 3.33Å; L125-S129 PolarHBondContact O-OG 3.41Å; S126-S129 PolarHBondContact O-N 3.04Å; S126-S129 PolarHBondContact O-OG 2.84Å; S127-S129 PolarHBondContact O-N 3.4Å; S129-A153 PolarHBondContact O-N 3.17Å; S129-G154 VanDerWaalsContact OG-CA 3.28Å; S129-G154 WeakPolarHBondContact OG-CA 3.21Å; S129-G154 PolarHBondContact OG-N 3.17Å
130	H	92.2	Very high	91	Very high	6 Å²	6	17 Å²	17	3%	0.028	9%	0.087	C	C	.	.	H	α-helix	trans	-83.8	-14.6	171.4	-77.2	80.3	0	0	0	113.3	N38 A42 S126 S127 L128 A153 G154 N179	N38-H130 WeakPolarHBondContact CB-NE2 3.29Å; N38-H130 PolarHBondContact ND2-NE2 2.79Å; N38-H130 VanDerWaalsContact ND2-NE2 3.19Å; A42-H130 HydrophobicContact CB-CB 3.69Å; S126-H130 PolarHBondContact O-N 3.48Å; S126-H130 VanDerWaalsContact O-N 3.16Å; S126-H130 PolarHBondContact O-ND1 2.82Å; S127-H130 PolarHBondContact O-N 3.34Å; S127-H130 VanDerWaalsContact O-N 3.12Å; L128-H130 PolarHBondContact O-N 3.42Å; H130-A153 PolarHBondContact CE1-O 3.21Å; H130-A153 PolarHBondContact NE2-O 3.32Å; H130-G154 PolarHBondContact CE1-N 3.26Å; H130-N179 PolarHBondContact O-ND2 2.87Å
131	V	92	Very high	92.1	Very high	8 Å²	8	20.4 Å²	20.4	5%	0.048	12%	0.116	C	C	.	.	H	α-helix	trans	-122.6	-11.1	-179.8	-62.2	0	0	0	0	114.8	A42 I46 S127 L128 L176 F177	A42-V131 HydrophobicContact CB-CG1 4.42Å; I46-V131 HydrophobicContact CB-CG2 4.06Å; I46-V131 HydrophobicContact CG2-CG2 3.85Å; S127-V131 PolarHBondContact O-N 2.73Å; L128-V131 WeakPolarHBondContact O-CG2 3.46Å; L128-V131 PolarHBondContact O-N 2.85Å; L128-V131 VanDerWaalsContact O-N 3.08Å; V131-L176 HydrophobicContact CG2-CD1 3.76Å; V131-F177 HydrophobicContact CB-CD1 3.93Å; V131-F177 HydrophobicContact CB-CE1 4.08Å; V131-F177 HydrophobicContact CG1-CD1 4.25Å; V131-F177 HydrophobicContact CG1-CE1 4.27Å; V131-F177 HydrophobicContact CG2-CD1 4.46Å; V131-F177 HydrophobicContact CG2-CE1 4.18Å; V131-F177 WeakPolarHBondContact O-CA 3.3Å; V131-F177 PolarHBondContact O-N 3.25Å
132	A	94.5	Very high	93.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-135.6	165.7	175.8	0	0	0	0	0	110.6	L128 V134 A173 L176	L128-A132 HydrophobicContact CD1-CB 4.31Å; L128-A132 PolarHBondContact O-N 2.73Å; A132-V134 HydrophobicContact CB-CG2 4.48Å; A132-A173 HydrophobicContact CB-CB 3.99Å; A132-L176 HydrophobicContact CB-CD1 3.98Å
133	L	95.7	Very high	93.7	Very high	45 Å²	45	24.2 Å²	24.2	24%	0.236	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	112.9	166.9	-57.9	177.4	0	0	0	107.8	R152 A173 E174 Y178	L133-R152 HydrophobicContact CD2-CG 4.34Å; L133-A173 WeakPolarHBondContact O-CA 3.39Å; L133-E174 HydrophobicContact CB-CB 4.37Å; L133-E174 PolarHBondContact N-O 3.02Å; L133-E174 PolarHBondContact O-N 3.45Å; L133-Y178 HydrophobicContact CD2-CE1 3.97Å; L133-Y178 HydrophobicContact CG-CE1 4.28Å
134	V	97.4	Very high	94	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.9	-172.2	173.9	0	0	0	0	110.6	L128 A132 V136 K150 Y151 I171 V172 A173	L128-V134 HydrophobicContact CB-CG2 4.4Å; L128-V134 HydrophobicContact CD2-CG2 4.27Å; L128-V134 HydrophobicContact CG-CG2 3.83Å; A132-V134 HydrophobicContact CB-CG2 4.48Å; V134-V136 HydrophobicContact CG1-CG2 4.18Å; V134-K150 CarbonylContact O-C 3.54Å; V134-K150 WeakPolarHBondContact O-CA 3.39Å; V134-Y151 HydrophobicContact CG1-CD2 4.27Å; V134-Y151 PolarHBondContact N-O 2.71Å; V134-Y151 PolarHBondContact O-N 2.98Å; V134-I171 HydrophobicContact CG1-CG2 4.18Å; V134-V172 CarbonylContact C-O 3.23Å; V134-V172 WeakPolarHBondContact CA-O 3.34Å; V134-A173 HydrophobicContact CG2-CB 4.35Å
135	T	97.4	Very high	94.3	Very high	10 Å²	10	32.1 Å²	32.1	6%	0.061	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.8	171.4	-59.9	0	0	0	0	108.8	K148 V149 K150 V172	T135-K148 HydrophobicContact CG2-CD 4.32Å; T135-K148 HydrophobicContact CG2-CG 4.04Å; T135-V149 WeakPolarHBondContact CA-O 3.3Å; T135-K150 HydrophobicContact CG2-CG 4.37Å; T135-V172 PolarHBondContact N-O 3.12Å; T135-V172 PolarHBondContact O-N 3.2Å
136	V	97.4	Very high	94.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	133.3	172.7	-176.6	0	0	0	0	108.6	L94 L97 V134 K148 V149 Y151 T169 T170 I171	L94-V136 HydrophobicContact CD2-CG1 4.39Å; L97-V136 HydrophobicContact CD2-CB 4.35Å; L97-V136 HydrophobicContact CD2-CG1 4.05Å; L97-V136 HydrophobicContact CD2-CG2 4.03Å; V134-V136 HydrophobicContact CG1-CG2 4.18Å; V136-K148 WeakPolarHBondContact O-CA 3.49Å; V136-V149 PolarHBondContact N-O 3.34Å; V136-V149 PolarHBondContact O-N 2.94Å; V136-Y151 HydrophobicContact CB-CE2 3.86Å; V136-Y151 HydrophobicContact CG2-CD2 4.16Å; V136-Y151 HydrophobicContact CG2-CE2 3.61Å; V136-T169 HydrophobicContact CG1-CG2 3.86Å; V136-T170 WeakPolarHBondContact CA-O 3.47Å; V136-I171 HydrophobicContact CG1-CG1 4.41Å; V136-I171 HydrophobicContact CG2-CG1 4.28Å; V136-I171 HydrophobicContact CG2-CG2 4.4Å
137	T	97.3	Very high	94.7	Very high	25 Å²	25	32 Å²	32	15%	0.153	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.5	167.9	-51.7	0	0	0	0	107.5	A146 F147 K148 T169 T170	T137-A146 HydrophobicContact CG2-CB 4.39Å; T137-F147 CarbonylContact C-O 3.6Å; T137-F147 WeakPolarHBondContact CA-O 3.35Å; T137-K148 HydrophobicContact CG2-CB 4.43Å; T137-T169 CarbonylContact O-C 3.54Å; T137-T170 PolarHBondContact N-O 3.32Å; T137-T170 PolarHBondContact O-N 3.47Å
138	T	97.7	Very high	94.9	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	157.3	-171.3	-166.7	0	0	0	0	112.2	I89 L94 A146 F147 G168 T169	I89-T138 HydrophobicContact CB-CG2 4.02Å; I89-T138 PolarHBondContact N-OG1 3.37Å; I89-T138 WeakPolarHBondContact O-CG2 3.39Å; L94-T138 HydrophobicContact CD1-CG2 4.19Å; L94-T138 HydrophobicContact CD2-CG2 3.9Å; L94-T138 HydrophobicContact CG-CG2 4.37Å; T138-A146 CarbonylContact O-C 3.52Å; T138-A146 VanDerWaalsContact O-CA 3.25Å; T138-A146 WeakPolarHBondContact O-CA 3.41Å; T138-A146 WeakPolarHBondContact O-CB 3.49Å; T138-F147 PolarHBondContact N-O 3.41Å; T138-F147 PolarHBondContact O-N 3.36Å; T138-G168 WeakPolarHBondContact CA-O 3.29Å; T138-G168 PolarHBondContact OG1-O 2.92Å; T138-T169 PolarHBondContact OG1-OG1 2.58Å
139	R	96.6	Very high	95	Very high	63 Å²	63	36.4 Å²	36.4	24%	0.238	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	123.7	175.3	176.8	175.6	166	-149.8	-11.9	110	Q143 A146 G165 P167 G168	R139-Q143 HydrophobicContact CG-CB 4.33Å; R139-Q143 PolarHBondContact NE-O 3.33Å; R139-A146 HydrophobicContact CB-CB 3.91Å; R139-G165 VanDerWaalsContact CD-O 3.26Å; R139-G165 WeakPolarHBondContact CD-O 3.45Å; R139-G165 PolarHBondContact NH1-O 3.3Å; R139-P167 WeakPolarHBondContact O-CA 3.39Å; R139-G168 PolarHBondContact N-O 3.1Å; R139-G168 PolarHBondContact O-N 3.22Å
140	T	95.6	Very high	95.2	Very high	21 Å²	21	41.4 Å²	41.4	13%	0.129	22%	0.222	C	C	.	.			trans	-79	158.9	166.7	71.1	0	0	0	0	110.9	C87 H90 N142 Q143	C87-T140 WeakPolarHBondContact O-CA 3.23Å; H90-T140 HydrophobicContact CB-CG2 4.45Å; T140-N142 PolarHBondContact O-N 2.84Å; T140-N142 VanDerWaalsContact O-N 3.12Å; T140-Q143 PolarHBondContact O-N 3.45Å; T140-Q143 VanDerWaalsContact O-N 3.08Å; T140-Q143 WeakPolarHBondContact OG1-CG 3.38Å; T140-Q143 PolarHBondContact OG1-OE1 3.33Å
141	A	91.6	Very high	95.4	Very high	80 Å²	80	41.2 Å²	41.2	66%	0.661	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-30.3	179.2	0	0	0	0	0	113.5	Q143	A141-Q143 VanDerWaalsContact C-N 3.3Å; A141-Q143 PolarHBondContact O-N 3.22Å
142	N	91.5	Very high	95.4	Very high	154 Å²	154	46.4 Å²	46.4	82%	0.824	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	2.5	-177.3	-61.2	-2.1	0	0	0	113.6	T140	T140-N142 PolarHBondContact O-N 2.84Å; T140-N142 VanDerWaalsContact O-N 3.12Å
143	Q	91.4	Very high	95.1	Very high	18 Å²	18	48.7 Å²	48.7	8%	0.084	26%	0.259	C	S	.	.			trans	-108.6	130.7	-176.8	-72.1	172	-39.7	0	0	112.6	R139 T140 A141 C145	R139-Q143 HydrophobicContact CG-CB 4.33Å; R139-Q143 PolarHBondContact NE-O 3.33Å; T140-Q143 PolarHBondContact O-N 3.45Å; T140-Q143 VanDerWaalsContact O-N 3.08Å; T140-Q143 WeakPolarHBondContact OG1-CG 3.38Å; T140-Q143 PolarHBondContact OG1-OE1 3.33Å; A141-Q143 VanDerWaalsContact C-N 3.3Å; A141-Q143 PolarHBondContact O-N 3.22Å; Q143-C145 VanDerWaalsContact C-N 3.27Å; Q143-C145 PolarHBondContact O-N 3.32Å
144	N	91.4	Very high	94.8	Very high	168 Å²	168	46.7 Å²	46.7	90%	0.898	25%	0.249	S	C	*	.	S	Bend	trans	-68.5	-21.1	-178.5	-65	-3.6	0	0	0	113.9
145	C	93.9	Very high	94.5	Very high	45 Å²	45	51.4 Å²	51.4	30%	0.304	28%	0.278	S	S	.	.	S	Bend	trans	-143.3	167.2	178.2	65.5	0	0	0	0	110.7	Q143	Q143-C145 VanDerWaalsContact C-N 3.27Å; Q143-C145 PolarHBondContact O-N 3.32Å
146	A	96.4	Very high	94.3	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	155	173.7	0	0	0	0	0	110.7	T137 T138 R139 P162 C163	T137-A146 HydrophobicContact CG2-CB 4.39Å; T138-A146 CarbonylContact O-C 3.52Å; T138-A146 VanDerWaalsContact O-CA 3.25Å; T138-A146 WeakPolarHBondContact O-CA 3.41Å; T138-A146 WeakPolarHBondContact O-CB 3.49Å; R139-A146 HydrophobicContact CB-CB 3.91Å; A146-P162 CarbonylContact O-C 3.58Å; A146-P162 WeakPolarHBondContact O-CA 3.35Å; A146-C163 PolarHBondContact N-O 2.99Å; A146-C163 PolarHBondContact O-N 3.37Å; A146-C163 PolarHBondContact O-SG 2.91Å; A146-C163 VanDerWaalsContact O-SG 3.33Å
147	F	97.1	Very high	94.1	Very high	20 Å²	20	56.4 Å²	56.4	9%	0.088	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.1	175.8	-70.2	-80.6	0	0	0	111.3	Q91 L94 T137 T138 P160 V161 P162	Q91-F147 HydrophobicContact CB-CD2 4.08Å; Q91-F147 HydrophobicContact CB-CE2 4.17Å; Q91-F147 HydrophobicContact CG-CD1 4.14Å; Q91-F147 HydrophobicContact CG-CD2 4.03Å; Q91-F147 HydrophobicContact CG-CE1 4.2Å; Q91-F147 HydrophobicContact CG-CE2 4.08Å; Q91-F147 HydrophobicContact CG-CG 4.06Å; Q91-F147 HydrophobicContact CG-CZ 4.17Å; Q91-F147 VanDerWaalsContact NE2-CE1 3.28Å; L94-F147 HydrophobicContact CD1-CB 3.57Å; T137-F147 CarbonylContact C-O 3.6Å; T137-F147 WeakPolarHBondContact CA-O 3.35Å; T138-F147 PolarHBondContact N-O 3.41Å; T138-F147 PolarHBondContact O-N 3.36Å; F147-P160 HydrophobicContact CB-CB 4.16Å; F147-P160 HydrophobicContact CD1-CB 3.93Å; F147-P160 HydrophobicContact CG-CB 4.33Å; F147-V161 WeakPolarHBondContact CA-O 3.44Å; F147-P162 HydrophobicContact CD1-CB 4.42Å; F147-P162 HydrophobicContact CE1-CB 4.05Å
148	K	97	Very high	93.8	Very high	96 Å²	96	57.7 Å²	57.7	42%	0.417	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.1	-178.6	-172.6	167.6	-171.7	171.2	0	111.2	T135 V136 T137 V161	T135-K148 HydrophobicContact CG2-CD 4.32Å; T135-K148 HydrophobicContact CG2-CG 4.04Å; V136-K148 WeakPolarHBondContact O-CA 3.49Å; T137-K148 HydrophobicContact CG2-CB 4.43Å; K148-V161 PolarHBondContact N-O 3.39Å; K148-V161 PolarHBondContact O-N 3.13Å
149	V	97	Very high	93.5	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	143	175	177.3	0	0	0	0	109.4	L94 T135 V136 Y151 A156 P160	L94-V149 HydrophobicContact CB-CG2 4.12Å; L94-V149 HydrophobicContact CD1-CG2 4.27Å; T135-V149 WeakPolarHBondContact CA-O 3.3Å; V136-V149 PolarHBondContact N-O 3.34Å; V136-V149 PolarHBondContact O-N 2.94Å; V149-Y151 HydrophobicContact CB-CE1 4.49Å; V149-Y151 HydrophobicContact CB-CE2 3.72Å; V149-Y151 HydrophobicContact CG1-CD1 4.17Å; V149-Y151 HydrophobicContact CG1-CD2 4.11Å; V149-Y151 HydrophobicContact CG1-CE1 3.66Å; V149-Y151 HydrophobicContact CG1-CE2 3.56Å; V149-Y151 HydrophobicContact CG1-CG 4.39Å; V149-A156 HydrophobicContact CG1-CB 3.68Å; V149-P160 HydrophobicContact CG2-CB 3.96Å; V149-P160 HydrophobicContact CG2-CG 3.89Å
150	K	97.2	Very high	93.4	Very high	106 Å²	106	64.9 Å²	64.9	46%	0.461	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.9	167.7	-64.5	-170.1	174.7	-169.4	0	110.2	V134 T135 A156 E157	V134-K150 CarbonylContact O-C 3.54Å; V134-K150 WeakPolarHBondContact O-CA 3.39Å; T135-K150 HydrophobicContact CG2-CG 4.37Å; K150-A156 CarbonylContact O-C 3.57Å; K150-A156 WeakPolarHBondContact O-CA 3.43Å; K150-E157 HydrophobicContact CB-CB 4.15Å; K150-E157 HydrophobicContact CB-CG 4.18Å; K150-E157 VanDerWaalsContact CB-OE2 3.29Å; K150-E157 WeakPolarHBondContact CB-OE2 3.36Å; K150-E157 WeakPolarHBondContact CD-OE2 3.33Å; K150-E157 PolarHBondContact O-N 3.37Å
151	Y	96.3	Very high	93.4	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.008	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.8	-178.2	-53.2	-96.8	0	0	0	111.5	L94 L97 C98 V134 V136 V149 V155 A156	L94-Y151 WeakPolarHBondContact CD2-OH 3.31Å; L94-Y151 VanDerWaalsContact O-CE1 3.26Å; L94-Y151 WeakPolarHBondContact O-CE1 3.31Å; L94-Y151 PolarHBondContact O-OH 2.7Å; L97-Y151 HydrophobicContact CB-CE1 4.37Å; C98-Y151 HydrophobicContact CB-CD1 3.61Å; C98-Y151 HydrophobicContact CB-CE1 4.18Å; C98-Y151 HydrophobicContact CB-CG 3.99Å; C98-Y151 VanDerWaalsContact SG-CD1 3.57Å; C98-Y151 VanDerWaalsContact SG-CG 3.5Å; V134-Y151 HydrophobicContact CG1-CD2 4.27Å; V134-Y151 PolarHBondContact N-O 2.71Å; V134-Y151 PolarHBondContact O-N 2.98Å; V136-Y151 HydrophobicContact CB-CE2 3.86Å; V136-Y151 HydrophobicContact CG2-CD2 4.16Å; V136-Y151 HydrophobicContact CG2-CE2 3.61Å; V149-Y151 HydrophobicContact CB-CE1 4.49Å; V149-Y151 HydrophobicContact CB-CE2 3.72Å; V149-Y151 HydrophobicContact CG1-CD1 4.17Å; V149-Y151 HydrophobicContact CG1-CD2 4.11Å; V149-Y151 HydrophobicContact CG1-CE1 3.66Å; V149-Y151 HydrophobicContact CG1-CE2 3.56Å; V149-Y151 HydrophobicContact CG1-CG 4.39Å; Y151-V155 VanDerWaalsContact CA-O 3.26Å; Y151-V155 WeakPolarHBondContact CA-O 3.37Å; Y151-A156 HydrophobicContact CD1-CB 4.02Å; Y151-A156 HydrophobicContact CE1-CB 3.97Å
152	R	92.5	Very high	93.6	Very high	116 Å²	116	67.9 Å²	67.9	44%	0.438	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	128.6	175.9	-169.6	-171.7	-54.8	-130.2	0.3	109.3	L133 G154 V155 E157	L133-R152 HydrophobicContact CD2-CG 4.34Å; R152-G154 PolarHBondContact O-N 3.06Å; R152-V155 PolarHBondContact N-O 2.95Å; R152-V155 PolarHBondContact O-N 3.36Å; R152-E157 HydrophobicContact CB-CG 4.35Å; R152-E157 IonicContact CZ-OE1 3.71Å; R152-E157 IonicContact NE-OE1 2.81Å; R152-E157 PolarHBondContact NE-OE1 2.79Å; R152-E157 IonicContact NH2-OE1 3.98Å; R152-E157 PolarHBondContact NH2-OE1 2.71Å
153	A	89.1	Confident	93.7	Very high	48 Å²	48	62.5 Å²	62.5	40%	0.397	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	43.9	-177.4	0	0	0	0	0	113.3	S129 H130 V155	S129-A153 PolarHBondContact O-N 3.17Å; H130-A153 PolarHBondContact CE1-O 3.21Å; H130-A153 PolarHBondContact NE2-O 3.32Å; A153-V155 VanDerWaalsContact C-N 3.26Å; A153-V155 PolarHBondContact O-N 3.06Å
154	G	87.8	Confident	93.9	Very high	4 Å²	4	66.3 Å²	66.3	4%	0.041	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	-17.3	-178.7	0	0	0	0	0	116.3	C98 S129 H130 R152	C98-G154 CarbonylContact C-O 3.55Å; C98-G154 VanDerWaalsContact C-O 3.23Å; C98-G154 WeakPolarHBondContact CB-O 3.41Å; C98-G154 WeakPolarHBondContact O-CA 3.44Å; S129-G154 VanDerWaalsContact OG-CA 3.28Å; S129-G154 WeakPolarHBondContact OG-CA 3.21Å; S129-G154 PolarHBondContact OG-N 3.17Å; H130-G154 PolarHBondContact CE1-N 3.26Å; R152-G154 PolarHBondContact O-N 3.06Å
155	V	91.7	Very high	93.8	Very high	99 Å²	99	59.6 Å²	59.6	60%	0.6	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	138.7	-173.3	-174.7	0	0	0	0	111.1	Y151 R152 A153	Y151-V155 VanDerWaalsContact CA-O 3.26Å; Y151-V155 WeakPolarHBondContact CA-O 3.37Å; R152-V155 PolarHBondContact N-O 2.95Å; R152-V155 PolarHBondContact O-N 3.36Å; A153-V155 VanDerWaalsContact C-N 3.26Å; A153-V155 PolarHBondContact O-N 3.06Å
156	A	93.9	Very high	93.8	Very high	27 Å²	27	63.4 Å²	63.4	22%	0.223	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	124.9	171.6	0	0	0	0	0	111.7	V149 K150 Y151 S158	V149-A156 HydrophobicContact CG1-CB 3.68Å; K150-A156 CarbonylContact O-C 3.57Å; K150-A156 WeakPolarHBondContact O-CA 3.43Å; Y151-A156 HydrophobicContact CD1-CB 4.02Å; Y151-A156 HydrophobicContact CE1-CB 3.97Å; A156-S158 PolarHBondContact O-N 3.47Å
157	E	92.2	Very high	93.7	Very high	89 Å²	89	66.2 Å²	66.2	42%	0.416	38%	0.377	S	S	.	.	S	Bend	trans	-72.1	-17.1	179.1	-59.5	-172.1	146.5	0	0	112.8	K150 R152	K150-E157 HydrophobicContact CB-CB 4.15Å; K150-E157 HydrophobicContact CB-CG 4.18Å; K150-E157 VanDerWaalsContact CB-OE2 3.29Å; K150-E157 WeakPolarHBondContact CB-OE2 3.36Å; K150-E157 WeakPolarHBondContact CD-OE2 3.33Å; K150-E157 PolarHBondContact O-N 3.37Å; R152-E157 HydrophobicContact CB-CG 4.35Å; R152-E157 IonicContact CZ-OE1 3.71Å; R152-E157 IonicContact NE-OE1 2.81Å; R152-E157 PolarHBondContact NE-OE1 2.79Å; R152-E157 IonicContact NH2-OE1 3.98Å; R152-E157 PolarHBondContact NH2-OE1 2.71Å
158	S	91	Very high	93.6	Very high	52 Å²	52	65.4 Å²	65.4	36%	0.364	37%	0.374	S	S	.	.	S	Bend	trans	-152.3	165.2	179	74.4	0	0	0	0	112.3	A156	A156-S158 PolarHBondContact O-N 3.47Å
159	K	91.5	Very high	93.7	Very high	187 Å²	187	61.1 Å²	61.1	81%	0.813	36%	0.356	S	S	*	.	S	Bend	trans	-60.3	156	160.7	-66.8	-174	179.1	-177.2	0	110.4	V161	K159-V161 PolarHBondContact O-N 3.19Å
160	P	94.5	Very high	93.7	Very high	28 Å²	28	62.3 Å²	62.3	18%	0.182	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-56	120.1	175.3	-26.1	35	0	0	0	113.1	Q91 L94 F147 V149	Q91-P160 HydrophobicContact CG-CB 4.19Å; Q91-P160 HydrophobicContact CG-CG 4.35Å; L94-P160 HydrophobicContact CB-CG 4Å; L94-P160 HydrophobicContact CD1-CB 3.97Å; L94-P160 HydrophobicContact CD1-CG 4.08Å; F147-P160 HydrophobicContact CB-CB 4.16Å; F147-P160 HydrophobicContact CD1-CB 3.93Å; F147-P160 HydrophobicContact CG-CB 4.33Å; V149-P160 HydrophobicContact CG2-CB 3.96Å; V149-P160 HydrophobicContact CG2-CG 3.89Å
161	V	95.5	Very high	93.7	Very high	80 Å²	80	57.9 Å²	57.9	49%	0.485	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	126.8	179.1	-176.7	0	0	0	0	109.3	F147 K148 K159	F147-V161 WeakPolarHBondContact CA-O 3.44Å; K148-V161 PolarHBondContact N-O 3.39Å; K148-V161 PolarHBondContact O-N 3.13Å; K159-V161 PolarHBondContact O-N 3.19Å
162	P	95.8	Very high	93.8	Very high	85 Å²	85	58.9 Å²	58.9	55%	0.552	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	142	176.2	29.1	-34.7	0	0	0	111.1	A146 F147	A146-P162 CarbonylContact O-C 3.58Å; A146-P162 WeakPolarHBondContact O-CA 3.35Å; F147-P162 HydrophobicContact CD1-CB 4.42Å; F147-P162 HydrophobicContact CE1-CB 4.05Å
163	C	95.4	Very high	94	Very high	40 Å²	40	53.6 Å²	53.6	27%	0.27	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	171.4	-176.9	64.2	0	0	0	0	112.1	A146	A146-C163 PolarHBondContact N-O 2.99Å; A146-C163 PolarHBondContact O-N 3.37Å; A146-C163 PolarHBondContact O-SG 2.91Å; A146-C163 VanDerWaalsContact O-SG 3.33Å
164	A	94	Very high	94.3	Very high	99 Å²	99	54.9 Å²	54.9	82%	0.818	33%	0.33	S	S	*	.			trans	-74.8	137	170.7	0	0	0	0	0	110.8
165	G	90.4	Very high	94.6	Very high	27 Å²	27	57.8 Å²	57.8	28%	0.278	34%	0.344	S	S	.	.			trans	-176.4	152.1	175.4	0	0	0	0	0	112.4	R139	R139-G165 VanDerWaalsContact CD-O 3.26Å; R139-G165 WeakPolarHBondContact CD-O 3.45Å; R139-G165 PolarHBondContact NH1-O 3.3Å
166	N	92.8	Very high	94.7	Very high	125 Å²	125	53.2 Å²	53.2	67%	0.668	32%	0.316	S	S	*	.			trans	-80.9	162.3	173.2	-66.9	-14.7	0	0	0	110.2
167	P	94.1	Very high	94.6	Very high	59 Å²	59	52 Å²	52	38%	0.383	31%	0.306	S	S	.	.	S	Bend	trans	-56.4	146.1	169.9	-22.3	34.7	0	0	0	111.7	R139	R139-P167 WeakPolarHBondContact O-CA 3.39Å
168	G	96.4	Very high	94.6	Very high	3 Å²	3	52 Å²	52	3%	0.031	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	108.3	-165.1	-170.6	0	0	0	0	0	112.5	G86 T138 R139	G86-G168 VanDerWaalsContact O-CA 3.29Å; G86-G168 WeakPolarHBondContact O-CA 3.46Å; G86-G168 PolarHBondContact O-N 3.04Å; T138-G168 WeakPolarHBondContact CA-O 3.29Å; T138-G168 PolarHBondContact OG1-O 2.92Å; R139-G168 PolarHBondContact N-O 3.1Å; R139-G168 PolarHBondContact O-N 3.22Å
169	T	97.7	Very high	94.5	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.043	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.9	-176.3	-55.6	0	0	0	0	111.8	Q83 D84 I89 V136 T137 T138 I171	Q83-T169 WeakPolarHBondContact CA-O 3.49Å; D84-T169 PolarHBondContact N-O 2.86Å; D84-T169 PolarHBondContact OD1-N 2.85Å; I89-T169 HydrophobicContact CD1-CG2 4.15Å; V136-T169 HydrophobicContact CG1-CG2 3.86Å; T137-T169 CarbonylContact O-C 3.54Å; T138-T169 PolarHBondContact OG1-OG1 2.58Å; T169-I171 HydrophobicContact CG2-CD1 4.23Å; T169-I171 HydrophobicContact CG2-CG1 3.77Å
170	T	97.6	Very high	94.3	Very high	26 Å²	26	44 Å²	44	16%	0.16	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	117.7	168.8	-59.1	0	0	0	0	108.7	Q81 V82 Q83 V136 T137 V172	Q81-T170 HydrophobicContact CG-CG2 4.12Å; V82-T170 CarbonylContact O-C 3.58Å; V82-T170 WeakPolarHBondContact O-CA 3.47Å; Q83-T170 HydrophobicContact CB-CG2 4.16Å; Q83-T170 WeakPolarHBondContact CG-OG1 3.41Å; V136-T170 WeakPolarHBondContact CA-O 3.47Å; T137-T170 PolarHBondContact N-O 3.32Å; T137-T170 PolarHBondContact O-N 3.47Å; T170-V172 HydrophobicContact CG2-CG2 4.17Å
171	I	97.5	Very high	94	Very high	13 Å²	13	47.2 Å²	47.2	7%	0.067	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.3	177.7	-52.9	-170.7	0	0	0	108.1	L56 Q81 V82 L125 V134 V136 T169	L56-I171 HydrophobicContact CD2-CB 4.04Å; L56-I171 HydrophobicContact CD2-CD1 3.77Å; L56-I171 HydrophobicContact CD2-CG1 4.42Å; L56-I171 HydrophobicContact CD2-CG2 3.85Å; Q81-I171 WeakPolarHBondContact CA-O 3.45Å; V82-I171 PolarHBondContact N-O 3.3Å; V82-I171 PolarHBondContact O-N 2.59Å; L125-I171 HydrophobicContact CD1-CD1 4.34Å; L125-I171 HydrophobicContact CD2-CD1 3.75Å; V134-I171 HydrophobicContact CG1-CG2 4.18Å; V136-I171 HydrophobicContact CG1-CG1 4.41Å; V136-I171 HydrophobicContact CG2-CG1 4.28Å; V136-I171 HydrophobicContact CG2-CG2 4.4Å; T169-I171 HydrophobicContact CG2-CD1 4.23Å; T169-I171 HydrophobicContact CG2-CG1 3.77Å
172	V	97.8	Very high	93.6	Very high	23 Å²	23	50.2 Å²	50.2	14%	0.139	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123	177.7	-172.7	0	0	0	0	108.3	L79 I80 Q81 V134 T135 T170 E174	L79-V172 HydrophobicContact CD1-CG1 3.46Å; L79-V172 VanDerWaalsContact CD1-CG1 3.46Å; I80-V172 CarbonylContact O-C 3.51Å; I80-V172 WeakPolarHBondContact O-CA 3.38Å; Q81-V172 HydrophobicContact CB-CG2 4.27Å; Q81-V172 HydrophobicContact CG-CG2 4.04Å; V134-V172 CarbonylContact C-O 3.23Å; V134-V172 WeakPolarHBondContact CA-O 3.34Å; T135-V172 PolarHBondContact N-O 3.12Å; T135-V172 PolarHBondContact O-N 3.2Å; T170-V172 HydrophobicContact CG2-CG2 4.17Å; V172-E174 HydrophobicContact CG1-CG 4.07Å
173	A	97.1	Very high	93.3	Very high	4 Å²	4	50.4 Å²	50.4	3%	0.033	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114	173.5	0	0	0	0	0	109.2	I80 L128 A132 L133 V134	I80-A173 HydrophobicContact CB-CB 4.43Å; I80-A173 PolarHBondContact N-O 2.73Å; I80-A173 PolarHBondContact O-N 2.83Å; L128-A173 HydrophobicContact CD1-CB 4.14Å; L128-A173 HydrophobicContact CD2-CB 4.08Å; L128-A173 HydrophobicContact CG-CB 4.2Å; A132-A173 HydrophobicContact CB-CB 3.99Å; L133-A173 WeakPolarHBondContact O-CA 3.39Å; V134-A173 HydrophobicContact CG2-CB 4.35Å
174	E	96.4	Very high	92.9	Very high	76 Å²	76	51.6 Å²	51.6	36%	0.355	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	143.8	-178.9	-57.9	-174.4	84.7	0	0	111.1	L79 L133 V172	L79-E174 HydrophobicContact CD1-CG 3.92Å; L133-E174 HydrophobicContact CB-CB 4.37Å; L133-E174 PolarHBondContact N-O 3.02Å; L133-E174 PolarHBondContact O-N 3.45Å; V172-E174 HydrophobicContact CG1-CG 4.07Å
175	N	93.6	Very high	92.6	Very high	64 Å²	64	49.6 Å²	49.6	34%	0.342	27%	0.272	S	S	.	.	S	Bend	trans	53	61.2	173.9	-60.7	-69.8	0	0	0	113.9	L77 K78 F177 Y178	L77-N175 WeakPolarHBondContact O-CA 3.43Å; K78-N175 PolarHBondContact O-N 2.88Å; N175-F177 PolarHBondContact O-N 2.82Å; N175-Y178 WeakPolarHBondContact O-CB 3.13Å; N175-Y178 WeakPolarHBondContact O-CD1 3.4Å; N175-Y178 PolarHBondContact O-N 3.46Å
176	L	93.5	Very high	92.5	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.016	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	138	176.3	-166.1	66.6	0	0	0	110.9	I46 P49 L77 L128 V131 A132 Y178 K184	I46-L176 HydrophobicContact CG2-CD1 4.17Å; P49-L176 HydrophobicContact CB-CD2 4.27Å; P49-L176 HydrophobicContact CG-CD2 3.86Å; L77-L176 PolarHBondContact O-N 2.7Å; L128-L176 HydrophobicContact CD1-CD1 4.15Å; V131-L176 HydrophobicContact CG2-CD1 3.76Å; A132-L176 HydrophobicContact CB-CD1 3.98Å; L176-Y178 VanDerWaalsContact C-N 3.28Å; L176-Y178 PolarHBondContact O-N 3.28Å; L176-K184 PolarHBondContact O-NZ 3.17Å
177	F	93	Very high	92.2	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	27.3	-176.8	-51.2	-52.9	0	0	0	115.4	I46 Q47 V131 N175 N179 A180 R183 K184 L187	I46-F177 HydrophobicContact CG2-CE1 4.24Å; I46-F177 HydrophobicContact CG2-CZ 4.11Å; I46-F177 VanDerWaalsContact O-CE1 3.3Å; I46-F177 WeakPolarHBondContact O-CE1 3.4Å; I46-F177 WeakPolarHBondContact O-CZ 3.21Å; Q47-F177 VanDerWaalsContact O-CZ 3.3Å; Q47-F177 WeakPolarHBondContact O-CZ 3.28Å; V131-F177 HydrophobicContact CB-CD1 3.93Å; V131-F177 HydrophobicContact CB-CE1 4.08Å; V131-F177 HydrophobicContact CG1-CD1 4.25Å; V131-F177 HydrophobicContact CG1-CE1 4.27Å; V131-F177 HydrophobicContact CG2-CD1 4.46Å; V131-F177 HydrophobicContact CG2-CE1 4.18Å; V131-F177 WeakPolarHBondContact O-CA 3.3Å; V131-F177 PolarHBondContact O-N 3.25Å; N175-F177 PolarHBondContact O-N 2.82Å; F177-N179 PolarHBondContact O-N 3.46Å; F177-N179 VanDerWaalsContact O-N 3.15Å; F177-A180 HydrophobicContact CB-CB 4.27Å; F177-A180 CarbonylContact O-C 3.58Å; F177-A180 PolarHBondContact O-N 2.8Å; F177-R183 HydrophobicContact CD1-CG 4.39Å; F177-R183 HydrophobicContact CD2-CG 4.23Å; F177-R183 HydrophobicContact CE2-CG 4.43Å; F177-R183 HydrophobicContact CG-CG 4.22Å; F177-K184 HydrophobicContact CB-CB 3.96Å; F177-L187 HydrophobicContact CD2-CD1 3.9Å; F177-L187 HydrophobicContact CE2-CD1 3.54Å
178	Y	91.4	Very high	91.2	Very high	89 Å²	89	52.1 Å²	52.1	35%	0.349	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30	177	76.9	-83.6	0	0	0	113.8	L133 N175 L176	L133-Y178 HydrophobicContact CD2-CE1 3.97Å; L133-Y178 HydrophobicContact CG-CE1 4.28Å; N175-Y178 WeakPolarHBondContact O-CB 3.13Å; N175-Y178 WeakPolarHBondContact O-CD1 3.4Å; N175-Y178 PolarHBondContact O-N 3.46Å; L176-Y178 VanDerWaalsContact C-N 3.28Å; L176-Y178 PolarHBondContact O-N 3.28Å
179	N	89.2	Confident	90.6	Very high	43 Å²	43	55.3 Å²	55.3	23%	0.23	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	12.3	179	64.6	-8	0	0	0	113.8	R39 H130 F177	R39-N179 PolarHBondContact NH2-O 3.44Å; H130-N179 PolarHBondContact O-ND2 2.87Å; F177-N179 PolarHBondContact O-N 3.46Å; F177-N179 VanDerWaalsContact O-N 3.15Å
180	A	87.6	Confident	90.1	Very high	30 Å²	30	55.5 Å²	55.5	25%	0.248	30%	0.298	C	S	.	.			trans	-138	67.1	179.2	0	0	0	0	0	110.4	F177 I182 R183 K184	F177-A180 HydrophobicContact CB-CB 4.27Å; F177-A180 CarbonylContact O-C 3.58Å; F177-A180 PolarHBondContact O-N 2.8Å; A180-I182 VanDerWaalsContact C-N 3.31Å; A180-I182 PolarHBondContact O-N 3.27Å; A180-R183 HydrophobicContact CB-CB 4.18Å; A180-R183 PolarHBondContact O-N 3.23Å; A180-R183 VanDerWaalsContact O-N 3.08Å; A180-K184 PolarHBondContact O-N 3.25Å
181	P	87.2	Confident	89.6	Confident	95 Å²	95	63.6 Å²	63.6	62%	0.617	33%	0.326	S	S	*	.	H	α-helix	trans	-60.2	-35.6	-167.6	22.5	-34	0	0	0	113.8	K184 S185	P181-K184 PolarHBondContact O-N 2.94Å; P181-S185 VanDerWaalsContact O-CB 3.3Å; P181-S185 WeakPolarHBondContact O-CB 3.36Å; P181-S185 PolarHBondContact O-N 3.25Å; P181-S185 PolarHBondContact O-OG 2.88Å
182	I	88.3	Confident	89.2	Confident	142 Å²	142	66.5 Å²	66.5	73%	0.728	34%	0.339	S	S	*	.	H	α-helix	trans	-60.6	-50.9	175.5	-59.9	173.4	0	0	0	110.1	A180 K184 S185 A186	A180-I182 VanDerWaalsContact C-N 3.31Å; A180-I182 PolarHBondContact O-N 3.27Å; I182-K184 PolarHBondContact O-N 2.87Å; I182-S185 PolarHBondContact O-N 3.34Å; I182-S185 VanDerWaalsContact O-N 3.07Å; I182-S185 PolarHBondContact O-OG 2.9Å; I182-A186 PolarHBondContact O-N 3.46Å; I182-A186 VanDerWaalsContact O-N 3.1Å
183	R	87.8	Confident	88.9	Confident	89 Å²	89	65.4 Å²	65.4	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-60.9	-44.1	177.4	-174	178.7	-70.5	-157.2	-4.1	111.4	G43 I46 F177 A180 S185 A186 L187	G43-R183 PolarHBondContact O-NH1 3.08Å; G43-R183 PolarHBondContact O-NH2 2.83Å; I46-R183 PolarHBondContact O-NH1 3.26Å; F177-R183 HydrophobicContact CD1-CG 4.39Å; F177-R183 HydrophobicContact CD2-CG 4.23Å; F177-R183 HydrophobicContact CE2-CG 4.43Å; F177-R183 HydrophobicContact CG-CG 4.22Å; A180-R183 HydrophobicContact CB-CB 4.18Å; A180-R183 PolarHBondContact O-N 3.23Å; A180-R183 VanDerWaalsContact O-N 3.08Å; R183-S185 VanDerWaalsContact C-N 3.26Å; R183-S185 PolarHBondContact O-N 3.36Å; R183-A186 PolarHBondContact O-N 3.04Å; R183-L187 PolarHBondContact O-N 3.28Å
184	K	88.7	Confident	88.6	Confident	65 Å²	65	66 Å²	66	28%	0.283	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-35.1	174.5	-168.8	165.5	-174.5	152.3	0	112.6	L176 F177 A180 P181 I182	L176-K184 PolarHBondContact O-NZ 3.17Å; F177-K184 HydrophobicContact CB-CB 3.96Å; A180-K184 PolarHBondContact O-N 3.25Å; P181-K184 PolarHBondContact O-N 2.94Å; I182-K184 PolarHBondContact O-N 2.87Å
185	S	86.6	Confident	88.3	Confident	57 Å²	57	64.6 Å²	64.6	40%	0.399	33%	0.334	S	S	.	.	H	α-helix	trans	-74.6	-23.3	179.5	78.8	0	0	0	0	114.3	P181 I182 R183 K188	P181-S185 VanDerWaalsContact O-CB 3.3Å; P181-S185 WeakPolarHBondContact O-CB 3.36Å; P181-S185 PolarHBondContact O-N 3.25Å; P181-S185 PolarHBondContact O-OG 2.88Å; I182-S185 PolarHBondContact O-N 3.34Å; I182-S185 VanDerWaalsContact O-N 3.07Å; I182-S185 PolarHBondContact O-OG 2.9Å; R183-S185 VanDerWaalsContact C-N 3.26Å; R183-S185 PolarHBondContact O-N 3.36Å; S185-K188 VanDerWaalsContact O-CD 3.26Å; S185-K188 WeakPolarHBondContact O-CD 3.4Å; S185-K188 WeakPolarHBondContact O-CE 3.41Å; S185-K188 VanDerWaalsContact O-CG 3.29Å; S185-K188 WeakPolarHBondContact O-CG 3.5Å
186	A	88.9	Confident	88.2	Confident	80 Å²	80	65 Å²	65	66%	0.661	33%	0.332	S	S	*	.	H	α-helix	trans	-79.4	-24.4	175.5	0	0	0	0	0	113.2	I182 R183	I182-A186 PolarHBondContact O-N 3.46Å; I182-A186 VanDerWaalsContact O-N 3.1Å; R183-A186 PolarHBondContact O-N 3.04Å
187	L	86.1	Confident	88.2	Confident	21 Å²	21	64.8 Å²	64.8	11%	0.11	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	20.8	-177.1	-54.8	179.6	0	0	0	113.6	R48 L77 F177 R183 N189 E193	R48-L187 HydrophobicContact CG-CD1 4.24Å; R48-L187 HydrophobicContact CG-CD2 4.03Å; L77-L187 VanDerWaalsContact CD1-O 3.24Å; L77-L187 WeakPolarHBondContact CD1-O 3.3Å; L77-L187 HydrophobicContact CD2-CB 4.07Å; L77-L187 HydrophobicContact CD2-CD1 4.47Å; F177-L187 HydrophobicContact CD2-CD1 3.9Å; F177-L187 HydrophobicContact CE2-CD1 3.54Å; R183-L187 PolarHBondContact O-N 3.28Å; L187-N189 PolarHBondContact O-N 3.25Å; L187-E193 WeakPolarHBondContact CD2-OE1 3.3Å
188	K	73.7	Confident	88.2	Confident	163 Å²	163	65.4 Å²	65.4	71%	0.709	34%	0.336	S	S	*	.			trans	-57.4	-20.6	-171.3	-79.1	169.6	-176.3	170.7	0	115.6	S185 G190	S185-K188 VanDerWaalsContact O-CD 3.26Å; S185-K188 WeakPolarHBondContact O-CD 3.4Å; S185-K188 WeakPolarHBondContact O-CE 3.41Å; S185-K188 VanDerWaalsContact O-CG 3.29Å; S185-K188 WeakPolarHBondContact O-CG 3.5Å; K188-G190 PolarHBondContact O-N 2.82Å
189	N	83.4	Confident	88.2	Confident	71 Å²	71	64.1 Å²	64.1	38%	0.38	33%	0.333	S	S	.	.			trans	-81.5	78.8	-178.9	-167.6	-11.5	0	0	0	111.5	L187 R191 E192 E193	L187-N189 PolarHBondContact O-N 3.25Å; N189-R191 PolarHBondContact O-N 3.37Å; N189-R191 PolarHBondContact OD1-N 2.91Å; N189-E192 HydrophobicContact CB-CB 4.03Å; N189-E192 WeakPolarHBondContact O-CB 3.33Å; N189-E192 PolarHBondContact O-N 3.4Å; N189-E192 PolarHBondContact OD1-N 2.87Å; N189-E193 PolarHBondContact O-N 3.43Å
190	G	85.9	Confident	88.4	Confident	10 Å²	10	63 Å²	63	10%	0.103	33%	0.327	C	S	.	.	H	α-helix	trans	-57.2	-19.3	178.9	0	0	0	0	0	114.9	G75 K188 L194	G75-G190 WeakPolarHBondContact CA-O 3.28Å; K188-G190 PolarHBondContact O-N 2.82Å; G190-L194 VanDerWaalsContact O-CB 3.28Å; G190-L194 WeakPolarHBondContact O-CB 3.42Å; G190-L194 PolarHBondContact O-N 3.38Å
191	R	87.2	Confident	88.8	Confident	197 Å²	197	61.6 Å²	61.6	74%	0.743	32%	0.316	S	S	*	.	H	α-helix	trans	-75.7	-37	172.7	-173.9	-176	-69.9	173.3	-1.1	112.1	N189 S195	N189-R191 PolarHBondContact O-N 3.37Å; N189-R191 PolarHBondContact OD1-N 2.91Å; R191-S195 PolarHBondContact O-N 2.66Å
192	E	89.5	Confident	89.1	Confident	73 Å²	73	57.2 Å²	57.2	34%	0.341	29%	0.287	S	S	.	.	H	α-helix	trans	-67.3	-45.9	174.7	-168.7	-156.3	141	0	0	111	R48 N189 L194 S195 K196	R48-E192 IonicContact CZ-OE1 2.85Å; R48-E192 IonicContact NH1-OE1 3.65Å; R48-E192 IonicContact NH2-OE1 3.86Å; R48-E192 PolarHBondContact NH2-OE1 3.01Å; R48-E192 IonicContact NH2-OE2 3.78Å; N189-E192 HydrophobicContact CB-CB 4.03Å; N189-E192 WeakPolarHBondContact O-CB 3.33Å; N189-E192 PolarHBondContact O-N 3.4Å; N189-E192 PolarHBondContact OD1-N 2.87Å; E192-L194 VanDerWaalsContact C-N 3.35Å; E192-L194 PolarHBondContact O-N 3.02Å; E192-S195 WeakPolarHBondContact O-CB 3.25Å; E192-S195 PolarHBondContact O-N 3.27Å; E192-K196 PolarHBondContact O-N 3.34Å; E192-K196 VanDerWaalsContact O-N 3.14Å; E192-K196 IonicContact OE1-NZ 2.71Å; E192-K196 PolarHBondContact OE1-NZ 2.93Å
193	E	91.2	Very high	89.4	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-61.1	-43.6	174.9	-60.8	-57.4	155.9	0	0	111.4	R48 P49 G75 L187 N189 S195 K196 V197	R48-E193 IonicContact CZ-OE1 2.79Å; R48-E193 IonicContact CZ-OE2 3.19Å; R48-E193 IonicContact NE-OE1 3.4Å; R48-E193 PolarHBondContact NE-OE1 3.14Å; R48-E193 IonicContact NE-OE2 2.72Å; R48-E193 PolarHBondContact NE-OE2 2.97Å; R48-E193 IonicContact NH2-OE1 2.71Å; R48-E193 PolarHBondContact NH2-OE1 3.15Å; R48-E193 IonicContact NH2-OE2 3.71Å; P49-E193 WeakPolarHBondContact CD-OE2 3.46Å; P49-E193 HydrophobicContact CG-CB 4.24Å; P49-E193 HydrophobicContact CG-CG 4.14Å; G75-E193 WeakPolarHBondContact O-CB 3.18Å; L187-E193 WeakPolarHBondContact CD2-OE1 3.3Å; N189-E193 PolarHBondContact O-N 3.43Å; E193-S195 VanDerWaalsContact C-N 3.33Å; E193-S195 PolarHBondContact O-N 2.95Å; E193-K196 PolarHBondContact O-N 2.6Å; E193-K196 VanDerWaalsContact O-N 3.14Å; E193-V197 WeakPolarHBondContact O-CG2 3.48Å; E193-V197 PolarHBondContact O-N 3.37Å
194	L	91.7	Very high	89.7	Confident	16 Å²	16	47.4 Å²	47.4	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-58	-45.1	174.9	178.6	63.5	0	0	0	111.5	V72 G190 E192 K196 V197 T198 S218	V72-L194 HydrophobicContact CG1-CD1 4.49Å; G190-L194 VanDerWaalsContact O-CB 3.28Å; G190-L194 WeakPolarHBondContact O-CB 3.42Å; G190-L194 PolarHBondContact O-N 3.38Å; E192-L194 VanDerWaalsContact C-N 3.35Å; E192-L194 PolarHBondContact O-N 3.02Å; L194-K196 PolarHBondContact O-N 3.28Å; L194-V197 PolarHBondContact O-N 3.43Å; L194-T198 WeakPolarHBondContact O-CB 3.3Å; L194-T198 PolarHBondContact O-N 2.84Å; L194-T198 PolarHBondContact O-OG1 2.9Å; L194-S218 VanDerWaalsContact CD2-OG 3.32Å; L194-S218 WeakPolarHBondContact CD2-OG 3.36Å
195	S	90.8	Very high	90	Very high	47 Å²	47	44.3 Å²	44.3	33%	0.329	23%	0.229	S	C	.	.	H	α-helix	trans	-58	-38.4	177.4	-168.7	0	0	0	0	112.4	R191 E192 E193 E199 M355	R191-S195 PolarHBondContact O-N 2.66Å; E192-S195 WeakPolarHBondContact O-CB 3.25Å; E192-S195 PolarHBondContact O-N 3.27Å; E193-S195 VanDerWaalsContact C-N 3.33Å; E193-S195 PolarHBondContact O-N 2.95Å; S195-E199 WeakPolarHBondContact O-CB 3.22Å; S195-E199 PolarHBondContact O-N 2.92Å; S195-M355 WeakPolarHBondContact OG-CE 3.35Å
196	K	91.4	Very high	90.4	Very high	71 Å²	71	41.6 Å²	41.6	31%	0.309	21%	0.21	S	C	.	.	H	α-helix	trans	-76.6	-35.5	-179.8	-71	172.4	175.1	177.7	0	112.5	V50 E192 E193 L194 E199 V200	V50-K196 WeakPolarHBondContact CG2-O 3.18Å; E192-K196 PolarHBondContact O-N 3.34Å; E192-K196 VanDerWaalsContact O-N 3.14Å; E192-K196 IonicContact OE1-NZ 2.71Å; E192-K196 PolarHBondContact OE1-NZ 2.93Å; E193-K196 PolarHBondContact O-N 2.6Å; E193-K196 VanDerWaalsContact O-N 3.14Å; L194-K196 PolarHBondContact O-N 3.28Å; K196-E199 PolarHBondContact O-N 3.31Å; K196-V200 PolarHBondContact O-N 2.75Å; K196-V200 VanDerWaalsContact O-N 3.14Å
197	V	93.3	Very high	90.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-46.5	170.4	169.9	0	0	0	0	110.8	P49 V50 I53 V72 E193 L194 E199 V200 V201 L216	P49-V197 HydrophobicContact CB-CG2 4.33Å; V50-V197 HydrophobicContact CB-CG2 4.25Å; I53-V197 HydrophobicContact CD1-CG1 4.32Å; I53-V197 HydrophobicContact CG1-CG1 3.9Å; I53-V197 HydrophobicContact CG1-CG2 4.02Å; I53-V197 HydrophobicContact CG2-CG1 4.36Å; V72-V197 HydrophobicContact CG2-CG1 4.09Å; E193-V197 WeakPolarHBondContact O-CG2 3.48Å; E193-V197 PolarHBondContact O-N 3.37Å; L194-V197 PolarHBondContact O-N 3.43Å; V197-E199 VanDerWaalsContact C-N 3.34Å; V197-E199 PolarHBondContact O-N 3.4Å; V197-V200 PolarHBondContact O-N 3.49Å; V197-V201 HydrophobicContact CG1-CG2 4.31Å; V197-V201 VanDerWaalsContact O-CG2 3.3Å; V197-V201 WeakPolarHBondContact O-CG2 3.31Å; V197-V201 PolarHBondContact O-N 3.49Å; V197-L216 HydrophobicContact CG1-CD1 4.43Å
198	T	93.1	Very high	91.1	Very high	14 Å²	14	38.1 Å²	38.1	9%	0.086	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-40.7	176.3	-59.2	0	0	0	0	111.9	L194 V201 A202 L216 L231	L194-T198 WeakPolarHBondContact O-CB 3.3Å; L194-T198 PolarHBondContact O-N 2.84Å; L194-T198 PolarHBondContact O-OG1 2.9Å; T198-V201 PolarHBondContact O-N 3.29Å; T198-A202 WeakPolarHBondContact O-CB 3.38Å; T198-A202 PolarHBondContact O-N 3.31Å; T198-L216 HydrophobicContact CG2-CD2 4.32Å; T198-L216 WeakPolarHBondContact OG1-CD2 3.33Å; T198-L231 HydrophobicContact CG2-CD1 4.41Å
199	E	91.6	Very high	92	Very high	61 Å²	61	30.3 Å²	30.3	29%	0.285	15%	0.145	S	C	.	.	H	α-helix	trans	-64.8	-40.9	178.1	-172.6	157.5	-124	0	0	112.9	S195 K196 V197 A202 Q203 K299	S195-E199 WeakPolarHBondContact O-CB 3.22Å; S195-E199 PolarHBondContact O-N 2.92Å; K196-E199 PolarHBondContact O-N 3.31Å; V197-E199 VanDerWaalsContact C-N 3.34Å; V197-E199 PolarHBondContact O-N 3.4Å; E199-A202 WeakPolarHBondContact O-CB 3.42Å; E199-Q203 WeakPolarHBondContact O-CG 3.36Å; E199-Q203 PolarHBondContact O-N 3.31Å; E199-K299 IonicContact OE1-NZ 2.66Å; E199-K299 PolarHBondContact OE1-NZ 3.07Å
200	V	93.3	Very high	92.3	Very high	20 Å²	20	32 Å²	32	12%	0.121	15%	0.151	C	C	.	.	H	α-helix	trans	-72.6	-41.6	175.3	171.4	0	0	0	0	112	V50 K54 K196 V197 A202 Q203 Y204 L308	V50-V200 HydrophobicContact CG2-CB 3.87Å; V50-V200 HydrophobicContact CG2-CG1 4.46Å; V50-V200 HydrophobicContact CG2-CG2 3.44Å; V50-V200 VanDerWaalsContact CG2-CG2 3.44Å; K54-V200 HydrophobicContact CB-CG1 4.44Å; K196-V200 PolarHBondContact O-N 2.75Å; K196-V200 VanDerWaalsContact O-N 3.14Å; V197-V200 PolarHBondContact O-N 3.49Å; V200-A202 VanDerWaalsContact C-N 3.27Å; V200-A202 PolarHBondContact O-N 3.35Å; V200-Q203 WeakPolarHBondContact O-CB 2.98Å; V200-Q203 PolarHBondContact O-N 3.08Å; V200-Y204 HydrophobicContact CG1-CD2 3.94Å; V200-Y204 HydrophobicContact CG1-CE2 3.91Å; V200-Y204 WeakPolarHBondContact O-CD2 3.22Å; V200-Y204 PolarHBondContact O-N 2.78Å; V200-Y204 VanDerWaalsContact O-N 3.13Å; V200-L308 HydrophobicContact CG1-CD2 4.09Å; V200-L308 HydrophobicContact CG2-CD2 4.41Å
201	V	95	Very high	92.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.7	-40.1	174.1	175.3	0	0	0	0	110.5	I53 L57 I70 V197 T198 Q203 Y204 A205 F214 L216 L231	I53-V201 HydrophobicContact CG2-CG2 3.95Å; L57-V201 HydrophobicContact CD1-CG2 4.21Å; I70-V201 HydrophobicContact CD1-CG1 4.17Å; V197-V201 HydrophobicContact CG1-CG2 4.31Å; V197-V201 VanDerWaalsContact O-CG2 3.3Å; V197-V201 WeakPolarHBondContact O-CG2 3.31Å; V197-V201 PolarHBondContact O-N 3.49Å; T198-V201 PolarHBondContact O-N 3.29Å; V201-Q203 PolarHBondContact O-N 3.43Å; V201-Y204 PolarHBondContact O-N 3.17Å; V201-A205 WeakPolarHBondContact O-CB 3.46Å; V201-A205 PolarHBondContact O-N 2.83Å; V201-F214 HydrophobicContact CG1-CB 4.4Å; V201-F214 HydrophobicContact CG1-CD1 4.49Å; V201-L216 HydrophobicContact CB-CD2 4.4Å; V201-L216 HydrophobicContact CG1-CB 4.27Å; V201-L216 HydrophobicContact CG2-CD2 4.41Å; V201-L231 HydrophobicContact CG1-CD1 4.38Å; V201-L231 HydrophobicContact CG1-CD2 4.17Å
202	A	93.7	Very high	93	Very high	3 Å²	3	28.3 Å²	28.3	3%	0.025	14%	0.139	C	C	.	.	H	α-helix	trans	-58.3	-44.7	173.6	0	0	0	0	0	112.9	T198 E199 V200 A205 I206 L231 V246	T198-A202 WeakPolarHBondContact O-CB 3.38Å; T198-A202 PolarHBondContact O-N 3.31Å; E199-A202 WeakPolarHBondContact O-CB 3.42Å; V200-A202 VanDerWaalsContact C-N 3.27Å; V200-A202 PolarHBondContact O-N 3.35Å; A202-A205 PolarHBondContact O-N 2.97Å; A202-I206 WeakPolarHBondContact O-CD1 3.21Å; A202-I206 VanDerWaalsContact O-CG1 3.29Å; A202-I206 WeakPolarHBondContact O-CG1 3.35Å; A202-I206 PolarHBondContact O-N 3.2Å; A202-L231 HydrophobicContact CB-CD1 3.81Å; A202-V246 HydrophobicContact CB-CG1 3.28Å
203	Q	94.4	Very high	93.2	Very high	26 Å²	26	24.8 Å²	24.8	12%	0.121	12%	0.123	C	C	.	.	H	α-helix	trans	-59.3	-51.9	177.5	-78.8	163.6	-19.2	0	0	112.1	E199 V200 V201 I206 H207 N301 F303 L308	E199-Q203 WeakPolarHBondContact O-CG 3.36Å; E199-Q203 PolarHBondContact O-N 3.31Å; V200-Q203 WeakPolarHBondContact O-CB 2.98Å; V200-Q203 PolarHBondContact O-N 3.08Å; V201-Q203 PolarHBondContact O-N 3.43Å; Q203-I206 PolarHBondContact O-N 3.49Å; Q203-H207 PolarHBondContact O-N 3.41Å; Q203-N301 HydrophobicContact CG-CB 4.33Å; Q203-N301 VanDerWaalsContact CG-CG 3.48Å; Q203-N301 VanDerWaalsContact CG-OD1 3.29Å; Q203-N301 WeakPolarHBondContact CG-OD1 3.3Å; Q203-N301 PolarHBondContact NE2-OD1 3.07Å; Q203-F303 HydrophobicContact CB-CE2 4.34Å; Q203-F303 HydrophobicContact CB-CZ 4.2Å; Q203-F303 WeakPolarHBondContact O-CZ 3.4Å; Q203-L308 HydrophobicContact CB-CD1 4.06Å; Q203-L308 HydrophobicContact CB-CD2 4.22Å; Q203-L308 HydrophobicContact CG-CD1 4.22Å; Q203-L308 VanDerWaalsContact OE1-CD2 3.29Å
204	Y	95.1	Very high	93.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.3	-41	176.8	-79.1	-94.4	0	0	0	111.7	K54 L57 E58 I61 V200 V201 I206 H207 Y208 L308	K54-Y204 HydrophobicContact CG-CE2 4.26Å; L57-Y204 HydrophobicContact CD1-CD2 4.09Å; L57-Y204 HydrophobicContact CD1-CG 4.18Å; E58-Y204 HydrophobicContact CG-CE1 4.31Å; E58-Y204 PolarHBondContact OE1-OH 3.38Å; I61-Y204 HydrophobicContact CD1-CD1 3.59Å; I61-Y204 HydrophobicContact CD1-CE1 4.04Å; V200-Y204 HydrophobicContact CG1-CD2 3.94Å; V200-Y204 HydrophobicContact CG1-CE2 3.91Å; V200-Y204 WeakPolarHBondContact O-CD2 3.22Å; V200-Y204 PolarHBondContact O-N 2.78Å; V200-Y204 VanDerWaalsContact O-N 3.13Å; V201-Y204 PolarHBondContact O-N 3.17Å; Y204-I206 VanDerWaalsContact C-N 3.29Å; Y204-I206 PolarHBondContact O-N 3.3Å; Y204-H207 PolarHBondContact O-N 3.29Å; Y204-Y208 AromaticContact CD1-CD2 3.95Å; Y204-Y208 HydrophobicContact CD1-CD2 3.95Å; Y204-Y208 AromaticContact CD1-CE2 3.7Å; Y204-Y208 HydrophobicContact CD1-CE2 3.7Å; Y204-Y208 HydrophobicContact CE1-CE2 4.21Å; Y204-Y208 WeakPolarHBondContact O-CB 3.37Å; Y204-Y208 WeakPolarHBondContact O-CD2 3.32Å; Y204-Y208 PolarHBondContact O-N 3.35Å; Y204-L308 HydrophobicContact CD2-CD2 4.18Å; Y204-L308 HydrophobicContact CE2-CB 3.84Å; Y204-L308 HydrophobicContact CE2-CD2 3.6Å; Y204-L308 HydrophobicContact CE2-CG 4.38Å
205	A	95	Very high	93.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64	-28.9	180	0	0	0	0	0	114.3	V201 A202 A209 F214 L231 T233	V201-A205 WeakPolarHBondContact O-CB 3.46Å; V201-A205 PolarHBondContact O-N 2.83Å; A202-A205 PolarHBondContact O-N 2.97Å; A205-A209 WeakPolarHBondContact O-CB 3.5Å; A205-A209 PolarHBondContact O-N 3.33Å; A205-F214 HydrophobicContact CB-CB 3.75Å; A205-F214 HydrophobicContact CB-CD2 3.85Å; A205-F214 HydrophobicContact CB-CG 3.8Å; A205-L231 HydrophobicContact CB-CD2 4.12Å; A205-T233 HydrophobicContact CB-CG2 4Å
206	I	94	Very high	93.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-78.8	-44.3	175.3	-71.8	163.1	0	0	0	111.2	A202 Q203 Y204 A242 I243 V246 I247 Y367	A202-I206 WeakPolarHBondContact O-CD1 3.21Å; A202-I206 VanDerWaalsContact O-CG1 3.29Å; A202-I206 WeakPolarHBondContact O-CG1 3.35Å; A202-I206 PolarHBondContact O-N 3.2Å; Q203-I206 PolarHBondContact O-N 3.49Å; Y204-I206 VanDerWaalsContact C-N 3.29Å; Y204-I206 PolarHBondContact O-N 3.3Å; I206-A242 HydrophobicContact CG1-CB 4.28Å; I206-I243 HydrophobicContact CB-CG1 4.48Å; I206-I243 HydrophobicContact CD1-CG1 3.92Å; I206-I243 HydrophobicContact CG1-CG1 4Å; I206-I243 HydrophobicContact CG2-CD1 4.01Å; I206-I243 HydrophobicContact CG2-CG1 3.66Å; I206-V246 HydrophobicContact CD1-CB 4.32Å; I206-V246 HydrophobicContact CD1-CG1 4.07Å; I206-V246 HydrophobicContact CG1-CB 4.4Å; I206-V246 HydrophobicContact CG1-CG1 4.47Å; I206-I247 HydrophobicContact CD1-CD1 3.62Å; I206-I247 HydrophobicContact CD1-CG1 4.01Å; I206-Y367 HydrophobicContact CG2-CD2 4.09Å; I206-Y367 HydrophobicContact CG2-CE2 4.3Å
207	H	95	Very high	93.8	Very high	15 Å²	15	23.4 Å²	23.4	7%	0.069	11%	0.112	C	C	.	.	H	α-helix	trans	-68.8	-44.6	-178.5	-175.6	71	0	0	0	112	Q203 Y204 F303 N306 Y367 N369	Q203-H207 PolarHBondContact O-N 3.41Å; Y204-H207 PolarHBondContact O-N 3.29Å; H207-F303 HydrophobicContact CB-CD1 4.04Å; H207-F303 HydrophobicContact CB-CD2 4.08Å; H207-F303 HydrophobicContact CB-CE1 3.71Å; H207-F303 HydrophobicContact CB-CE2 3.75Å; H207-F303 HydrophobicContact CB-CG 4.23Å; H207-F303 HydrophobicContact CB-CZ 3.56Å; H207-F303 AromaticContact CD2-CD1 3.49Å; H207-F303 VanDerWaalsContact CD2-CD1 3.49Å; H207-F303 WeakPolarHBondContact CD2-CD1 3.25Å; H207-F303 AromaticContact CD2-CE1 3.71Å; H207-F303 AromaticContact CE1-CD1 3.98Å; H207-F303 AromaticContact CE1-CG 3.91Å; H207-F303 AromaticContact CG-CD1 3.53Å; H207-F303 AromaticContact CG-CE1 3.68Å; H207-F303 AromaticContact CG-CG 3.73Å; H207-F303 AromaticContact ND1-CD1 3.84Å; H207-F303 AromaticContact ND1-CD2 3.98Å; H207-F303 AromaticContact ND1-CG 3.61Å; H207-F303 AromaticContact NE2-CD1 3.79Å; H207-N306 WeakPolarHBondContact NE2-CA 3.26Å; H207-N306 WeakPolarHBondContact NE2-CB 3.37Å; H207-Y367 HydrophobicContact CB-CE2 4.21Å; H207-Y367 AromaticContact ND1-CE2 3.91Å; H207-Y367 AromaticContact ND1-CZ 3.84Å; H207-Y367 PolarHBondContact ND1-OH 2.74Å; H207-N369 PolarHBondContact CE1-OD1 2.64Å
208	Y	94.8	Very high	93.5	Very high	12 Å²	12	24.5 Å²	24.5	5%	0.047	12%	0.119	C	C	.	.	S	Bend	trans	-89.9	6.4	-177	-72.7	-79.2	0	0	0	115	I61 F118 Y204 Q210 Q211 C212 N306	I61-Y208 HydrophobicContact CD1-CD2 3.88Å; I61-Y208 HydrophobicContact CD1-CE2 3.73Å; I61-Y208 HydrophobicContact CD1-CG 4.4Å; I61-Y208 HydrophobicContact CG2-CD1 4.33Å; I61-Y208 HydrophobicContact CG2-CE1 3.72Å; F118-Y208 WeakPolarHBondContact CE2-OH 3.48Å; F118-Y208 WeakPolarHBondContact CZ-OH 3.3Å; Y204-Y208 AromaticContact CD1-CD2 3.95Å; Y204-Y208 HydrophobicContact CD1-CD2 3.95Å; Y204-Y208 AromaticContact CD1-CE2 3.7Å; Y204-Y208 HydrophobicContact CD1-CE2 3.7Å; Y204-Y208 HydrophobicContact CE1-CE2 4.21Å; Y204-Y208 WeakPolarHBondContact O-CB 3.37Å; Y204-Y208 WeakPolarHBondContact O-CD2 3.32Å; Y204-Y208 PolarHBondContact O-N 3.35Å; Y208-Q210 PolarHBondContact O-N 2.87Å; Y208-Q211 PolarHBondContact O-N 2.9Å; Y208-C212 PolarHBondContact O-N 3.19Å; Y208-N306 PolarHBondContact OH-O 3.36Å
209	A	92.2	Very high	93	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-35.2	-174.8	0	0	0	0	0	114.9	A205 Q211 A235 G236 W237 A242	A205-A209 WeakPolarHBondContact O-CB 3.5Å; A205-A209 PolarHBondContact O-N 3.33Å; A209-Q211 VanDerWaalsContact C-N 3.33Å; A209-Q211 PolarHBondContact O-N 3.03Å; A209-A235 CarbonylContact O-C 3.49Å; A209-A235 WeakPolarHBondContact O-CA 3.49Å; A209-G236 PolarHBondContact O-N 3.05Å; A209-W237 CarbonylContact C-O 3.47Å; A209-W237 HydrophobicContact CB-CB 4.25Å; A209-W237 PolarHBondContact O-N 3.47Å; A209-W237 VanDerWaalsContact O-N 3.11Å; A209-A242 HydrophobicContact CB-CB 3.65Å
210	Q	91.2	Very high	91.8	Very high	107 Å²	107	26.6 Å²	26.6	50%	0.5	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-24	178.8	-68.4	173.4	-32.2	0	0	113.6	Y208 G236 W237	Y208-Q210 PolarHBondContact O-N 2.87Å; Q210-G236 PolarHBondContact O-N 2.91Å; Q210-W237 WeakPolarHBondContact CG-O 3.43Å; Q210-W237 PolarHBondContact N-O 2.73Å
211	Q	92.2	Very high	90.1	Very high	126 Å²	126	28.8 Å²	28.8	59%	0.589	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-38.3	-171.1	-61.8	176.5	3.5	0	0	113	Y208 A209	Y208-Q211 PolarHBondContact O-N 2.9Å; A209-Q211 VanDerWaalsContact C-N 3.33Å; A209-Q211 PolarHBondContact O-N 3.03Å
212	C	94.2	Very high	88.4	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.014	19%	0.186	C	C	.	.			trans	-140.1	134	-170.9	-175.2	0	0	0	0	112.1	S65 T66 Y208 F214	S65-C212 PolarHBondContact O-SG 3.5Å; T66-C212 VanDerWaalsContact C-SG 3.55Å; T66-C212 WeakPolarHBondContact O-CA 3.35Å; Y208-C212 PolarHBondContact O-N 3.19Å; C212-F214 HydrophobicContact CB-CE2 3.82Å; C212-F214 HydrophobicContact CB-CZ 4.36Å; C212-F214 WeakPolarHBondContact O-CD2 3.34Å; C212-F214 WeakPolarHBondContact O-CE2 2.78Å
213	G	94.9	Very high	86.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	145.1	169.7	0	0	0	0	0	111.8	T66 M67 I68 T233	T66-G213 PolarHBondContact O-N 2.85Å; M67-G213 WeakPolarHBondContact CA-O 3.43Å; I68-G213 PolarHBondContact N-O 3.41Å; G213-T233 VanDerWaalsContact CA-O 3.31Å; G213-T233 WeakPolarHBondContact CA-O 3.42Å
214	F	96	Very high	84.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.6	-177.7	-67.7	-107.7	0	0	0	109.8	L57 I61 I68 I70 V201 A205 C212 L231 R232 T233	L57-F214 HydrophobicContact CD1-CE1 4.49Å; L57-F214 HydrophobicContact CD2-CD1 4.34Å; L57-F214 HydrophobicContact CD2-CE1 4.13Å; I61-F214 HydrophobicContact CD1-CZ 4.3Å; I68-F214 HydrophobicContact CB-CD1 4.42Å; I68-F214 HydrophobicContact CD1-CE1 3.97Å; I68-F214 HydrophobicContact CD1-CZ 4.19Å; I68-F214 WeakPolarHBondContact O-CA 3.38Å; I70-F214 HydrophobicContact CD1-CD1 4.46Å; V201-F214 HydrophobicContact CG1-CB 4.4Å; V201-F214 HydrophobicContact CG1-CD1 4.49Å; A205-F214 HydrophobicContact CB-CB 3.75Å; A205-F214 HydrophobicContact CB-CD2 3.85Å; A205-F214 HydrophobicContact CB-CG 3.8Å; C212-F214 HydrophobicContact CB-CE2 3.82Å; C212-F214 HydrophobicContact CB-CZ 4.36Å; C212-F214 WeakPolarHBondContact O-CD2 3.34Å; C212-F214 WeakPolarHBondContact O-CE2 2.78Å; F214-L231 HydrophobicContact CB-CD2 4.48Å; F214-R232 CarbonylContact O-C 3.56Å; F214-R232 WeakPolarHBondContact O-CA 3.39Å; F214-T233 PolarHBondContact N-O 2.94Å; F214-T233 PolarHBondContact N-OG1 3.15Å; F214-T233 PolarHBondContact O-N 3.07Å
215	H	95.2	Very high	81.7	Confident	47 Å²	47	47.9 Å²	47.9	22%	0.218	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	103.1	178.1	-74.4	-165.1	0	0	0	109.2	I68 K69 I70 L231 R232	I68-H215 PolarHBondContact O-N 3.25Å; K69-H215 CarbonylContact C-O 3.56Å; K69-H215 WeakPolarHBondContact CA-O 3.35Å; K69-H215 HydrophobicContact CB-CB 4.4Å; K69-H215 HydrophobicContact CG-CB 4.24Å; I70-H215 PolarHBondContact N-O 3.26Å; H215-L231 CarbonylContact C-O 3.53Å; H215-L231 WeakPolarHBondContact CA-O 3.31Å; H215-R232 VanDerWaalsContact CD2-CG 3.48Å; H215-R232 WeakPolarHBondContact CD2-CG 3.37Å; H215-R232 PolarHBondContact CE1-NE 3.49Å; H215-R232 VanDerWaalsContact CE1-NE 3.35Å; H215-R232 PolarHBondContact NE2-NE 3.4Å
216	L	94.6	Very high	79	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	134	171.7	179	61.8	0	0	0	110.2	I70 V72 V197 T198 V201 D230 L231	I70-L216 HydrophobicContact CB-CD1 3.78Å; I70-L216 HydrophobicContact CG2-CD1 3.68Å; I70-L216 CarbonylContact O-C 3.53Å; I70-L216 WeakPolarHBondContact O-CA 3.33Å; V72-L216 HydrophobicContact CG2-CD1 3.65Å; V197-L216 HydrophobicContact CG1-CD1 4.43Å; T198-L216 HydrophobicContact CG2-CD2 4.32Å; T198-L216 WeakPolarHBondContact OG1-CD2 3.33Å; V201-L216 HydrophobicContact CB-CD2 4.4Å; V201-L216 HydrophobicContact CG1-CB 4.27Å; V201-L216 HydrophobicContact CG2-CD2 4.41Å; L216-D230 VanDerWaalsContact O-CA 3.26Å; L216-D230 WeakPolarHBondContact O-CA 3.49Å; L216-L231 HydrophobicContact CB-CB 4.02Å; L216-L231 PolarHBondContact N-O 3.4Å; L216-L231 PolarHBondContact O-N 3.14Å
217	H	92	Very high	76.7	Confident	56 Å²	56	57.9 Å²	57.9	26%	0.259	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.5	171.6	-177.3	65.9	0	0	0	111	I70 T71 V72 D230	I70-H217 PolarHBondContact O-N 2.9Å; T71-H217 WeakPolarHBondContact CA-O 3.28Å; V72-H217 PolarHBondContact N-O 3.11Å; H217-D230 WeakPolarHBondContact CA-OD1 3.25Å; H217-D230 IonicContact CE1-OD1 3.42Å; H217-D230 IonicContact CE1-OD2 2.75Å; H217-D230 IonicContact CG-OD1 3.85Å; H217-D230 IonicContact CG-OD2 3.93Å; H217-D230 VanDerWaalsContact ND1-CG 3.28Å; H217-D230 IonicContact ND1-OD1 3.31Å; H217-D230 PolarHBondContact ND1-OD1 2.94Å; H217-D230 IonicContact ND1-OD2 2.65Å; H217-D230 PolarHBondContact ND1-OD2 3.37Å
218	S	87.1	Confident	74.6	Confident	23 Å²	23	62.4 Å²	62.4	16%	0.161	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	105.7	-176.4	172.8	0	0	0	0	112.6	V72 L194 S220	V72-S218 CarbonylContact O-C 3.51Å; V72-S218 WeakPolarHBondContact O-CA 3.46Å; L194-S218 VanDerWaalsContact CD2-OG 3.32Å; L194-S218 WeakPolarHBondContact CD2-OG 3.36Å; S218-S220 PolarHBondContact O-N 3.34Å
219	E	81.7	Confident	72.8	Confident	68 Å²	68	63.8 Å²	63.8	32%	0.318	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	120.4	175.5	-71.7	-174.3	-151.4	0	0	112.2	T71 V72 K73	T71-E219 HydrophobicContact CG2-CG 4.22Å; V72-E219 PolarHBondContact O-N 2.92Å; K73-E219 HydrophobicContact CB-CB 4.2Å; K73-E219 HydrophobicContact CD-CB 3.99Å; K73-E219 WeakPolarHBondContact CD-OE2 3.26Å; K73-E219 VanDerWaalsContact CE-OE2 3.29Å; K73-E219 WeakPolarHBondContact CE-OE2 3.41Å; K73-E219 HydrophobicContact CG-CB 3.85Å; K73-E219 IonicContact NZ-OE2 3.14Å; K73-E219 PolarHBondContact NZ-OE2 3.26Å
220	S	66	Low	72	Confident	52 Å²	52	67.8 Å²	67.8	36%	0.364	39%	0.385	S	S	.	.			trans	-65.7	140.5	169.5	178.2	0	0	0	0	111.8	S218 T222	S218-S220 PolarHBondContact O-N 3.34Å; S220-T222 PolarHBondContact O-N 3.24Å; S220-T222 PolarHBondContact OG-N 3.28Å; S220-T222 PolarHBondContact OG-OG1 2.63Å; S220-T222 VanDerWaalsContact OG-OG1 3.05Å
221	A	58.8	Low	71.9	Confident	66 Å²	66	63.4 Å²	63.4	55%	0.545	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-22.6	175.6	0	0	0	0	0	113.5
222	T	58.5	Low	71.9	Confident	107 Å²	107	65.2 Å²	65.2	66%	0.656	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	0.3	-173.9	59	0	0	0	0	114.5	S220 K224	S220-T222 PolarHBondContact O-N 3.24Å; S220-T222 PolarHBondContact OG-N 3.28Å; S220-T222 PolarHBondContact OG-OG1 2.63Å; S220-T222 VanDerWaalsContact OG-OG1 3.05Å; T222-K224 PolarHBondContact O-N 3.24Å
223	G	53.9	Low	71.8	Confident	72 Å²	72	65.1 Å²	65.1	74%	0.742	37%	0.366	S	S	*	.	S	Bend	trans	69.3	-7.7	177.5	0	0	0	0	0	116.1
224	K	50.1	Low	71.6	Confident	158 Å²	158	67 Å²	67	69%	0.687	38%	0.379	S	S	*	.			trans	-82.7	122.4	171.6	-63	-175.5	178.9	-177.7	0	108.9	T222 S226	T222-K224 PolarHBondContact O-N 3.24Å; K224-S226 PolarHBondContact O-N 2.98Å; K224-S226 VanDerWaalsContact O-N 3.13Å
225	S	39	Very low	71.3	Confident	93 Å²	93	69.2 Å²	69.2	65%	0.65	40%	0.397	S	S	*	.			trans	-69.8	106.8	170	175.6	0	0	0	0	108.4	E228	S225-E228 PolarHBondContact OG-OE1 2.78Å
226	S	37.5	Very low	71.1	Confident	80 Å²	80	69.8 Å²	69.8	56%	0.559	42%	0.416	S	S	*	.			trans	-150.9	105.4	177.3	60.5	0	0	0	0	108.8	K224	K224-S226 PolarHBondContact O-N 2.98Å; K224-S226 VanDerWaalsContact O-N 3.13Å
227	I	46.3	Very low	71	Confident	130 Å²	130	73.7 Å²	73.7	67%	0.667	43%	0.431	S	S	*	.			trans	69	75.5	-177.9	-43.7	173.2	0	0	0	112.8	Q229	I227-Q229 PolarHBondContact O-N 3.08Å
228	E	50.2	Low	71	Confident	109 Å²	109	73.1 Å²	73.1	51%	0.509	43%	0.433	S	S	.	.			trans	-65.7	124.9	164.8	-73.6	160.7	-172	0	0	109.8	S225	S225-E228 PolarHBondContact OG-OE1 2.78Å
229	Q	57.6	Low	71.2	Confident	42 Å²	42	74.1 Å²	74.1	20%	0.196	43%	0.433	C	S	.	.			trans	-101.4	58.8	170.5	-67	-164.2	5.8	0	0	109.8	I227 M355	I227-Q229 PolarHBondContact O-N 3.08Å; Q229-M355 PolarHBondContact NE2-SD 2.66Å
230	D	76.2	Confident	71.7	Confident	83 Å²	83	73.3 Å²	73.3	44%	0.444	43%	0.43	S	S	.	.			trans	-82.5	122.1	-178.9	-80.5	32	0	0	0	110.3	L216 H217	L216-D230 VanDerWaalsContact O-CA 3.26Å; L216-D230 WeakPolarHBondContact O-CA 3.49Å; H217-D230 WeakPolarHBondContact CA-OD1 3.25Å; H217-D230 IonicContact CE1-OD1 3.42Å; H217-D230 IonicContact CE1-OD2 2.75Å; H217-D230 IonicContact CG-OD1 3.85Å; H217-D230 IonicContact CG-OD2 3.93Å; H217-D230 VanDerWaalsContact ND1-CG 3.28Å; H217-D230 IonicContact ND1-OD1 3.31Å; H217-D230 PolarHBondContact ND1-OD1 2.94Å; H217-D230 IonicContact ND1-OD2 2.65Å; H217-D230 PolarHBondContact ND1-OD2 3.37Å
231	L	87.9	Confident	72.9	Confident	15 Å²	15	73.4 Å²	73.4	8%	0.079	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.5	173.8	179.4	162.1	0	0	0	108.3	T198 V201 A202 A205 F214 H215 L216 T233 V246	T198-L231 HydrophobicContact CG2-CD1 4.41Å; V201-L231 HydrophobicContact CG1-CD1 4.38Å; V201-L231 HydrophobicContact CG1-CD2 4.17Å; A202-L231 HydrophobicContact CB-CD1 3.81Å; A205-L231 HydrophobicContact CB-CD2 4.12Å; F214-L231 HydrophobicContact CB-CD2 4.48Å; H215-L231 CarbonylContact C-O 3.53Å; H215-L231 WeakPolarHBondContact CA-O 3.31Å; L216-L231 HydrophobicContact CB-CB 4.02Å; L216-L231 PolarHBondContact N-O 3.4Å; L216-L231 PolarHBondContact O-N 3.14Å; L231-T233 HydrophobicContact CD2-CG2 4.48Å; L231-V246 HydrophobicContact CD1-CG1 3.78Å; L231-V246 HydrophobicContact CD1-CG2 4.25Å; L231-V246 HydrophobicContact CD2-CG2 4.2Å; L231-V246 HydrophobicContact CG-CG1 4.45Å; L231-V246 HydrophobicContact CG-CG2 4.11Å
232	R	91.8	Very high	74.6	Confident	165 Å²	165	70.3 Å²	70.3	62%	0.623	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	120.5	-177.8	-162.3	178.3	178.5	-173.3	-7.4	113	F214 H215	F214-R232 CarbonylContact O-C 3.56Å; F214-R232 WeakPolarHBondContact O-CA 3.39Å; H215-R232 VanDerWaalsContact CD2-CG 3.48Å; H215-R232 WeakPolarHBondContact CD2-CG 3.37Å; H215-R232 PolarHBondContact CE1-NE 3.49Å; H215-R232 VanDerWaalsContact CE1-NE 3.35Å; H215-R232 PolarHBondContact NE2-NE 3.4Å
233	T	92.6	Very high	76.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	37%	0.37	C	S	.	.			trans	-125.1	156.3	165.1	65.7	0	0	0	0	111.3	A205 G213 F214 L231 W237 A242 V246	A205-T233 HydrophobicContact CB-CG2 4Å; G213-T233 VanDerWaalsContact CA-O 3.31Å; G213-T233 WeakPolarHBondContact CA-O 3.42Å; F214-T233 PolarHBondContact N-O 2.94Å; F214-T233 PolarHBondContact N-OG1 3.15Å; F214-T233 PolarHBondContact O-N 3.07Å; L231-T233 HydrophobicContact CD2-CG2 4.48Å; T233-W237 HydrophobicContact CG2-CE3 4.17Å; T233-W237 HydrophobicContact CG2-CZ3 4.02Å; T233-A242 HydrophobicContact CG2-CB 4.38Å; T233-V246 HydrophobicContact CG2-CG2 3.6Å
234	S	91.1	Very high	77.9	Confident	40 Å²	40	66.6 Å²	66.6	28%	0.28	35%	0.352	S	S	.	.			trans	-110.3	151.1	172.2	-55.6	0	0	0	0	110.3
235	A	90.5	Very high	79.7	Confident	45 Å²	45	61.8 Å²	61.8	37%	0.372	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	149.6	170.2	0	0	0	0	0	111.2	A209 W237	A209-A235 CarbonylContact O-C 3.49Å; A209-A235 WeakPolarHBondContact O-CA 3.49Å; A235-W237 VanDerWaalsContact C-N 3.31Å
236	G	90.2	Very high	82.1	Confident	60 Å²	60	57.9 Å²	57.9	62%	0.619	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	3.1	-177.6	0	0	0	0	0	114.9	A209 Q210	A209-G236 PolarHBondContact O-N 3.05Å; Q210-G236 PolarHBondContact O-N 2.91Å
237	W	92.2	Very high	84.4	Confident	83 Å²	83	54.8 Å²	54.8	31%	0.314	29%	0.291	S	S	.	.			trans	-72.1	149.2	173.6	-79.7	7.3	0	0	0	111.7	A209 Q210 T233 A235 D241 A245	A209-W237 CarbonylContact C-O 3.47Å; A209-W237 HydrophobicContact CB-CB 4.25Å; A209-W237 PolarHBondContact O-N 3.47Å; A209-W237 VanDerWaalsContact O-N 3.11Å; Q210-W237 WeakPolarHBondContact CG-O 3.43Å; Q210-W237 PolarHBondContact N-O 2.73Å; T233-W237 HydrophobicContact CG2-CE3 4.17Å; T233-W237 HydrophobicContact CG2-CZ3 4.02Å; A235-W237 VanDerWaalsContact C-N 3.31Å; W237-D241 HydrophobicContact CB-CB 4.36Å; W237-D241 HydrophobicContact CG-CB 4.49Å; W237-A245 HydrophobicContact CH2-CB 4.26Å; W237-A245 HydrophobicContact CZ3-CB 3.68Å
238	S	92.3	Very high	86.3	Confident	45 Å²	45	49.7 Å²	49.7	32%	0.315	27%	0.271	S	S	.	.			trans	-70.5	157	166.4	84	0	0	0	0	109.9	M240 D241 A242	S238-M240 PolarHBondContact O-N 3.19Å; S238-M240 PolarHBondContact OG-N 3.3Å; S238-D241 WeakPolarHBondContact CB-OD2 3.27Å; S238-D241 PolarHBondContact N-OD2 2.88Å; S238-D241 PolarHBondContact O-N 3.49Å; S238-D241 VanDerWaalsContact O-N 3.12Å; S238-D241 PolarHBondContact OG-N 2.96Å; S238-D241 VanDerWaalsContact OG-N 3.15Å; S238-D241 PolarHBondContact OG-OD2 2.92Å; S238-A242 PolarHBondContact O-N 3.35Å
239	R	91.6	Very high	87.9	Confident	43 Å²	43	47.4 Å²	47.4	16%	0.162	27%	0.267	C	S	.	.	H	α-helix	trans	-65.1	-27	178.1	-51.3	-166.5	-150.4	90.3	-10.8	111.9	I243 E281 Y367	R239-I243 WeakPolarHBondContact O-CB 3.19Å; R239-I243 WeakPolarHBondContact O-CD1 3.33Å; R239-I243 WeakPolarHBondContact O-CG1 3.45Å; R239-I243 PolarHBondContact O-N 3.36Å; R239-E281 IonicContact CZ-OE1 2.66Å; R239-E281 IonicContact CZ-OE2 3.57Å; R239-E281 IonicContact NH1-OE1 3.05Å; R239-E281 PolarHBondContact NH1-OE1 2.96Å; R239-E281 IonicContact NH1-OE2 3.75Å; R239-E281 PolarHBondContact NH1-OE2 3.22Å; R239-E281 IonicContact NH2-OE1 3.44Å; R239-E281 PolarHBondContact NH2-OE1 2.88Å; R239-E281 IonicContact NH2-OE2 2.64Å; R239-E281 PolarHBondContact NH2-OE2 3.41Å; R239-Y367 WeakPolarHBondContact CD-OH 3.43Å
240	M	91.5	Very high	89.1	Confident	52 Å²	52	48.8 Å²	48.8	26%	0.256	28%	0.281	S	S	.	.	H	α-helix	trans	-67.5	-44.1	171.9	-65.6	-65	-81	0	0	111.5	S238 A242 I243 R244 E252 L255 L283	S238-M240 PolarHBondContact O-N 3.19Å; S238-M240 PolarHBondContact OG-N 3.3Å; M240-A242 VanDerWaalsContact C-N 3.34Å; M240-A242 PolarHBondContact O-N 3.25Å; M240-I243 PolarHBondContact O-N 3.01Å; M240-R244 WeakPolarHBondContact O-CB 2.95Å; M240-R244 PolarHBondContact O-N 2.89Å; M240-E252 HydrophobicContact CB-CG 4.46Å; M240-E252 HydrophobicContact CE-CG 3.87Å; M240-E252 WeakPolarHBondContact CE-O 3.33Å; M240-L255 HydrophobicContact CE-CB 4.16Å; M240-L255 HydrophobicContact SD-CB 4.43Å; M240-L255 HydrophobicContact SD-CD1 4.09Å; M240-L283 HydrophobicContact SD-CD1 3.9Å; M240-L283 HydrophobicContact SD-CD2 4.02Å
241	D	92.4	Very high	89.5	Confident	54 Å²	54	46.2 Å²	46.2	29%	0.289	27%	0.267	S	S	.	.	H	α-helix	trans	-63.8	-40.5	176.3	-54.7	-52.8	0	0	0	111.6	W237 S238 R244 A245	W237-D241 HydrophobicContact CB-CB 4.36Å; W237-D241 HydrophobicContact CG-CB 4.49Å; S238-D241 WeakPolarHBondContact CB-OD2 3.27Å; S238-D241 PolarHBondContact N-OD2 2.88Å; S238-D241 PolarHBondContact O-N 3.49Å; S238-D241 VanDerWaalsContact O-N 3.12Å; S238-D241 PolarHBondContact OG-N 2.96Å; S238-D241 VanDerWaalsContact OG-N 3.15Å; S238-D241 PolarHBondContact OG-OD2 2.92Å; D241-R244 PolarHBondContact O-N 3.21Å; D241-R244 IonicContact OD1-CZ 3.28Å; D241-R244 IonicContact OD1-NH1 3.43Å; D241-R244 PolarHBondContact OD1-NH1 2.73Å; D241-R244 IonicContact OD1-NH2 2.71Å; D241-R244 PolarHBondContact OD1-NH2 2.66Å; D241-A245 WeakPolarHBondContact O-CB 3.36Å; D241-A245 PolarHBondContact O-N 2.83Å
242	A	92.7	Very high	89.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-45.2	174	0	0	0	0	0	112	I206 A209 T233 S238 M240 R244 A245 V246	I206-A242 HydrophobicContact CG1-CB 4.28Å; A209-A242 HydrophobicContact CB-CB 3.65Å; T233-A242 HydrophobicContact CG2-CB 4.38Å; S238-A242 PolarHBondContact O-N 3.35Å; M240-A242 VanDerWaalsContact C-N 3.34Å; M240-A242 PolarHBondContact O-N 3.25Å; A242-R244 PolarHBondContact O-N 2.91Å; A242-A245 PolarHBondContact O-N 3.48Å; A242-V246 WeakPolarHBondContact O-CB 3.27Å; A242-V246 WeakPolarHBondContact O-CG2 3.26Å; A242-V246 PolarHBondContact O-N 3.03Å
243	I	91.4	Very high	89.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-42.9	174.1	-71.3	162.4	0	0	0	111.1	I206 R239 M240 A245 V246 I247 G248 E252 L255 L283 Y365	I206-I243 HydrophobicContact CB-CG1 4.48Å; I206-I243 HydrophobicContact CD1-CG1 3.92Å; I206-I243 HydrophobicContact CG1-CG1 4Å; I206-I243 HydrophobicContact CG2-CD1 4.01Å; I206-I243 HydrophobicContact CG2-CG1 3.66Å; R239-I243 WeakPolarHBondContact O-CB 3.19Å; R239-I243 WeakPolarHBondContact O-CD1 3.33Å; R239-I243 WeakPolarHBondContact O-CG1 3.45Å; R239-I243 PolarHBondContact O-N 3.36Å; M240-I243 PolarHBondContact O-N 3.01Å; I243-A245 VanDerWaalsContact C-N 3.29Å; I243-A245 PolarHBondContact O-N 3.11Å; I243-V246 PolarHBondContact O-N 3.25Å; I243-I247 HydrophobicContact CG2-CB 4.3Å; I243-I247 HydrophobicContact CG2-CD1 4.38Å; I243-I247 WeakPolarHBondContact O-CA 3.46Å; I243-I247 WeakPolarHBondContact O-CB 3.32Å; I243-I247 PolarHBondContact O-N 3.09Å; I243-G248 PolarHBondContact O-N 3.31Å; I243-E252 HydrophobicContact CG2-CB 4.15Å; I243-L255 HydrophobicContact CD1-CD1 3.9Å; I243-L255 HydrophobicContact CG2-CD1 4.01Å; I243-L283 HydrophobicContact CD1-CD1 3.45Å; I243-L283 VanDerWaalsContact CD1-CD1 3.45Å; I243-Y365 HydrophobicContact CD1-CE1 4.02Å; I243-Y365 HydrophobicContact CG1-CE1 4.36Å
244	R	90.8	Very high	88.7	Confident	101 Å²	101	47.5 Å²	47.5	38%	0.381	28%	0.281	S	S	.	.	H	α-helix	trans	-59.7	-38.9	178	-163.4	-173.3	-55.8	113.8	10.2	112.1	M240 D241 A242 G248 E252	M240-R244 WeakPolarHBondContact O-CB 2.95Å; M240-R244 PolarHBondContact O-N 2.89Å; D241-R244 PolarHBondContact O-N 3.21Å; D241-R244 IonicContact OD1-CZ 3.28Å; D241-R244 IonicContact OD1-NH1 3.43Å; D241-R244 PolarHBondContact OD1-NH1 2.73Å; D241-R244 IonicContact OD1-NH2 2.71Å; D241-R244 PolarHBondContact OD1-NH2 2.66Å; A242-R244 PolarHBondContact O-N 2.91Å; R244-G248 VanDerWaalsContact O-CA 3.26Å; R244-G248 WeakPolarHBondContact O-CA 3.11Å; R244-G248 PolarHBondContact O-N 3.46Å; R244-E252 HydrophobicContact CB-CB 4.27Å; R244-E252 HydrophobicContact CB-CG 4.01Å; R244-E252 WeakPolarHBondContact CD-OE2 3.23Å; R244-E252 HydrophobicContact CG-CG 4.44Å; R244-E252 WeakPolarHBondContact CG-OE2 3.38Å; R244-E252 IonicContact CZ-OE1 3.56Å; R244-E252 IonicContact CZ-OE2 3.13Å; R244-E252 IonicContact NE-OE1 3.29Å; R244-E252 PolarHBondContact NE-OE1 2.93Å; R244-E252 IonicContact NE-OE2 3.28Å; R244-E252 PolarHBondContact NE-OE2 3.05Å; R244-E252 IonicContact NH2-OE1 2.68Å; R244-E252 PolarHBondContact NH2-OE1 3.04Å; R244-E252 IonicContact NH2-OE2 2.72Å
245	A	88.7	Confident	88.6	Confident	57 Å²	57	46.8 Å²	46.8	47%	0.471	27%	0.274	S	S	.	.	H	α-helix	trans	-79	-40.1	179	0	0	0	0	0	113.6	W237 D241 A242 I243	W237-A245 HydrophobicContact CH2-CB 4.26Å; W237-A245 HydrophobicContact CZ3-CB 3.68Å; D241-A245 WeakPolarHBondContact O-CB 3.36Å; D241-A245 PolarHBondContact O-N 2.83Å; A242-A245 PolarHBondContact O-N 3.48Å; I243-A245 VanDerWaalsContact C-N 3.29Å; I243-A245 PolarHBondContact O-N 3.11Å
246	V	88.7	Confident	88.5	Confident	11 Å²	11	46 Å²	46	7%	0.067	26%	0.263	C	S	.	.	H	α-helix	trans	-88.8	-39.8	-170.9	172.4	0	0	0	0	112.9	A202 I206 L231 T233 A242 I243	A202-V246 HydrophobicContact CB-CG1 3.28Å; I206-V246 HydrophobicContact CD1-CB 4.32Å; I206-V246 HydrophobicContact CD1-CG1 4.07Å; I206-V246 HydrophobicContact CG1-CB 4.4Å; I206-V246 HydrophobicContact CG1-CG1 4.47Å; L231-V246 HydrophobicContact CD1-CG1 3.78Å; L231-V246 HydrophobicContact CD1-CG2 4.25Å; L231-V246 HydrophobicContact CD2-CG2 4.2Å; L231-V246 HydrophobicContact CG-CG1 4.45Å; L231-V246 HydrophobicContact CG-CG2 4.11Å; T233-V246 HydrophobicContact CG2-CG2 3.6Å; A242-V246 WeakPolarHBondContact O-CB 3.27Å; A242-V246 WeakPolarHBondContact O-CG2 3.26Å; A242-V246 PolarHBondContact O-N 3.03Å; I243-V246 PolarHBondContact O-N 3.25Å
247	I	86	Confident	88.6	Confident	15 Å²	15	46.8 Å²	46.8	8%	0.077	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-42.6	-175.1	-59.8	-179	0	0	0	110.5	I206 I243 I251 Y356 Y365	I206-I247 HydrophobicContact CD1-CD1 3.62Å; I206-I247 HydrophobicContact CD1-CG1 4.01Å; I243-I247 HydrophobicContact CG2-CB 4.3Å; I243-I247 HydrophobicContact CG2-CD1 4.38Å; I243-I247 WeakPolarHBondContact O-CA 3.46Å; I243-I247 WeakPolarHBondContact O-CB 3.32Å; I243-I247 PolarHBondContact O-N 3.09Å; I247-I251 HydrophobicContact CG2-CB 4.21Å; I247-I251 HydrophobicContact CG2-CD1 3.55Å; I247-I251 HydrophobicContact CG2-CG1 4.45Å; I247-I251 HydrophobicContact CG2-CG2 4.28Å; I247-Y356 HydrophobicContact CG2-CD1 4.43Å; I247-Y365 HydrophobicContact CD1-CD2 3.81Å; I247-Y365 HydrophobicContact CD1-CE1 4.05Å; I247-Y365 HydrophobicContact CD1-CE2 3.27Å; I247-Y365 HydrophobicContact CD1-CG 4.39Å; I247-Y365 VanDerWaalsContact CD1-CZ 3.4Å
248	G	85.6	Confident	88.5	Confident	23 Å²	23	43.2 Å²	43.2	24%	0.237	25%	0.246	C	C	.	.			trans	125.8	151.6	173.6	0	0	0	0	0	114.3	I243 R244 S250 I251 E252	I243-G248 PolarHBondContact O-N 3.31Å; R244-G248 VanDerWaalsContact O-CA 3.26Å; R244-G248 WeakPolarHBondContact O-CA 3.11Å; R244-G248 PolarHBondContact O-N 3.46Å; G248-S250 VanDerWaalsContact C-N 3.27Å; G248-S250 PolarHBondContact O-N 3.35Å; G248-I251 PolarHBondContact O-N 3.43Å; G248-E252 PolarHBondContact O-N 3.13Å
249	S	85.2	Confident	88.5	Confident	61 Å²	61	43 Å²	43	43%	0.427	24%	0.243	S	C	.	.	H	α-helix	trans	-56.1	-32.6	-177.8	53.2	0	0	0	0	115	I251 E252 Q253	S249-I251 PolarHBondContact O-N 2.88Å; S249-E252 PolarHBondContact O-N 2.97Å; S249-Q253 WeakPolarHBondContact O-CB 3.48Å; S249-Q253 VanDerWaalsContact O-CG 3.29Å; S249-Q253 WeakPolarHBondContact O-CG 3.47Å; S249-Q253 PolarHBondContact O-N 2.95Å
250	S	81.8	Confident	88.3	Confident	71 Å²	71	41.7 Å²	41.7	50%	0.497	24%	0.241	S	C	.	.	H	α-helix	trans	-64.9	-25.2	-178.5	-166.4	0	0	0	0	113.9	G248 N254	G248-S250 VanDerWaalsContact C-N 3.27Å; G248-S250 PolarHBondContact O-N 3.35Å; S250-N254 PolarHBondContact O-ND2 2.96Å
251	I	84.1	Confident	87.6	Confident	30 Å²	30	44 Å²	44	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-88.4	-46.8	173.3	-76.6	167.2	0	0	0	109.3	I247 G248 S249 Q253 N254 L255 Y365	I247-I251 HydrophobicContact CG2-CB 4.21Å; I247-I251 HydrophobicContact CG2-CD1 3.55Å; I247-I251 HydrophobicContact CG2-CG1 4.45Å; I247-I251 HydrophobicContact CG2-CG2 4.28Å; G248-I251 PolarHBondContact O-N 3.43Å; S249-I251 PolarHBondContact O-N 2.88Å; I251-Q253 VanDerWaalsContact C-N 3.34Å; I251-Q253 PolarHBondContact O-N 2.88Å; I251-N254 CarbonylContact O-C 3.49Å; I251-N254 WeakPolarHBondContact O-CA 3.49Å; I251-N254 PolarHBondContact O-N 3.34Å; I251-L255 HydrophobicContact CG2-CD2 4.01Å; I251-L255 HydrophobicContact CG2-CG 4.49Å; I251-L255 WeakPolarHBondContact O-CG 3.36Å; I251-L255 PolarHBondContact O-N 3.2Å; I251-Y365 HydrophobicContact CG2-CD1 3.96Å; I251-Y365 HydrophobicContact CG2-CG 4.08Å
252	E	87	Confident	86.5	Confident	25 Å²	25	47 Å²	47	12%	0.117	27%	0.274	C	S	.	.	H	α-helix	trans	-54.8	-43	-179.6	-178.3	-105	163.7	0	0	113.9	M240 I243 R244 G248 S249 N254 L255	M240-E252 HydrophobicContact CB-CG 4.46Å; M240-E252 HydrophobicContact CE-CG 3.87Å; M240-E252 WeakPolarHBondContact CE-O 3.33Å; I243-E252 HydrophobicContact CG2-CB 4.15Å; R244-E252 HydrophobicContact CB-CB 4.27Å; R244-E252 HydrophobicContact CB-CG 4.01Å; R244-E252 WeakPolarHBondContact CD-OE2 3.23Å; R244-E252 HydrophobicContact CG-CG 4.44Å; R244-E252 WeakPolarHBondContact CG-OE2 3.38Å; R244-E252 IonicContact CZ-OE1 3.56Å; R244-E252 IonicContact CZ-OE2 3.13Å; R244-E252 IonicContact NE-OE1 3.29Å; R244-E252 PolarHBondContact NE-OE1 2.93Å; R244-E252 IonicContact NE-OE2 3.28Å; R244-E252 PolarHBondContact NE-OE2 3.05Å; R244-E252 IonicContact NH2-OE1 2.68Å; R244-E252 PolarHBondContact NH2-OE1 3.04Å; R244-E252 IonicContact NH2-OE2 2.72Å; G248-E252 PolarHBondContact O-N 3.13Å; S249-E252 PolarHBondContact O-N 2.97Å; E252-N254 PolarHBondContact O-N 2.89Å; E252-N254 VanDerWaalsContact O-N 3.1Å; E252-L255 PolarHBondContact O-N 3.3Å
253	Q	84.5	Confident	85	Confident	148 Å²	148	49.1 Å²	49.1	69%	0.692	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-11.6	176.2	-72.5	175.5	-20.1	0	0	114.4	S249 I251	S249-Q253 WeakPolarHBondContact O-CB 3.48Å; S249-Q253 VanDerWaalsContact O-CG 3.29Å; S249-Q253 WeakPolarHBondContact O-CG 3.47Å; S249-Q253 PolarHBondContact O-N 2.95Å; I251-Q253 VanDerWaalsContact C-N 3.34Å; I251-Q253 PolarHBondContact O-N 2.88Å
254	N	84.9	Confident	83.4	Confident	34 Å²	34	54.7 Å²	54.7	18%	0.182	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	21.6	-178.2	-67.3	-72.8	0	0	0	112.3	S250 I251 E252 T285 A286 Q289	S250-N254 PolarHBondContact O-ND2 2.96Å; I251-N254 CarbonylContact O-C 3.49Å; I251-N254 WeakPolarHBondContact O-CA 3.49Å; I251-N254 PolarHBondContact O-N 3.34Å; E252-N254 PolarHBondContact O-N 2.89Å; E252-N254 VanDerWaalsContact O-N 3.1Å; N254-T285 CarbonylContact O-C 3.59Å; N254-T285 WeakPolarHBondContact O-CA 3.28Å; N254-A286 PolarHBondContact O-N 3.48Å; N254-Q289 HydrophobicContact CB-CG 3.89Å; N254-Q289 VanDerWaalsContact CG-NE2 3.32Å; N254-Q289 PolarHBondContact ND2-NE2 3.43Å; N254-Q289 PolarHBondContact OD1-NE2 3.02Å
255	L	88.8	Confident	82	Confident	25 Å²	25	53.5 Å²	53.5	13%	0.131	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.7	176.4	-59.6	-176.6	0	0	0	112.8	M240 I243 I251 E252 L283 L284 Y365	M240-L255 HydrophobicContact CE-CB 4.16Å; M240-L255 HydrophobicContact SD-CB 4.43Å; M240-L255 HydrophobicContact SD-CD1 4.09Å; I243-L255 HydrophobicContact CD1-CD1 3.9Å; I243-L255 HydrophobicContact CG2-CD1 4.01Å; I251-L255 HydrophobicContact CG2-CD2 4.01Å; I251-L255 HydrophobicContact CG2-CG 4.49Å; I251-L255 WeakPolarHBondContact O-CG 3.36Å; I251-L255 PolarHBondContact O-N 3.2Å; E252-L255 PolarHBondContact O-N 3.3Å; L255-L283 HydrophobicContact CB-CB 4.42Å; L255-L283 HydrophobicContact CD1-CB 4.1Å; L255-L283 HydrophobicContact CD1-CD1 4.35Å; L255-L284 CarbonylContact C-O 3.45Å; L255-L284 WeakPolarHBondContact CA-O 3.44Å; L255-Y365 HydrophobicContact CD1-CD1 4.39Å; L255-Y365 HydrophobicContact CD1-CE1 4.47Å; L255-Y365 HydrophobicContact CD2-CD1 4.07Å
256	I	89.4	Confident	81.4	Confident	27 Å²	27	51.5 Å²	51.5	14%	0.138	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127	168.1	-51.4	155.7	0	0	0	107.5	L283 L284 A286 L408 S411	I256-L283 CarbonylContact O-C 3.55Å; I256-L283 VanDerWaalsContact O-CA 3.3Å; I256-L283 WeakPolarHBondContact O-CA 3.41Å; I256-L284 HydrophobicContact CB-CB 4.46Å; I256-L284 PolarHBondContact N-O 3.08Å; I256-L284 PolarHBondContact O-N 3.25Å; I256-A286 HydrophobicContact CD1-CB 4.07Å; I256-A286 HydrophobicContact CG1-CB 4.19Å; I256-L408 HydrophobicContact CD1-CD2 4.18Å; I256-S411 WeakPolarHBondContact CD1-OG 3.41Å; I256-S411 WeakPolarHBondContact CG1-OG 3.12Å
257	S	91.4	Very high	81.2	Confident	78 Å²	78	56.3 Å²	56.3	55%	0.545	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.7	170.1	52.7	0	0	0	0	111.6	G282	S257-G282 WeakPolarHBondContact CA-O 3.27Å
258	F	91	Very high	81	Confident	7 Å²	7	58.1 Å²	58.1	3%	0.031	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	140.5	173.3	80.8	-67.5	0	0	0	111.8	Q262 Y280 G282 L284 L368 A403 V404 A407	F258-Q262 VanDerWaalsContact CA-OE1 3.31Å; F258-Y280 AromaticContact CD2-CD2 3.92Å; F258-Y280 HydrophobicContact CD2-CD2 3.92Å; F258-Y280 AromaticContact CD2-CE2 3.62Å; F258-Y280 HydrophobicContact CD2-CE2 3.62Å; F258-Y280 AromaticContact CE2-CD2 3.7Å; F258-Y280 HydrophobicContact CE2-CD2 3.7Å; F258-Y280 AromaticContact CE2-CE2 3.74Å; F258-Y280 HydrophobicContact CE2-CE2 3.74Å; F258-Y280 HydrophobicContact CZ-CD2 4.49Å; F258-G282 PolarHBondContact N-O 3.39Å; F258-G282 PolarHBondContact O-N 3.17Å; F258-L284 HydrophobicContact CD1-CD1 3.82Å; F258-L284 HydrophobicContact CD1-CD2 4.38Å; F258-L284 HydrophobicContact CD1-CG 3.76Å; F258-L284 HydrophobicContact CE1-CD1 3.79Å; F258-L284 HydrophobicContact CE1-CD2 3.68Å; F258-L284 HydrophobicContact CE1-CG 3.57Å; F258-L284 HydrophobicContact CG-CD1 4.46Å; F258-L284 HydrophobicContact CZ-CD1 4.4Å; F258-L284 HydrophobicContact CZ-CD2 4.34Å; F258-L284 HydrophobicContact CZ-CG 4.5Å; F258-L368 HydrophobicContact CE1-CD1 4.43Å; F258-L368 HydrophobicContact CZ-CD1 3.9Å; F258-A403 HydrophobicContact CE2-CB 4.32Å; F258-V404 HydrophobicContact CE2-CG2 3.86Å; F258-V404 HydrophobicContact CZ-CG2 3.66Å; F258-A407 HydrophobicContact CB-CB 3.62Å; F258-A407 HydrophobicContact CD1-CB 4.42Å; F258-A407 HydrophobicContact CD2-CB 4.02Å; F258-A407 HydrophobicContact CG-CB 3.78Å
259	T	91.5	Very high	80.9	Confident	41 Å²	41	57.1 Å²	57.1	25%	0.252	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.4	-171.4	-56.8	0	0	0	0	110.7	S261 Q262 Y280	T259-S261 PolarHBondContact O-N 3Å; T259-Q262 WeakPolarHBondContact O-CB 3.46Å; T259-Q262 PolarHBondContact O-N 2.67Å; T259-Y280 VanDerWaalsContact C-CE2 3.45Å; T259-Y280 WeakPolarHBondContact CA-O 3.06Å
260	S	86.5	Confident	80.9	Confident	16 Å²	16	59 Å²	59	11%	0.112	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-55	-14	178.3	53.1	0	0	0	0	116.3	Q262 Y280	S260-Q262 VanDerWaalsContact C-N 3.33Å; S260-Y280 VanDerWaalsContact CA-CZ 3.49Å; S260-Y280 VanDerWaalsContact N-CE2 3.3Å; S260-Y280 PolarHBondContact N-O 3.44Å; S260-Y280 PolarHBondContact OG-N 2.89Å; S260-Y280 PolarHBondContact OG-O 3.34Å
261	S	77.3	Confident	81.1	Confident	99 Å²	99	58.9 Å²	58.9	69%	0.692	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-77.5	-11.7	171.7	51.3	0	0	0	0	114.7	T259	T259-S261 PolarHBondContact O-N 3Å
262	Q	70.1	Confident	81.1	Confident	119 Å²	119	57.5 Å²	57.5	56%	0.556	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-98.6	6	-178.6	-63.1	164.2	-42.9	0	0	112.8	F258 T259 S260 S264	F258-Q262 VanDerWaalsContact CA-OE1 3.31Å; T259-Q262 WeakPolarHBondContact O-CB 3.46Å; T259-Q262 PolarHBondContact O-N 2.67Å; S260-Q262 VanDerWaalsContact C-N 3.33Å; Q262-S264 PolarHBondContact O-N 2.71Å
263	C	61.1	Low	81.1	Confident	43 Å²	43	57.6 Å²	57.6	29%	0.291	33%	0.327	S	S	.	.			trans	-76.6	107.8	-175.9	-177.5	0	0	0	0	111.7	T269 I273	C263-T269 HydrophobicContact CB-CG2 4.3Å; C263-T269 WeakPolarHBondContact SG-CG2 3.02Å; C263-I273 HydrophobicContact CB-CD1 3.86Å
264	S	56.9	Low	81.2	Confident	118 Å²	118	56.7 Å²	56.7	83%	0.825	32%	0.323	S	S	*	.			trans	-127.8	-9.8	-178.9	58.9	0	0	0	0	115.6	Q262	Q262-S264 PolarHBondContact O-N 2.71Å
265	S	62.7	Low	81.2	Confident	75 Å²	75	63.1 Å²	63.1	52%	0.524	35%	0.345	S	S	.	.	S	Bend	trans	-124.6	-32.7	-166.3	57.6	0	0	0	0	117.1	Q406	S265-Q406 PolarHBondContact OG-OE1 3.23Å
266	S	76.1	Confident	81.1	Confident	16 Å²	16	63 Å²	63	11%	0.112	34%	0.342	C	S	.	.			trans	-95.4	126.3	178.1	170.9	0	0	0	0	112.6	S268 T269 R270 D402	S266-S268 VanDerWaalsContact C-N 3.34Å; S266-S268 PolarHBondContact OG-N 2.81Å; S266-S268 PolarHBondContact OG-OG 3.06Å; S266-T269 PolarHBondContact OG-N 3.15Å; S266-R270 WeakPolarHBondContact O-CB 3.5Å; S266-R270 PolarHBondContact O-N 2.84Å; S266-D402 PolarHBondContact OG-OD2 2.98Å
267	E	82.7	Confident	80.9	Confident	112 Å²	112	63.1 Å²	63.1	52%	0.523	35%	0.35	S	S	.	.	H	α-helix	trans	-66.4	-33.9	170.1	-175.5	64.7	179.9	0	0	112.2	R270 L271	E267-R270 VanDerWaalsContact CD-NH2 3.26Å; E267-R270 PolarHBondContact O-N 3.32Å; E267-R270 IonicContact OE1-CZ 2.97Å; E267-R270 IonicContact OE1-NE 2.64Å; E267-R270 IonicContact OE1-NH2 3.55Å; E267-R270 PolarHBondContact OE1-NH2 3.45Å; E267-R270 IonicContact OE2-CZ 3.77Å; E267-R270 VanDerWaalsContact OE2-CZ 3.29Å; E267-R270 IonicContact OE2-NE 3.71Å; E267-R270 PolarHBondContact OE2-NE 2.84Å; E267-R270 IonicContact OE2-NH2 2.77Å; E267-R270 PolarHBondContact OE2-NH2 2.88Å; E267-L271 VanDerWaalsContact O-CB 3.27Å; E267-L271 WeakPolarHBondContact O-CB 3.45Å; E267-L271 PolarHBondContact O-N 3.19Å
268	S	82.2	Confident	80.8	Confident	52 Å²	52	59.4 Å²	59.4	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-63.5	-46.7	176.6	-26.5	0	0	0	0	111	S266 A272 D402	S266-S268 VanDerWaalsContact C-N 3.34Å; S266-S268 PolarHBondContact OG-N 2.81Å; S266-S268 PolarHBondContact OG-OG 3.06Å; S268-A272 WeakPolarHBondContact O-CB 3.4Å; S268-A272 PolarHBondContact O-N 2.86Å; S268-D402 WeakPolarHBondContact CB-OD2 3.47Å; S268-D402 PolarHBondContact OG-OD2 3.38Å
269	T	83.2	Confident	80.9	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.018	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-42.3	176.3	-50.4	0	0	0	0	111	C263 S266 A272 I273 Y280 G399 D402 A403	C263-T269 HydrophobicContact CB-CG2 4.3Å; C263-T269 WeakPolarHBondContact SG-CG2 3.02Å; S266-T269 PolarHBondContact OG-N 3.15Å; T269-A272 PolarHBondContact O-N 3.31Å; T269-I273 HydrophobicContact CG2-CD1 3.93Å; T269-I273 VanDerWaalsContact O-CG1 3.31Å; T269-I273 WeakPolarHBondContact O-CG1 3.36Å; T269-I273 PolarHBondContact O-N 3.11Å; T269-Y280 HydrophobicContact CG2-CE1 3.94Å; T269-G399 WeakPolarHBondContact CB-O 3.5Å; T269-G399 WeakPolarHBondContact CG2-O 3.25Å; T269-G399 PolarHBondContact OG1-O 3.24Å; T269-D402 WeakPolarHBondContact OG1-CB 3.38Å; T269-A403 HydrophobicContact CG2-CB 3.96Å
270	R	86.4	Confident	80.9	Confident	101 Å²	101	64 Å²	64	38%	0.381	34%	0.337	S	S	.	.	H	α-helix	trans	-60.2	-47.7	177.2	-167.3	179.6	75	79.4	4.9	111.6	S266 E267 A272 I273 E274	S266-R270 WeakPolarHBondContact O-CB 3.5Å; S266-R270 PolarHBondContact O-N 2.84Å; E267-R270 VanDerWaalsContact CD-NH2 3.26Å; E267-R270 PolarHBondContact O-N 3.32Å; E267-R270 IonicContact OE1-CZ 2.97Å; E267-R270 IonicContact OE1-NE 2.64Å; E267-R270 IonicContact OE1-NH2 3.55Å; E267-R270 PolarHBondContact OE1-NH2 3.45Å; E267-R270 IonicContact OE2-CZ 3.77Å; E267-R270 VanDerWaalsContact OE2-CZ 3.29Å; E267-R270 IonicContact OE2-NE 3.71Å; E267-R270 PolarHBondContact OE2-NE 2.84Å; E267-R270 IonicContact OE2-NH2 2.77Å; E267-R270 PolarHBondContact OE2-NH2 2.88Å; R270-A272 VanDerWaalsContact C-N 3.34Å; R270-A272 PolarHBondContact O-N 2.82Å; R270-I273 PolarHBondContact O-N 2.93Å; R270-E274 HydrophobicContact CG-CG 4.42Å; R270-E274 WeakPolarHBondContact CG-OE1 3.39Å; R270-E274 IonicContact CZ-OE1 2.73Å; R270-E274 IonicContact CZ-OE2 2.74Å; R270-E274 IonicContact NH1-OE1 3.92Å; R270-E274 PolarHBondContact NH1-OE1 3.18Å; R270-E274 IonicContact NH1-OE2 3.71Å; R270-E274 PolarHBondContact NH1-OE2 2.77Å; R270-E274 WeakPolarHBondContact O-CB 3.44Å; R270-E274 WeakPolarHBondContact O-CG 3.41Å; R270-E274 PolarHBondContact O-N 2.89Å
271	L	85.6	Confident	81.3	Confident	67 Å²	67	65.9 Å²	65.9	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-58.6	-44.1	174.8	-174.1	72.5	0	0	0	111.5	E267 I273 E274 R275	E267-L271 VanDerWaalsContact O-CB 3.27Å; E267-L271 WeakPolarHBondContact O-CB 3.45Å; E267-L271 PolarHBondContact O-N 3.19Å; L271-I273 PolarHBondContact O-N 3.43Å; L271-E274 PolarHBondContact O-N 3.33Å; L271-R275 HydrophobicContact CD1-CB 4.19Å; L271-R275 HydrophobicContact CG-CB 4.48Å; L271-R275 WeakPolarHBondContact O-CB 3.37Å; L271-R275 PolarHBondContact O-N 3.18Å
272	A	84.6	Confident	82	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-41.1	178.7	0	0	0	0	0	112.7	S268 T269 R270 Y276 G277 L278	S268-A272 WeakPolarHBondContact O-CB 3.4Å; S268-A272 PolarHBondContact O-N 2.86Å; T269-A272 PolarHBondContact O-N 3.31Å; R270-A272 VanDerWaalsContact C-N 3.34Å; R270-A272 PolarHBondContact O-N 2.82Å; A272-Y276 CarbonylContact O-C 3.58Å; A272-Y276 PolarHBondContact O-N 3.05Å; A272-G277 PolarHBondContact O-N 2.98Å; A272-L278 HydrophobicContact CB-CB 4.22Å; A272-L278 HydrophobicContact CB-CD2 3.73Å; A272-L278 VanDerWaalsContact O-CB 3.31Å; A272-L278 WeakPolarHBondContact O-CB 3.26Å; A272-L278 PolarHBondContact O-N 2.82Å; A272-L278 VanDerWaalsContact O-N 3.12Å
273	I	87.3	Confident	83.1	Confident	28 Å²	28	56.3 Å²	56.3	14%	0.144	29%	0.289	C	S	.	.	H	α-helix	trans	-67.9	-49.1	176.6	-64.5	165.2	0	0	0	111	C263 T269 R270 L271 G277 L278 Y280	C263-I273 HydrophobicContact CB-CD1 3.86Å; T269-I273 HydrophobicContact CG2-CD1 3.93Å; T269-I273 VanDerWaalsContact O-CG1 3.31Å; T269-I273 WeakPolarHBondContact O-CG1 3.36Å; T269-I273 PolarHBondContact O-N 3.11Å; R270-I273 PolarHBondContact O-N 2.93Å; L271-I273 PolarHBondContact O-N 3.43Å; I273-G277 WeakPolarHBondContact O-CA 3.35Å; I273-G277 PolarHBondContact O-N 3.09Å; I273-L278 WeakPolarHBondContact CA-O 3.2Å; I273-L278 WeakPolarHBondContact CG1-O 3.44Å; I273-Y280 HydrophobicContact CD1-CE1 4.24Å
274	E	86.5	Confident	84.6	Confident	128 Å²	128	54.3 Å²	54.3	60%	0.598	28%	0.276	S	S	*	.	H	α-helix	trans	-74.5	-42.2	-173.6	-71.9	177.4	-164.9	0	0	113.4	R270 L271	R270-E274 HydrophobicContact CG-CG 4.42Å; R270-E274 WeakPolarHBondContact CG-OE1 3.39Å; R270-E274 IonicContact CZ-OE1 2.73Å; R270-E274 IonicContact CZ-OE2 2.74Å; R270-E274 IonicContact NH1-OE1 3.92Å; R270-E274 PolarHBondContact NH1-OE1 3.18Å; R270-E274 IonicContact NH1-OE2 3.71Å; R270-E274 PolarHBondContact NH1-OE2 2.77Å; R270-E274 WeakPolarHBondContact O-CB 3.44Å; R270-E274 WeakPolarHBondContact O-CG 3.41Å; R270-E274 PolarHBondContact O-N 2.89Å; L271-E274 PolarHBondContact O-N 3.33Å
275	R	85.1	Confident	86.1	Confident	170 Å²	170	49.1 Å²	49.1	64%	0.642	24%	0.239	S	C	*	.	H	α-helix	trans	-94.3	-38.6	-170.2	-171.3	177.2	178.5	165	-1.2	113.7	L271	L271-R275 HydrophobicContact CD1-CB 4.19Å; L271-R275 HydrophobicContact CG-CB 4.48Å; L271-R275 WeakPolarHBondContact O-CB 3.37Å; L271-R275 PolarHBondContact O-N 3.18Å
276	Y	85.3	Confident	87.2	Confident	21 Å²	21	45.8 Å²	45.8	8%	0.082	22%	0.216	C	C	.	.	H	α-helix	trans	-108.1	1.6	-175.9	-55.4	-59.7	0	0	0	112.9	A272 L278 P373 H392 E395	A272-Y276 CarbonylContact O-C 3.58Å; A272-Y276 PolarHBondContact O-N 3.05Å; Y276-L278 VanDerWaalsContact C-N 3.29Å; Y276-L278 PolarHBondContact O-N 3.21Å; Y276-P373 WeakPolarHBondContact O-CD 3.48Å; Y276-H392 HydrophobicContact CD1-CB 3.94Å; Y276-H392 AromaticContact CD1-CD2 3.73Å; Y276-H392 AromaticContact CD1-CG 3.77Å; Y276-H392 HydrophobicContact CD2-CB 4.49Å; Y276-H392 HydrophobicContact CE1-CB 3.8Å; Y276-H392 AromaticContact CE1-CD2 3.44Å; Y276-H392 VanDerWaalsContact CE1-CD2 3.44Å; Y276-H392 WeakPolarHBondContact CE1-CD2 3.39Å; Y276-H392 AromaticContact CE1-CE1 3.86Å; Y276-H392 AromaticContact CE1-CG 3.3Å; Y276-H392 AromaticContact CE1-ND1 3.57Å; Y276-H392 AromaticContact CE1-NE2 3.81Å; Y276-H392 HydrophobicContact CE2-CB 4.37Å; Y276-H392 HydrophobicContact CG-CB 4.29Å; Y276-H392 AromaticContact CZ-CG 3.76Å; Y276-H392 AromaticContact CZ-ND1 3.74Å; Y276-E395 HydrophobicContact CD2-CB 3.95Å; Y276-E395 HydrophobicContact CE2-CB 3.42Å; Y276-E395 VanDerWaalsContact CE2-CB 3.42Å; Y276-E395 HydrophobicContact CE2-CG 3.79Å; Y276-E395 VanDerWaalsContact CZ-OE1 3.31Å; Y276-E395 PolarHBondContact OH-OE1 3.15Å
277	G	85.5	Confident	87.3	Confident	30 Å²	30	46 Å²	46	31%	0.309	22%	0.217	S	C	.	.			trans	72	18.8	175.1	0	0	0	0	0	114.4	A272 I273 R279	A272-G277 PolarHBondContact O-N 2.98Å; I273-G277 WeakPolarHBondContact O-CA 3.35Å; I273-G277 PolarHBondContact O-N 3.09Å; G277-R279 PolarHBondContact O-N 3.19Å
278	L	89.5	Confident	86.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.212	C	C	.	.			trans	-59.2	126.9	-179.4	176.8	60.7	0	0	0	110.9	A272 I273 Y276 Y280 I370 L372 I396	A272-L278 HydrophobicContact CB-CB 4.22Å; A272-L278 HydrophobicContact CB-CD2 3.73Å; A272-L278 VanDerWaalsContact O-CB 3.31Å; A272-L278 WeakPolarHBondContact O-CB 3.26Å; A272-L278 PolarHBondContact O-N 2.82Å; A272-L278 VanDerWaalsContact O-N 3.12Å; I273-L278 WeakPolarHBondContact CA-O 3.2Å; I273-L278 WeakPolarHBondContact CG1-O 3.44Å; Y276-L278 VanDerWaalsContact C-N 3.29Å; Y276-L278 PolarHBondContact O-N 3.21Å; L278-Y280 HydrophobicContact CD2-CD1 4.27Å; L278-Y280 HydrophobicContact CG-CD1 4.18Å; L278-I370 HydrophobicContact CD1-CG2 3.71Å; L278-L372 HydrophobicContact CB-CD2 4.26Å; L278-L372 HydrophobicContact CD1-CD2 4.07Å; L278-L372 HydrophobicContact CD1-CG 4.44Å; L278-I396 HydrophobicContact CD1-CG2 4.23Å; L278-I396 HydrophobicContact CD2-CG2 4.47Å
279	R	92.3	Very high	85.8	Confident	131 Å²	131	45.9 Å²	45.9	49%	0.494	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.2	163.8	-62.8	-65	-177.1	153.7	-0.4	109	G277 I370 Q371	G277-R279 PolarHBondContact O-N 3.19Å; R279-I370 CarbonylContact O-C 3.55Å; R279-I370 WeakPolarHBondContact O-CA 3.48Å; R279-Q371 HydrophobicContact CB-CB 4.18Å; R279-Q371 PolarHBondContact N-O 3.02Å; R279-Q371 PolarHBondContact O-N 3.44Å
280	Y	92.8	Very high	84.7	Confident	13 Å²	13	47.1 Å²	47.1	5%	0.051	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	153	177.8	60	-94.5	0	0	0	111.7	F258 T259 S260 T269 I273 L278 N369 L400 A403	F258-Y280 AromaticContact CD2-CD2 3.92Å; F258-Y280 HydrophobicContact CD2-CD2 3.92Å; F258-Y280 AromaticContact CD2-CE2 3.62Å; F258-Y280 HydrophobicContact CD2-CE2 3.62Å; F258-Y280 AromaticContact CE2-CD2 3.7Å; F258-Y280 HydrophobicContact CE2-CD2 3.7Å; F258-Y280 AromaticContact CE2-CE2 3.74Å; F258-Y280 HydrophobicContact CE2-CE2 3.74Å; F258-Y280 HydrophobicContact CZ-CD2 4.49Å; T259-Y280 VanDerWaalsContact C-CE2 3.45Å; T259-Y280 WeakPolarHBondContact CA-O 3.06Å; S260-Y280 VanDerWaalsContact CA-CZ 3.49Å; S260-Y280 VanDerWaalsContact N-CE2 3.3Å; S260-Y280 PolarHBondContact N-O 3.44Å; S260-Y280 PolarHBondContact OG-N 2.89Å; S260-Y280 PolarHBondContact OG-O 3.34Å; T269-Y280 HydrophobicContact CG2-CE1 3.94Å; I273-Y280 HydrophobicContact CD1-CE1 4.24Å; L278-Y280 HydrophobicContact CD2-CD1 4.27Å; L278-Y280 HydrophobicContact CG-CD1 4.18Å; Y280-N369 VanDerWaalsContact CA-O 3.3Å; Y280-N369 WeakPolarHBondContact CA-O 3.47Å; Y280-L400 HydrophobicContact CG-CD1 4.48Å; Y280-A403 HydrophobicContact CE1-CB 4.04Å; Y280-A403 HydrophobicContact CE2-CB 3.98Å; Y280-A403 WeakPolarHBondContact OH-CB 3.5Å
281	E	93.7	Very high	83	Confident	56 Å²	56	45.6 Å²	45.6	26%	0.262	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	126.1	171.1	175.5	-172.7	-146	0	0	107.3	R239 N369	R239-E281 IonicContact CZ-OE1 2.66Å; R239-E281 IonicContact CZ-OE2 3.57Å; R239-E281 IonicContact NH1-OE1 3.05Å; R239-E281 PolarHBondContact NH1-OE1 2.96Å; R239-E281 IonicContact NH1-OE2 3.75Å; R239-E281 PolarHBondContact NH1-OE2 3.22Å; R239-E281 IonicContact NH2-OE1 3.44Å; R239-E281 PolarHBondContact NH2-OE1 2.88Å; R239-E281 IonicContact NH2-OE2 2.64Å; R239-E281 PolarHBondContact NH2-OE2 3.41Å; E281-N369 PolarHBondContact N-O 3.36Å; E281-N369 PolarHBondContact O-N 3.16Å
282	G	92.7	Very high	81.1	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	165.5	-177.1	0	0	0	0	0	114.4	S257 F258 Y367	S257-G282 WeakPolarHBondContact CA-O 3.27Å; F258-G282 PolarHBondContact N-O 3.39Å; F258-G282 PolarHBondContact O-N 3.17Å; G282-Y367 CarbonylContact C-O 3.54Å; G282-Y367 WeakPolarHBondContact CA-O 3.4Å
283	L	93.3	Very high	79.2	Confident	17 Å²	17	51.6 Å²	51.6	9%	0.089	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	118.2	177.2	-57.6	168.1	0	0	0	108.2	M240 I243 L255 I256 V366 Y367	M240-L283 HydrophobicContact SD-CD1 3.9Å; M240-L283 HydrophobicContact SD-CD2 4.02Å; I243-L283 HydrophobicContact CD1-CD1 3.45Å; I243-L283 VanDerWaalsContact CD1-CD1 3.45Å; L255-L283 HydrophobicContact CB-CB 4.42Å; L255-L283 HydrophobicContact CD1-CB 4.1Å; L255-L283 HydrophobicContact CD1-CD1 4.35Å; I256-L283 CarbonylContact O-C 3.55Å; I256-L283 VanDerWaalsContact O-CA 3.3Å; I256-L283 WeakPolarHBondContact O-CA 3.41Å; L283-V366 WeakPolarHBondContact O-CA 3.24Å; L283-Y367 HydrophobicContact CB-CD1 4.46Å; L283-Y367 HydrophobicContact CD1-CD1 4.11Å; L283-Y367 HydrophobicContact CG-CD1 4.13Å; L283-Y367 PolarHBondContact N-O 3.49Å; L283-Y367 PolarHBondContact O-N 3.45Å
284	L	92	Very high	77.1	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.9	-175.1	-56.1	177.5	0	0	0	110	L255 I256 F258 A286 V366 V404 A407 L408	L255-L284 CarbonylContact C-O 3.45Å; L255-L284 WeakPolarHBondContact CA-O 3.44Å; I256-L284 HydrophobicContact CB-CB 4.46Å; I256-L284 PolarHBondContact N-O 3.08Å; I256-L284 PolarHBondContact O-N 3.25Å; F258-L284 HydrophobicContact CD1-CD1 3.82Å; F258-L284 HydrophobicContact CD1-CD2 4.38Å; F258-L284 HydrophobicContact CD1-CG 3.76Å; F258-L284 HydrophobicContact CE1-CD1 3.79Å; F258-L284 HydrophobicContact CE1-CD2 3.68Å; F258-L284 HydrophobicContact CE1-CG 3.57Å; F258-L284 HydrophobicContact CG-CD1 4.46Å; F258-L284 HydrophobicContact CZ-CD1 4.4Å; F258-L284 HydrophobicContact CZ-CD2 4.34Å; F258-L284 HydrophobicContact CZ-CG 4.5Å; L284-A286 PolarHBondContact O-N 3.37Å; L284-V366 HydrophobicContact CD2-CB 4.34Å; L284-V366 HydrophobicContact CD2-CG1 3.76Å; L284-V366 HydrophobicContact CD2-CG2 3.71Å; L284-V404 HydrophobicContact CD1-CG1 4.06Å; L284-V404 HydrophobicContact CD2-CG1 4.45Å; L284-A407 HydrophobicContact CD1-CB 3.84Å; L284-L408 HydrophobicContact CB-CD2 4.24Å; L284-L408 HydrophobicContact CD1-CD2 4.02Å; L284-L408 HydrophobicContact CD1-CG 4Å
285	T	89.2	Confident	75.6	Confident	8 Å²	8	51 Å²	51	5%	0.049	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	132.3	167.9	-57.8	0	0	0	0	109.8	N254 Q289 Y322 L364 Y365	N254-T285 CarbonylContact O-C 3.59Å; N254-T285 WeakPolarHBondContact O-CA 3.28Å; T285-Q289 HydrophobicContact CG2-CB 4.4Å; T285-Y322 PolarHBondContact N-OH 3.31Å; T285-Y322 VanDerWaalsContact O-CE1 3.24Å; T285-Y322 WeakPolarHBondContact O-CE1 3.41Å; T285-Y322 PolarHBondContact O-OH 3.25Å; T285-L364 HydrophobicContact CG2-CD2 3.91Å; T285-Y365 WeakPolarHBondContact CB-O 3.41Å; T285-Y365 PolarHBondContact N-O 2.66Å; T285-Y365 WeakPolarHBondContact OG1-CA 3.3Å; T285-Y365 PolarHBondContact OG1-N 3.01Å; T285-Y365 PolarHBondContact OG1-O 2.71Å
286	A	85.9	Confident	74.5	Confident	6 Å²	6	44.6 Å²	44.6	5%	0.05	28%	0.278	C	S	.	.			trans	-62.2	137.8	179.8	0	0	0	0	0	111.7	N254 I256 L284 N288 Q289	N254-A286 PolarHBondContact O-N 3.48Å; I256-A286 HydrophobicContact CD1-CB 4.07Å; I256-A286 HydrophobicContact CG1-CB 4.19Å; L284-A286 PolarHBondContact O-N 3.37Å; A286-N288 VanDerWaalsContact CB-OD1 3.29Å; A286-N288 WeakPolarHBondContact CB-OD1 3.49Å; A286-N288 PolarHBondContact O-N 2.84Å; A286-N288 VanDerWaalsContact O-N 3.13Å; A286-Q289 PolarHBondContact O-N 2.89Å
287	P	77.1	Confident	73.9	Confident	19 Å²	19	47.2 Å²	47.2	12%	0.123	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-65.1	-20.8	-174.1	25.5	-33.8	0	0	0	113	Q289 V290 V325 I326	P287-Q289 PolarHBondContact O-N 3.12Å; P287-V290 PolarHBondContact O-N 3.17Å; P287-V325 HydrophobicContact CB-CG1 4.46Å; P287-V325 HydrophobicContact CG-CG1 4.23Å; P287-I326 HydrophobicContact CB-CG1 4.14Å
288	N	69.4	Low	73.8	Confident	80 Å²	80	46.4 Å²	46.4	43%	0.428	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-67.5	-8.4	177.8	66.4	4.7	0	0	0	115.1	A286	A286-N288 VanDerWaalsContact CB-OD1 3.29Å; A286-N288 WeakPolarHBondContact CB-OD1 3.49Å; A286-N288 PolarHBondContact O-N 2.84Å; A286-N288 VanDerWaalsContact O-N 3.13Å
289	Q	64.4	Low	73.7	Confident	83 Å²	83	50.1 Å²	50.1	39%	0.388	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-90.1	-6.6	174	-68.1	-60.9	-26.3	0	0	113.6	N254 T285 A286 P287 S291	N254-Q289 HydrophobicContact CB-CG 3.89Å; N254-Q289 VanDerWaalsContact CG-NE2 3.32Å; N254-Q289 PolarHBondContact ND2-NE2 3.43Å; N254-Q289 PolarHBondContact OD1-NE2 3.02Å; T285-Q289 HydrophobicContact CG2-CB 4.4Å; A286-Q289 PolarHBondContact O-N 2.89Å; P287-Q289 PolarHBondContact O-N 3.12Å; Q289-S291 PolarHBondContact O-N 3Å
290	V	59.9	Low	73.6	Confident	29 Å²	29	45.4 Å²	45.4	18%	0.176	29%	0.289	C	S	.	.			trans	-82.9	108.1	178.3	-175.7	0	0	0	0	109.8	P287 P296 I326 L364	P287-V290 PolarHBondContact O-N 3.17Å; V290-P296 HydrophobicContact CG1-CB 4.31Å; V290-P296 HydrophobicContact CG1-CG 3.94Å; V290-P296 HydrophobicContact CG2-CG 4.18Å; V290-I326 HydrophobicContact CB-CD1 4.14Å; V290-I326 HydrophobicContact CG1-CD1 4.23Å; V290-I326 HydrophobicContact CG2-CD1 3.84Å; V290-L364 HydrophobicContact CG2-CD1 4.36Å; V290-L364 HydrophobicContact CG2-CD2 3.69Å; V290-L364 HydrophobicContact CG2-CG 4.13Å
291	S	51.7	Low	73.6	Confident	69 Å²	69	45.3 Å²	45.3	48%	0.483	29%	0.289	S	S	.	.			trans	-69.9	133.4	171.6	-65.1	0	0	0	0	110.2	Q289	Q289-S291 PolarHBondContact O-N 3Å
292	S	44.4	Very low	73.7	Confident	112 Å²	112	42.8 Å²	42.8	78%	0.783	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	144.2	-177.3	49.8	0	0	0	0	112.5
293	G	44.8	Very low	73.7	Confident	81 Å²	81	42.7 Å²	42.7	84%	0.835	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	110	-0.8	173.1	0	0	0	0	0	117.1
294	C	43.5	Very low	73.6	Confident	64 Å²	64	42 Å²	42	43%	0.432	27%	0.273	S	S	.	.	S	Bend	trans	-146.7	134.1	170.3	-91.4	0	0	0	0	111.6	P296	C294-P296 VanDerWaalsContact O-CD 3.31Å; C294-P296 WeakPolarHBondContact O-CD 3.42Å; C294-P296 VanDerWaalsContact O-N 3.16Å
295	S	56	Low	73.5	Confident	81 Å²	81	44.1 Å²	44.1	57%	0.566	28%	0.284	S	S	*	.			trans	-58.7	115.9	168.3	-48.5	0	0	0	0	109.5
296	P	61.2	Low	73.5	Confident	34 Å²	34	46.7 Å²	46.7	22%	0.221	30%	0.298	C	S	.	.			trans	-72.3	143.9	-174.5	29.6	-35.8	0	0	0	110.8	V290 C294 L298 N362 L364	V290-P296 HydrophobicContact CG1-CB 4.31Å; V290-P296 HydrophobicContact CG1-CG 3.94Å; V290-P296 HydrophobicContact CG2-CG 4.18Å; C294-P296 VanDerWaalsContact O-CD 3.31Å; C294-P296 WeakPolarHBondContact O-CD 3.42Å; C294-P296 VanDerWaalsContact O-N 3.16Å; P296-L298 PolarHBondContact O-N 3.02Å; P296-N362 WeakPolarHBondContact CA-O 3.37Å; P296-L364 HydrophobicContact CB-CD1 4.16Å; P296-L364 HydrophobicContact CB-CG 4.02Å; P296-L364 HydrophobicContact CG-CD1 3.57Å; P296-L364 HydrophobicContact CG-CG 3.98Å
297	S	71.9	Confident	73.7	Confident	77 Å²	77	47.1 Å²	47.1	54%	0.538	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.5	178.3	-170.7	0	0	0	0	110.4	K299 N362 S363 L364	S297-K299 PolarHBondContact O-N 2.74Å; S297-N362 PolarHBondContact N-O 3.24Å; S297-S363 CarbonylContact O-C 3.53Å; S297-S363 VanDerWaalsContact O-CA 3.24Å; S297-S363 WeakPolarHBondContact O-CA 3.37Å; S297-S363 WeakPolarHBondContact O-CB 3.43Å; S297-L364 PolarHBondContact O-N 3.46Å
298	L	83.5	Confident	74.4	Confident	12 Å²	12	46.9 Å²	46.9	6%	0.063	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	115.6	177.9	-177.9	67.7	0	0	0	111.4	P296 L300 K315 V318 E319 Y322 L364 V366	P296-L298 PolarHBondContact O-N 3.02Å; L298-L300 HydrophobicContact CD2-CB 4.46Å; L298-L300 HydrophobicContact CG-CB 4.45Å; L298-K315 HydrophobicContact CD2-CG 4.22Å; L298-V318 HydrophobicContact CD1-CG1 4.18Å; L298-V318 HydrophobicContact CD2-CB 4Å; L298-V318 HydrophobicContact CD2-CG1 3.62Å; L298-E319 HydrophobicContact CB-CG 4.06Å; L298-E319 HydrophobicContact CD2-CG 3.52Å; L298-E319 HydrophobicContact CG-CG 4.42Å; L298-Y322 HydrophobicContact CD1-CE2 4.29Å; L298-L364 HydrophobicContact CD1-CB 3.88Å; L298-V366 HydrophobicContact CD1-CB 4.17Å; L298-V366 HydrophobicContact CD1-CG2 3.68Å
299	K	87.5	Confident	75.4	Confident	79 Å²	79	43.5 Å²	43.5	34%	0.343	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	102.2	163.9	-70.1	-159	169.5	-143	0	109.6	E199 S297 L364 Y365 V366	E199-K299 IonicContact OE1-NZ 2.66Å; E199-K299 PolarHBondContact OE1-NZ 3.07Å; S297-K299 PolarHBondContact O-N 2.74Å; K299-L364 PolarHBondContact N-O 3.34Å; K299-Y365 HydrophobicContact CB-CD2 4.38Å; K299-V366 PolarHBondContact O-N 2.66Å
300	L	91.4	Very high	76.5	Confident	32 Å²	32	43 Å²	43	17%	0.168	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	114.7	178	174.9	60.1	0	0	0	110.9	L298 L302 I314 K315 V366 L368	L298-L300 HydrophobicContact CD2-CB 4.46Å; L298-L300 HydrophobicContact CG-CB 4.45Å; L300-L302 HydrophobicContact CD1-CB 4.23Å; L300-L302 HydrophobicContact CD2-CB 4.26Å; L300-L302 HydrophobicContact CG-CB 3.98Å; L300-I314 HydrophobicContact CD2-CG2 4.4Å; L300-K315 HydrophobicContact CD2-CB 3.84Å; L300-K315 HydrophobicContact CD2-CG 4.22Å; L300-V366 HydrophobicContact CD1-CB 4.1Å; L300-V366 HydrophobicContact CD1-CG1 3.61Å; L300-L368 HydrophobicContact CD1-CB 4.4Å
301	N	93.2	Very high	77.9	Confident	11 Å²	11	42.2 Å²	42.2	6%	0.059	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	87	169.2	-76.7	2.8	0	0	0	108.9	Q203 Y365 V366 Y367 L368	Q203-N301 HydrophobicContact CG-CB 4.33Å; Q203-N301 VanDerWaalsContact CG-CG 3.48Å; Q203-N301 VanDerWaalsContact CG-OD1 3.29Å; Q203-N301 WeakPolarHBondContact CG-OD1 3.3Å; Q203-N301 PolarHBondContact NE2-OD1 3.07Å; N301-Y365 HydrophobicContact CB-CE2 4.33Å; N301-Y365 VanDerWaalsContact ND2-CE2 3.34Å; N301-Y365 WeakPolarHBondContact ND2-CE2 3.31Å; N301-Y365 PolarHBondContact ND2-OH 2.75Å; N301-V366 PolarHBondContact N-O 2.81Å; N301-Y367 HydrophobicContact CB-CD2 4.44Å; N301-L368 PolarHBondContact O-N 2.83Å
302	L	94.4	Very high	79.7	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.8	-177.3	175.3	63.1	0	0	0	112	L300 I304 V309 C311 I314 L368 I370	L300-L302 HydrophobicContact CD1-CB 4.23Å; L300-L302 HydrophobicContact CD2-CB 4.26Å; L300-L302 HydrophobicContact CG-CB 3.98Å; L302-I304 HydrophobicContact CD1-CG1 4.11Å; L302-I304 HydrophobicContact CD2-CD1 4.11Å; L302-I304 HydrophobicContact CG-CD1 4.31Å; L302-I304 HydrophobicContact CG-CG1 4.18Å; L302-V309 PolarHBondContact O-N 3.49Å; L302-V309 VanDerWaalsContact O-N 3.07Å; L302-C311 HydrophobicContact CD2-CB 3.58Å; L302-I314 HydrophobicContact CD1-CG2 4.27Å; L302-I314 HydrophobicContact CD2-CB 4.2Å; L302-I314 HydrophobicContact CD2-CD1 4.09Å; L302-I314 HydrophobicContact CD2-CG2 3.97Å; L302-L368 CarbonylContact C-O 3.52Å; L302-L368 WeakPolarHBondContact CA-O 3.47Å; L302-L368 HydrophobicContact CD1-CB 4.25Å; L302-L368 HydrophobicContact CD1-CD2 4.12Å; L302-L368 HydrophobicContact CD1-CG 4.14Å; L302-I370 HydrophobicContact CD1-CD1 3.84Å; L302-I370 HydrophobicContact CD1-CG1 4.19Å
303	F	93.7	Very high	81.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.7	170.6	-74.8	-99.1	0	0	0	110	Q203 H207 R307 L308 Y367 L368 N369 I370	Q203-F303 HydrophobicContact CB-CE2 4.34Å; Q203-F303 HydrophobicContact CB-CZ 4.2Å; Q203-F303 WeakPolarHBondContact O-CZ 3.4Å; H207-F303 HydrophobicContact CB-CD1 4.04Å; H207-F303 HydrophobicContact CB-CD2 4.08Å; H207-F303 HydrophobicContact CB-CE1 3.71Å; H207-F303 HydrophobicContact CB-CE2 3.75Å; H207-F303 HydrophobicContact CB-CG 4.23Å; H207-F303 HydrophobicContact CB-CZ 3.56Å; H207-F303 AromaticContact CD2-CD1 3.49Å; H207-F303 VanDerWaalsContact CD2-CD1 3.49Å; H207-F303 WeakPolarHBondContact CD2-CD1 3.25Å; H207-F303 AromaticContact CD2-CE1 3.71Å; H207-F303 AromaticContact CE1-CD1 3.98Å; H207-F303 AromaticContact CE1-CG 3.91Å; H207-F303 AromaticContact CG-CD1 3.53Å; H207-F303 AromaticContact CG-CE1 3.68Å; H207-F303 AromaticContact CG-CG 3.73Å; H207-F303 AromaticContact ND1-CD1 3.84Å; H207-F303 AromaticContact ND1-CD2 3.98Å; H207-F303 AromaticContact ND1-CG 3.61Å; H207-F303 AromaticContact NE2-CD1 3.79Å; F303-R307 CarbonylContact C-O 3.51Å; F303-R307 VanDerWaalsContact CA-O 3.23Å; F303-R307 WeakPolarHBondContact CA-O 3.23Å; F303-L308 HydrophobicContact CD1-CB 4.35Å; F303-L308 HydrophobicContact CE1-CB 3.81Å; F303-L308 HydrophobicContact CE2-CD1 3.99Å; F303-L308 HydrophobicContact CZ-CB 4Å; F303-L308 HydrophobicContact CZ-CD1 3.98Å; F303-Y367 HydrophobicContact CD2-CE2 4.17Å; F303-L368 PolarHBondContact N-O 3.32Å; F303-N369 WeakPolarHBondContact O-CA 3.43Å; F303-I370 PolarHBondContact O-N 2.83Å
304	I	91.2	Very high	84.1	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.015	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.3	175.7	-60.7	166.6	0	0	0	107.5	L302 N306 R307 V309 I314 I370 L377 V388 F390	L302-I304 HydrophobicContact CD1-CG1 4.11Å; L302-I304 HydrophobicContact CD2-CD1 4.11Å; L302-I304 HydrophobicContact CG-CD1 4.31Å; L302-I304 HydrophobicContact CG-CG1 4.18Å; I304-N306 PolarHBondContact O-N 3.2Å; I304-R307 PolarHBondContact N-O 2.81Å; I304-R307 WeakPolarHBondContact O-CB 3.45Å; I304-R307 PolarHBondContact O-N 2.97Å; I304-V309 HydrophobicContact CB-CG2 4.46Å; I304-V309 HydrophobicContact CD1-CB 4.13Å; I304-V309 HydrophobicContact CD1-CG1 3.97Å; I304-I314 HydrophobicContact CD1-CD1 4.43Å; I304-I370 CarbonylContact C-O 3.6Å; I304-I370 WeakPolarHBondContact CA-O 3.29Å; I304-I370 HydrophobicContact CG1-CB 4.25Å; I304-I370 HydrophobicContact CG1-CD1 4.48Å; I304-L377 HydrophobicContact CG2-CD1 3.96Å; I304-L377 HydrophobicContact CG2-CD2 3.86Å; I304-V388 HydrophobicContact CD1-CG2 3.72Å; I304-F390 HydrophobicContact CD1-CE1 3.86Å; I304-F390 HydrophobicContact CD1-CZ 3.66Å
305	N	89.5	Confident	86.4	Confident	45 Å²	45	36.7 Å²	36.7	24%	0.241	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	47.6	-171.4	-71.8	-12.2	0	0	0	111.9	R307 I370 Q371 L372 L377	N305-R307 PolarHBondContact O-N 3.21Å; N305-R307 VanDerWaalsContact O-N 3.14Å; N305-I370 PolarHBondContact N-O 2.72Å; N305-Q371 VanDerWaalsContact OD1-CA 3.32Å; N305-Q371 WeakPolarHBondContact OD1-CA 3.43Å; N305-L372 PolarHBondContact ND2-O 3.15Å; N305-L372 PolarHBondContact OD1-N 3.16Å; N305-L372 PolarHBondContact OD1-O 3.21Å; N305-L377 HydrophobicContact CB-CD2 4.43Å
306	N	89.6	Confident	88	Confident	62 Å²	62	37.4 Å²	37.4	33%	0.332	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	6.1	-177.5	-43.9	-36.3	0	0	0	116.2	F118 H207 Y208 I304	F118-N306 WeakPolarHBondContact CE1-O 3.47Å; F118-N306 HydrophobicContact CZ-CB 4.02Å; F118-N306 WeakPolarHBondContact CZ-O 3.25Å; H207-N306 WeakPolarHBondContact NE2-CA 3.26Å; H207-N306 WeakPolarHBondContact NE2-CB 3.37Å; Y208-N306 PolarHBondContact OH-O 3.36Å; I304-N306 PolarHBondContact O-N 3.2Å
307	R	88.7	Confident	89.4	Confident	14 Å²	14	36.4 Å²	36.4	5%	0.053	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	133.3	173.8	-173.8	-175.9	-62.2	-78.6	6.5	110.7	E58 T117 F118 F303 I304 N305 V309	E58-R307 IonicContact OE1-NH1 2.74Å; E58-R307 PolarHBondContact OE1-NH1 3.45Å; E58-R307 IonicContact OE2-NH1 3.16Å; E58-R307 PolarHBondContact OE2-NH1 2.85Å; E58-R307 VanDerWaalsContact OE2-NH1 3.13Å; T117-R307 PolarHBondContact O-NH2 3.46Å; F118-R307 HydrophobicContact CD1-CB 4.18Å; F118-R307 HydrophobicContact CD1-CG 4.33Å; F118-R307 HydrophobicContact CE1-CB 3.92Å; F118-R307 PolarHBondContact O-NH1 2.89Å; F118-R307 PolarHBondContact O-NH2 3.38Å; F303-R307 CarbonylContact C-O 3.51Å; F303-R307 VanDerWaalsContact CA-O 3.23Å; F303-R307 WeakPolarHBondContact CA-O 3.23Å; I304-R307 PolarHBondContact N-O 2.81Å; I304-R307 WeakPolarHBondContact O-CB 3.45Å; I304-R307 PolarHBondContact O-N 2.97Å; N305-R307 PolarHBondContact O-N 3.21Å; N305-R307 VanDerWaalsContact O-N 3.14Å; R307-V309 HydrophobicContact CB-CG2 4.2Å; R307-V309 HydrophobicContact CG-CG2 3.95Å; R307-V309 PolarHBondContact O-N 3.28Å
308	L	92	Very high	90.3	Very high	15 Å²	15	32.7 Å²	32.7	8%	0.079	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	121.1	168.5	176.5	66.9	0	0	0	110.1	V200 Q203 Y204 F303	V200-L308 HydrophobicContact CG1-CD2 4.09Å; V200-L308 HydrophobicContact CG2-CD2 4.41Å; Q203-L308 HydrophobicContact CB-CD1 4.06Å; Q203-L308 HydrophobicContact CB-CD2 4.22Å; Q203-L308 HydrophobicContact CG-CD1 4.22Å; Q203-L308 VanDerWaalsContact OE1-CD2 3.29Å; Y204-L308 HydrophobicContact CD2-CD2 4.18Å; Y204-L308 HydrophobicContact CE2-CB 3.84Å; Y204-L308 HydrophobicContact CE2-CD2 3.6Å; Y204-L308 HydrophobicContact CE2-CG 4.38Å; F303-L308 HydrophobicContact CD1-CB 4.35Å; F303-L308 HydrophobicContact CE1-CB 3.81Å; F303-L308 HydrophobicContact CE2-CD1 3.99Å; F303-L308 HydrophobicContact CZ-CB 4Å; F303-L308 HydrophobicContact CZ-CD1 3.98Å
309	V	90.5	Very high	90.5	Very high	8 Å²	8	35.4 Å²	35.4	5%	0.048	18%	0.183	C	C	.	.			trans	-138	140.9	-173.3	174.6	0	0	0	0	111.5	L302 I304 R307 V388	L302-V309 PolarHBondContact O-N 3.49Å; L302-V309 VanDerWaalsContact O-N 3.07Å; I304-V309 HydrophobicContact CB-CG2 4.46Å; I304-V309 HydrophobicContact CD1-CB 4.13Å; I304-V309 HydrophobicContact CD1-CG1 3.97Å; R307-V309 HydrophobicContact CB-CG2 4.2Å; R307-V309 HydrophobicContact CG-CG2 3.95Å; R307-V309 PolarHBondContact O-N 3.28Å; V309-V388 HydrophobicContact CG1-CB 4.45Å; V309-V388 HydrophobicContact CG1-CG1 4.1Å; V309-V388 HydrophobicContact CG1-CG2 3.86Å; V309-V388 HydrophobicContact CG2-CG1 3.82Å
310	S	88.3	Confident	90.5	Very high	74 Å²	74	34 Å²	34	52%	0.517	18%	0.183	S	C	.	.			trans	-89.7	123.1	164.6	-178.1	0	0	0	0	109.6	A386	S310-A386 PolarHBondContact N-O 3.06Å
311	C	89.9	Confident	90.3	Very high	12 Å²	12	32.5 Å²	32.5	8%	0.081	18%	0.175	C	C	.	.			trans	-133.5	112.3	173.6	176.8	0	0	0	0	109.5	L302 I314 K315	L302-C311 HydrophobicContact CD2-CB 3.58Å; C311-I314 HydrophobicContact CB-CB 4.07Å; C311-I314 HydrophobicContact CB-CD1 4.1Å; C311-I314 HydrophobicContact CB-CG1 4.31Å; C311-I314 VanDerWaalsContact SG-CG1 3.55Å; C311-K315 WeakPolarHBondContact O-CB 3.35Å; C311-K315 PolarHBondContact O-N 2.99Å
312	T	88.7	Confident	90	Very high	77 Å²	77	32.1 Å²	32.1	47%	0.472	17%	0.173	S	C	.	.	H	α-helix	trans	-68.3	-42.2	-176.5	-61.3	0	0	0	0	112.9	K315 R316	T312-K315 PolarHBondContact O-N 3.45Å; T312-R316 HydrophobicContact CG2-CG 4.42Å; T312-R316 WeakPolarHBondContact O-CG 3.29Å; T312-R316 PolarHBondContact O-N 3.38Å
313	P	90	Very high	89.4	Confident	48 Å²	48	34.3 Å²	34.3	31%	0.312	19%	0.188	S	C	.	.	H	α-helix	trans	-58.7	-48.9	173	-31	40.9	0	0	0	113.7	K315 R316 I317 E393 V397	P313-K315 VanDerWaalsContact C-N 3.28Å; P313-K315 PolarHBondContact O-N 3.45Å; P313-R316 PolarHBondContact O-N 3.15Å; P313-R316 VanDerWaalsContact O-N 3.11Å; P313-I317 PolarHBondContact O-N 3.33Å; P313-E393 WeakPolarHBondContact CG-OE1 3.3Å; P313-V397 HydrophobicContact CB-CG2 4.31Å
314	I	91.7	Very high	88.7	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-38.9	175.8	-68.3	172.8	0	0	0	111.3	L300 L302 I304 C311 I317 V318 L368 I370 F390 V397 L400	L300-I314 HydrophobicContact CD2-CG2 4.4Å; L302-I314 HydrophobicContact CD1-CG2 4.27Å; L302-I314 HydrophobicContact CD2-CB 4.2Å; L302-I314 HydrophobicContact CD2-CD1 4.09Å; L302-I314 HydrophobicContact CD2-CG2 3.97Å; I304-I314 HydrophobicContact CD1-CD1 4.43Å; C311-I314 HydrophobicContact CB-CB 4.07Å; C311-I314 HydrophobicContact CB-CD1 4.1Å; C311-I314 HydrophobicContact CB-CG1 4.31Å; C311-I314 VanDerWaalsContact SG-CG1 3.55Å; I314-I317 WeakPolarHBondContact O-CG1 3.47Å; I314-V318 WeakPolarHBondContact O-CG2 3.38Å; I314-V318 PolarHBondContact O-N 2.99Å; I314-L368 HydrophobicContact CG2-CD2 4.16Å; I314-I370 HydrophobicContact CD1-CD1 3.76Å; I314-F390 HydrophobicContact CD1-CE2 4.32Å; I314-F390 HydrophobicContact CD1-CZ 3.72Å; I314-V397 HydrophobicContact CG1-CG2 4.19Å; I314-L400 HydrophobicContact CD1-CD2 4.38Å; I314-L400 HydrophobicContact CG1-CD2 4.17Å; I314-L400 HydrophobicContact CG2-CD2 4.01Å
315	K	91.5	Very high	88.1	Confident	83 Å²	83	35.9 Å²	35.9	36%	0.361	20%	0.199	S	C	.	.	H	α-helix	trans	-62.8	-47.1	174.2	-174.4	177.7	166.3	176.7	0	112.1	L298 L300 C311 T312 P313 I317 V318 E319	L298-K315 HydrophobicContact CD2-CG 4.22Å; L300-K315 HydrophobicContact CD2-CB 3.84Å; L300-K315 HydrophobicContact CD2-CG 4.22Å; C311-K315 WeakPolarHBondContact O-CB 3.35Å; C311-K315 PolarHBondContact O-N 2.99Å; T312-K315 PolarHBondContact O-N 3.45Å; P313-K315 VanDerWaalsContact C-N 3.28Å; P313-K315 PolarHBondContact O-N 3.45Å; K315-I317 PolarHBondContact O-N 3.36Å; K315-V318 PolarHBondContact O-N 3.05Å; K315-E319 WeakPolarHBondContact CE-OE1 3.48Å; K315-E319 IonicContact NZ-OE1 2.71Å; K315-E319 WeakPolarHBondContact O-CG 3.4Å; K315-E319 PolarHBondContact O-N 3.04Å
316	R	89.8	Confident	87.4	Confident	96 Å²	96	35.9 Å²	35.9	36%	0.362	20%	0.198	S	C	.	.	H	α-helix	trans	-60	-43.1	-179	-74.7	174.2	-179.4	176.1	3.2	112.3	T312 P313 V318 E319 C320 S593	T312-R316 HydrophobicContact CG2-CG 4.42Å; T312-R316 WeakPolarHBondContact O-CG 3.29Å; T312-R316 PolarHBondContact O-N 3.38Å; P313-R316 PolarHBondContact O-N 3.15Å; P313-R316 VanDerWaalsContact O-N 3.11Å; R316-V318 VanDerWaalsContact C-N 3.34Å; R316-V318 PolarHBondContact O-N 3.35Å; R316-E319 PolarHBondContact O-N 3.47Å; R316-C320 WeakPolarHBondContact O-CB 3.26Å; R316-C320 PolarHBondContact O-N 3.14Å; R316-C320 PolarHBondContact O-SG 3.33Å; R316-C320 VanDerWaalsContact O-SG 3.39Å; R316-S593 PolarHBondContact NH1-OG 3.41Å
317	I	90.3	Very high	86.4	Confident	13 Å²	13	36 Å²	36	7%	0.067	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-34.9	178.8	59.3	163.9	0	0	0	112.8	P313 I314 K315 C320 A321 V397 L400 Q401	P313-I317 PolarHBondContact O-N 3.33Å; I314-I317 WeakPolarHBondContact O-CG1 3.47Å; K315-I317 PolarHBondContact O-N 3.36Å; I317-C320 PolarHBondContact O-N 3.31Å; I317-A321 WeakPolarHBondContact O-CB 3.48Å; I317-A321 PolarHBondContact O-N 2.81Å; I317-V397 HydrophobicContact CD1-CG1 3.98Å; I317-V397 VanDerWaalsContact CD1-O 3.26Å; I317-V397 WeakPolarHBondContact CD1-O 3.46Å; I317-V397 HydrophobicContact CG1-CG1 4.38Å; I317-V397 HydrophobicContact CG2-CG1 3.49Å; I317-V397 VanDerWaalsContact CG2-CG1 3.49Å; I317-L400 HydrophobicContact CD1-CB 4.08Å; I317-L400 HydrophobicContact CD1-CD2 3.98Å; I317-L400 HydrophobicContact CD1-CG 3.92Å; I317-Q401 HydrophobicContact CB-CB 3.94Å; I317-Q401 HydrophobicContact CB-CG 4.04Å; I317-Q401 HydrophobicContact CD1-CB 4.04Å; I317-Q401 HydrophobicContact CG2-CB 4.19Å; I317-Q401 HydrophobicContact CG2-CG 4.41Å; I317-Q401 VanDerWaalsContact CG2-OE1 3.25Å
318	V	90.1	Very high	85.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.9	-43.3	176.9	175	0	0	0	0	109.9	L298 I314 K315 R316 C320 A321 Y322 V366 V404	L298-V318 HydrophobicContact CD1-CG1 4.18Å; L298-V318 HydrophobicContact CD2-CB 4Å; L298-V318 HydrophobicContact CD2-CG1 3.62Å; I314-V318 WeakPolarHBondContact O-CG2 3.38Å; I314-V318 PolarHBondContact O-N 2.99Å; K315-V318 PolarHBondContact O-N 3.05Å; R316-V318 VanDerWaalsContact C-N 3.34Å; R316-V318 PolarHBondContact O-N 3.35Å; V318-C320 VanDerWaalsContact C-N 3.33Å; V318-C320 PolarHBondContact O-N 3.32Å; V318-A321 PolarHBondContact O-N 3Å; V318-Y322 HydrophobicContact CG1-CD2 3.89Å; V318-Y322 HydrophobicContact CG1-CE2 3.86Å; V318-Y322 VanDerWaalsContact O-CD2 3.31Å; V318-Y322 WeakPolarHBondContact O-CD2 3.35Å; V318-Y322 PolarHBondContact O-N 3.22Å; V318-V366 HydrophobicContact CG1-CG2 4Å; V318-V404 HydrophobicContact CG2-CG2 4.45Å
319	E	88.5	Confident	83.1	Confident	69 Å²	69	41.7 Å²	41.7	32%	0.322	24%	0.235	S	C	.	.	H	α-helix	trans	-60	-41.6	173.3	-67.5	177.8	155.4	0	0	111.6	L298 K315 R316 S323	L298-E319 HydrophobicContact CB-CG 4.06Å; L298-E319 HydrophobicContact CD2-CG 3.52Å; L298-E319 HydrophobicContact CG-CG 4.42Å; K315-E319 WeakPolarHBondContact CE-OE1 3.48Å; K315-E319 IonicContact NZ-OE1 2.71Å; K315-E319 WeakPolarHBondContact O-CG 3.4Å; K315-E319 PolarHBondContact O-N 3.04Å; R316-E319 PolarHBondContact O-N 3.47Å; E319-S323 WeakPolarHBondContact O-CB 3.39Å; E319-S323 PolarHBondContact O-N 2.62Å
320	C	87.3	Confident	80.8	Confident	49 Å²	49	47 Å²	47	33%	0.331	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-43.6	174.2	-75.1	0	0	0	0	113.2	R316 I317 V318 S323 S324	R316-C320 WeakPolarHBondContact O-CB 3.26Å; R316-C320 PolarHBondContact O-N 3.14Å; R316-C320 PolarHBondContact O-SG 3.33Å; R316-C320 VanDerWaalsContact O-SG 3.39Å; I317-C320 PolarHBondContact O-N 3.31Å; V318-C320 VanDerWaalsContact C-N 3.33Å; V318-C320 PolarHBondContact O-N 3.32Å; C320-S323 WeakPolarHBondContact O-CB 3.37Å; C320-S323 PolarHBondContact O-N 2.95Å; C320-S324 WeakPolarHBondContact O-CB 3.31Å; C320-S324 PolarHBondContact O-N 3.46Å
321	A	87.1	Confident	78.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.3	-40.7	179.1	0	0	0	0	0	111.9	I317 V318 S324 V325 V404 E405 L408	I317-A321 WeakPolarHBondContact O-CB 3.48Å; I317-A321 PolarHBondContact O-N 2.81Å; V318-A321 PolarHBondContact O-N 3Å; A321-S324 WeakPolarHBondContact O-CB 3.33Å; A321-S324 PolarHBondContact O-N 3.02Å; A321-V325 PolarHBondContact O-N 3.23Å; A321-V325 VanDerWaalsContact O-N 3.1Å; A321-V404 HydrophobicContact CB-CB 4.34Å; A321-V404 HydrophobicContact CB-CG1 3.75Å; A321-E405 HydrophobicContact CB-CB 4.36Å; A321-L408 HydrophobicContact CB-CD1 4.25Å
322	Y	86.5	Confident	75.9	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-46.7	169.9	-87	-72.1	0	0	0	112.1	T285 L298 V318 S324 V325 I326 L364 V366 L408	T285-Y322 PolarHBondContact N-OH 3.31Å; T285-Y322 VanDerWaalsContact O-CE1 3.24Å; T285-Y322 WeakPolarHBondContact O-CE1 3.41Å; T285-Y322 PolarHBondContact O-OH 3.25Å; L298-Y322 HydrophobicContact CD1-CE2 4.29Å; V318-Y322 HydrophobicContact CG1-CD2 3.89Å; V318-Y322 HydrophobicContact CG1-CE2 3.86Å; V318-Y322 VanDerWaalsContact O-CD2 3.31Å; V318-Y322 WeakPolarHBondContact O-CD2 3.35Å; V318-Y322 PolarHBondContact O-N 3.22Å; Y322-S324 VanDerWaalsContact C-N 3.29Å; Y322-S324 PolarHBondContact O-N 2.85Å; Y322-V325 PolarHBondContact O-N 2.81Å; Y322-I326 HydrophobicContact CD1-CD1 4.31Å; Y322-I326 VanDerWaalsContact O-CB 3.3Å; Y322-I326 WeakPolarHBondContact O-CB 3.47Å; Y322-I326 WeakPolarHBondContact O-CD1 3.21Å; Y322-I326 WeakPolarHBondContact O-CG1 3.27Å; Y322-I326 PolarHBondContact O-N 2.84Å; Y322-L364 HydrophobicContact CD1-CD1 3.56Å; Y322-L364 HydrophobicContact CD1-CD2 4.14Å; Y322-L364 HydrophobicContact CD2-CD1 3.81Å; Y322-L364 HydrophobicContact CE1-CD1 3.82Å; Y322-L364 HydrophobicContact CE1-CD2 3.65Å; Y322-L364 HydrophobicContact CE1-CG 4.33Å; Y322-L364 HydrophobicContact CE2-CD1 4.06Å; Y322-L364 HydrophobicContact CG-CD1 3.55Å; Y322-V366 HydrophobicContact CE2-CG2 3.73Å; Y322-L408 HydrophobicContact CD1-CD1 3.93Å; Y322-L408 HydrophobicContact CD1-CD2 4.11Å; Y322-L408 HydrophobicContact CD2-CD1 4.27Å; Y322-L408 HydrophobicContact CE1-CD1 4.1Å; Y322-L408 HydrophobicContact CE1-CD2 3.54Å; Y322-L408 HydrophobicContact CE2-CD1 4.43Å; Y322-L408 HydrophobicContact CG-CD1 4.02Å
323	S	81.7	Confident	73.2	Confident	47 Å²	47	52.1 Å²	52.1	33%	0.329	29%	0.294	S	S	.	.	H	α-helix	trans	-59.8	-41.2	178.2	-160.4	0	0	0	0	111.8	E319 C320 S327	E319-S323 WeakPolarHBondContact O-CB 3.39Å; E319-S323 PolarHBondContact O-N 2.62Å; C320-S323 WeakPolarHBondContact O-CB 3.37Å; C320-S323 PolarHBondContact O-N 2.95Å; S323-S327 VanDerWaalsContact O-CB 3.29Å; S323-S327 WeakPolarHBondContact O-CB 3.37Å; S323-S327 PolarHBondContact O-N 2.97Å; S323-S327 PolarHBondContact O-OG 3.48Å
324	S	80.6	Confident	70.3	Confident	28 Å²	28	54.2 Å²	54.2	20%	0.196	31%	0.31	C	S	.	.	H	α-helix	trans	-58.2	-53.5	176.4	-176.3	0	0	0	0	111.8	C320 A321 Y322 R328 E405	C320-S324 WeakPolarHBondContact O-CB 3.31Å; C320-S324 PolarHBondContact O-N 3.46Å; A321-S324 WeakPolarHBondContact O-CB 3.33Å; A321-S324 PolarHBondContact O-N 3.02Å; Y322-S324 VanDerWaalsContact C-N 3.29Å; Y322-S324 PolarHBondContact O-N 2.85Å; S324-R328 WeakPolarHBondContact O-CG 3.33Å; S324-R328 PolarHBondContact O-N 3.19Å; S324-R328 VanDerWaalsContact O-N 3.09Å; S324-R328 PolarHBondContact OG-NH2 3.2Å; S324-E405 VanDerWaalsContact CB-OE2 3.25Å; S324-E405 WeakPolarHBondContact CB-OE2 3.29Å; S324-E405 PolarHBondContact OG-OE2 3.33Å
325	V	77.6	Confident	67.3	Low	8 Å²	8	60.3 Å²	60.3	5%	0.048	35%	0.347	C	S	.	.	H	α-helix	trans	-72.5	-38.4	-177.2	178.3	0	0	0	0	112.6	P287 A321 Y322 R328 G329 E405 L408 L409	P287-V325 HydrophobicContact CB-CG1 4.46Å; P287-V325 HydrophobicContact CG-CG1 4.23Å; A321-V325 PolarHBondContact O-N 3.23Å; A321-V325 VanDerWaalsContact O-N 3.1Å; Y322-V325 PolarHBondContact O-N 2.81Å; V325-R328 PolarHBondContact O-N 3.4Å; V325-G329 PolarHBondContact O-N 3.02Å; V325-E405 HydrophobicContact CG2-CG 4.02Å; V325-L408 HydrophobicContact CB-CB 4.23Å; V325-L408 HydrophobicContact CG1-CB 4.22Å; V325-L408 HydrophobicContact CG2-CB 3.78Å; V325-L409 HydrophobicContact CG1-CD2 4.32Å; V325-L409 HydrophobicContact CG2-CD2 3.82Å; V325-L409 HydrophobicContact CG2-CG 3.86Å
326	I	74.9	Confident	64.2	Low	45 Å²	45	63.5 Å²	63.5	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-65.9	-39.7	177.4	-66.5	164.6	0	0	0	110.7	P287 V290 Y322 L330	P287-I326 HydrophobicContact CB-CG1 4.14Å; V290-I326 HydrophobicContact CB-CD1 4.14Å; V290-I326 HydrophobicContact CG1-CD1 4.23Å; V290-I326 HydrophobicContact CG2-CD1 3.84Å; Y322-I326 HydrophobicContact CD1-CD1 4.31Å; Y322-I326 VanDerWaalsContact O-CB 3.3Å; Y322-I326 WeakPolarHBondContact O-CB 3.47Å; Y322-I326 WeakPolarHBondContact O-CD1 3.21Å; Y322-I326 WeakPolarHBondContact O-CG1 3.27Å; Y322-I326 PolarHBondContact O-N 2.84Å; I326-L330 PolarHBondContact O-N 2.7Å
327	S	68.9	Low	61.2	Low	65 Å²	65	66.3 Å²	66.3	46%	0.455	39%	0.385	S	S	.	.	H	α-helix	trans	-63.7	-46.5	173.4	-68.9	0	0	0	0	112.1	S323 G329 L330 S331	S323-S327 VanDerWaalsContact O-CB 3.29Å; S323-S327 WeakPolarHBondContact O-CB 3.37Å; S323-S327 PolarHBondContact O-N 2.97Å; S323-S327 PolarHBondContact O-OG 3.48Å; S327-G329 VanDerWaalsContact C-N 3.32Å; S327-G329 PolarHBondContact O-N 3.05Å; S327-L330 WeakPolarHBondContact O-CB 3.49Å; S327-L330 PolarHBondContact O-N 2.94Å; S327-L330 VanDerWaalsContact O-N 3.09Å; S327-S331 PolarHBondContact O-N 3.4Å; S327-S331 PolarHBondContact O-OG 2.89Å
328	R	61.1	Low	58.1	Low	113 Å²	113	74.2 Å²	74.2	43%	0.426	42%	0.422	S	S	.	.	H	α-helix	trans	-61.4	-37.9	178.3	-70.1	176.3	-160.7	164.7	12.1	112.7	S324 V325 L330 S331 S332 E405	S324-R328 WeakPolarHBondContact O-CG 3.33Å; S324-R328 PolarHBondContact O-N 3.19Å; S324-R328 VanDerWaalsContact O-N 3.09Å; S324-R328 PolarHBondContact OG-NH2 3.2Å; V325-R328 PolarHBondContact O-N 3.4Å; R328-L330 PolarHBondContact O-N 2.71Å; R328-S331 PolarHBondContact O-N 3.43Å; R328-S332 PolarHBondContact O-N 3.22Å; R328-E405 IonicContact CZ-OE1 3.98Å; R328-E405 IonicContact NH1-OE1 2.7Å; R328-E405 PolarHBondContact NH1-OE1 2.97Å; R328-E405 IonicContact NH2-OE1 2.76Å; R328-E405 PolarHBondContact NH2-OE1 3.24Å; R328-E405 IonicContact NH2-OE2 2.69Å; R328-E405 PolarHBondContact NH2-OE2 3.24Å
329	G	50.8	Low	55	Low	35 Å²	35	78.6 Å²	78.6	36%	0.361	46%	0.458	S	S	.	.	H	α-helix	trans	-68.8	-12.2	176.2	0	0	0	0	0	115.1	V325 S327	V325-G329 PolarHBondContact O-N 3.02Å; S327-G329 VanDerWaalsContact C-N 3.32Å; S327-G329 PolarHBondContact O-N 3.05Å
330	L	42.5	Very low	52	Low	119 Å²	119	81 Å²	81	62%	0.623	48%	0.477	S	S	*	.	H	α-helix	trans	-90.1	-30.5	167.9	-67	165.4	0	0	0	111.4	I326 S327 R328	I326-L330 PolarHBondContact O-N 2.7Å; S327-L330 WeakPolarHBondContact O-CB 3.49Å; S327-L330 PolarHBondContact O-N 2.94Å; S327-L330 VanDerWaalsContact O-N 3.09Å; R328-L330 PolarHBondContact O-N 2.71Å
331	S	36.7	Very low	49.1	Very low	86 Å²	86	87.2 Å²	87.2	60%	0.601	51%	0.506	S	S	*	.	H	α-helix	trans	-75.2	-25.1	176.6	-51.9	0	0	0	0	114.1	S327 R328 N333	S327-S331 PolarHBondContact O-N 3.4Å; S327-S331 PolarHBondContact O-OG 2.89Å; R328-S331 PolarHBondContact O-N 3.43Å; S331-N333 VanDerWaalsContact C-N 3.32Å; S331-N333 PolarHBondContact O-N 3.01Å
332	S	38.6	Very low	46.2	Very low	81 Å²	81	90.5 Å²	90.5	57%	0.566	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.7	-178	59.6	0	0	0	0	115.1	R328	R328-S332 PolarHBondContact O-N 3.22Å
333	N	31.9	Very low	43.4	Very low	104 Å²	104	97.9 Å²	97.9	56%	0.556	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	17.4	-169.3	-60.4	8.4	0	0	0	112.4	S331 T335	S331-N333 VanDerWaalsContact C-N 3.32Å; S331-N333 PolarHBondContact O-N 3.01Å; N333-T335 PolarHBondContact O-N 2.84Å
334	S	28.2	Very low	40.7	Very low	93 Å²	93	103.8 Å²	103.8	65%	0.65	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	21.1	-174	61.2	0	0	0	0	114.9
335	T	28.7	Very low	38.1	Very low	128 Å²	128	111.7 Å²	111.7	79%	0.785	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.8	7.8	175.4	48	0	0	0	0	113.5	N333	N333-T335 PolarHBondContact O-N 2.84Å
336	D	26.1	Very low	35.7	Very low	150 Å²	150	119.4 Å²	119.4	80%	0.802	65%	0.65	S	S	*	*			trans	-122.8	95	169	-90	-51.2	0	0	0	109.4
337	H	27.4	Very low	33.2	Very low	156 Å²	156	127.2 Å²	127.2	72%	0.722	68%	0.682	S	S	*	*			trans	-78.4	147.6	175.9	-106.3	-107.1	0	0	0	111.6
338	Q	24.9	Very low	31.3	Very low	179 Å²	179	130.8 Å²	130.8	84%	0.836	70%	0.695	S	S	*	*			trans	65.6	68.6	166.7	-51.2	-171.8	47.8	0	0	119.3
339	A	24.9	Very low	29.6	Very low	91 Å²	91	130 Å²	130	75%	0.752	71%	0.706	S	S	*	*			trans	-137.2	124	166.6	0	0	0	0	0	116
340	V	26.5	Very low	28.3	Very low	120 Å²	120	135.1 Å²	135.1	73%	0.727	73%	0.73	S	S	*	*			trans	58.1	60.6	157.5	-154.9	0	0	0	0	119.1	T342	V340-T342 PolarHBondContact O-N 3.38Å
341	L	26.3	Very low	27.6	Very low	179 Å²	179	136.7 Å²	136.7	94%	0.937	74%	0.74	S	S	*	*			trans	-90.9	73.7	152.5	-83.9	171.6	0	0	0	111.3
342	T	25.9	Very low	27.1	Very low	70 Å²	70	137.1 Å²	137.1	43%	0.429	74%	0.743	S	S	.	*			trans	-115.4	122.1	176.8	60	0	0	0	0	113	V340 K344 F428	V340-T342 PolarHBondContact O-N 3.38Å; T342-K344 PolarHBondContact O-N 3.08Å; T342-F428 HydrophobicContact CG2-CZ 4.4Å
343	N	26.9	Very low	26.5	Very low	158 Å²	158	138.5 Å²	138.5	85%	0.845	74%	0.744	S	S	*	*			trans	-73.7	85.3	-173.9	-85.7	-70.8	0	0	0	113.2	K345	N343-K345 VanDerWaalsContact C-N 3.27Å; N343-K345 PolarHBondContact O-N 3.46Å
344	K	25.9	Very low	26.5	Very low	172 Å²	172	138.8 Å²	138.8	75%	0.748	74%	0.744	S	S	*	*			trans	-71	80.1	165.2	-86.1	-175.9	176.5	171.7	0	111.5	T342 F346	T342-K344 PolarHBondContact O-N 3.08Å; K344-F346 VanDerWaalsContact C-N 3.3Å; K344-F346 PolarHBondContact O-N 3.1Å
345	K	24.9	Very low	26.8	Very low	194 Å²	194	138.9 Å²	138.9	84%	0.843	74%	0.735	S	S	*	*			trans	-63.7	89.1	162.2	-81.1	-173	175.3	178.8	0	109.9	N343 K347	N343-K345 VanDerWaalsContact C-N 3.27Å; N343-K345 PolarHBondContact O-N 3.46Å; K345-K347 PolarHBondContact O-N 3.44Å
346	F	28.1	Very low	27.2	Very low	170 Å²	170	135.7 Å²	135.7	75%	0.746	71%	0.71	S	S	*	*			trans	-63.7	115.6	168.8	-102.7	-85.4	0	0	0	110	K344 I348	K344-F346 VanDerWaalsContact C-N 3.3Å; K344-F346 PolarHBondContact O-N 3.1Å; F346-I348 PolarHBondContact O-N 3.07Å
347	K	22.3	Very low	27.3	Very low	209 Å²	209	136 Å²	136	91%	0.909	70%	0.704	S	S	*	*			trans	-67.5	98.4	161.6	-78.2	-175.1	175.1	-178.7	0	108	K345	K345-K347 PolarHBondContact O-N 3.44Å
348	I	28	Very low	27.5	Very low	140 Å²	140	134.5 Å²	134.5	72%	0.718	71%	0.711	S	S	*	*			trans	-77.7	123	165.5	-61.8	179.5	0	0	0	107.1	F346	F346-I348 PolarHBondContact O-N 3.07Å
349	S	27.1	Very low	27.9	Very low	96 Å²	96	130.5 Å²	130.5	67%	0.671	70%	0.702	S	S	*	*			trans	-70.8	147.6	178.4	46.2	0	0	0	0	111.4	N351	S349-N351 PolarHBondContact O-N 2.7Å
350	T	23.5	Very low	28.4	Very low	142 Å²	142	128.6 Å²	128.6	87%	0.871	68%	0.682	S	S	*	*			trans	-68.3	100.6	174.8	47.5	0	0	0	0	110.5
351	N	26.8	Very low	29	Very low	152 Å²	152	130 Å²	130	81%	0.813	68%	0.678	S	S	*	*			trans	-136.4	134	157.8	-97.3	-36.7	0	0	0	109	S349	S349-N351 PolarHBondContact O-N 2.7Å
352	S	26	Very low	30.1	Very low	96 Å²	96	124.5 Å²	124.5	67%	0.671	65%	0.65	S	S	*	*			trans	-72.6	163.2	-171.9	50.6	0	0	0	0	113.5
353	N	26.6	Very low	32	Very low	110 Å²	110	123.1 Å²	123.1	59%	0.588	64%	0.643	S	S	*	*			trans	103.7	150	167	-50.7	-12.9	0	0	0	115.9
354	I	32.2	Very low	34.7	Very low	109 Å²	109	116 Å²	116	56%	0.559	61%	0.605	S	S	*	*			trans	74.6	106.8	179.7	-50.2	168.4	0	0	0	115.1	Y356 K357	I354-Y356 HydrophobicContact CG2-CD2 4.38Å; I354-Y356 PolarHBondContact O-N 3.37Å; I354-K357 PolarHBondContact O-N 2.72Å
355	M	33.7	Very low	37.8	Very low	95 Å²	95	108.1 Å²	108.1	47%	0.468	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	15.1	-178.3	-162	169	65	0	0	114.9	S195 Q229	S195-M355 WeakPolarHBondContact OG-CE 3.35Å; Q229-M355 PolarHBondContact NE2-SD 2.66Å
356	Y	36.2	Very low	41	Very low	62 Å²	62	98.9 Å²	98.9	24%	0.243	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-8.1	174.3	-77.8	-92.2	0	0	0	113.9	I247 I354	I247-Y356 HydrophobicContact CG2-CD1 4.43Å; I354-Y356 HydrophobicContact CG2-CD2 4.38Å; I354-Y356 PolarHBondContact O-N 3.37Å
357	K	29.9	Very low	44.2	Very low	156 Å²	156	90.9 Å²	90.9	68%	0.678	50%	0.495	S	S	*	.	S	Bend	trans	-93.6	7.3	-169.5	-83.6	-173.8	173.8	179.4	0	117.5	I354 T360	I354-K357 PolarHBondContact O-N 2.72Å; K357-T360 WeakPolarHBondContact CA-OG1 3.16Å; K357-T360 PolarHBondContact O-OG1 3.22Å
358	S	30.5	Very low	47.7	Very low	124 Å²	124	81 Å²	81	87%	0.867	45%	0.452	S	S	*	.	S	Bend	trans	-112.5	15.6	-173.4	-162.1	0	0	0	0	115.7
359	S	32.9	Very low	50.9	Low	95 Å²	95	74.8 Å²	74.8	66%	0.664	42%	0.42	S	S	*	.	S	Bend	trans	-146.3	17.8	-179.3	-174.1	0	0	0	0	112.9	F361	S359-F361 VanDerWaalsContact C-N 3.34Å; S359-F361 PolarHBondContact O-N 3.43Å
360	T	35.6	Very low	54	Low	52 Å²	52	70.2 Å²	70.2	32%	0.319	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	19.7	-137.8	-17.5	0	0	0	0	116.6	K357	K357-T360 WeakPolarHBondContact CA-OG1 3.16Å; K357-T360 PolarHBondContact O-OG1 3.22Å
361	F	39.3	Very low	57.3	Low	149 Å²	149	68 Å²	68	65%	0.654	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.7	0.6	-175.8	-73.2	-73.5	0	0	0	115.2	S359	S359-F361 VanDerWaalsContact C-N 3.34Å; S359-F361 PolarHBondContact O-N 3.43Å
362	N	50.5	Low	60.2	Low	63 Å²	63	61.2 Å²	61.2	34%	0.337	33%	0.332	S	S	.	.	S	Bend	trans	-143.2	34.1	-177.1	-93.5	-20.6	0	0	0	113.9	P296 S297	P296-N362 WeakPolarHBondContact CA-O 3.37Å; S297-N362 PolarHBondContact N-O 3.24Å
363	S	65.7	Low	63.1	Low	41 Å²	41	58.3 Å²	58.3	29%	0.287	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.1	173.2	61	0	0	0	0	111.4	S297	S297-S363 CarbonylContact O-C 3.53Å; S297-S363 VanDerWaalsContact O-CA 3.24Å; S297-S363 WeakPolarHBondContact O-CA 3.37Å; S297-S363 WeakPolarHBondContact O-CB 3.43Å
364	L	84	Confident	65.7	Low	8 Å²	8	55.9 Å²	55.9	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	135.9	174	-72.7	168.6	0	0	0	109.7	T285 V290 P296 S297 L298 K299 Y322	T285-L364 HydrophobicContact CG2-CD2 3.91Å; V290-L364 HydrophobicContact CG2-CD1 4.36Å; V290-L364 HydrophobicContact CG2-CD2 3.69Å; V290-L364 HydrophobicContact CG2-CG 4.13Å; P296-L364 HydrophobicContact CB-CD1 4.16Å; P296-L364 HydrophobicContact CB-CG 4.02Å; P296-L364 HydrophobicContact CG-CD1 3.57Å; P296-L364 HydrophobicContact CG-CG 3.98Å; S297-L364 PolarHBondContact O-N 3.46Å; L298-L364 HydrophobicContact CD1-CB 3.88Å; K299-L364 PolarHBondContact N-O 3.34Å; Y322-L364 HydrophobicContact CD1-CD1 3.56Å; Y322-L364 HydrophobicContact CD1-CD2 4.14Å; Y322-L364 HydrophobicContact CD2-CD1 3.81Å; Y322-L364 HydrophobicContact CE1-CD1 3.82Å; Y322-L364 HydrophobicContact CE1-CD2 3.65Å; Y322-L364 HydrophobicContact CE1-CG 4.33Å; Y322-L364 HydrophobicContact CE2-CD1 4.06Å; Y322-L364 HydrophobicContact CG-CD1 3.55Å
365	Y	89.6	Confident	68	Low	7 Å²	7	58 Å²	58	3%	0.027	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	133.1	169.4	178.7	-103.1	0	0	0	110.6	I243 I247 I251 L255 T285 K299 N301	I243-Y365 HydrophobicContact CD1-CE1 4.02Å; I243-Y365 HydrophobicContact CG1-CE1 4.36Å; I247-Y365 HydrophobicContact CD1-CD2 3.81Å; I247-Y365 HydrophobicContact CD1-CE1 4.05Å; I247-Y365 HydrophobicContact CD1-CE2 3.27Å; I247-Y365 HydrophobicContact CD1-CG 4.39Å; I247-Y365 VanDerWaalsContact CD1-CZ 3.4Å; I251-Y365 HydrophobicContact CG2-CD1 3.96Å; I251-Y365 HydrophobicContact CG2-CG 4.08Å; L255-Y365 HydrophobicContact CD1-CD1 4.39Å; L255-Y365 HydrophobicContact CD1-CE1 4.47Å; L255-Y365 HydrophobicContact CD2-CD1 4.07Å; T285-Y365 WeakPolarHBondContact CB-O 3.41Å; T285-Y365 PolarHBondContact N-O 2.66Å; T285-Y365 WeakPolarHBondContact OG1-CA 3.3Å; T285-Y365 PolarHBondContact OG1-N 3.01Å; T285-Y365 PolarHBondContact OG1-O 2.71Å; K299-Y365 HydrophobicContact CB-CD2 4.38Å; N301-Y365 HydrophobicContact CB-CE2 4.33Å; N301-Y365 VanDerWaalsContact ND2-CE2 3.34Å; N301-Y365 WeakPolarHBondContact ND2-CE2 3.31Å; N301-Y365 PolarHBondContact ND2-OH 2.75Å
366	V	93	Very high	70.4	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.2	170.8	169.6	0	0	0	0	109.4	L283 L284 L298 K299 L300 N301 V318 Y322 L368	L283-V366 WeakPolarHBondContact O-CA 3.24Å; L284-V366 HydrophobicContact CD2-CB 4.34Å; L284-V366 HydrophobicContact CD2-CG1 3.76Å; L284-V366 HydrophobicContact CD2-CG2 3.71Å; L298-V366 HydrophobicContact CD1-CB 4.17Å; L298-V366 HydrophobicContact CD1-CG2 3.68Å; K299-V366 PolarHBondContact O-N 2.66Å; L300-V366 HydrophobicContact CD1-CB 4.1Å; L300-V366 HydrophobicContact CD1-CG1 3.61Å; N301-V366 PolarHBondContact N-O 2.81Å; V318-V366 HydrophobicContact CG1-CG2 4Å; Y322-V366 HydrophobicContact CE2-CG2 3.73Å; V366-L368 HydrophobicContact CG1-CB 4.37Å
367	Y	95.2	Very high	72.7	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.1	160.6	165.6	-90.9	0	0	0	108.4	I206 H207 R239 G282 L283 N301 F303 N369	I206-Y367 HydrophobicContact CG2-CD2 4.09Å; I206-Y367 HydrophobicContact CG2-CE2 4.3Å; H207-Y367 HydrophobicContact CB-CE2 4.21Å; H207-Y367 AromaticContact ND1-CE2 3.91Å; H207-Y367 AromaticContact ND1-CZ 3.84Å; H207-Y367 PolarHBondContact ND1-OH 2.74Å; R239-Y367 WeakPolarHBondContact CD-OH 3.43Å; G282-Y367 CarbonylContact C-O 3.54Å; G282-Y367 WeakPolarHBondContact CA-O 3.4Å; L283-Y367 HydrophobicContact CB-CD1 4.46Å; L283-Y367 HydrophobicContact CD1-CD1 4.11Å; L283-Y367 HydrophobicContact CG-CD1 4.13Å; L283-Y367 PolarHBondContact N-O 3.49Å; L283-Y367 PolarHBondContact O-N 3.45Å; N301-Y367 HydrophobicContact CB-CD2 4.44Å; F303-Y367 HydrophobicContact CD2-CE2 4.17Å; Y367-N369 HydrophobicContact CE1-CB 4.11Å
368	L	95.1	Very high	75.2	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	124.3	176.5	-178.5	58.6	0	0	0	110.1	F258 L300 N301 L302 F303 I314 V366 I370 L400	F258-L368 HydrophobicContact CE1-CD1 4.43Å; F258-L368 HydrophobicContact CZ-CD1 3.9Å; L300-L368 HydrophobicContact CD1-CB 4.4Å; N301-L368 PolarHBondContact O-N 2.83Å; L302-L368 CarbonylContact C-O 3.52Å; L302-L368 WeakPolarHBondContact CA-O 3.47Å; L302-L368 HydrophobicContact CD1-CB 4.25Å; L302-L368 HydrophobicContact CD1-CD2 4.12Å; L302-L368 HydrophobicContact CD1-CG 4.14Å; F303-L368 PolarHBondContact N-O 3.32Å; I314-L368 HydrophobicContact CG2-CD2 4.16Å; V366-L368 HydrophobicContact CG1-CB 4.37Å; L368-I370 HydrophobicContact CD1-CG1 4.42Å; L368-I370 HydrophobicContact CD2-CD1 4.07Å; L368-I370 HydrophobicContact CD2-CG1 4.24Å; L368-I370 HydrophobicContact CG-CD1 4.35Å; L368-I370 HydrophobicContact CG-CG1 3.98Å; L368-L400 HydrophobicContact CD1-CD1 4.41Å; L368-L400 HydrophobicContact CD2-CD1 4.05Å; L368-L400 HydrophobicContact CD2-CD2 3.89Å; L368-L400 HydrophobicContact CD2-CG 4.47Å
369	N	95.2	Very high	77.5	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.053	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.6	173.3	178.8	34.1	0	0	0	109	H207 Y280 E281 F303 Y367	H207-N369 PolarHBondContact CE1-OD1 2.64Å; Y280-N369 VanDerWaalsContact CA-O 3.3Å; Y280-N369 WeakPolarHBondContact CA-O 3.47Å; E281-N369 PolarHBondContact N-O 3.36Å; E281-N369 PolarHBondContact O-N 3.16Å; F303-N369 WeakPolarHBondContact O-CA 3.43Å; Y367-N369 HydrophobicContact CE1-CB 4.11Å
370	I	93.1	Very high	79.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.4	179.2	-57.8	-179.5	0	0	0	108.5	L278 R279 L302 F303 I304 N305 I314 L368 L372 L400	L278-I370 HydrophobicContact CD1-CG2 3.71Å; R279-I370 CarbonylContact O-C 3.55Å; R279-I370 WeakPolarHBondContact O-CA 3.48Å; L302-I370 HydrophobicContact CD1-CD1 3.84Å; L302-I370 HydrophobicContact CD1-CG1 4.19Å; F303-I370 PolarHBondContact O-N 2.83Å; I304-I370 CarbonylContact C-O 3.6Å; I304-I370 WeakPolarHBondContact CA-O 3.29Å; I304-I370 HydrophobicContact CG1-CB 4.25Å; I304-I370 HydrophobicContact CG1-CD1 4.48Å; N305-I370 PolarHBondContact N-O 2.72Å; I314-I370 HydrophobicContact CD1-CD1 3.76Å; L368-I370 HydrophobicContact CD1-CG1 4.42Å; L368-I370 HydrophobicContact CD2-CD1 4.07Å; L368-I370 HydrophobicContact CD2-CG1 4.24Å; L368-I370 HydrophobicContact CG-CD1 4.35Å; L368-I370 HydrophobicContact CG-CG1 3.98Å; I370-L372 HydrophobicContact CG2-CD1 4Å; I370-L372 HydrophobicContact CG2-CG 3.92Å; I370-L400 HydrophobicContact CD1-CD2 3.8Å
371	Q	91.5	Very high	81.7	Confident	96 Å²	96	42.8 Å²	42.8	45%	0.449	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.6	167	-64.1	174.3	-17.8	0	0	108.8	R279 N305	R279-Q371 HydrophobicContact CB-CB 4.18Å; R279-Q371 PolarHBondContact N-O 3.02Å; R279-Q371 PolarHBondContact O-N 3.44Å; N305-Q371 VanDerWaalsContact OD1-CA 3.32Å; N305-Q371 WeakPolarHBondContact OD1-CA 3.43Å
372	L	89.3	Confident	83.4	Confident	9 Å²	9	38.5 Å²	38.5	5%	0.047	21%	0.205	C	C	.	.			trans	-137.1	149.6	-179.5	-79.3	167.1	0	0	0	109.7	L278 N305 I370 V374 F390 I396	L278-L372 HydrophobicContact CB-CD2 4.26Å; L278-L372 HydrophobicContact CD1-CD2 4.07Å; L278-L372 HydrophobicContact CD1-CG 4.44Å; N305-L372 PolarHBondContact ND2-O 3.15Å; N305-L372 PolarHBondContact OD1-N 3.16Å; N305-L372 PolarHBondContact OD1-O 3.21Å; I370-L372 HydrophobicContact CG2-CD1 4Å; I370-L372 HydrophobicContact CG2-CG 3.92Å; L372-V374 PolarHBondContact O-N 2.93Å; L372-F390 HydrophobicContact CD1-CD1 3.7Å; L372-F390 HydrophobicContact CD1-CE1 3.88Å; L372-I396 HydrophobicContact CD1-CD1 4.24Å; L372-I396 HydrophobicContact CD1-CG2 4.4Å; L372-I396 HydrophobicContact CD2-CD1 3.87Å; L372-I396 HydrophobicContact CD2-CG1 4.41Å
373	P	86.1	Confident	84.6	Confident	36 Å²	36	37.1 Å²	37.1	23%	0.234	20%	0.2	C	C	.	.			trans	-55	135	172.8	-22.6	33	0	0	0	111.5	Y276 H375 T376	Y276-P373 WeakPolarHBondContact O-CD 3.48Å; P373-H375 WeakPolarHBondContact CB-CE1 3.41Å; P373-H375 PolarHBondContact O-N 3.07Å; P373-T376 PolarHBondContact O-N 3.33Å; P373-T376 PolarHBondContact O-OG1 3.01Å
374	V	81.5	Confident	85	Confident	58 Å²	58	36 Å²	36	35%	0.352	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-58.6	-26.2	-175.6	-175.8	0	0	0	0	112.5	S113 L372 T376 L377	S113-V374 WeakPolarHBondContact O-CG1 3.48Å; L372-V374 PolarHBondContact O-N 2.93Å; V374-T376 VanDerWaalsContact C-N 3.34Å; V374-T376 PolarHBondContact O-N 3.02Å; V374-L377 PolarHBondContact O-N 3.05Å
375	H	80.9	Confident	84.6	Confident	155 Å²	155	36 Å²	36	72%	0.718	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-77.6	-9.1	177.6	63.9	-104.6	0	0	0	115.1	P373	P373-H375 WeakPolarHBondContact CB-CE1 3.41Å; P373-H375 PolarHBondContact O-N 3.07Å
376	T	83.3	Confident	84	Confident	8 Å²	8	37.1 Å²	37.1	5%	0.049	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-100.1	6.6	172.7	62.2	0	0	0	0	113.1	P373 V374 F390 L391	P373-T376 PolarHBondContact O-N 3.33Å; P373-T376 PolarHBondContact O-OG1 3.01Å; V374-T376 VanDerWaalsContact C-N 3.34Å; V374-T376 PolarHBondContact O-N 3.02Å; T376-F390 WeakPolarHBondContact O-CA 3.37Å; T376-L391 PolarHBondContact O-N 3.31Å
377	L	84.2	Confident	83.5	Confident	18 Å²	18	41.4 Å²	41.4	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	113.9	-171.1	-172.5	73.1	0	0	0	111.8	I304 N305 V374 V379 V388 F390	I304-L377 HydrophobicContact CG2-CD1 3.96Å; I304-L377 HydrophobicContact CG2-CD2 3.86Å; N305-L377 HydrophobicContact CB-CD2 4.43Å; V374-L377 PolarHBondContact O-N 3.05Å; L377-V379 HydrophobicContact CD2-CG2 3.7Å; L377-V379 HydrophobicContact CG-CG2 3.87Å; L377-V388 HydrophobicContact CD1-CB 3.83Å; L377-V388 HydrophobicContact CD1-CG2 3.61Å; L377-V388 HydrophobicContact CG-CB 4.45Å; L377-F390 HydrophobicContact CD1-CD1 3.86Å; L377-F390 HydrophobicContact CD1-CE1 4Å
378	D	82.5	Confident	82.9	Confident	79 Å²	79	41.9 Å²	41.9	42%	0.422	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	114.9	166.3	-173.6	10.6	0	0	0	110.4	N380 V381 V388 N389	D378-N380 WeakPolarHBondContact OD1-CA 3.28Å; D378-N380 VanDerWaalsContact OD1-CB 3.25Å; D378-N380 WeakPolarHBondContact OD1-CB 3.17Å; D378-N380 PolarHBondContact OD1-N 3.02Å; D378-V381 HydrophobicContact CB-CG2 4.3Å; D378-V381 WeakPolarHBondContact O-CG2 3.37Å; D378-V388 VanDerWaalsContact O-CA 3.3Å; D378-V388 WeakPolarHBondContact O-CA 3.46Å; D378-V388 WeakPolarHBondContact O-CB 3.47Å; D378-N389 HydrophobicContact CB-CB 4.41Å; D378-N389 PolarHBondContact N-O 3.34Å; D378-N389 PolarHBondContact O-N 3.28Å
379	V	78.5	Confident	82.4	Confident	29 Å²	29	45.9 Å²	45.9	18%	0.176	25%	0.245	C	C	.	.			trans	-97.3	-6	178.1	-173.3	0	0	0	0	111.5	F120 L377	F120-V379 HydrophobicContact CE1-CG1 4.36Å; L377-V379 HydrophobicContact CD2-CG2 3.7Å; L377-V379 HydrophobicContact CG-CG2 3.87Å
380	N	77.9	Confident	81.8	Confident	77 Å²	77	46.4 Å²	46.4	41%	0.412	25%	0.247	S	C	.	.			trans	-90.5	3.2	-172.6	-164	41.9	0	0	0	114	F120 R121 D378 H382	F120-N380 HydrophobicContact CZ-CB 4.41Å; R121-N380 PolarHBondContact NE-OD1 3.49Å; R121-N380 VanDerWaalsContact NE-OD1 3.17Å; R121-N380 PolarHBondContact NH2-O 3.44Å; R121-N380 PolarHBondContact NH2-OD1 3.45Å; D378-N380 WeakPolarHBondContact OD1-CA 3.28Å; D378-N380 VanDerWaalsContact OD1-CB 3.25Å; D378-N380 WeakPolarHBondContact OD1-CB 3.17Å; D378-N380 PolarHBondContact OD1-N 3.02Å; N380-H382 PolarHBondContact O-N 3.27Å
381	V	79.3	Confident	81.1	Confident	52 Å²	52	51.1 Å²	51.1	32%	0.315	27%	0.272	S	S	.	.	S	Bend	trans	-56	-51.8	-172.5	-174.9	0	0	0	0	113.6	D378 N389	D378-V381 HydrophobicContact CB-CG2 4.3Å; D378-V381 WeakPolarHBondContact O-CG2 3.37Å; V381-N389 HydrophobicContact CG2-CB 3.99Å
382	H	75.8	Confident	80.9	Confident	59 Å²	59	50.1 Å²	50.1	27%	0.273	27%	0.267	S	S	.	.	S	Bend	trans	-126.5	139.1	-172.5	-168.4	-100.2	0	0	0	112.6	N380 T384 K385 E387	N380-H382 PolarHBondContact O-N 3.27Å; H382-T384 PolarHBondContact CE1-OG1 2.99Å; H382-T384 PolarHBondContact ND1-N 3.09Å; H382-T384 PolarHBondContact ND1-OG1 3.18Å; H382-T384 PolarHBondContact O-N 3.21Å; H382-K385 PolarHBondContact O-N 3.04Å; H382-E387 HydrophobicContact CB-CB 4.43Å
383	P	74.5	Confident	80.8	Confident	35 Å²	35	52.5 Å²	52.5	23%	0.227	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.5	-176.5	-28.5	36	0	0	0	116.1	V45 K385	V45-P383 HydrophobicContact CG2-CB 4.12Å; P383-K385 VanDerWaalsContact C-N 3.33Å
384	T	75	Confident	80.9	Confident	16 Å²	16	56.6 Å²	56.6	10%	0.098	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	0.2	177.9	66.5	0	0	0	0	114.2	N51 K54 H382 A386	N51-T384 WeakPolarHBondContact ND2-CG2 3.34Å; K54-T384 PolarHBondContact NZ-O 3.38Å; K54-T384 VanDerWaalsContact NZ-O 3.14Å; H382-T384 PolarHBondContact CE1-OG1 2.99Å; H382-T384 PolarHBondContact ND1-N 3.09Å; H382-T384 PolarHBondContact ND1-OG1 3.18Å; H382-T384 PolarHBondContact O-N 3.21Å; T384-A386 PolarHBondContact O-N 3.04Å; T384-A386 WeakPolarHBondContact OG1-CB 3.36Å
385	K	74.8	Confident	81.2	Confident	10 Å²	10	56.9 Å²	56.9	4%	0.043	30%	0.295	C	S	.	.	S	Bend	trans	50.9	43.6	-177.8	-57.4	-178.8	-94	75.1	0	112	K54 E55 E58 F118 F120 H382 P383	K54-K385 PolarHBondContact NZ-O 3.4Å; E55-K385 IonicContact OE1-NZ 3.59Å; E55-K385 PolarHBondContact OE1-NZ 3.33Å; E55-K385 IonicContact OE2-NZ 2.74Å; E55-K385 PolarHBondContact OE2-NZ 3.31Å; E58-K385 IonicContact OE2-NZ 2.71Å; E58-K385 PolarHBondContact OE2-NZ 3.42Å; F118-K385 WeakPolarHBondContact O-CD 3.29Å; F118-K385 WeakPolarHBondContact O-CE 3.48Å; F120-K385 HydrophobicContact CD1-CD 4.48Å; F120-K385 HydrophobicContact CE1-CD 4.12Å; H382-K385 PolarHBondContact O-N 3.04Å; P383-K385 VanDerWaalsContact C-N 3.33Å
386	A	76.7	Confident	81.6	Confident	30 Å²	30	49.5 Å²	49.5	25%	0.248	26%	0.261	C	S	.	.			trans	-105.6	-12.3	-176.8	0	0	0	0	0	113.2	S310 T384	S310-A386 PolarHBondContact N-O 3.06Å; T384-A386 PolarHBondContact O-N 3.04Å; T384-A386 WeakPolarHBondContact OG1-CB 3.36Å
387	E	82.5	Confident	82	Confident	91 Å²	91	49.7 Å²	49.7	43%	0.425	26%	0.262	S	S	.	.			trans	-131.1	151.2	-179.7	-64.6	176.6	162.3	0	0	108	H382	H382-E387 HydrophobicContact CB-CB 4.43Å
388	V	83.6	Confident	82.2	Confident	11 Å²	11	52.6 Å²	52.6	7%	0.067	28%	0.278	C	S	.	.			trans	-141.3	149.6	176.1	-55.9	0	0	0	0	108.4	I304 V309 L377 D378 F390	I304-V388 HydrophobicContact CD1-CG2 3.72Å; V309-V388 HydrophobicContact CG1-CB 4.45Å; V309-V388 HydrophobicContact CG1-CG1 4.1Å; V309-V388 HydrophobicContact CG1-CG2 3.86Å; V309-V388 HydrophobicContact CG2-CG1 3.82Å; L377-V388 HydrophobicContact CD1-CB 3.83Å; L377-V388 HydrophobicContact CD1-CG2 3.61Å; L377-V388 HydrophobicContact CG-CB 4.45Å; D378-V388 VanDerWaalsContact O-CA 3.3Å; D378-V388 WeakPolarHBondContact O-CA 3.46Å; D378-V388 WeakPolarHBondContact O-CB 3.47Å; V388-F390 HydrophobicContact CG2-CE1 4.14Å; V388-F390 HydrophobicContact CG2-CZ 3.98Å
389	N	84.2	Confident	82.4	Confident	84 Å²	84	48.9 Å²	48.9	45%	0.449	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145.8	174.1	-66	-10.8	0	0	0	109.4	D378 V381	D378-N389 HydrophobicContact CB-CB 4.41Å; D378-N389 PolarHBondContact N-O 3.34Å; D378-N389 PolarHBondContact O-N 3.28Å; V381-N389 HydrophobicContact CG2-CB 3.99Å
390	F	81.6	Confident	83	Confident	21 Å²	21	47.5 Å²	47.5	9%	0.092	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	142.3	179.5	-43.7	-92.6	0	0	0	111	I304 I314 L372 T376 L377 V388 E393 I396	I304-F390 HydrophobicContact CD1-CE1 3.86Å; I304-F390 HydrophobicContact CD1-CZ 3.66Å; I314-F390 HydrophobicContact CD1-CE2 4.32Å; I314-F390 HydrophobicContact CD1-CZ 3.72Å; L372-F390 HydrophobicContact CD1-CD1 3.7Å; L372-F390 HydrophobicContact CD1-CE1 3.88Å; T376-F390 WeakPolarHBondContact O-CA 3.37Å; L377-F390 HydrophobicContact CD1-CD1 3.86Å; L377-F390 HydrophobicContact CD1-CE1 4Å; V388-F390 HydrophobicContact CG2-CE1 4.14Å; V388-F390 HydrophobicContact CG2-CZ 3.98Å; F390-E393 HydrophobicContact CB-CB 3.98Å; F390-E393 HydrophobicContact CB-CG 4.49Å; F390-E393 HydrophobicContact CD2-CB 4.14Å; F390-E393 HydrophobicContact CD2-CG 3.71Å; F390-E393 HydrophobicContact CE2-CG 4.42Å; F390-E393 HydrophobicContact CG-CG 4.49Å; F390-I396 HydrophobicContact CB-CD1 4.48Å
391	L	80.4	Confident	83.6	Confident	100 Å²	100	46.5 Å²	46.5	52%	0.524	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	130.5	155.2	-165.7	71.9	0	0	0	107.2	T376	T376-L391 PolarHBondContact O-N 3.31Å
392	H	85.9	Confident	84.1	Confident	74 Å²	74	46.3 Å²	46.3	34%	0.343	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	43.8	-172	-54.6	-76.4	0	0	0	114	Y276 D394 E395 I396	Y276-H392 HydrophobicContact CD1-CB 3.94Å; Y276-H392 AromaticContact CD1-CD2 3.73Å; Y276-H392 AromaticContact CD1-CG 3.77Å; Y276-H392 HydrophobicContact CD2-CB 4.49Å; Y276-H392 HydrophobicContact CE1-CB 3.8Å; Y276-H392 AromaticContact CE1-CD2 3.44Å; Y276-H392 VanDerWaalsContact CE1-CD2 3.44Å; Y276-H392 WeakPolarHBondContact CE1-CD2 3.39Å; Y276-H392 AromaticContact CE1-CE1 3.86Å; Y276-H392 AromaticContact CE1-CG 3.3Å; Y276-H392 AromaticContact CE1-ND1 3.57Å; Y276-H392 AromaticContact CE1-NE2 3.81Å; Y276-H392 HydrophobicContact CE2-CB 4.37Å; Y276-H392 HydrophobicContact CG-CB 4.29Å; Y276-H392 AromaticContact CZ-CG 3.76Å; Y276-H392 AromaticContact CZ-ND1 3.74Å; H392-D394 PolarHBondContact O-N 3.47Å; H392-E395 VanDerWaalsContact CA-OE2 3.26Å; H392-E395 WeakPolarHBondContact CA-OE2 3.13Å; H392-E395 WeakPolarHBondContact CB-OE2 3.42Å; H392-E395 IonicContact CE1-OE1 3.19Å; H392-E395 IonicContact CG-OE1 3.85Å; H392-E395 IonicContact CG-OE2 3.19Å; H392-E395 IonicContact ND1-OE1 2.68Å; H392-E395 PolarHBondContact ND1-OE1 3.33Å; H392-E395 IonicContact ND1-OE2 3.26Å; H392-E395 PolarHBondContact O-N 2.93Å; H392-I396 WeakPolarHBondContact O-CB 3.48Å; H392-I396 WeakPolarHBondContact O-CD1 3.37Å; H392-I396 VanDerWaalsContact O-CG1 3.28Å; H392-I396 WeakPolarHBondContact O-CG1 3.11Å; H392-I396 PolarHBondContact O-N 3.48Å; H392-I396 VanDerWaalsContact O-N 3.08Å
393	E	87.4	Confident	84.7	Confident	60 Å²	60	43.9 Å²	43.9	28%	0.28	23%	0.23	S	C	.	.	H	α-helix	trans	-55.3	-51.3	179.5	-176.4	161.7	-160.3	0	0	112.2	P313 F390 E395 I396 V397	P313-E393 WeakPolarHBondContact CG-OE1 3.3Å; F390-E393 HydrophobicContact CB-CB 3.98Å; F390-E393 HydrophobicContact CB-CG 4.49Å; F390-E393 HydrophobicContact CD2-CB 4.14Å; F390-E393 HydrophobicContact CD2-CG 3.71Å; F390-E393 HydrophobicContact CE2-CG 4.42Å; F390-E393 HydrophobicContact CG-CG 4.49Å; E393-E395 PolarHBondContact O-N 3.13Å; E393-I396 PolarHBondContact O-N 2.85Å; E393-V397 HydrophobicContact CG-CG2 3.88Å; E393-V397 WeakPolarHBondContact O-CB 3.45Å; E393-V397 WeakPolarHBondContact O-CG2 3.47Å; E393-V397 PolarHBondContact O-N 3.48Å
394	D	88.8	Confident	85.5	Confident	121 Å²	121	42.2 Å²	42.2	65%	0.647	22%	0.219	S	C	*	.	H	α-helix	trans	-60.3	-43.1	-177.7	-69.9	-48.2	0	0	0	112	H392 N398	H392-D394 PolarHBondContact O-N 3.47Å; D394-N398 VanDerWaalsContact O-CB 3.29Å; D394-N398 WeakPolarHBondContact O-CB 3.49Å; D394-N398 VanDerWaalsContact O-CG 3.25Å; D394-N398 PolarHBondContact O-N 2.9Å; D394-N398 PolarHBondContact O-ND2 2.87Å
395	E	88.3	Confident	86.1	Confident	64 Å²	64	43 Å²	43	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-68.4	-38.7	179.2	-55.9	104.6	114.6	0	0	112.7	Y276 H392 E393 G399	Y276-E395 HydrophobicContact CD2-CB 3.95Å; Y276-E395 HydrophobicContact CE2-CB 3.42Å; Y276-E395 VanDerWaalsContact CE2-CB 3.42Å; Y276-E395 HydrophobicContact CE2-CG 3.79Å; Y276-E395 VanDerWaalsContact CZ-OE1 3.31Å; Y276-E395 PolarHBondContact OH-OE1 3.15Å; H392-E395 VanDerWaalsContact CA-OE2 3.26Å; H392-E395 WeakPolarHBondContact CA-OE2 3.13Å; H392-E395 WeakPolarHBondContact CB-OE2 3.42Å; H392-E395 IonicContact CE1-OE1 3.19Å; H392-E395 IonicContact CG-OE1 3.85Å; H392-E395 IonicContact CG-OE2 3.19Å; H392-E395 IonicContact ND1-OE1 2.68Å; H392-E395 PolarHBondContact ND1-OE1 3.33Å; H392-E395 IonicContact ND1-OE2 3.26Å; H392-E395 PolarHBondContact O-N 2.93Å; E393-E395 PolarHBondContact O-N 3.13Å; E395-G399 PolarHBondContact O-N 2.85Å
396	I	88.7	Confident	86.7	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-43.5	176.7	-69.6	166.7	0	0	0	110.7	L278 L372 F390 H392 E393 L400	L278-I396 HydrophobicContact CD1-CG2 4.23Å; L278-I396 HydrophobicContact CD2-CG2 4.47Å; L372-I396 HydrophobicContact CD1-CD1 4.24Å; L372-I396 HydrophobicContact CD1-CG2 4.4Å; L372-I396 HydrophobicContact CD2-CD1 3.87Å; L372-I396 HydrophobicContact CD2-CG1 4.41Å; F390-I396 HydrophobicContact CB-CD1 4.48Å; H392-I396 WeakPolarHBondContact O-CB 3.48Å; H392-I396 WeakPolarHBondContact O-CD1 3.37Å; H392-I396 VanDerWaalsContact O-CG1 3.28Å; H392-I396 WeakPolarHBondContact O-CG1 3.11Å; H392-I396 PolarHBondContact O-N 3.48Å; H392-I396 VanDerWaalsContact O-N 3.08Å; E393-I396 PolarHBondContact O-N 2.85Å; I396-L400 VanDerWaalsContact O-CB 3.29Å; I396-L400 WeakPolarHBondContact O-CB 3.34Å; I396-L400 PolarHBondContact O-N 3.34Å
397	V	90.9	Very high	87.2	Confident	11 Å²	11	45.7 Å²	45.7	7%	0.067	23%	0.231	C	C	.	.	H	α-helix	trans	-66.8	-47.1	179.8	166.7	0	0	0	0	110.7	P313 I314 I317 E393 L400 Q401	P313-V397 HydrophobicContact CB-CG2 4.31Å; I314-V397 HydrophobicContact CG1-CG2 4.19Å; I317-V397 HydrophobicContact CD1-CG1 3.98Å; I317-V397 VanDerWaalsContact CD1-O 3.26Å; I317-V397 WeakPolarHBondContact CD1-O 3.46Å; I317-V397 HydrophobicContact CG1-CG1 4.38Å; I317-V397 HydrophobicContact CG2-CG1 3.49Å; I317-V397 VanDerWaalsContact CG2-CG1 3.49Å; E393-V397 HydrophobicContact CG-CG2 3.88Å; E393-V397 WeakPolarHBondContact O-CB 3.45Å; E393-V397 WeakPolarHBondContact O-CG2 3.47Å; E393-V397 PolarHBondContact O-N 3.48Å; V397-L400 PolarHBondContact O-N 3.49Å; V397-Q401 PolarHBondContact O-N 2.89Å
398	N	88.8	Confident	87.4	Confident	80 Å²	80	41.3 Å²	41.3	43%	0.428	21%	0.21	S	C	.	.	H	α-helix	trans	-63.8	-44.5	176.6	-72.2	-51.6	0	0	0	111.9	D394 L400 Q401 D402	D394-N398 VanDerWaalsContact O-CB 3.29Å; D394-N398 WeakPolarHBondContact O-CB 3.49Å; D394-N398 VanDerWaalsContact O-CG 3.25Å; D394-N398 PolarHBondContact O-N 2.9Å; D394-N398 PolarHBondContact O-ND2 2.87Å; N398-L400 PolarHBondContact O-N 2.83Å; N398-Q401 PolarHBondContact O-N 3.08Å; N398-Q401 VanDerWaalsContact O-N 3.14Å; N398-D402 PolarHBondContact O-N 3.11Å
399	G	87.4	Confident	87.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-31.3	176.1	0	0	0	0	0	113.7	T269 E395	T269-G399 WeakPolarHBondContact CB-O 3.5Å; T269-G399 WeakPolarHBondContact CG2-O 3.25Å; T269-G399 PolarHBondContact OG1-O 3.24Å; E395-G399 PolarHBondContact O-N 2.85Å
400	L	90.9	Very high	87.2	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-77.4	-35.4	173.3	177.1	62.7	0	0	0	112.9	Y280 I314 I317 L368 I370 I396 V397 N398 A403 V404	Y280-L400 HydrophobicContact CG-CD1 4.48Å; I314-L400 HydrophobicContact CD1-CD2 4.38Å; I314-L400 HydrophobicContact CG1-CD2 4.17Å; I314-L400 HydrophobicContact CG2-CD2 4.01Å; I317-L400 HydrophobicContact CD1-CB 4.08Å; I317-L400 HydrophobicContact CD1-CD2 3.98Å; I317-L400 HydrophobicContact CD1-CG 3.92Å; L368-L400 HydrophobicContact CD1-CD1 4.41Å; L368-L400 HydrophobicContact CD2-CD1 4.05Å; L368-L400 HydrophobicContact CD2-CD2 3.89Å; L368-L400 HydrophobicContact CD2-CG 4.47Å; I370-L400 HydrophobicContact CD1-CD2 3.8Å; I396-L400 VanDerWaalsContact O-CB 3.29Å; I396-L400 WeakPolarHBondContact O-CB 3.34Å; I396-L400 PolarHBondContact O-N 3.34Å; V397-L400 PolarHBondContact O-N 3.49Å; N398-L400 PolarHBondContact O-N 2.83Å; L400-A403 PolarHBondContact O-N 3.47Å; L400-V404 HydrophobicContact CD1-CG2 4.32Å; L400-V404 WeakPolarHBondContact O-CG2 3.44Å; L400-V404 PolarHBondContact O-N 2.94Å
401	Q	90.7	Very high	86.8	Confident	56 Å²	56	41.1 Å²	41.1	26%	0.262	22%	0.216	S	C	.	.	H	α-helix	trans	-59.8	-49.4	176.8	-177.9	178	-45.1	0	0	110.8	I317 V397 N398 A403 V404 E405	I317-Q401 HydrophobicContact CB-CB 3.94Å; I317-Q401 HydrophobicContact CB-CG 4.04Å; I317-Q401 HydrophobicContact CD1-CB 4.04Å; I317-Q401 HydrophobicContact CG2-CB 4.19Å; I317-Q401 HydrophobicContact CG2-CG 4.41Å; I317-Q401 VanDerWaalsContact CG2-OE1 3.25Å; V397-Q401 PolarHBondContact O-N 2.89Å; N398-Q401 PolarHBondContact O-N 3.08Å; N398-Q401 VanDerWaalsContact O-N 3.14Å; Q401-A403 VanDerWaalsContact C-N 3.3Å; Q401-A403 PolarHBondContact O-N 3.32Å; Q401-V404 PolarHBondContact O-N 3.39Å; Q401-E405 PolarHBondContact O-N 3.23Å
402	D	88.4	Confident	85.8	Confident	48 Å²	48	38.5 Å²	38.5	26%	0.257	21%	0.209	S	C	.	.	H	α-helix	trans	-58.1	-43.2	177.5	-76.7	2.2	0	0	0	111.5	S266 S268 T269 N398 V404 E405 Q406	S266-D402 PolarHBondContact OG-OD2 2.98Å; S268-D402 WeakPolarHBondContact CB-OD2 3.47Å; S268-D402 PolarHBondContact OG-OD2 3.38Å; T269-D402 WeakPolarHBondContact OG1-CB 3.38Å; N398-D402 PolarHBondContact O-N 3.11Å; D402-V404 VanDerWaalsContact C-N 3.35Å; D402-V404 PolarHBondContact O-N 3.36Å; D402-E405 PolarHBondContact O-N 2.97Å; D402-Q406 WeakPolarHBondContact O-CB 3.47Å; D402-Q406 WeakPolarHBondContact O-CG 2.84Å; D402-Q406 PolarHBondContact O-N 2.96Å
403	A	90	Very high	84.1	Confident	8 Å²	8	41.7 Å²	41.7	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-40.4	177.6	0	0	0	0	0	112.9	F258 T269 Y280 L400 Q401 A407	F258-A403 HydrophobicContact CE2-CB 4.32Å; T269-A403 HydrophobicContact CG2-CB 3.96Å; Y280-A403 HydrophobicContact CE1-CB 4.04Å; Y280-A403 HydrophobicContact CE2-CB 3.98Å; Y280-A403 WeakPolarHBondContact OH-CB 3.5Å; L400-A403 PolarHBondContact O-N 3.47Å; Q401-A403 VanDerWaalsContact C-N 3.3Å; Q401-A403 PolarHBondContact O-N 3.32Å; A403-A407 WeakPolarHBondContact O-CB 3.43Å; A403-A407 PolarHBondContact O-N 3.21Å; A403-A407 VanDerWaalsContact O-N 3.13Å
404	V	90.6	Very high	81.8	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-70.4	-42.2	177	173.8	0	0	0	0	111	F258 L284 V318 A321 L400 Q401 D402 A407 L408	F258-V404 HydrophobicContact CE2-CG2 3.86Å; F258-V404 HydrophobicContact CZ-CG2 3.66Å; L284-V404 HydrophobicContact CD1-CG1 4.06Å; L284-V404 HydrophobicContact CD2-CG1 4.45Å; V318-V404 HydrophobicContact CG2-CG2 4.45Å; A321-V404 HydrophobicContact CB-CB 4.34Å; A321-V404 HydrophobicContact CB-CG1 3.75Å; L400-V404 HydrophobicContact CD1-CG2 4.32Å; L400-V404 WeakPolarHBondContact O-CG2 3.44Å; L400-V404 PolarHBondContact O-N 2.94Å; Q401-V404 PolarHBondContact O-N 3.39Å; D402-V404 VanDerWaalsContact C-N 3.35Å; D402-V404 PolarHBondContact O-N 3.36Å; V404-A407 PolarHBondContact O-N 3.02Å; V404-L408 HydrophobicContact CG1-CD1 4.02Å; V404-L408 WeakPolarHBondContact O-CG 3.33Å; V404-L408 PolarHBondContact O-N 3.39Å
405	E	88.1	Confident	79.3	Confident	33 Å²	33	41.9 Å²	41.9	15%	0.154	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-43.9	177.8	-170.3	172.4	118.9	0	0	111.4	A321 S324 V325 R328 Q401 D402 A407 L408 L409	A321-E405 HydrophobicContact CB-CB 4.36Å; S324-E405 VanDerWaalsContact CB-OE2 3.25Å; S324-E405 WeakPolarHBondContact CB-OE2 3.29Å; S324-E405 PolarHBondContact OG-OE2 3.33Å; V325-E405 HydrophobicContact CG2-CG 4.02Å; R328-E405 IonicContact CZ-OE1 3.98Å; R328-E405 IonicContact NH1-OE1 2.7Å; R328-E405 PolarHBondContact NH1-OE1 2.97Å; R328-E405 IonicContact NH2-OE1 2.76Å; R328-E405 PolarHBondContact NH2-OE1 3.24Å; R328-E405 IonicContact NH2-OE2 2.69Å; R328-E405 PolarHBondContact NH2-OE2 3.24Å; Q401-E405 PolarHBondContact O-N 3.23Å; D402-E405 PolarHBondContact O-N 2.97Å; E405-A407 VanDerWaalsContact C-N 3.34Å; E405-A407 PolarHBondContact O-N 3.15Å; E405-L408 PolarHBondContact O-N 3.29Å; E405-L409 HydrophobicContact CG-CD1 3.87Å; E405-L409 HydrophobicContact CG-CG 4.18Å; E405-L409 WeakPolarHBondContact O-CB 3.48Å; E405-L409 VanDerWaalsContact O-CG 3.27Å; E405-L409 WeakPolarHBondContact O-CG 3.43Å; E405-L409 PolarHBondContact O-N 3.32Å
406	Q	86	Confident	76.7	Confident	87 Å²	87	44 Å²	44	41%	0.407	24%	0.241	S	C	.	.	H	α-helix	trans	-62.2	-38.4	176.1	-66.9	-71.1	-39.6	0	0	112.4	S265 D402 S410	S265-Q406 PolarHBondContact OG-OE1 3.23Å; D402-Q406 WeakPolarHBondContact O-CB 3.47Å; D402-Q406 WeakPolarHBondContact O-CG 2.84Å; D402-Q406 PolarHBondContact O-N 2.96Å; Q406-S410 WeakPolarHBondContact O-CB 3.38Å; Q406-S410 PolarHBondContact O-N 3.35Å; Q406-S410 PolarHBondContact O-OG 3.02Å
407	A	88	Confident	73.8	Confident	8 Å²	8	53.5 Å²	53.5	7%	0.066	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-38.3	175	0	0	0	0	0	113	F258 L284 A403 V404 E405 S410 S411	F258-A407 HydrophobicContact CB-CB 3.62Å; F258-A407 HydrophobicContact CD1-CB 4.42Å; F258-A407 HydrophobicContact CD2-CB 4.02Å; F258-A407 HydrophobicContact CG-CB 3.78Å; L284-A407 HydrophobicContact CD1-CB 3.84Å; A403-A407 WeakPolarHBondContact O-CB 3.43Å; A403-A407 PolarHBondContact O-N 3.21Å; A403-A407 VanDerWaalsContact O-N 3.13Å; V404-A407 PolarHBondContact O-N 3.02Å; E405-A407 VanDerWaalsContact C-N 3.34Å; E405-A407 PolarHBondContact O-N 3.15Å; A407-S410 PolarHBondContact O-OG 3.16Å; A407-S411 PolarHBondContact O-N 3.48Å
408	L	87.5	Confident	70.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-73.2	-40.1	176.6	-69.1	172.4	0	0	0	112.3	I256 L284 A321 Y322 V325 V404 E405 A412	I256-L408 HydrophobicContact CD1-CD2 4.18Å; L284-L408 HydrophobicContact CB-CD2 4.24Å; L284-L408 HydrophobicContact CD1-CD2 4.02Å; L284-L408 HydrophobicContact CD1-CG 4Å; A321-L408 HydrophobicContact CB-CD1 4.25Å; Y322-L408 HydrophobicContact CD1-CD1 3.93Å; Y322-L408 HydrophobicContact CD1-CD2 4.11Å; Y322-L408 HydrophobicContact CD2-CD1 4.27Å; Y322-L408 HydrophobicContact CE1-CD1 4.1Å; Y322-L408 HydrophobicContact CE1-CD2 3.54Å; Y322-L408 HydrophobicContact CE2-CD1 4.43Å; Y322-L408 HydrophobicContact CG-CD1 4.02Å; V325-L408 HydrophobicContact CB-CB 4.23Å; V325-L408 HydrophobicContact CG1-CB 4.22Å; V325-L408 HydrophobicContact CG2-CB 3.78Å; V404-L408 HydrophobicContact CG1-CD1 4.02Å; V404-L408 WeakPolarHBondContact O-CG 3.33Å; V404-L408 PolarHBondContact O-N 3.39Å; E405-L408 PolarHBondContact O-N 3.29Å; L408-A412 PolarHBondContact O-N 3.18Å
409	L	83.7	Confident	68.1	Low	35 Å²	35	61.5 Å²	61.5	18%	0.183	32%	0.316	C	S	.	.	H	α-helix	trans	-66.1	-46.9	178	-73.3	171	0	0	0	112.5	V325 E405 S411 A412 Q413	V325-L409 HydrophobicContact CG1-CD2 4.32Å; V325-L409 HydrophobicContact CG2-CD2 3.82Å; V325-L409 HydrophobicContact CG2-CG 3.86Å; E405-L409 HydrophobicContact CG-CD1 3.87Å; E405-L409 HydrophobicContact CG-CG 4.18Å; E405-L409 WeakPolarHBondContact O-CB 3.48Å; E405-L409 VanDerWaalsContact O-CG 3.27Å; E405-L409 WeakPolarHBondContact O-CG 3.43Å; E405-L409 PolarHBondContact O-N 3.32Å; L409-S411 VanDerWaalsContact C-N 3.31Å; L409-S411 PolarHBondContact O-N 3.12Å; L409-A412 WeakPolarHBondContact O-CB 3.49Å; L409-A412 PolarHBondContact O-N 3.05Å; L409-Q413 PolarHBondContact O-N 3.42Å; L409-Q413 VanDerWaalsContact O-N 3.11Å
410	S	78.4	Confident	65.2	Low	54 Å²	54	69.2 Å²	69.2	38%	0.378	36%	0.357	S	S	.	.	H	α-helix	trans	-60.5	-40.6	178.5	50.4	0	0	0	0	111.8	Q406 A407 A412 Q413 I414	Q406-S410 WeakPolarHBondContact O-CB 3.38Å; Q406-S410 PolarHBondContact O-N 3.35Å; Q406-S410 PolarHBondContact O-OG 3.02Å; A407-S410 PolarHBondContact O-OG 3.16Å; S410-A412 VanDerWaalsContact C-N 3.29Å; S410-A412 PolarHBondContact O-N 2.97Å; S410-Q413 PolarHBondContact O-N 3.08Å; S410-I414 WeakPolarHBondContact O-CD1 3.46Å; S410-I414 VanDerWaalsContact O-CG1 3.3Å; S410-I414 WeakPolarHBondContact O-CG1 3.32Å; S410-I414 PolarHBondContact O-N 3.05Å
411	S	73.7	Confident	62.1	Low	23 Å²	23	74.4 Å²	74.4	16%	0.161	39%	0.392	C	S	.	.	H	α-helix	trans	-66.2	-25.4	173	-176.4	0	0	0	0	114.3	I256 A407 L409	I256-S411 WeakPolarHBondContact CD1-OG 3.41Å; I256-S411 WeakPolarHBondContact CG1-OG 3.12Å; A407-S411 PolarHBondContact O-N 3.48Å; L409-S411 VanDerWaalsContact C-N 3.31Å; L409-S411 PolarHBondContact O-N 3.12Å
412	A	59.5	Low	58.9	Low	45 Å²	45	79.5 Å²	79.5	37%	0.372	42%	0.42	S	S	.	.	H	α-helix	trans	-73.9	-44.5	175.8	0	0	0	0	0	111.1	L408 L409 S410 I414 Q415	L408-A412 PolarHBondContact O-N 3.18Å; L409-A412 WeakPolarHBondContact O-CB 3.49Å; L409-A412 PolarHBondContact O-N 3.05Å; S410-A412 VanDerWaalsContact C-N 3.29Å; S410-A412 PolarHBondContact O-N 2.97Å; A412-I414 VanDerWaalsContact C-N 3.3Å; A412-I414 PolarHBondContact O-N 3.39Å; A412-Q415 PolarHBondContact O-N 3.34Å
413	Q	49.9	Very low	55.9	Low	141 Å²	141	83.2 Å²	83.2	66%	0.659	45%	0.448	S	S	*	.	H	α-helix	trans	-64.5	-30	-179.4	-68.6	174.1	-11.6	0	0	113.5	L409 S410 Q415 T416	L409-Q413 PolarHBondContact O-N 3.42Å; L409-Q413 VanDerWaalsContact O-N 3.11Å; S410-Q413 PolarHBondContact O-N 3.08Å; Q413-Q415 PolarHBondContact O-N 2.96Å; Q413-T416 PolarHBondContact O-OG1 2.87Å
414	I	40.1	Very low	52.8	Low	117 Å²	117	89 Å²	89	60%	0.6	48%	0.482	S	S	*	.	H	α-helix	trans	-66.8	-16.6	179.4	-71.3	164.5	0	0	0	113	S410 A412	S410-I414 WeakPolarHBondContact O-CD1 3.46Å; S410-I414 VanDerWaalsContact O-CG1 3.3Å; S410-I414 WeakPolarHBondContact O-CG1 3.32Å; S410-I414 PolarHBondContact O-N 3.05Å; A412-I414 VanDerWaalsContact C-N 3.3Å; A412-I414 PolarHBondContact O-N 3.39Å
415	Q	36.5	Very low	49.6	Very low	67 Å²	67	95 Å²	95	31%	0.313	52%	0.521	S	S	.	.	H	α-helix	trans	-106.4	-17.5	-171	-79.6	-80.4	-60.8	0	0	115.6	A412 Q413 F417 V418	A412-Q415 PolarHBondContact O-N 3.34Å; Q413-Q415 PolarHBondContact O-N 2.96Å; Q415-F417 VanDerWaalsContact C-N 3.29Å; Q415-F417 PolarHBondContact O-N 2.97Å; Q415-V418 PolarHBondContact O-N 3.48Å
416	T	33.4	Very low	46.7	Very low	110 Å²	110	99.5 Å²	99.5	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-67.2	-30	175.5	33.8	0	0	0	0	112.5	Q413 V418	Q413-T416 PolarHBondContact O-OG1 2.87Å; T416-V418 VanDerWaalsContact C-N 3.29Å; T416-V418 PolarHBondContact O-N 3.42Å
417	F	28	Very low	43.7	Very low	200 Å²	200	101.8 Å²	101.8	88%	0.877	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-4.2	-179.8	-155	-98.6	0	0	0	114.8	Q415	Q415-F417 VanDerWaalsContact C-N 3.29Å; Q415-F417 PolarHBondContact O-N 2.97Å
418	V	30.2	Very low	40.7	Very low	99 Å²	99	108.8 Å²	108.8	60%	0.6	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-6.9	-165	-172.5	0	0	0	0	113.6	Q415 T416	Q415-V418 PolarHBondContact O-N 3.48Å; T416-V418 VanDerWaalsContact C-N 3.29Å; T416-V418 PolarHBondContact O-N 3.42Å
419	R	28.6	Very low	37.8	Very low	159 Å²	159	116 Å²	116	60%	0.6	63%	0.626	S	S	*	*			trans	-94.5	-1.7	-164.9	-115.8	-174.4	-173.9	83.6	4.1	117.5	C421	R419-C421 PolarHBondContact O-N 3.14Å
420	N	26.3	Very low	35	Very low	162 Å²	162	121.7 Å²	121.7	87%	0.866	66%	0.656	S	S	*	*			trans	-78.2	80.1	-177.4	-72.7	9.7	0	0	0	112.2
421	C	26.3	Very low	32.6	Very low	109 Å²	109	125.1 Å²	125.1	74%	0.736	68%	0.677	S	S	*	*			trans	-140.7	93.7	174.8	-89	0	0	0	0	113.5	R419	R419-C421 PolarHBondContact O-N 3.14Å
422	L	23.5	Very low	30.3	Very low	163 Å²	163	132.4 Å²	132.4	85%	0.853	71%	0.706	S	S	*	*			trans	49.7	95.2	144	-69	159.4	0	0	0	118.3
423	P	25.5	Very low	28.6	Very low	127 Å²	127	137.6 Å²	137.6	83%	0.825	72%	0.723	S	S	*	*			trans	-74.3	153.4	165.5	32.7	-34.2	0	0	0	112
424	T	24.1	Very low	27.4	Very low	128 Å²	128	138 Å²	138	79%	0.785	73%	0.729	S	S	*	*			trans	-129.9	141.1	170	35.9	0	0	0	0	110.4
425	P	25.3	Very low	26.7	Very low	129 Å²	129	138.5 Å²	138.5	84%	0.838	73%	0.732	S	S	*	*			trans	-81.2	147.4	-165.3	31.4	-36.1	0	0	0	113.7
426	I	25.7	Very low	26.2	Very low	127 Å²	127	141.1 Å²	141.1	65%	0.651	75%	0.753	S	S	*	*			trans	-126.5	116.9	175.2	-58.7	177.4	0	0	0	109.1
427	T	23.7	Very low	25.9	Very low	135 Å²	135	145.1 Å²	145.1	83%	0.828	76%	0.764	S	S	*	*			trans	-80.1	127.3	176.9	-41.6	0	0	0	0	111.3
428	F	25	Very low	25.8	Very low	155 Å²	155	142.8 Å²	142.8	68%	0.68	76%	0.76	S	S	*	*			trans	-85.1	148.6	174.8	-77.2	-96.8	0	0	0	112.8	T342	T342-F428 HydrophobicContact CG2-CZ 4.4Å
429	K	26.1	Very low	25.7	Very low	152 Å²	152	145.8 Å²	145.8	66%	0.661	77%	0.773	S	S	*	*			trans	-138.2	127.9	161.1	-89.1	-176.2	165.5	176.2	0	109.9	N558	K429-N558 WeakPolarHBondContact CE-OD1 3.49Å; K429-N558 PolarHBondContact NZ-OD1 3.45Å
430	N	25.1	Very low	25.5	Very low	153 Å²	153	149.9 Å²	149.9	82%	0.818	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.6	139.7	-178.1	-68.7	-13.4	0	0	0	112.4
431	P	27.9	Very low	25.7	Very low	126 Å²	126	146.4 Å²	146.4	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-85	151.7	151.4	-5.3	24.9	0	0	0	110.8
432	K	25.8	Very low	26.1	Very low	176 Å²	176	147.3 Å²	147.3	77%	0.765	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-97.8	153.9	174.3	-69.5	-175.1	169.7	-161.5	0	112.3
433	E	23.7	Very low	26.9	Very low	155 Å²	155	143.8 Å²	143.8	72%	0.724	76%	0.761	S	S	*	*			trans	24.2	128.4	136.5	-54.5	162.3	139.9	0	0	119.1
434	L	25	Very low	27.7	Very low	150 Å²	150	140 Å²	140	79%	0.785	73%	0.731	S	S	*	*				-165.9	138.9	106.7	-126.1	76.6	0	0	0	113.8
435	N	25.6	Very low	28.8	Very low	127 Å²	127	136.5 Å²	136.5	68%	0.679	71%	0.71	S	S	*	*			trans	31.8	111.4	142.9	-59.5	3.6	0	0	0	119.5
436	T	24.6	Very low	29.9	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	69%	0.686	S	S	*	*				62	116.2	72.5	68.8	0	0	0	0	116
437	H	28.8	Very low	30.8	Very low	193 Å²	193	132.8 Å²	132.8	89%	0.894	68%	0.681	S	S	*	*			trans	-139.6	154.1	148.7	-109.8	-93.8	0	0	0	109.1
438	N	25.4	Very low	31.6	Very low	152 Å²	152	134.1 Å²	134.1	81%	0.813	68%	0.675	S	S	*	*			trans	-84	149.2	-174.7	-56.2	-57.3	0	0	0	112
439	D	27.3	Very low	32	Very low	162 Å²	162	132.6 Å²	132.6	87%	0.866	68%	0.678	S	S	*	*			trans	-142.3	166	133.9	-123.5	-41.9	0	0	0	110.9
440	R	24	Very low	32.5	Very low	245 Å²	245	132.1 Å²	132.1	93%	0.925	67%	0.672	S	S	*	*			trans	-108.6	81.4	-166	-74.8	-177.3	171.2	177.6	-2.6	114.9
441	S	30.7	Very low	33.1	Very low	89 Å²	89	132.2 Å²	132.2	62%	0.622	67%	0.671	S	S	*	*			trans	-106.2	154.6	152.7	44.8	0	0	0	0	110.7	D443	S441-D443 VanDerWaalsContact C-N 3.26Å; S441-D443 VanDerWaalsContact CB-OD1 3.31Å; S441-D443 WeakPolarHBondContact CB-OD1 3.24Å; S441-D443 PolarHBondContact O-N 3.28Å; S441-D443 PolarHBondContact OG-OD1 3.14Å
442	T	35.4	Very low	33.4	Very low	128 Å²	128	129.1 Å²	129.1	79%	0.785	65%	0.648	S	S	*	*			trans	-89.4	61.6	175.5	47	0	0	0	0	111.4
443	D	39.4	Very low	34.3	Very low	89 Å²	89	127.5 Å²	127.5	48%	0.476	65%	0.646	S	S	.	*			trans	-50.1	151	173.9	-65.1	15.3	0	0	0	111.9	S441 E447	S441-D443 VanDerWaalsContact C-N 3.26Å; S441-D443 VanDerWaalsContact CB-OD1 3.31Å; S441-D443 WeakPolarHBondContact CB-OD1 3.24Å; S441-D443 PolarHBondContact O-N 3.28Å; S441-D443 PolarHBondContact OG-OD1 3.14Å; D443-E447 WeakPolarHBondContact CA-OE2 3.39Å; D443-E447 HydrophobicContact CB-CB 4.36Å; D443-E447 WeakPolarHBondContact CB-OE2 3.18Å
444	R	43.6	Very low	35.2	Very low	48 Å²	48	129.1 Å²	129.1	18%	0.181	65%	0.646	C	S	.	*			trans	-66.8	150.5	174.8	-78.9	-177.9	168.6	-162.8	-6.9	109.9	N446 E447 E703 W754 S758	R444-N446 WeakPolarHBondContact CB-OD1 3.3Å; R444-N446 PolarHBondContact O-N 3.19Å; R444-E447 PolarHBondContact N-OE2 3.45Å; R444-E447 PolarHBondContact O-N 3.38Å; R444-E447 VanDerWaalsContact O-N 3.1Å; R444-E703 IonicContact CZ-OE2 3.77Å; R444-E703 IonicContact NE-OE2 3.8Å; R444-E703 IonicContact NH2-OE2 3.87Å; R444-E703 PolarHBondContact NH2-OE2 3.38Å; R444-W754 HydrophobicContact CG-CH2 3.99Å; R444-W754 HydrophobicContact CG-CZ2 3.69Å; R444-S758 PolarHBondContact NH1-OG 2.84Å; R444-S758 PolarHBondContact NH2-OG 3.48Å
445	P	46	Very low	36.5	Very low	53 Å²	53	125.9 Å²	125.9	34%	0.344	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.2	-9.9	-173.1	-24	35.3	0	0	0	115.7	R450 W754	P445-R450 PolarHBondContact O-NH1 3.24Å; P445-W754 HydrophobicContact CG-CE3 4.19Å; P445-W754 HydrophobicContact CG-CZ3 4.17Å
446	N	48.7	Very low	37.7	Very low	65 Å²	65	122.4 Å²	122.4	35%	0.348	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.6	-8.3	-174.5	55.9	31.7	0	0	0	114.1	R444 K448 D755	R444-N446 WeakPolarHBondContact CB-OD1 3.3Å; R444-N446 PolarHBondContact O-N 3.19Å; N446-K448 PolarHBondContact O-N 2.82Å; N446-D755 PolarHBondContact ND2-OD1 2.76Å
447	E	44.9	Very low	39.2	Very low	114 Å²	114	121.8 Å²	121.8	53%	0.533	60%	0.595	S	S	.	*	S	Bend	trans	-72.6	-12.7	171	-69.8	173.9	110.6	0	0	111.8	D443 R444 V449	D443-E447 WeakPolarHBondContact CA-OE2 3.39Å; D443-E447 HydrophobicContact CB-CB 4.36Å; D443-E447 WeakPolarHBondContact CB-OE2 3.18Å; R444-E447 PolarHBondContact N-OE2 3.45Å; R444-E447 PolarHBondContact O-N 3.38Å; R444-E447 VanDerWaalsContact O-N 3.1Å; E447-V449 PolarHBondContact O-N 2.64Å
448	K	40.6	Very low	40.3	Very low	162 Å²	162	112.9 Å²	112.9	70%	0.704	55%	0.554	S	S	*	*	S	Bend	trans	-82.5	106.6	164.1	-66.1	178.2	-177	175.5	0	110.1	N446 R450	N446-K448 PolarHBondContact O-N 2.82Å; K448-R450 PolarHBondContact O-N 3.01Å
449	V	33.9	Very low	41.7	Very low	123 Å²	123	112.1 Å²	112.1	75%	0.745	55%	0.546	S	S	*	.			trans	-50.5	117.1	-178.1	178.7	0	0	0	0	112.1	E447 I451	E447-V449 PolarHBondContact O-N 2.64Å; V449-I451 HydrophobicContact CG1-CD1 3.76Å; V449-I451 HydrophobicContact CG1-CG1 3.72Å
450	R	36.9	Very low	43.2	Very low	143 Å²	143	112.4 Å²	112.4	54%	0.54	53%	0.534	S	S	.	.			trans	-121.9	136	167.7	-70	178	179	92.6	-9.7	109.1	P445 K448 E455	P445-R450 PolarHBondContact O-NH1 3.24Å; K448-R450 PolarHBondContact O-N 3.01Å; R450-E455 VanDerWaalsContact CD-OE2 3.25Å; R450-E455 WeakPolarHBondContact CD-OE2 3.26Å; R450-E455 WeakPolarHBondContact CG-OE2 3.35Å; R450-E455 IonicContact NE-OE2 3.87Å
451	I	36.7	Very low	44.7	Very low	155 Å²	155	103.6 Å²	103.6	80%	0.795	50%	0.503	S	S	*	.			trans	-141.1	51.2	-175.9	-37.9	178.7	0	0	0	110.5	V449	V449-I451 HydrophobicContact CG1-CD1 3.76Å; V449-I451 HydrophobicContact CG1-CG1 3.72Å
452	D	35.4	Very low	45.5	Very low	61 Å²	61	101.2 Å²	101.2	33%	0.326	48%	0.483	S	S	.	.			trans	-129.4	130.5	163.4	-167.1	-41.1	0	0	0	107.9	R454 E455	D452-R454 PolarHBondContact O-N 2.83Å; D452-R454 WeakPolarHBondContact OD1-CB 3.29Å; D452-R454 IonicContact OD1-CZ 3.52Å; D452-R454 PolarHBondContact OD1-N 3.03Å; D452-R454 IonicContact OD1-NE 3.73Å; D452-R454 PolarHBondContact OD1-NE 2.7Å; D452-R454 IonicContact OD1-NH2 3.64Å; D452-R454 IonicContact OD2-CZ 2.63Å; D452-R454 IonicContact OD2-NE 3.9Å; D452-R454 PolarHBondContact OD2-NE 2.83Å; D452-R454 IonicContact OD2-NH2 2.71Å; D452-R454 PolarHBondContact OD2-NH2 2.85Å; D452-E455 HydrophobicContact CB-CG 4.46Å; D452-E455 PolarHBondContact O-N 3.03Å
453	L	43.8	Very low	45.9	Very low	141 Å²	141	98.6 Å²	98.6	74%	0.738	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-67.7	-23.4	-177.1	-76.9	72.8	0	0	0	111.6	E455	L453-E455 VanDerWaalsContact C-N 3.29Å; L453-E455 PolarHBondContact O-N 3.47Å
454	R	42.2	Very low	45.7	Very low	190 Å²	190	99.7 Å²	99.7	72%	0.717	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-73.9	-14.8	179.4	-63.4	169.7	-69.8	-168.1	2.3	113.6	D452 Q456	D452-R454 PolarHBondContact O-N 2.83Å; D452-R454 WeakPolarHBondContact OD1-CB 3.29Å; D452-R454 IonicContact OD1-CZ 3.52Å; D452-R454 PolarHBondContact OD1-N 3.03Å; D452-R454 IonicContact OD1-NE 3.73Å; D452-R454 PolarHBondContact OD1-NE 2.7Å; D452-R454 IonicContact OD1-NH2 3.64Å; D452-R454 IonicContact OD2-CZ 2.63Å; D452-R454 IonicContact OD2-NE 3.9Å; D452-R454 PolarHBondContact OD2-NE 2.83Å; D452-R454 IonicContact OD2-NH2 2.71Å; D452-R454 PolarHBondContact OD2-NH2 2.85Å; R454-Q456 VanDerWaalsContact C-N 3.28Å; R454-Q456 PolarHBondContact O-N 3Å
455	E	51.7	Low	45	Very low	81 Å²	81	107 Å²	107	38%	0.379	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-80.1	1.6	179.2	-74.1	-155.5	111.1	0	0	114.6	R450 D452 L453 R460	R450-E455 VanDerWaalsContact CD-OE2 3.25Å; R450-E455 WeakPolarHBondContact CD-OE2 3.26Å; R450-E455 WeakPolarHBondContact CG-OE2 3.35Å; R450-E455 IonicContact NE-OE2 3.87Å; D452-E455 HydrophobicContact CB-CG 4.46Å; D452-E455 PolarHBondContact O-N 3.03Å; L453-E455 VanDerWaalsContact C-N 3.29Å; L453-E455 PolarHBondContact O-N 3.47Å; E455-R460 IonicContact OE1-CZ 3.73Å; E455-R460 IonicContact OE1-NH1 2.7Å; E455-R460 PolarHBondContact OE1-NH1 3.39Å; E455-R460 IonicContact OE1-NH2 3.86Å
456	Q	51.9	Low	44.2	Very low	55 Å²	55	109.4 Å²	109.4	26%	0.257	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-87.6	-14.7	-173.2	-59	-162.4	9.2	0	0	115.7	R454 L633 Y756	R454-Q456 VanDerWaalsContact C-N 3.28Å; R454-Q456 PolarHBondContact O-N 3Å; Q456-L633 HydrophobicContact CB-CD2 3.97Å; Q456-L633 WeakPolarHBondContact O-CD2 3.29Å; Q456-Y756 PolarHBondContact O-OH 2.96Å
457	Q	55.6	Low	43.1	Very low	109 Å²	109	112.3 Å²	112.3	51%	0.509	55%	0.552	S	S	.	*			trans	-73.7	147.7	-169.6	-63.2	177.7	-77.4	0	0	114.6	E459	Q457-E459 VanDerWaalsContact C-N 3.3Å; Q457-E459 PolarHBondContact O-N 3.37Å
458	L	51.8	Low	42.2	Very low	5 Å²	5	116.6 Å²	116.6	3%	0.026	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	-28.7	-177.8	-176.1	65.8	0	0	0	114.6	R460 F461 L462 M752 E804 C807 F808	L458-R460 PolarHBondContact O-N 2.91Å; L458-F461 HydrophobicContact CD1-CB 4.45Å; L458-F461 HydrophobicContact CD1-CD2 4.3Å; L458-F461 WeakPolarHBondContact O-CB 3.34Å; L458-F461 PolarHBondContact O-N 2.99Å; L458-L462 HydrophobicContact CD2-CD1 4.12Å; L458-L462 HydrophobicContact CD2-CD2 4.45Å; L458-L462 HydrophobicContact CG-CD1 4.09Å; L458-L462 HydrophobicContact CG-CD2 4.28Å; L458-L462 HydrophobicContact CG-CG 4.1Å; L458-M752 HydrophobicContact CD1-CE 4.3Å; L458-M752 HydrophobicContact CD1-CG 3.85Å; L458-E804 HydrophobicContact CB-CB 4.12Å; L458-E804 HydrophobicContact CB-CG 3.81Å; L458-E804 VanDerWaalsContact CB-OE2 3.3Å; L458-E804 WeakPolarHBondContact CB-OE2 3.34Å; L458-E804 HydrophobicContact CD2-CB 4.02Å; L458-E804 HydrophobicContact CD2-CG 4.12Å; L458-E804 PolarHBondContact N-OE2 3.01Å; L458-C807 HydrophobicContact CD2-CB 4.11Å; L458-F808 HydrophobicContact CD1-CE1 4.37Å; L458-F808 HydrophobicContact CD1-CZ 4.41Å
459	E	55	Low	41.4	Very low	137 Å²	137	116.6 Å²	116.6	64%	0.64	57%	0.569	S	S	*	*	H	α-helix	trans	-49.9	-35.9	-171.6	-61	-176.3	-179.7	0	0	114.2	Q457 F461 L462 S463	Q457-E459 VanDerWaalsContact C-N 3.3Å; Q457-E459 PolarHBondContact O-N 3.37Å; E459-F461 PolarHBondContact O-N 3.1Å; E459-L462 PolarHBondContact O-N 3.09Å; E459-S463 PolarHBondContact O-N 3.43Å
460	R	58.4	Low	41.1	Very low	167 Å²	167	117.4 Å²	117.4	63%	0.63	57%	0.569	S	S	*	*	H	α-helix	trans	-62.9	-26.2	179.8	-163.4	176.9	-168.9	167.3	5.7	113.5	E455 L458	E455-R460 IonicContact OE1-CZ 3.73Å; E455-R460 IonicContact OE1-NH1 2.7Å; E455-R460 PolarHBondContact OE1-NH1 3.39Å; E455-R460 IonicContact OE1-NH2 3.86Å; L458-R460 PolarHBondContact O-N 2.91Å
461	F	56.4	Low	40.5	Very low	61 Å²	61	116.9 Å²	116.9	27%	0.268	58%	0.577	S	S	.	*	H	α-helix	trans	-86.2	-18.8	175.3	-61.6	-83.8	0	0	0	113	L458 E459 M752	L458-F461 HydrophobicContact CD1-CB 4.45Å; L458-F461 HydrophobicContact CD1-CD2 4.3Å; L458-F461 WeakPolarHBondContact O-CB 3.34Å; L458-F461 PolarHBondContact O-N 2.99Å; E459-F461 PolarHBondContact O-N 3.1Å; F461-M752 HydrophobicContact CD1-CB 3.99Å; F461-M752 HydrophobicContact CD2-CB 4.45Å; F461-M752 HydrophobicContact CD2-CG 4.41Å; F461-M752 HydrophobicContact CE1-CB 4.18Å; F461-M752 HydrophobicContact CG-CB 4.13Å; F461-M752 HydrophobicContact CZ-CB 4.49Å
462	L	46.8	Very low	40	Very low	39 Å²	39	116.6 Å²	116.6	20%	0.204	58%	0.577	C	S	.	*	H	α-helix	trans	-88.1	-30.6	-175.4	-56.8	-177.3	0	0	0	112.5	L458 E459 K748 W801	L458-L462 HydrophobicContact CD2-CD1 4.12Å; L458-L462 HydrophobicContact CD2-CD2 4.45Å; L458-L462 HydrophobicContact CG-CD1 4.09Å; L458-L462 HydrophobicContact CG-CD2 4.28Å; L458-L462 HydrophobicContact CG-CG 4.1Å; E459-L462 PolarHBondContact O-N 3.09Å; L462-K748 WeakPolarHBondContact O-CE 3.37Å; L462-K748 PolarHBondContact O-NZ 3.19Å; L462-W801 VanDerWaalsContact CD1-O 3.3Å; L462-W801 WeakPolarHBondContact CD1-O 3.42Å; L462-W801 WeakPolarHBondContact CD2-O 3.48Å
463	S	43.4	Very low	39.5	Very low	72 Å²	72	122.6 Å²	122.6	50%	0.503	61%	0.605	S	S	.	*	S	Bend	trans	-66.1	132.4	-179.6	61.8	0	0	0	0	112.9	E459 Q465	E459-S463 PolarHBondContact O-N 3.43Å; S463-Q465 PolarHBondContact O-N 3.46Å
464	P	36.3	Very low	38.7	Very low	113 Å²	113	120.5 Å²	120.5	73%	0.734	61%	0.608	S	S	*	*			trans	-75.3	123	174.9	29.7	-32.4	0	0	0	110.4	S466	P464-S466 PolarHBondContact O-N 3.36Å; P464-S466 VanDerWaalsContact O-N 3.11Å
465	Q	29.3	Very low	37.8	Very low	200 Å²	200	116.7 Å²	116.7	94%	0.935	61%	0.61	S	S	*	*			trans	-68.8	107.7	173.8	-71.7	-171	-3	0	0	110.7	S463	S463-Q465 PolarHBondContact O-N 3.46Å
466	S	28	Very low	36.5	Very low	105 Å²	105	117.3 Å²	117.3	73%	0.734	62%	0.623	S	S	*	*			trans	-88.2	114.1	177.4	42.9	0	0	0	0	112.5	P464	P464-S466 PolarHBondContact O-N 3.36Å; P464-S466 VanDerWaalsContact O-N 3.11Å
467	N	25.8	Very low	35.3	Very low	126 Å²	126	123 Å²	123	67%	0.674	65%	0.647	S	S	*	*			trans	71.5	121.3	138.8	-73.7	-11	0	0	0	121.7
468	Y	26.1	Very low	33.9	Very low	203 Å²	203	124.6 Å²	124.6	80%	0.796	66%	0.658	S	S	*	*			trans	59.2	127.6	148.2	-56.4	-62.1	0	0	0	118.3
469	M	24.4	Very low	32.7	Very low	162 Å²	162	130.3 Å²	130.3	80%	0.798	69%	0.685	S	S	*	*			cis	51.9	78.7	46.4	-61.1	-153.2	86.7	0	0	115.3
470	N	26.2	Very low	31.3	Very low	140 Å²	140	133.3 Å²	133.3	75%	0.749	69%	0.69	S	S	*	*				-169.5	140	114.5	-102.4	-42.3	0	0	0	115.2
471	N	25.8	Very low	29.9	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	70%	0.696	S	S	*	*			trans	26.4	118.3	144.3	-60.8	-25	0	0	0	121.5
472	N	25.3	Very low	28.7	Very low	148 Å²	148	136 Å²	136	79%	0.791	71%	0.714	S	S	*	*				41.3	113.5	121.8	-65.9	-10.2	0	0	0	120.5
473	M	25.7	Very low	27.9	Very low	187 Å²	187	139.6 Å²	139.6	92%	0.921	73%	0.734	S	S	*	*				78.8	128.8	126.2	-152.4	172.6	-161.8	0	0	118.7
474	A	27	Very low	27.2	Very low	97 Å²	97	142.3 Å²	142.3	80%	0.802	74%	0.743	S	S	*	*			trans	68.8	153.7	170.6	0	0	0	0	0	117.9
475	C	23	Very low	26.9	Very low	110 Å²	110	140.9 Å²	140.9	74%	0.743	74%	0.736	S	S	*	*			cis	-163.5	128.5	-34.9	-167.4	0	0	0	0	111.8
476	S	23.9	Very low	27	Very low	94 Å²	94	138.4 Å²	138.4	66%	0.657	73%	0.728	S	S	*	*			trans	70.3	152.6	152.3	81.9	0	0	0	0	121.7
477	K	27.6	Very low	27.1	Very low	175 Å²	175	142.3 Å²	142.3	76%	0.761	73%	0.732	S	S	*	*			trans	75	118.1	156.7	-70.3	176.6	179.6	176.7	0	117
478	L	25.8	Very low	27.3	Very low	142 Å²	142	146.3 Å²	146.3	74%	0.743	74%	0.743	S	S	*	*				72.8	133.2	95.8	-65.5	175.4	0	0	0	111.4
479	E	26.6	Very low	27.4	Very low	126 Å²	126	141.3 Å²	141.3	59%	0.589	74%	0.738	S	S	*	*			cis	-154.8	155.1	21.6	-124	172.1	140.2	0	0	111.5
480	R	25.9	Very low	27.6	Very low	200 Å²	200	142.1 Å²	142.1	76%	0.755	74%	0.744	S	S	*	*				45.1	133.9	109.1	-78	-175.6	-173.1	151.5	-10.6	115.8
481	L	28.4	Very low	27.6	Very low	144 Å²	144	138.6 Å²	138.6	75%	0.754	74%	0.74	S	S	*	*			cis	-145.4	-162.3	9.4	-75.3	121.1	0	0	0	108.5
482	H	30.4	Very low	27.6	Very low	140 Å²	140	141.4 Å²	141.4	65%	0.648	75%	0.749	S	S	*	*			cis	-169.9	139.6	19.4	-153	38.4	0	0	0	112.9
483	N	30.3	Very low	27.7	Very low	114 Å²	114	143.2 Å²	143.2	61%	0.61	76%	0.755	S	S	*	*			trans	59	168.3	148	-67.5	4.4	0	0	0	119.7
484	N	29.2	Very low	27.8	Very low	129 Å²	129	139.3 Å²	139.3	69%	0.69	75%	0.746	S	S	*	*			cis	-167.4	160	-33.4	-108.6	-47	0	0	0	106
485	S	30.9	Very low	28.1	Very low	84 Å²	84	140 Å²	140	59%	0.587	74%	0.743	S	S	*	*			cis	-156.3	-166.4	-10.2	-125.2	0	0	0	0	105
486	L	31.6	Very low	28.1	Very low	147 Å²	147	142 Å²	142	77%	0.77	75%	0.746	S	S	*	*			cis	-134.9	154	17.7	-86.6	86.4	0	0	0	109.4
487	K	29.3	Very low	28.3	Very low	188 Å²	188	144.6 Å²	144.6	82%	0.817	75%	0.751	S	S	*	*				39.9	130.3	99.9	-47.2	-178.2	178.3	178.2	0	115.4
488	K	30.4	Very low	28.2	Very low	209 Å²	209	144.4 Å²	144.4	91%	0.909	75%	0.753	S	S	*	*			cis	-142.9	170.3	38.9	-153.5	174.9	178.8	-173.7	0	113.6
489	S	27	Very low	28.4	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	75%	0.751	S	S	*	*			trans	-104.5	154.3	-163.7	54.1	0	0	0	0	116.1
490	I	29	Very low	28.5	Very low	179 Å²	179	144 Å²	144	92%	0.918	76%	0.759	S	S	*	*			trans	146.5	140.1	158.5	-81.1	154.6	0	0	0	105
491	G	27.5	Very low	28.7	Very low	66 Å²	66	140.1 Å²	140.1	68%	0.68	76%	0.763	S	S	*	*			cis	175.2	158.3	-1.1	0	0	0	0	0	107.6
492	E	24.4	Very low	28.9	Very low	191 Å²	191	140.1 Å²	140.1	89%	0.893	76%	0.764	S	S	*	*			trans	-67.9	131.2	-169.2	-61.1	156.4	127.7	0	0	113.8
493	M	26.7	Very low	29.1	Very low	186 Å²	186	139.7 Å²	139.7	92%	0.916	76%	0.762	S	S	*	*			trans	-167.5	149.3	140.5	-140.9	87.3	82.1	0	0	112.9
494	S	28	Very low	29.2	Very low	106 Å²	106	138 Å²	138	74%	0.741	76%	0.764	S	S	*	*			trans	-75.7	168.5	149.4	-83	0	0	0	0	109.4
495	P	33.3	Very low	29.6	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	76%	0.757	S	S	*	*			cis	-149.1	-152.2	40.9	45	-22.3	0	0	0	115.2
496	D	24.4	Very low	29.8	Very low	152 Å²	152	139.3 Å²	139.3	81%	0.813	76%	0.76	S	S	*	*			trans	-60.8	147.4	178.4	-45.3	-97.3	0	0	0	113.7
497	I	28.2	Very low	29.9	Very low	149 Å²	149	137.2 Å²	137.2	76%	0.764	75%	0.748	S	S	*	*			trans	-139.6	126.6	164.6	-62.6	176.6	0	0	0	108.1	V499	I497-V499 HydrophobicContact CG2-CG2 4.27Å
498	E	25.3	Very low	30.2	Very low	170 Å²	170	133.9 Å²	133.9	79%	0.794	74%	0.739	S	S	*	*			trans	-78.5	145.7	166.6	-59.3	-176.9	131	0	0	109.3
499	V	29.1	Very low	30.4	Very low	118 Å²	118	130 Å²	130	72%	0.715	72%	0.722	S	S	*	*			trans	-130.7	127.6	-179.8	-178	0	0	0	0	110.1	I497	I497-V499 HydrophobicContact CG2-CG2 4.27Å
500	D	29.1	Very low	30.7	Very low	142 Å²	142	128.9 Å²	128.9	76%	0.759	71%	0.714	S	S	*	*			trans	-69.9	158	-174.3	-94.1	-56	0	0	0	115.4	D502	D500-D502 VanDerWaalsContact C-N 3.31Å; D500-D502 PolarHBondContact O-N 2.93Å
501	S	30.3	Very low	31	Very low	119 Å²	119	126.7 Å²	126.7	83%	0.832	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	42.9	-169.1	63.5	0	0	0	0	116.6
502	D	33.3	Very low	31.2	Very low	143 Å²	143	130.3 Å²	130.3	77%	0.765	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	-10.9	178.6	-84.9	-42.1	0	0	0	115.2	D500 A504	D500-D502 VanDerWaalsContact C-N 3.31Å; D500-D502 PolarHBondContact O-N 2.93Å; D502-A504 PolarHBondContact O-N 3.19Å; D502-A504 VanDerWaalsContact O-N 3.14Å
503	E	33.3	Very low	31.4	Very low	131 Å²	131	128.4 Å²	128.4	61%	0.612	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-8	-170.5	-153.1	173	-157.1	0	0	115	D505	E503-D505 PolarHBondContact O-N 3.21Å
504	A	33.7	Very low	31.4	Very low	78 Å²	78	128.4 Å²	128.4	65%	0.645	70%	0.7	S	S	*	*	H	α-helix	trans	-68.4	-29.2	-174.8	0	0	0	0	0	114.6	D502	D502-A504 PolarHBondContact O-N 3.19Å; D502-A504 VanDerWaalsContact O-N 3.14Å
505	D	36	Very low	31.4	Very low	102 Å²	102	132 Å²	132	55%	0.545	71%	0.706	S	S	.	*	H	α-helix	trans	-89.2	-11	-174.7	-88.5	0.5	0	0	0	114	E503 K509	E503-D505 PolarHBondContact O-N 3.21Å; D505-K509 WeakPolarHBondContact O-CD 3.29Å; D505-K509 WeakPolarHBondContact O-CG 3.12Å
506	E	35.6	Very low	31.1	Very low	139 Å²	139	134.5 Å²	134.5	65%	0.65	71%	0.713	S	S	*	*	H	α-helix	trans	-86.9	-36.8	173.6	-69.1	-124.3	115.3	0	0	112.3	L508 K509 S510	E506-L508 PolarHBondContact O-N 2.93Å; E506-K509 PolarHBondContact O-N 3.2Å; E506-K509 VanDerWaalsContact O-N 3.15Å; E506-S510 PolarHBondContact O-N 3.26Å; E506-S510 PolarHBondContact O-OG 3.23Å
507	I	34.4	Very low	31.1	Very low	103 Å²	103	133.5 Å²	133.5	53%	0.528	72%	0.718	S	S	.	*	H	α-helix	trans	-65	-25.3	178.2	-61.3	174	0	0	0	111.2	S510 N511	I507-S510 WeakPolarHBondContact CA-OG 3.4Å; I507-S510 PolarHBondContact O-OG 2.99Å; I507-N511 PolarHBondContact O-ND2 2.89Å
508	L	34.4	Very low	30.9	Very low	119 Å²	119	130.2 Å²	130.2	62%	0.623	71%	0.708	S	S	*	*	H	α-helix	trans	-83.9	-31.3	173.5	-154.6	72.1	0	0	0	113.5	E506	E506-L508 PolarHBondContact O-N 2.93Å
509	K	36	Very low	31	Very low	126 Å²	126	133.5 Å²	133.5	55%	0.548	71%	0.713	S	S	.	*	H	α-helix	trans	-72.3	-37.8	176.8	-74	168.8	-171.3	155.1	0	112.7	D505 E506 N511 L512	D505-K509 WeakPolarHBondContact O-CD 3.29Å; D505-K509 WeakPolarHBondContact O-CG 3.12Å; E506-K509 PolarHBondContact O-N 3.2Å; E506-K509 VanDerWaalsContact O-N 3.15Å; K509-N511 VanDerWaalsContact C-N 3.27Å; K509-N511 PolarHBondContact O-N 3.13Å; K509-L512 PolarHBondContact O-N 3.46Å
510	S	33.4	Very low	30.7	Very low	77 Å²	77	135 Å²	135	54%	0.538	72%	0.717	S	S	.	*	H	α-helix	trans	-64.4	-28.7	-180	43.6	0	0	0	0	113.4	E506 I507 L512	E506-S510 PolarHBondContact O-N 3.26Å; E506-S510 PolarHBondContact O-OG 3.23Å; I507-S510 WeakPolarHBondContact CA-OG 3.4Å; I507-S510 PolarHBondContact O-OG 2.99Å; S510-L512 VanDerWaalsContact C-N 3.32Å; S510-L512 PolarHBondContact O-N 2.79Å
511	N	35.2	Very low	30.5	Very low	132 Å²	132	135.4 Å²	135.4	71%	0.706	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	5.8	177.6	-73.5	-73.6	0	0	0	114.6	I507 K509	I507-N511 PolarHBondContact O-ND2 2.89Å; K509-N511 VanDerWaalsContact C-N 3.27Å; K509-N511 PolarHBondContact O-N 3.13Å
512	L	32	Very low	30.4	Very low	143 Å²	143	135.3 Å²	135.3	75%	0.749	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	10.8	178.9	-92.2	161.8	0	0	0	113.7	K509 S510	K509-L512 PolarHBondContact O-N 3.46Å; S510-L512 VanDerWaalsContact C-N 3.32Å; S510-L512 PolarHBondContact O-N 2.79Å
513	L	28.1	Very low	30.1	Very low	150 Å²	150	136.7 Å²	136.7	79%	0.785	72%	0.72	S	S	*	*	S	Bend	trans	-123.5	40.9	-173.5	-72.9	170.8	0	0	0	113.3
514	Q	27.3	Very low	29.8	Very low	187 Å²	187	138 Å²	138	87%	0.874	73%	0.73	S	S	*	*	S	Bend	trans	-139.4	8.9	178.2	-138.6	165.1	62.5	0	0	117.6
515	E	27.8	Very low	29.5	Very low	182 Å²	182	141.7 Å²	141.7	85%	0.85	74%	0.739	S	S	*	*	S	Bend	trans	-134.4	100.7	167.4	-81.6	-176.2	173.7	0	0	111.1
516	N	26.6	Very low	29	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	75%	0.754	S	S	*	*			trans	164	82.5	152.3	-93.2	-61.4	0	0	0	110.2
517	S	24	Very low	28.5	Very low	132 Å²	132	146 Å²	146	92%	0.923	76%	0.758	S	S	*	*			trans	-122.1	33.6	178.8	50.3	0	0	0	0	113.4
518	S	24.8	Very low	28.4	Very low	79 Å²	79	149.9 Å²	149.9	55%	0.552	77%	0.771	S	S	*	*			trans	-159.8	145.7	164.7	-171.5	0	0	0	0	104.5
519	W	26.1	Very low	28.2	Very low	240 Å²	240	151.5 Å²	151.5	91%	0.909	78%	0.779	S	S	*	*			cis	-135.1	154.1	24.3	-65.7	54.7	0	0	0	110.5
520	N	23.9	Very low	27.7	Very low	150 Å²	150	155.1 Å²	155.1	80%	0.802	80%	0.795	S	S	*	*			trans	-117	155.4	172.9	-92.1	-31.8	0	0	0	111.9
521	N	25	Very low	27.4	Very low	150 Å²	150	155.3 Å²	155.3	80%	0.802	80%	0.801	S	S	*	*			trans	89.5	152.2	167.7	-48.4	-41	0	0	0	118.1
522	S	28.6	Very low	27.2	Very low	116 Å²	116	155.1 Å²	155.1	81%	0.811	81%	0.805	S	S	*	*			trans	56.4	104.3	-164.8	54.7	0	0	0	0	113.4
523	E	25.5	Very low	27	Very low	173 Å²	173	153.2 Å²	153.2	81%	0.808	80%	0.799	S	S	*	*			cis	72.6	132.1	24.9	-154.4	177.4	-152.4	0	0	115.5
524	L	27.4	Very low	27	Very low	157 Å²	157	153.1 Å²	153.1	82%	0.822	80%	0.795	S	S	*	*			trans	64.1	133.8	-166.5	-57.1	107.5	0	0	0	113.8
525	D	28.5	Very low	27	Very low	156 Å²	156	151.7 Å²	151.7	83%	0.834	79%	0.788	S	S	*	*			cis	-132.6	170.7	27.7	-155.3	-5.9	0	0	0	114.2
526	R	24.2	Very low	27.1	Very low	228 Å²	228	147.6 Å²	147.6	86%	0.86	78%	0.779	S	S	*	*			trans	-114.5	153.2	-172.1	-100.3	-170.9	176.4	-151.5	2.1	114.4
527	S	25.7	Very low	27.1	Very low	105 Å²	105	147.3 Å²	147.3	73%	0.734	77%	0.772	S	S	*	*			trans	81.8	120.2	149.3	78.4	0	0	0	0	120
528	K	31.7	Very low	27.2	Very low	184 Å²	184	147.9 Å²	147.9	80%	0.8	76%	0.764	S	S	*	*				-165.7	134	108.8	-100.1	157	-174.2	171.3	0	111.4
529	I	30	Very low	27.3	Very low	152 Å²	152	153.2 Å²	153.2	78%	0.779	78%	0.778	S	S	*	*			trans	62.9	112.8	147.7	-56.9	165.8	0	0	0	115.5
530	K	26	Very low	27.3	Very low	202 Å²	202	151 Å²	151	88%	0.878	77%	0.771	S	S	*	*			cis	55.9	127.8	18.5	-86.1	-159.3	174.6	-165.3	0	115.8
531	A	27.5	Very low	27.5	Very low	81 Å²	81	151.1 Å²	151.1	67%	0.669	77%	0.772	S	S	*	*			cis	-145.5	175.7	-0.2	0	0	0	0	0	109.1
532	T	30.2	Very low	27.6	Very low	129 Å²	129	151.9 Å²	151.9	79%	0.791	77%	0.77	S	S	*	*				-167.2	131.7	68.3	33.9	0	0	0	0	109.9
533	T	28.8	Very low	27.5	Very low	103 Å²	103	155.3 Å²	155.3	63%	0.632	77%	0.774	S	S	*	*				80.1	104.7	77.2	-63	0	0	0	0	112
534	E	27.7	Very low	27.6	Very low	147 Å²	147	154 Å²	154	69%	0.687	77%	0.767	S	S	*	*				112.5	154.7	54.4	-88.7	160.2	-94.4	0	0	109.4
535	Q	27.8	Very low	27.6	Very low	158 Å²	158	153.4 Å²	153.4	74%	0.738	76%	0.758	S	S	*	*			cis	-144.8	-166.5	0.4	-101.9	159.6	50.4	0	0	106.9
536	S	29	Very low	27.6	Very low	95 Å²	95	151.6 Å²	151.6	66%	0.664	75%	0.749	S	S	*	*			cis	-144.6	-173.9	9.8	67.6	0	0	0	0	108.7
537	H	25.8	Very low	27.8	Very low	156 Å²	156	149.1 Å²	149.1	72%	0.722	74%	0.744	S	S	*	*			cis	78	136.3	17.4	-48.3	-60.8	0	0	0	117.1
538	L	26.2	Very low	27.9	Very low	144 Å²	144	150.7 Å²	150.7	75%	0.754	74%	0.744	S	S	*	*			cis	-167.9	176	-8	-118.7	172.9	0	0	0	112.6
539	F	27.3	Very low	27.7	Very low	192 Å²	192	149.3 Å²	149.3	84%	0.842	74%	0.741	S	S	*	*			trans	129.7	155.5	152.2	-83.4	-80.3	0	0	0	121.1
540	Y	26.2	Very low	27.6	Very low	193 Å²	193	148.1 Å²	148.1	76%	0.757	74%	0.736	S	S	*	*			trans	-162.1	163.1	-156.5	-141.7	-94.5	0	0	0	112.3
541	D	27.5	Very low	27.7	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	73%	0.73	S	S	*	*			trans	163.1	173.4	142	-85.4	-9.7	0	0	0	117.3
542	Q	27	Very low	27.6	Very low	166 Å²	166	149.1 Å²	149.1	78%	0.776	73%	0.734	S	S	*	*			trans	-138.3	172.2	-156.4	-49.3	170.8	-70.1	0	0	116.9
543	Q	27.2	Very low	27.4	Very low	188 Å²	188	148.7 Å²	148.7	88%	0.879	73%	0.731	S	S	*	*			trans	163.1	164.9	152.9	-93.2	159.3	31.7	0	0	112.9
544	E	27.4	Very low	27.3	Very low	145 Å²	145	149.1 Å²	149.1	68%	0.678	73%	0.734	S	S	*	*			cis	-173.4	156.9	-40.1	-126.7	-159.7	166.5	0	0	114.4
545	K	27.9	Very low	27.2	Very low	145 Å²	145	148.8 Å²	148.8	63%	0.63	74%	0.742	S	S	*	*			trans	65	159.6	153.4	-62.8	-163.7	157.8	63.9	0	124.1
546	D	27.9	Very low	27.1	Very low	118 Å²	118	145.2 Å²	145.2	63%	0.631	74%	0.74	S	S	*	*			cis	-173.1	170.4	-27	-87.8	-16.6	0	0	0	112.7
547	F	28.2	Very low	27	Very low	176 Å²	176	148.5 Å²	148.5	77%	0.772	75%	0.745	S	S	*	*			trans	106.6	107.8	153.5	-74.5	-81.5	0	0	0	126.2
548	D	28.9	Very low	27	Very low	137 Å²	137	145 Å²	145	73%	0.733	73%	0.731	S	S	*	*				42.4	158.9	126.3	-54.2	7.9	0	0	0	126.3
549	E	28	Very low	27	Very low	156 Å²	156	146.6 Å²	146.6	73%	0.729	73%	0.734	S	S	*	*			cis	-175	166.7	-34.5	-154.4	-174.7	-141.3	0	0	112.6
550	N	28	Very low	27	Very low	126 Å²	126	142.1 Å²	142.1	67%	0.674	73%	0.727	S	S	*	*			trans	76.9	151.9	157	-66.7	-50.7	0	0	0	123.9
551	E	27.1	Very low	26.9	Very low	161 Å²	161	141.1 Å²	141.1	75%	0.752	73%	0.729	S	S	*	*			cis	-169.4	-178.8	-30.9	-141.4	-141.3	134.3	0	0	114.1
552	L	25.7	Very low	26.7	Very low	144 Å²	144	137.8 Å²	137.8	75%	0.754	72%	0.717	S	S	*	*			trans	90.1	158.6	162.8	-107.1	78.7	0	0	0	124.6
553	T	26.9	Very low	26.6	Very low	120 Å²	120	138.8 Å²	138.8	74%	0.736	72%	0.716	S	S	*	*			trans	-131.4	-159.8	-155.9	61	0	0	0	0	114.8
554	T	25.6	Very low	26.4	Very low	111 Å²	111	136.1 Å²	136.1	68%	0.681	71%	0.712	S	S	*	*			cis	-165.9	168.6	19	-15.1	0	0	0	0	114.6
555	T	25.6	Very low	26.3	Very low	141 Å²	141	136.5 Å²	136.5	87%	0.865	72%	0.719	S	S	*	*			trans	66.7	171.7	158.3	57.4	0	0	0	0	120.5
556	A	26.6	Very low	26.2	Very low	83 Å²	83	135.3 Å²	135.3	69%	0.686	73%	0.729	S	S	*	*			cis	-172.1	-175	-38.6	0	0	0	0	0	109.2
557	Q	25.3	Very low	26.2	Very low	164 Å²	164	137.1 Å²	137.1	77%	0.766	74%	0.739	S	S	*	*			cis	-164.5	152.4	-1.7	-143.1	-167.3	102.7	0	0	114.2
558	N	26.8	Very low	26.1	Very low	81 Å²	81	132.9 Å²	132.9	43%	0.433	74%	0.736	S	S	.	*			trans	36	127.5	150.2	-74.9	-34.2	0	0	0	127.4	K429	K429-N558 WeakPolarHBondContact CE-OD1 3.49Å; K429-N558 PolarHBondContact NZ-OD1 3.45Å
559	H	26.3	Very low	26	Very low	178 Å²	178	133 Å²	133	82%	0.824	74%	0.742	S	S	*	*				-177.2	-176.9	105.6	-105.6	-73.2	0	0	0	115
560	S	26.2	Very low	25.8	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	74%	0.742	S	S	*	*			trans	-162.5	154.7	-151.8	57.2	0	0	0	0	118.6
561	Q	24.6	Very low	25.7	Very low	173 Å²	173	134.4 Å²	134.4	81%	0.808	75%	0.753	S	S	*	*			trans	-159.5	-161.7	152.5	-129	176.9	103.3	0	0	115.4
562	S	24	Very low	25.6	Very low	82 Å²	82	132.9 Å²	132.9	57%	0.573	75%	0.75	S	S	*	*			trans	-147.4	-160.4	-148.7	56.3	0	0	0	0	117.3
563	Y	24.1	Very low	25.7	Very low	188 Å²	188	134.1 Å²	134.1	74%	0.737	76%	0.757	S	S	*	*			trans	85.7	143.4	170.4	-49.5	-68.4	0	0	0	118.5
564	T	24	Very low	25.6	Very low	131 Å²	131	135.3 Å²	135.3	80%	0.804	76%	0.759	S	S	*	*			cis	-161.6	168.6	-30.4	11.3	0	0	0	0	110.7
565	N	25.5	Very low	25.5	Very low	154 Å²	154	136.8 Å²	136.8	82%	0.824	77%	0.768	S	S	*	*			trans	-101.5	169.8	-171.6	-71.6	-9.3	0	0	0	116.6
566	S	26	Very low	25.4	Very low	120 Å²	120	136.6 Å²	136.6	84%	0.839	77%	0.767	S	S	*	*			trans	-152.1	157.3	151.3	57.3	0	0	0	0	112.3
567	N	26	Very low	25.4	Very low	156 Å²	156	137.3 Å²	137.3	83%	0.834	76%	0.762	S	S	*	*			trans	-133.1	159.2	-166.8	-69.1	-14.7	0	0	0	113.6
568	A	26.5	Very low	25.4	Very low	86 Å²	86	134.5 Å²	134.5	71%	0.711	76%	0.761	S	S	*	*			trans	-155.3	106.1	158.7	0	0	0	0	0	110
569	T	26.4	Very low	25.3	Very low	141 Å²	141	138.7 Å²	138.7	87%	0.865	78%	0.782	S	S	*	*				80.7	144.1	104.2	54	0	0	0	0	116.5
570	I	24.6	Very low	25.4	Very low	141 Å²	141	134.3 Å²	134.3	72%	0.723	77%	0.768	S	S	*	*			trans	-134.2	151.7	-164	-64.8	165.9	0	0	0	109.2	N572	I570-N572 VanDerWaalsContact CG2-OD1 3.31Å; I570-N572 WeakPolarHBondContact CG2-OD1 3.42Å
571	D	26.5	Very low	25.7	Very low	169 Å²	169	132.5 Å²	132.5	90%	0.904	76%	0.756	S	S	*	*			trans	-133.8	143.1	155.4	-95	-46.2	0	0	0	109.8
572	N	25.3	Very low	26.2	Very low	130 Å²	130	133 Å²	133	70%	0.695	76%	0.755	S	S	*	*			trans	-114.4	157.9	-172.9	-73.8	-14.3	0	0	0	112.5	I570	I570-N572 VanDerWaalsContact CG2-OD1 3.31Å; I570-N572 WeakPolarHBondContact CG2-OD1 3.42Å
573	N	26.7	Very low	26.7	Very low	169 Å²	169	130.1 Å²	130.1	90%	0.904	74%	0.735	S	S	*	*			trans	-157.7	137.5	153.2	-101.1	-57.2	0	0	0	109.9
574	D	24.1	Very low	27.6	Very low	145 Å²	145	122.3 Å²	122.3	78%	0.775	71%	0.705	S	S	*	*			trans	-87.3	150.8	-166.5	-63.9	-65.7	0	0	0	115.2
575	T	25.2	Very low	28.2	Very low	142 Å²	142	116.9 Å²	116.9	87%	0.871	67%	0.671	S	S	*	*			trans	-155.6	124.2	143.9	-20	0	0	0	0	110.6
576	T	22.9	Very low	28.5	Very low	137 Å²	137	113.9 Å²	113.9	84%	0.84	65%	0.648	S	S	*	*			trans	-85.7	130.3	-171.5	52.4	0	0	0	0	113.2
577	V	26	Very low	28.8	Very low	98 Å²	98	110.5 Å²	110.5	59%	0.594	62%	0.623	S	S	*	*			trans	-129.5	124.1	168.1	-178.6	0	0	0	0	109
578	S	25.7	Very low	29.1	Very low	105 Å²	105	107.8 Å²	107.8	73%	0.734	61%	0.608	S	S	*	*			trans	-80.6	130.8	-172.6	53.4	0	0	0	0	113.3
579	L	24.1	Very low	29.2	Very low	169 Å²	169	110.3 Å²	110.3	89%	0.885	62%	0.615	S	S	*	*			trans	-82	115.7	175.5	-69.4	163.8	0	0	0	111.5
580	T	29.7	Very low	29.2	Very low	86 Å²	86	107 Å²	107	53%	0.528	60%	0.597	S	S	.	*			trans	-130	123.8	164.9	55.5	0	0	0	0	109.5	K582 I705	T580-K582 PolarHBondContact O-N 3.47Å; T580-I705 HydrophobicContact CG2-CD1 4.12Å
581	S	32.1	Very low	29.5	Very low	60 Å²	60	104.6 Å²	104.6	42%	0.42	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-65.1	127	-177.9	39	0	0	0	0	112
582	K	33.7	Very low	29.7	Very low	184 Å²	184	101.9 Å²	101.9	80%	0.8	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-76.4	137.6	178.9	-64.4	-178.8	179.2	-179.6	0	110.7	T580	T580-K582 PolarHBondContact O-N 3.47Å
583	P	35	Very low	30.2	Very low	22 Å²	22	99.3 Å²	99.3	14%	0.143	57%	0.572	C	S	.	*	P	Polyproline II helix	trans	-67.2	155.2	173.6	29.7	-35.9	0	0	0	111.6	L776 A779	P583-L776 HydrophobicContact CB-CG 4.1Å; P583-L776 HydrophobicContact CG-CD1 4.33Å; P583-L776 HydrophobicContact CG-CD2 3.84Å; P583-L776 HydrophobicContact CG-CG 3.79Å; P583-A779 HydrophobicContact CG-CB 3.82Å
584	I	43.4	Very low	30.4	Very low	23 Å²	23	94.2 Å²	94.2	12%	0.118	55%	0.545	C	S	.	.	S	Bend	trans	-88	-18	-161.9	-72.9	170	0	0	0	114.2	S607	I584-S607 VanDerWaalsContact CG2-CB 3.41Å
585	I	37.5	Very low	30.7	Very low	17 Å²	17	95.5 Å²	95.5	9%	0.087	55%	0.546	C	S	.	.			trans	-100.6	127.8	-170.5	-53.8	175.7	0	0	0	111.2	L693 A779 I870	I585-L693 HydrophobicContact CD1-CD1 4.17Å; I585-L693 HydrophobicContact CD1-CD2 3.75Å; I585-A779 VanDerWaalsContact O-CB 3.23Å; I585-A779 WeakPolarHBondContact O-CB 3.38Å; I585-I870 HydrophobicContact CD1-CG2 4.43Å; I585-I870 HydrophobicContact CG2-CD1 3.64Å; I585-I870 HydrophobicContact CG2-CG1 3.88Å
586	R	30.2	Very low	31.1	Very low	92 Å²	92	96.5 Å²	96.5	35%	0.347	55%	0.546	S	S	.	.			trans	-112.6	154.3	172.1	-81.2	178.8	155.7	-174.1	-20	111.2	L610 L611 Y613 S614	R586-L610 PolarHBondContact NH1-O 3.34Å; R586-L611 HydrophobicContact CG-CD2 4.33Å; R586-Y613 VanDerWaalsContact CZ-O 3.32Å; R586-Y613 PolarHBondContact NH1-O 3.37Å; R586-Y613 PolarHBondContact NH2-O 3.33Å; R586-S614 PolarHBondContact NH2-O 2.92Å
587	T	32.1	Very low	31.7	Very low	48 Å²	48	91.1 Å²	91.1	29%	0.294	51%	0.513	S	S	.	.			trans	-99.4	11.8	-170.4	47.2	0	0	0	0	114.4	T589 I866	T587-T589 PolarHBondContact O-N 2.93Å; T587-I866 HydrophobicContact CG2-CB 4.12Å; T587-I866 HydrophobicContact CG2-CG1 4.22Å; T587-I866 HydrophobicContact CG2-CG2 3.83Å
588	D	32.4	Very low	32.3	Very low	100 Å²	100	92.2 Å²	92.2	54%	0.535	52%	0.52	S	S	.	.			trans	-68.8	114.2	-169.4	-67.4	-50.3	0	0	0	113.9	S590	D588-S590 PolarHBondContact O-N 3.4Å
589	T	28.6	Very low	33	Very low	138 Å²	138	90.6 Å²	90.6	85%	0.847	51%	0.506	S	S	*	.	S	Bend	trans	-72.5	87.4	-168.9	-48.7	0	0	0	0	113.9	T587	T587-T589 PolarHBondContact O-N 2.93Å
590	S	27.4	Very low	33.7	Very low	71 Å²	71	83.2 Å²	83.2	50%	0.497	47%	0.467	S	S	.	.			trans	-146.1	30.5	170.9	60.6	0	0	0	0	113.9	D588 S592	D588-S590 PolarHBondContact O-N 3.4Å; S590-S592 PolarHBondContact O-N 2.79Å
591	L	31.6	Very low	33.9	Very low	91 Å²	91	84.8 Å²	84.8	48%	0.476	47%	0.472	S	S	.	.			trans	-93.6	45.8	-162.2	-54.4	-179.2	0	0	0	114.8	L594	L591-L594 HydrophobicContact CB-CD1 4.34Å; L591-L594 HydrophobicContact CD2-CD1 3.91Å
592	S	30.2	Very low	34.2	Very low	112 Å²	112	83.8 Å²	83.8	78%	0.783	46%	0.462	S	S	*	.	S	Bend	trans	-79.3	-21.8	175.6	48.9	0	0	0	0	114.2	S590	S590-S592 PolarHBondContact O-N 2.79Å
593	S	34.8	Very low	34.4	Very low	77 Å²	77	77 Å²	77	54%	0.538	44%	0.435	S	S	.	.	S	Bend	trans	-102.7	33	-170.3	75.6	0	0	0	0	115	R316	R316-S593 PolarHBondContact NH1-OG 3.41Å
594	L	31.7	Very low	34.3	Very low	62 Å²	62	77.1 Å²	77.1	33%	0.325	43%	0.434	S	S	.	.			trans	-121.4	56.9	-172.2	-77.6	178.7	0	0	0	114	L591 R656	L591-L594 HydrophobicContact CB-CD1 4.34Å; L591-L594 HydrophobicContact CD2-CD1 3.91Å; L594-R656 PolarHBondContact O-NH1 2.8Å; L594-R656 VanDerWaalsContact O-NH1 3.16Å
595	Q	30.8	Very low	33.8	Very low	172 Å²	172	78 Å²	78	80%	0.804	44%	0.442	S	S	*	.	S	Bend	trans	-96.5	-30.9	178.8	-69.4	-173.3	-21.1	0	0	114.7
596	N	33.7	Very low	33.7	Very low	163 Å²	163	81 Å²	81	87%	0.872	46%	0.455	S	S	*	.			trans	-118.8	87.6	-176.4	-73.9	-31.2	0	0	0	113.3
597	T	34.6	Very low	33.7	Very low	24 Å²	24	78.3 Å²	78.3	15%	0.147	45%	0.45	C	S	.	.			trans	-139.3	136.1	163.9	51.3	0	0	0	0	110.9	K652	T597-K652 PolarHBondContact O-NZ 2.92Å; T597-K652 VanDerWaalsContact O-NZ 3.12Å
598	T	39.6	Very low	33.6	Very low	121 Å²	121	79 Å²	79	74%	0.742	45%	0.451	S	S	*	.			trans	-121.6	-10.2	-165.9	43.6	0	0	0	0	115.6
599	T	40.4	Very low	33.5	Very low	71 Å²	71	78.3 Å²	78.3	44%	0.436	45%	0.451	S	S	.	.			trans	-134.8	145.9	-177.1	55.4	0	0	0	0	112.8	N601 D602	T599-N601 PolarHBondContact O-N 2.9Å; T599-D602 PolarHBondContact O-N 2.91Å
600	I	38.1	Very low	33.6	Very low	13 Å²	13	77.1 Å²	77.1	7%	0.067	44%	0.439	C	S	.	.	H	α-helix	trans	-65.6	-37	-177.2	-72.1	172.7	0	0	0	112.6	D602 L603 L604 E644 T696 L876	I600-D602 PolarHBondContact O-N 2.8Å; I600-D602 VanDerWaalsContact O-N 3.15Å; I600-L603 WeakPolarHBondContact O-CB 3.41Å; I600-L603 PolarHBondContact O-N 3.11Å; I600-L603 VanDerWaalsContact O-N 3.14Å; I600-L604 PolarHBondContact O-N 3.37Å; I600-E644 HydrophobicContact CD1-CG 3.87Å; I600-E644 WeakPolarHBondContact CD1-OE1 3.5Å; I600-E644 HydrophobicContact CG1-CG 4.45Å; I600-E644 WeakPolarHBondContact CG1-OE1 3.3Å; I600-E644 PolarHBondContact N-OE1 2.84Å; I600-T696 HydrophobicContact CG2-CG2 3.44Å; I600-T696 VanDerWaalsContact CG2-CG2 3.44Å; I600-T696 WeakPolarHBondContact CG2-OG1 3.36Å; I600-L876 HydrophobicContact CD1-CD1 4.18Å; I600-L876 HydrophobicContact CG1-CD1 3.57Å
601	N	34.9	Very low	33.6	Very low	120 Å²	120	76.7 Å²	76.7	64%	0.642	43%	0.431	S	S	*	.	H	α-helix	trans	-60.4	-26.9	-179.8	-68.7	-29.4	0	0	0	113	T599 L604 S605	T599-N601 PolarHBondContact O-N 2.9Å; N601-L604 PolarHBondContact O-N 3.19Å; N601-S605 PolarHBondContact O-N 3.28Å
602	D	38.3	Very low	33.3	Very low	39 Å²	39	75.9 Å²	75.9	21%	0.209	44%	0.437	C	S	.	.	H	α-helix	trans	-82.5	-20.1	-177.8	-149.7	41.5	0	0	0	113	T599 I600 S605 K606	T599-D602 PolarHBondContact O-N 2.91Å; I600-D602 PolarHBondContact O-N 2.8Å; I600-D602 VanDerWaalsContact O-N 3.15Å; D602-S605 PolarHBondContact O-OG 2.79Å; D602-S605 PolarHBondContact OD1-OG 3.07Å; D602-K606 VanDerWaalsContact CG-NZ 3.35Å; D602-K606 WeakPolarHBondContact O-CB 3.47Å; D602-K606 WeakPolarHBondContact O-CD 3.46Å; D602-K606 WeakPolarHBondContact O-CG 3.36Å; D602-K606 PolarHBondContact O-N 3.03Å; D602-K606 WeakPolarHBondContact OD1-CE 3.5Å; D602-K606 IonicContact OD1-NZ 2.76Å; D602-K606 PolarHBondContact OD1-NZ 2.96Å; D602-K606 WeakPolarHBondContact OD2-CE 3.48Å; D602-K606 IonicContact OD2-NZ 3.73Å; D602-K606 PolarHBondContact OD2-NZ 2.94Å
603	L	36.2	Very low	33.1	Very low	42 Å²	42	79.8 Å²	79.8	22%	0.22	44%	0.436	C	S	.	.	H	α-helix	trans	-70.7	-46	165.6	-68.8	165.1	0	0	0	110.1	I600 K606 S607	I600-L603 WeakPolarHBondContact O-CB 3.41Å; I600-L603 PolarHBondContact O-N 3.11Å; I600-L603 VanDerWaalsContact O-N 3.14Å; L603-K606 PolarHBondContact O-N 2.71Å; L603-S607 PolarHBondContact O-N 3.47Å; L603-S607 PolarHBondContact O-OG 2.9Å
604	L	33.5	Very low	32.7	Very low	24 Å²	24	80 Å²	80	13%	0.126	44%	0.438	C	S	.	.	H	α-helix	trans	-65.9	-39.3	179.5	-65.1	-172.6	0	0	0	113.4	I600 N601 K606 N608 T696 N697	I600-L604 PolarHBondContact O-N 3.37Å; N601-L604 PolarHBondContact O-N 3.19Å; L604-K606 VanDerWaalsContact C-N 3.31Å; L604-K606 PolarHBondContact O-N 2.79Å; L604-N608 PolarHBondContact O-N 3.21Å; L604-N608 PolarHBondContact O-ND2 3.42Å; L604-T696 HydrophobicContact CD1-CG2 3.68Å; L604-T696 HydrophobicContact CD2-CG2 3.78Å; L604-T696 HydrophobicContact CG-CG2 3.85Å; L604-N697 WeakPolarHBondContact CD2-OD1 3.26Å
605	S	33.5	Very low	32.6	Very low	42 Å²	42	84.6 Å²	84.6	29%	0.294	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-39.3	177.4	71.3	0	0	0	0	111.7	N601 D602 T609	N601-S605 PolarHBondContact O-N 3.28Å; D602-S605 PolarHBondContact O-OG 2.79Å; D602-S605 PolarHBondContact OD1-OG 3.07Å; S605-T609 PolarHBondContact O-OG1 2.72Å
606	K	35.1	Very low	32.4	Very low	80 Å²	80	84 Å²	84	35%	0.348	47%	0.465	S	S	.	.	H	α-helix	trans	-86.7	-33.1	-173.5	-70.1	168.2	-174.5	169.9	0	113.8	D602 L603 L604 N608 T609	D602-K606 VanDerWaalsContact CG-NZ 3.35Å; D602-K606 WeakPolarHBondContact O-CB 3.47Å; D602-K606 WeakPolarHBondContact O-CD 3.46Å; D602-K606 WeakPolarHBondContact O-CG 3.36Å; D602-K606 PolarHBondContact O-N 3.03Å; D602-K606 WeakPolarHBondContact OD1-CE 3.5Å; D602-K606 IonicContact OD1-NZ 2.76Å; D602-K606 PolarHBondContact OD1-NZ 2.96Å; D602-K606 WeakPolarHBondContact OD2-CE 3.48Å; D602-K606 IonicContact OD2-NZ 3.73Å; D602-K606 PolarHBondContact OD2-NZ 2.94Å; L603-K606 PolarHBondContact O-N 2.71Å; L604-K606 VanDerWaalsContact C-N 3.31Å; L604-K606 PolarHBondContact O-N 2.79Å; K606-N608 VanDerWaalsContact C-N 3.32Å; K606-N608 PolarHBondContact O-N 2.8Å; K606-T609 PolarHBondContact O-N 2.85Å; K606-T609 PolarHBondContact O-OG1 3.38Å
607	S	31	Very low	32.1	Very low	35 Å²	35	83.3 Å²	83.3	25%	0.245	46%	0.461	C	S	.	.	H	α-helix	trans	-63.9	-36.3	172.7	-66.3	0	0	0	0	112.5	I584 L603 T609 L610	I584-S607 VanDerWaalsContact CG2-CB 3.41Å; L603-S607 PolarHBondContact O-N 3.47Å; L603-S607 PolarHBondContact O-OG 2.9Å; S607-T609 PolarHBondContact O-N 2.77Å; S607-T609 VanDerWaalsContact O-N 3.15Å; S607-L610 PolarHBondContact O-N 2.96Å; S607-L610 VanDerWaalsContact O-N 3.16Å
608	N	29.1	Very low	31.6	Very low	62 Å²	62	90.5 Å²	90.5	33%	0.332	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.1	175.7	-85.3	-70.6	0	0	0	113.9	L604 K606	L604-N608 PolarHBondContact O-N 3.21Å; L604-N608 PolarHBondContact O-ND2 3.42Å; K606-N608 VanDerWaalsContact C-N 3.32Å; K606-N608 PolarHBondContact O-N 2.8Å
609	T	31.3	Very low	31.1	Very low	86 Å²	86	90.7 Å²	90.7	53%	0.528	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-16.7	179.4	-31.9	0	0	0	0	113.2	S605 K606 S607	S605-T609 PolarHBondContact O-OG1 2.72Å; K606-T609 PolarHBondContact O-N 2.85Å; K606-T609 PolarHBondContact O-OG1 3.38Å; S607-T609 PolarHBondContact O-N 2.77Å; S607-T609 VanDerWaalsContact O-N 3.15Å
610	L	29	Very low	30.3	Very low	113 Å²	113	96.5 Å²	96.5	59%	0.592	51%	0.512	S	S	*	.	S	Bend	trans	-95.8	1.6	-176.6	-68.4	173	0	0	0	114.3	R586 S607 A612	R586-L610 PolarHBondContact NH1-O 3.34Å; S607-L610 PolarHBondContact O-N 2.96Å; S607-L610 VanDerWaalsContact O-N 3.16Å; L610-A612 PolarHBondContact O-N 3.3Å
611	L	27.6	Very low	29.8	Very low	62 Å²	62	99.2 Å²	99.2	33%	0.325	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	7.3	178.5	-66.8	171.2	0	0	0	114.4	R586	R586-L611 HydrophobicContact CG-CD2 4.33Å
612	A	27	Very low	29.4	Very low	73 Å²	73	101.4 Å²	101.4	60%	0.603	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	5.6	-165.8	0	0	0	0	0	116.5	L610	L610-A612 PolarHBondContact O-N 3.3Å
613	Y	25.4	Very low	28.9	Very low	194 Å²	194	105.8 Å²	105.8	76%	0.761	58%	0.576	S	S	*	*	S	Bend	trans	-134.4	166.6	175.1	-69.6	-79.5	0	0	0	111.4	R586	R586-Y613 VanDerWaalsContact CZ-O 3.32Å; R586-Y613 PolarHBondContact NH1-O 3.37Å; R586-Y613 PolarHBondContact NH2-O 3.33Å
614	S	26.4	Very low	28.6	Very low	83 Å²	83	108.2 Å²	108.2	58%	0.58	60%	0.597	S	S	*	*	S	Bend	trans	55.8	75.7	-178.1	-55.7	0	0	0	0	114.8	R586	R586-S614 PolarHBondContact NH2-O 2.92Å
615	N	29.2	Very low	28.5	Very low	158 Å²	158	114.6 Å²	114.6	85%	0.845	62%	0.624	S	S	*	*				-175.1	131.3	109.9	-89.6	-9.1	0	0	0	110
616	N	25.9	Very low	28.9	Very low	158 Å²	158	117.3 Å²	117.3	85%	0.845	64%	0.64	S	S	*	*			trans	-83.6	121.5	167.3	-67	-31.3	0	0	0	108.2
617	D	27.7	Very low	29.5	Very low	149 Å²	149	125.3 Å²	125.3	80%	0.797	67%	0.668	S	S	*	*				-178.3	125.6	126	-95.5	-22.6	0	0	0	112
618	M	25.3	Very low	30.9	Very low	176 Å²	176	127.6 Å²	127.6	87%	0.867	68%	0.675	S	S	*	*			trans	61.1	155.9	160	-61.2	-65.8	-172.8	0	0	120.7
619	I	29	Very low	32.8	Very low	124 Å²	124	127.7 Å²	127.7	64%	0.636	67%	0.67	S	S	*	*			trans	68.3	87.5	171.1	-44.4	-177.6	0	0	0	116	S621	I619-S621 PolarHBondContact O-N 3.34Å
620	E	24	Very low	34.8	Very low	193 Å²	193	127.5 Å²	127.5	90%	0.902	67%	0.67	S	S	*	*			trans	-76.5	98	158.5	-74.1	-172.8	111.6	0	0	110.8
621	S	26.5	Very low	37	Very low	71 Å²	71	123 Å²	123	50%	0.497	65%	0.647	S	S	.	*			trans	-146.9	106.4	166	62.9	0	0	0	0	112.7	I619	I619-S621 PolarHBondContact O-N 3.34Å
622	I	26.6	Very low	39.4	Very low	166 Å²	166	126.8 Å²	126.8	85%	0.851	66%	0.658	S	S	*	*			trans	51.7	67.2	160.7	-40.8	180	0	0	0	115.1	S624	I622-S624 PolarHBondContact O-N 2.95Å; I622-S624 VanDerWaalsContact O-N 3.07Å
623	S	27.8	Very low	42	Very low	130 Å²	130	123.8 Å²	123.8	91%	0.909	63%	0.631	S	S	*	*			trans	-78.6	86.8	170.7	-172.4	0	0	0	0	112
624	S	30.5	Very low	44.8	Very low	94 Å²	94	121.2 Å²	121.2	66%	0.657	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-74.3	132.4	161.4	56	0	0	0	0	110	I622	I622-S624 PolarHBondContact O-N 2.95Å; I622-S624 VanDerWaalsContact O-N 3.07Å
625	K	32	Very low	47.7	Very low	158 Å²	158	117.9 Å²	117.9	69%	0.687	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-52.2	135.7	168.5	-71	-172.8	176.8	-173.3	0	109.6	R627	K625-R627 PolarHBondContact O-N 2.95Å
626	P	40.4	Very low	50.6	Low	98 Å²	98	110.5 Å²	110.5	64%	0.636	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-59.6	126.5	178.1	24.8	-33.3	0	0	0	109.9	H628	P626-H628 PolarHBondContact O-N 3.31Å
627	R	47.3	Very low	53.5	Low	249 Å²	249	106.2 Å²	106.2	94%	0.94	54%	0.542	S	S	*	.			trans	-79.7	102.8	176.8	-72.9	-179.6	173.4	173.3	-1.6	109.1	K625 R629	K625-R627 PolarHBondContact O-N 2.95Å; R627-R629 PolarHBondContact O-N 2.87Å
628	H	61.1	Low	56.3	Low	82 Å²	82	101.3 Å²	101.3	38%	0.38	52%	0.522	S	S	.	.			trans	-68.2	128.2	172.6	-168.5	-83.4	0	0	0	110.3	P626 T630 N700	P626-H628 PolarHBondContact O-N 3.31Å; H628-T630 PolarHBondContact O-N 3.06Å; H628-N700 WeakPolarHBondContact CA-OD1 3.35Å; H628-N700 VanDerWaalsContact CD2-CG 3.47Å; H628-N700 PolarHBondContact CD2-OD1 2.95Å; H628-N700 VanDerWaalsContact CD2-OD1 3.29Å; H628-N700 PolarHBondContact CE1-ND2 3.16Å; H628-N700 VanDerWaalsContact CG-OD1 3.31Å; H628-N700 VanDerWaalsContact NE2-CG 3.31Å
629	R	68.6	Low	59.2	Low	64 Å²	64	93.5 Å²	93.5	24%	0.242	48%	0.483	C	S	.	.			trans	-75	111.1	171.5	177.4	-171.6	-172.4	165.6	5.3	108.8	R627 V631 N700 D755 Y756	R627-R629 PolarHBondContact O-N 2.87Å; R629-V631 HydrophobicContact CG-CG2 4.16Å; R629-N700 PolarHBondContact N-OD1 3.44Å; R629-N700 PolarHBondContact O-ND2 3.12Å; R629-D755 IonicContact CZ-OD2 2.79Å; R629-D755 VanDerWaalsContact CZ-OD2 3.27Å; R629-D755 PolarHBondContact NH1-O 3.5Å; R629-D755 IonicContact NH1-OD1 2.94Å; R629-D755 PolarHBondContact NH1-OD1 2.69Å; R629-D755 VanDerWaalsContact NH1-OD1 3.12Å; R629-D755 IonicContact NH1-OD2 3.59Å; R629-D755 PolarHBondContact NH1-OD2 2.8Å; R629-D755 IonicContact NH2-OD2 3.74Å; R629-D755 PolarHBondContact NH2-OD2 2.98Å; R629-Y756 VanDerWaalsContact NH2-CE1 3.27Å; R629-Y756 PolarHBondContact NH2-OH 3.22Å
630	T	73.1	Confident	62	Low	83 Å²	83	89.2 Å²	89.2	51%	0.509	46%	0.46	S	S	.	.			trans	-70.7	132.1	165.6	-45.1	0	0	0	0	109.2	H628 Y632	H628-T630 PolarHBondContact O-N 3.06Å; T630-Y632 HydrophobicContact CG2-CD2 4.28Å; T630-Y632 HydrophobicContact CG2-CE1 4.01Å; T630-Y632 HydrophobicContact CG2-CE2 3.58Å; T630-Y632 VanDerWaalsContact CG2-CZ 3.43Å
631	V	75	Confident	64.9	Low	18 Å²	18	87.7 Å²	87.7	11%	0.109	45%	0.446	C	S	.	.			trans	-112.9	124	-178.4	175	0	0	0	0	108.5	R629 L633 F698	R629-V631 HydrophobicContact CG-CG2 4.16Å; V631-L633 HydrophobicContact CG1-CB 3.93Å; V631-L633 HydrophobicContact CG1-CD1 3.75Å; V631-L633 HydrophobicContact CG1-CG 3.78Å; V631-F698 HydrophobicContact CG1-CD1 4Å; V631-F698 HydrophobicContact CG1-CE1 4.45Å; V631-F698 HydrophobicContact CG2-CD1 4.26Å
632	Y	78.1	Confident	67.6	Low	142 Å²	142	89 Å²	89	56%	0.557	45%	0.448	S	S	*	.			trans	-110.8	16.8	-177.2	-63.5	-82.2	0	0	0	112.7	T630 M634	T630-Y632 HydrophobicContact CG2-CD2 4.28Å; T630-Y632 HydrophobicContact CG2-CE1 4.01Å; T630-Y632 HydrophobicContact CG2-CE2 3.58Å; T630-Y632 VanDerWaalsContact CG2-CZ 3.43Å; Y632-M634 PolarHBondContact O-N 3.17Å
633	L	83.1	Confident	70.3	Confident	9 Å²	9	81.7 Å²	81.7	5%	0.047	41%	0.41	C	S	.	.			trans	-64.8	119.1	177.9	-66.3	170.4	0	0	0	110.3	Q456 V631 S635 I636 L637 F698 Y756 F808	Q456-L633 HydrophobicContact CB-CD2 3.97Å; Q456-L633 WeakPolarHBondContact O-CD2 3.29Å; V631-L633 HydrophobicContact CG1-CB 3.93Å; V631-L633 HydrophobicContact CG1-CD1 3.75Å; V631-L633 HydrophobicContact CG1-CG 3.78Å; L633-S635 PolarHBondContact O-N 3.1Å; L633-I636 HydrophobicContact CB-CB 4.23Å; L633-I636 HydrophobicContact CB-CG1 4.03Å; L633-I636 HydrophobicContact CD1-CG1 4.19Å; L633-I636 PolarHBondContact O-N 3.02Å; L633-I636 VanDerWaalsContact O-N 3.08Å; L633-L637 WeakPolarHBondContact O-CG 3.44Å; L633-L637 PolarHBondContact O-N 3.03Å; L633-F698 HydrophobicContact CD1-CE1 3.82Å; L633-Y756 HydrophobicContact CD1-CE1 3.98Å; L633-F808 HydrophobicContact CD1-CE2 3.91Å; L633-F808 HydrophobicContact CD1-CZ 4.32Å
634	M	84.6	Confident	72.7	Confident	141 Å²	141	79.1 Å²	79.1	70%	0.695	38%	0.384	S	S	*	.	H	α-helix	trans	-59.3	-34.2	-179.7	-69.2	-62.2	134.3	0	0	112.2	Y632 L637 A638	Y632-M634 PolarHBondContact O-N 3.17Å; M634-L637 HydrophobicContact CE-CD1 3.91Å; M634-L637 PolarHBondContact O-N 3.33Å; M634-L637 HydrophobicContact SD-CD1 4.4Å; M634-A638 VanDerWaalsContact O-CB 3.25Å; M634-A638 WeakPolarHBondContact O-CB 3.47Å; M634-A638 PolarHBondContact O-N 3.29Å
635	S	87.3	Confident	75	Confident	13 Å²	13	79.2 Å²	79.2	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-53.6	-53.4	170.8	52	0	0	0	0	112.5	L633 A638 L639 E804	L633-S635 PolarHBondContact O-N 3.1Å; S635-A638 PolarHBondContact O-N 3.06Å; S635-L639 VanDerWaalsContact O-CG 3.31Å; S635-L639 WeakPolarHBondContact O-CG 3.16Å; S635-L639 PolarHBondContact O-N 3.36Å; S635-E804 WeakPolarHBondContact CB-OE1 3.48Å; S635-E804 PolarHBondContact OG-OE1 2.84Å
636	I	88.7	Confident	77	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-70.6	-36.7	-179.9	-59.1	-58.2	0	0	0	111.9	L633 L639 K640 L695 F698 F808	L633-I636 HydrophobicContact CB-CB 4.23Å; L633-I636 HydrophobicContact CB-CG1 4.03Å; L633-I636 HydrophobicContact CD1-CG1 4.19Å; L633-I636 PolarHBondContact O-N 3.02Å; L633-I636 VanDerWaalsContact O-N 3.08Å; I636-L639 HydrophobicContact CD1-CD1 4.47Å; I636-L639 PolarHBondContact O-N 3.45Å; I636-K640 HydrophobicContact CG2-CD 4.42Å; I636-K640 WeakPolarHBondContact O-CB 3.31Å; I636-K640 WeakPolarHBondContact O-CG 3.38Å; I636-K640 PolarHBondContact O-N 2.91Å; I636-L695 HydrophobicContact CD1-CD2 4.25Å; I636-F698 HydrophobicContact CD1-CD1 4.22Å; I636-F698 HydrophobicContact CD1-CD2 3.7Å; I636-F698 HydrophobicContact CD1-CE1 3.98Å; I636-F698 HydrophobicContact CD1-CE2 3.43Å; I636-F698 VanDerWaalsContact CD1-CE2 3.43Å; I636-F698 HydrophobicContact CD1-CG 4.08Å; I636-F698 HydrophobicContact CD1-CZ 3.59Å; I636-F698 HydrophobicContact CG1-CD1 3.92Å; I636-F698 HydrophobicContact CG1-CD2 4.28Å; I636-F698 HydrophobicContact CG1-CE1 3.75Å; I636-F698 HydrophobicContact CG1-CE2 4.15Å; I636-F698 HydrophobicContact CG1-CG 4.16Å; I636-F698 HydrophobicContact CG1-CZ 3.89Å; I636-F698 HydrophobicContact CG2-CB 4.24Å; I636-F698 HydrophobicContact CG2-CG 4.28Å; I636-F808 HydrophobicContact CD1-CB 3.74Å; I636-F808 HydrophobicContact CD1-CD2 3.54Å; I636-F808 HydrophobicContact CD1-CE2 4.38Å; I636-F808 HydrophobicContact CD1-CG 3.89Å; I636-F808 HydrophobicContact CG1-CD2 3.98Å; I636-F808 HydrophobicContact CG1-CE2 4.4Å
637	L	87.2	Confident	79.1	Confident	69 Å²	69	70.2 Å²	70.2	36%	0.361	34%	0.337	S	S	.	.	H	α-helix	trans	-67.9	-38.4	176.9	-67.3	173.2	0	0	0	111.8	L633 M634 K640 R641	L633-L637 WeakPolarHBondContact O-CG 3.44Å; L633-L637 PolarHBondContact O-N 3.03Å; M634-L637 HydrophobicContact CE-CD1 3.91Å; M634-L637 PolarHBondContact O-N 3.33Å; M634-L637 HydrophobicContact SD-CD1 4.4Å; L637-K640 PolarHBondContact O-N 3.11Å; L637-R641 WeakPolarHBondContact O-CB 3.3Å; L637-R641 PolarHBondContact O-N 3.26Å
638	A	86.4	Confident	81	Confident	46 Å²	46	58.7 Å²	58.7	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-65.2	-46.7	172.3	0	0	0	0	0	111.8	M634 S635 K640 R641 N642	M634-A638 VanDerWaalsContact O-CB 3.25Å; M634-A638 WeakPolarHBondContact O-CB 3.47Å; M634-A638 PolarHBondContact O-N 3.29Å; S635-A638 PolarHBondContact O-N 3.06Å; A638-K640 VanDerWaalsContact C-N 3.29Å; A638-K640 PolarHBondContact O-N 2.93Å; A638-R641 PolarHBondContact O-N 3.45Å; A638-N642 WeakPolarHBondContact O-CB 3.44Å; A638-N642 PolarHBondContact O-N 3.03Å; A638-N642 PolarHBondContact O-OD1 3.32Å
639	L	87	Confident	82.1	Confident	11 Å²	11	59.3 Å²	59.3	6%	0.058	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-36.3	176.2	-71.1	171	0	0	0	112.5	S635 I636 L695 E809	S635-L639 VanDerWaalsContact O-CG 3.31Å; S635-L639 WeakPolarHBondContact O-CG 3.16Å; S635-L639 PolarHBondContact O-N 3.36Å; I636-L639 HydrophobicContact CD1-CD1 4.47Å; I636-L639 PolarHBondContact O-N 3.45Å; L639-L695 HydrophobicContact CB-CD1 4.03Å; L639-L695 HydrophobicContact CB-CD2 3.9Å; L639-L695 HydrophobicContact CD1-CD2 3.98Å; L639-E809 HydrophobicContact CD1-CB 4.08Å; L639-E809 HydrophobicContact CD2-CB 4.12Å; L639-E809 HydrophobicContact CD2-CG 4.37Å
640	K	87.9	Confident	83	Confident	35 Å²	35	60.2 Å²	60.2	15%	0.152	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-52.5	170.5	-75.5	178.1	179	-169.9	0	111.9	I636 L637 A638 N642 L643 E644 L695 T696	I636-K640 HydrophobicContact CG2-CD 4.42Å; I636-K640 WeakPolarHBondContact O-CB 3.31Å; I636-K640 WeakPolarHBondContact O-CG 3.38Å; I636-K640 PolarHBondContact O-N 2.91Å; L637-K640 PolarHBondContact O-N 3.11Å; A638-K640 VanDerWaalsContact C-N 3.29Å; A638-K640 PolarHBondContact O-N 2.93Å; K640-N642 VanDerWaalsContact C-N 3.28Å; K640-N642 PolarHBondContact O-N 2.93Å; K640-L643 PolarHBondContact O-N 3.26Å; K640-E644 PolarHBondContact O-N 2.93Å; K640-E644 VanDerWaalsContact O-N 3.09Å; K640-L695 VanDerWaalsContact CE-C 3.45Å; K640-L695 WeakPolarHBondContact CE-O 3.38Å; K640-L695 HydrophobicContact CG-CB 4.39Å; K640-L695 PolarHBondContact NZ-O 3.43Å; K640-T696 PolarHBondContact NZ-O 2.93Å
641	R	84.8	Confident	83.7	Confident	160 Å²	160	56.7 Å²	56.7	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-57.7	-39.6	-179.3	-177.7	173.1	171.2	131.1	-11.6	112	L637 A638 L643 E644 C645	L637-R641 WeakPolarHBondContact O-CB 3.3Å; L637-R641 PolarHBondContact O-N 3.26Å; A638-R641 PolarHBondContact O-N 3.45Å; R641-L643 PolarHBondContact O-N 3.38Å; R641-E644 PolarHBondContact O-N 3.14Å; R641-E644 VanDerWaalsContact O-N 3.13Å; R641-C645 WeakPolarHBondContact O-CB 3.35Å; R641-C645 PolarHBondContact O-N 3.49Å; R641-C645 PolarHBondContact O-SG 3.07Å; R641-C645 VanDerWaalsContact O-SG 3.34Å
642	N	83.3	Confident	84.3	Confident	99 Å²	99	56.9 Å²	56.9	53%	0.529	29%	0.291	S	S	.	.	H	α-helix	trans	-59.7	-31.2	176.5	-72	-10.1	0	0	0	113.3	A638 K640	A638-N642 WeakPolarHBondContact O-CB 3.44Å; A638-N642 PolarHBondContact O-N 3.03Å; A638-N642 PolarHBondContact O-OD1 3.32Å; K640-N642 VanDerWaalsContact C-N 3.28Å; K640-N642 PolarHBondContact O-N 2.93Å
643	L	81.8	Confident	84.7	Confident	12 Å²	12	54.9 Å²	54.9	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-83.9	-31.9	174.9	-64.8	173.3	0	0	0	112.8	K640 R641 L647 Y691 Q692 L695 Y881	K640-L643 PolarHBondContact O-N 3.26Å; R641-L643 PolarHBondContact O-N 3.38Å; L643-L647 VanDerWaalsContact O-CD2 3.25Å; L643-L647 WeakPolarHBondContact O-CD2 3.25Å; L643-L647 WeakPolarHBondContact O-CG 3.29Å; L643-Y691 HydrophobicContact CD1-CD1 4.02Å; L643-Y691 HydrophobicContact CD1-CE1 3.91Å; L643-Y691 HydrophobicContact CD2-CE1 4.38Å; L643-Q692 HydrophobicContact CD1-CG 3.84Å; L643-L695 HydrophobicContact CD1-CD1 3.74Å; L643-Y881 HydrophobicContact CD2-CD1 4.09Å; L643-Y881 HydrophobicContact CD2-CE1 3.94Å
644	E	78.7	Confident	85	Confident	77 Å²	77	55.6 Å²	55.6	36%	0.36	30%	0.295	S	S	.	.	H	α-helix	trans	-77.9	-29.3	178.9	-69.4	-175.4	136.1	0	0	113.1	I600 K640 R641 L647	I600-E644 HydrophobicContact CD1-CG 3.87Å; I600-E644 WeakPolarHBondContact CD1-OE1 3.5Å; I600-E644 HydrophobicContact CG1-CG 4.45Å; I600-E644 WeakPolarHBondContact CG1-OE1 3.3Å; I600-E644 PolarHBondContact N-OE1 2.84Å; K640-E644 PolarHBondContact O-N 2.93Å; K640-E644 VanDerWaalsContact O-N 3.09Å; R641-E644 PolarHBondContact O-N 3.14Å; R641-E644 VanDerWaalsContact O-N 3.13Å; E644-L647 WeakPolarHBondContact O-CD1 3.4Å; E644-L647 WeakPolarHBondContact O-CG 3.34Å
645	C	77.9	Confident	85.2	Confident	95 Å²	95	49 Å²	49	64%	0.642	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.9	-178.8	-73	0	0	0	0	114.9	R641	R641-C645 WeakPolarHBondContact O-CB 3.35Å; R641-C645 PolarHBondContact O-N 3.49Å; R641-C645 PolarHBondContact O-SG 3.07Å; R641-C645 VanDerWaalsContact O-SG 3.34Å
646	D	75.3	Confident	85.3	Confident	32 Å²	32	51.6 Å²	51.6	17%	0.171	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	41	-173	-155.1	-1	0	0	0	113	S878 R879 R880	D646-S878 CarbonylContact O-C 3.54Å; D646-S878 WeakPolarHBondContact O-CA 3.11Å; D646-R879 PolarHBondContact O-N 3.29Å; D646-R879 VanDerWaalsContact OD1-CD 3.23Å; D646-R879 WeakPolarHBondContact OD1-CD 3.45Å; D646-R879 WeakPolarHBondContact OD1-CG 3.34Å; D646-R879 IonicContact OD1-NE 2.73Å; D646-R880 IonicContact OD2-CZ 2.85Å; D646-R880 IonicContact OD2-NE 3.12Å; D646-R880 PolarHBondContact OD2-NE 3.03Å; D646-R880 IonicContact OD2-NH2 3.79Å; D646-R880 PolarHBondContact OD2-NH2 2.87Å
647	L	84.1	Confident	85.4	Confident	35 Å²	35	53.3 Å²	53.3	18%	0.183	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-74	123.3	-175.9	-70.4	173	0	0	0	113.3	L643 E644 Q649 L876	L643-L647 VanDerWaalsContact O-CD2 3.25Å; L643-L647 WeakPolarHBondContact O-CD2 3.25Å; L643-L647 WeakPolarHBondContact O-CG 3.29Å; E644-L647 WeakPolarHBondContact O-CD1 3.4Å; E644-L647 WeakPolarHBondContact O-CG 3.34Å; L647-Q649 PolarHBondContact O-N 3.38Å; L647-L876 HydrophobicContact CD2-CB 3.81Å; L647-L876 WeakPolarHBondContact CD2-O 3.44Å
648	D	86.5	Confident	85.5	Confident	7 Å²	7	50.5 Å²	50.5	4%	0.037	27%	0.268	C	S	.	.			trans	-83.2	94.6	171	-163.6	-49.9	0	0	0	111	S650 I651 K652 P877 R879	D648-S650 PolarHBondContact O-N 3.44Å; D648-S650 WeakPolarHBondContact OD1-CA 3.5Å; D648-S650 WeakPolarHBondContact OD1-CB 3.26Å; D648-S650 PolarHBondContact OD1-N 2.93Å; D648-I651 HydrophobicContact CB-CB 4.29Å; D648-I651 HydrophobicContact CB-CD1 3.9Å; D648-I651 HydrophobicContact CB-CG1 4.12Å; D648-I651 PolarHBondContact O-N 3.49Å; D648-I651 PolarHBondContact OD1-N 2.87Å; D648-K652 PolarHBondContact O-N 2.97Å; D648-P877 PolarHBondContact N-O 3.25Å; D648-R879 HydrophobicContact CB-CG 4.16Å; D648-R879 IonicContact OD2-CZ 3.34Å; D648-R879 VanDerWaalsContact OD2-CZ 3.28Å; D648-R879 IonicContact OD2-NH1 2.98Å; D648-R879 PolarHBondContact OD2-NH1 3.47Å; D648-R879 IonicContact OD2-NH2 3.73Å; D648-R879 PolarHBondContact OD2-NH2 2.85Å
649	Q	85.6	Confident	85.7	Confident	96 Å²	96	55 Å²	55	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-23.3	177.8	-53.4	-61.3	-19.4	0	0	113	L647 K652 N653	L647-Q649 PolarHBondContact O-N 3.38Å; Q649-K652 VanDerWaalsContact OE1-CD 3.29Å; Q649-N653 WeakPolarHBondContact O-CB 3.49Å; Q649-N653 PolarHBondContact O-N 2.64Å; Q649-N653 PolarHBondContact O-ND2 3.37Å; Q649-N653 PolarHBondContact O-OD1 2.75Å
650	S	85.9	Confident	85.9	Confident	82 Å²	82	56.3 Å²	56.3	57%	0.573	29%	0.285	S	S	*	.	H	α-helix	trans	-69.5	-50	176.9	-169.5	0	0	0	0	110.2	D648 K652 N653 T654	D648-S650 PolarHBondContact O-N 3.44Å; D648-S650 WeakPolarHBondContact OD1-CA 3.5Å; D648-S650 WeakPolarHBondContact OD1-CB 3.26Å; D648-S650 PolarHBondContact OD1-N 2.93Å; S650-K652 VanDerWaalsContact C-N 3.3Å; S650-K652 PolarHBondContact O-N 2.79Å; S650-N653 PolarHBondContact O-N 3.42Å; S650-T654 PolarHBondContact O-N 2.73Å; S650-T654 PolarHBondContact O-OG1 2.7Å; S650-T654 VanDerWaalsContact O-OG1 3.11Å
651	I	87.9	Confident	86	Confident	9 Å²	9	59.1 Å²	59.1	5%	0.046	30%	0.3	C	S	.	.	H	α-helix	trans	-62.8	-39.1	175.4	-57.4	172.4	0	0	0	110.6	D648 N653 T654 L655 P877 L898 Q899 F902	D648-I651 HydrophobicContact CB-CB 4.29Å; D648-I651 HydrophobicContact CB-CD1 3.9Å; D648-I651 HydrophobicContact CB-CG1 4.12Å; D648-I651 PolarHBondContact O-N 3.49Å; D648-I651 PolarHBondContact OD1-N 2.87Å; I651-N653 PolarHBondContact O-N 2.91Å; I651-T654 PolarHBondContact O-N 2.87Å; I651-L655 HydrophobicContact CG2-CD1 4.12Å; I651-L655 WeakPolarHBondContact O-CB 3.43Å; I651-L655 PolarHBondContact O-N 3.07Å; I651-P877 HydrophobicContact CB-CB 3.96Å; I651-P877 HydrophobicContact CB-CG 3.83Å; I651-P877 HydrophobicContact CG2-CB 3.67Å; I651-P877 HydrophobicContact CG2-CG 3.77Å; I651-L898 HydrophobicContact CD1-CB 4.08Å; I651-Q899 HydrophobicContact CD1-CB 3.93Å; I651-F902 HydrophobicContact CG2-CD2 4.4Å; I651-F902 HydrophobicContact CG2-CE2 3.52Å; I651-F902 HydrophobicContact CG2-CZ 3.84Å
652	K	88.6	Confident	86.2	Confident	22 Å²	22	52.5 Å²	52.5	10%	0.096	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-48.6	175.5	-168.9	-174.2	178.9	-176.1	0	110.8	T597 D648 Q649 S650 L655 R656 L876 P877	T597-K652 PolarHBondContact O-NZ 2.92Å; T597-K652 VanDerWaalsContact O-NZ 3.12Å; D648-K652 PolarHBondContact O-N 2.97Å; Q649-K652 VanDerWaalsContact OE1-CD 3.29Å; S650-K652 VanDerWaalsContact C-N 3.3Å; S650-K652 PolarHBondContact O-N 2.79Å; K652-L655 PolarHBondContact O-N 3.01Å; K652-R656 WeakPolarHBondContact O-CG 3.39Å; K652-R656 PolarHBondContact O-N 2.71Å; K652-L876 HydrophobicContact CD-CD2 4.42Å; K652-P877 HydrophobicContact CB-CG 3.87Å
653	N	87	Confident	86.5	Confident	100 Å²	100	49.4 Å²	49.4	54%	0.535	26%	0.263	S	S	.	.	H	α-helix	trans	-67.6	-39	-179.4	-69.1	-13.5	0	0	0	112.6	Q649 S650 I651 R656 S657	Q649-N653 WeakPolarHBondContact O-CB 3.49Å; Q649-N653 PolarHBondContact O-N 2.64Å; Q649-N653 PolarHBondContact O-ND2 3.37Å; Q649-N653 PolarHBondContact O-OD1 2.75Å; S650-N653 PolarHBondContact O-N 3.42Å; I651-N653 PolarHBondContact O-N 2.91Å; N653-R656 PolarHBondContact O-N 3.04Å; N653-S657 PolarHBondContact O-N 3.42Å; N653-S657 PolarHBondContact O-OG 3.22Å
654	T	88.9	Confident	86.8	Confident	25 Å²	25	53 Å²	53	15%	0.153	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-49.7	172.7	-60.8	0	0	0	0	110.9	S650 I651 R656 S657 C658 L678 F902	S650-T654 PolarHBondContact O-N 2.73Å; S650-T654 PolarHBondContact O-OG1 2.7Å; S650-T654 VanDerWaalsContact O-OG1 3.11Å; I651-T654 PolarHBondContact O-N 2.87Å; T654-R656 VanDerWaalsContact C-N 3.34Å; T654-R656 PolarHBondContact O-N 2.87Å; T654-S657 PolarHBondContact O-N 2.84Å; T654-S657 PolarHBondContact O-OG 3.21Å; T654-C658 WeakPolarHBondContact O-CB 3.24Å; T654-C658 PolarHBondContact O-N 2.85Å; T654-C658 PolarHBondContact O-SG 3.02Å; T654-L678 HydrophobicContact CG2-CD1 3.84Å; T654-F902 HydrophobicContact CG2-CD1 4.04Å; T654-F902 HydrophobicContact CG2-CE1 4.25Å
655	L	89.3	Confident	87.1	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-39.2	177.3	-81	168.2	0	0	0	113.1	I651 K652 S657 L685 C872 L875 P877 F902	I651-L655 HydrophobicContact CG2-CD1 4.12Å; I651-L655 WeakPolarHBondContact O-CB 3.43Å; I651-L655 PolarHBondContact O-N 3.07Å; K652-L655 PolarHBondContact O-N 3.01Å; L655-S657 VanDerWaalsContact C-N 3.26Å; L655-S657 PolarHBondContact O-N 2.87Å; L655-L685 HydrophobicContact CD1-CD2 4.37Å; L655-C872 PolarHBondContact O-SG 3.22Å; L655-L875 HydrophobicContact CD1-CD2 3.84Å; L655-L875 HydrophobicContact CD1-CG 4.35Å; L655-P877 HydrophobicContact CD1-CG 4.37Å; L655-F902 HydrophobicContact CD1-CZ 4.21Å; L655-F902 HydrophobicContact CD2-CE1 3.87Å; L655-F902 HydrophobicContact CD2-CZ 3.74Å; L655-F902 HydrophobicContact CG-CE1 4.08Å; L655-F902 HydrophobicContact CG-CZ 3.74Å
656	R	89.6	Confident	87.3	Confident	66 Å²	66	49.6 Å²	49.6	25%	0.249	26%	0.258	C	S	.	.	H	α-helix	trans	-67.1	-24.7	179.3	-68.6	-80.5	160.2	154.3	-5.3	113.6	L594 K652 N653 T654 C872 S873	L594-R656 PolarHBondContact O-NH1 2.8Å; L594-R656 VanDerWaalsContact O-NH1 3.16Å; K652-R656 WeakPolarHBondContact O-CG 3.39Å; K652-R656 PolarHBondContact O-N 2.71Å; N653-R656 PolarHBondContact O-N 3.04Å; T654-R656 VanDerWaalsContact C-N 3.34Å; T654-R656 PolarHBondContact O-N 2.87Å; R656-C872 WeakPolarHBondContact CD-O 3.2Å; R656-C872 PolarHBondContact NE-O 3.11Å; R656-S873 VanDerWaalsContact CZ-O 3.24Å; R656-S873 PolarHBondContact NH1-O 3.12Å; R656-S873 PolarHBondContact NH2-O 2.99Å
657	S	89.1	Confident	87.8	Confident	38 Å²	38	49.3 Å²	49.3	27%	0.266	26%	0.257	S	S	.	.	H	α-helix	trans	-109.5	-7.2	-177	55.1	0	0	0	0	114.1	N653 T654 L655 K659 H673 H674	N653-S657 PolarHBondContact O-N 3.42Å; N653-S657 PolarHBondContact O-OG 3.22Å; T654-S657 PolarHBondContact O-N 2.84Å; T654-S657 PolarHBondContact O-OG 3.21Å; L655-S657 VanDerWaalsContact C-N 3.26Å; L655-S657 PolarHBondContact O-N 2.87Å; S657-K659 PolarHBondContact O-N 3.49Å; S657-H673 PolarHBondContact OG-CD2 3.01Å; S657-H673 PolarHBondContact OG-NE2 3.36Å; S657-H674 PolarHBondContact OG-CE1 3.4Å
658	C	89.6	Confident	88.1	Confident	10 Å²	10	52.5 Å²	52.5	7%	0.068	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	125.3	173.5	-81.8	0	0	0	0	112.4	T654 A671 Q672 W868	T654-C658 WeakPolarHBondContact O-CB 3.24Å; T654-C658 PolarHBondContact O-N 2.85Å; T654-C658 PolarHBondContact O-SG 3.02Å; C658-A671 HydrophobicContact CB-CB 4.17Å; C658-Q672 CarbonylContact C-O 3.58Å; C658-Q672 WeakPolarHBondContact CA-O 3.42Å; C658-W868 HydrophobicContact CB-CH2 4.13Å; C658-W868 HydrophobicContact CB-CZ2 3.88Å
659	K	90.2	Very high	88.5	Confident	142 Å²	142	52.2 Å²	52.2	62%	0.617	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.6	168.5	-64	180	-179.8	178.3	0	110.1	S657 A671 Q672	S657-K659 PolarHBondContact O-N 3.49Å; K659-A671 CarbonylContact O-C 3.55Å; K659-A671 WeakPolarHBondContact O-CA 3.39Å; K659-A671 WeakPolarHBondContact O-CB 3.47Å; K659-Q672 HydrophobicContact CB-CB 4.47Å; K659-Q672 PolarHBondContact N-O 3.4Å; K659-Q672 PolarHBondContact O-N 3.11Å
660	F	91.4	Very high	88.8	Confident	38 Å²	38	49.3 Å²	49.3	17%	0.167	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	137.7	175.5	-167	-94.3	0	0	0	111.3	G662 F663 C669 Q864 W868	F660-G662 VanDerWaalsContact CE1-CA 3.49Å; F660-F663 HydrophobicContact CE1-CD2 4.33Å; F660-F663 HydrophobicContact CE1-CE2 4.03Å; F660-F663 HydrophobicContact CE1-CZ 4.42Å; F660-F663 HydrophobicContact CE2-CE1 4.27Å; F660-F663 HydrophobicContact CE2-CZ 4.15Å; F660-F663 HydrophobicContact CZ-CD1 4.18Å; F660-F663 AromaticContact CZ-CD2 3.84Å; F660-F663 HydrophobicContact CZ-CD2 3.84Å; F660-F663 AromaticContact CZ-CE1 3.88Å; F660-F663 HydrophobicContact CZ-CE1 3.88Å; F660-F663 AromaticContact CZ-CE2 3.49Å; F660-F663 HydrophobicContact CZ-CE2 3.49Å; F660-F663 VanDerWaalsContact CZ-CE2 3.49Å; F660-F663 HydrophobicContact CZ-CG 4.15Å; F660-F663 AromaticContact CZ-CZ 3.52Å; F660-F663 HydrophobicContact CZ-CZ 3.52Å; F660-C669 HydrophobicContact CD2-CB 4.27Å; F660-C669 HydrophobicContact CE2-CB 3.45Å; F660-C669 VanDerWaalsContact CE2-CB 3.45Å; F660-C669 HydrophobicContact CZ-CB 4Å; F660-Q864 HydrophobicContact CD1-CG 3.81Å; F660-Q864 HydrophobicContact CE1-CB 4.18Å; F660-Q864 HydrophobicContact CE1-CG 3.73Å; F660-Q864 HydrophobicContact CG-CG 4.45Å; F660-Q864 HydrophobicContact CZ-CB 4.33Å; F660-Q864 HydrophobicContact CZ-CG 4.33Å; F660-W868 HydrophobicContact CB-CD2 4.31Å; F660-W868 HydrophobicContact CB-CG 4.38Å; F660-W868 HydrophobicContact CB-CZ2 4.4Å; F660-W868 AromaticContact CD2-CD2 3.67Å; F660-W868 HydrophobicContact CD2-CD2 3.67Å; F660-W868 AromaticContact CD2-CE3 3.86Å; F660-W868 HydrophobicContact CD2-CE3 3.86Å; F660-W868 AromaticContact CD2-CG 3.97Å; F660-W868 HydrophobicContact CD2-CG 3.97Å; F660-W868 HydrophobicContact CD2-CZ3 4.38Å; F660-W868 HydrophobicContact CE2-CE3 4.41Å; F660-W868 HydrophobicContact CG-CD2 4.44Å
661	I	90.9	Very high	89.2	Confident	94 Å²	94	45.4 Å²	45.4	48%	0.482	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-49.2	176.1	-60.5	167.3	0	0	0	110.6	L670 Q672 L677	I661-L670 HydrophobicContact CB-CB 4.04Å; I661-L670 WeakPolarHBondContact CB-O 3.39Å; I661-L670 HydrophobicContact CD1-CB 4.33Å; I661-L670 HydrophobicContact CG2-CB 4.49Å; I661-L670 PolarHBondContact N-O 2.8Å; I661-Q672 HydrophobicContact CD1-CB 4.07Å; I661-Q672 HydrophobicContact CG1-CB 4.41Å; I661-L677 HydrophobicContact CD1-CD1 3.3Å
662	G	89.4	Confident	89.3	Confident	20 Å²	20	49.4 Å²	49.4	21%	0.206	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.7	173.7	-174.3	0	0	0	0	0	112.7	F660 C669 L670	F660-G662 VanDerWaalsContact CE1-CA 3.49Å; G662-C669 CarbonylContact O-C 3.56Å; G662-C669 WeakPolarHBondContact O-CA 3.47Å; G662-C669 WeakPolarHBondContact O-CB 3.43Å; G662-L670 PolarHBondContact O-N 3.32Å
663	F	88.8	Confident	89.4	Confident	35 Å²	35	49.6 Å²	49.6	15%	0.154	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	154.1	175.1	-65.5	-81.9	0	0	0	112	F660 C669 L682 L856 E860 I863 Q864	F660-F663 HydrophobicContact CE1-CD2 4.33Å; F660-F663 HydrophobicContact CE1-CE2 4.03Å; F660-F663 HydrophobicContact CE1-CZ 4.42Å; F660-F663 HydrophobicContact CE2-CE1 4.27Å; F660-F663 HydrophobicContact CE2-CZ 4.15Å; F660-F663 HydrophobicContact CZ-CD1 4.18Å; F660-F663 AromaticContact CZ-CD2 3.84Å; F660-F663 HydrophobicContact CZ-CD2 3.84Å; F660-F663 AromaticContact CZ-CE1 3.88Å; F660-F663 HydrophobicContact CZ-CE1 3.88Å; F660-F663 AromaticContact CZ-CE2 3.49Å; F660-F663 HydrophobicContact CZ-CE2 3.49Å; F660-F663 VanDerWaalsContact CZ-CE2 3.49Å; F660-F663 HydrophobicContact CZ-CG 4.15Å; F660-F663 AromaticContact CZ-CZ 3.52Å; F660-F663 HydrophobicContact CZ-CZ 3.52Å; F663-C669 HydrophobicContact CD1-CB 4.33Å; F663-L682 HydrophobicContact CD1-CD1 4.43Å; F663-L682 HydrophobicContact CE1-CD1 4.06Å; F663-L856 HydrophobicContact CD2-CD2 3.89Å; F663-L856 HydrophobicContact CE2-CD2 3.85Å; F663-E860 HydrophobicContact CD1-CG 4.44Å; F663-E860 HydrophobicContact CD2-CB 3.82Å; F663-E860 HydrophobicContact CD2-CG 3.73Å; F663-E860 HydrophobicContact CE2-CB 3.5Å; F663-E860 VanDerWaalsContact CE2-CB 3.5Å; F663-E860 HydrophobicContact CE2-CG 3.88Å; F663-E860 WeakPolarHBondContact CE2-O 3.45Å; F663-E860 HydrophobicContact CG-CG 4.04Å; F663-E860 HydrophobicContact CZ-CB 3.99Å; F663-E860 HydrophobicContact CZ-CG 4.3Å; F663-E860 VanDerWaalsContact CZ-O 3.26Å; F663-E860 WeakPolarHBondContact CZ-O 3.46Å; F663-I863 HydrophobicContact CE1-CB 4.1Å; F663-I863 HydrophobicContact CE1-CG2 3.68Å; F663-I863 HydrophobicContact CZ-CB 3.91Å; F663-I863 HydrophobicContact CZ-CG2 3.82Å; F663-Q864 HydrophobicContact CE2-CB 4.04Å; F663-Q864 HydrophobicContact CZ-CB 4.08Å
664	I	88.4	Confident	89.5	Confident	88 Å²	88	50.8 Å²	50.8	45%	0.451	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-40.8	159.1	-58.2	-167.3	0	0	0	109.1	R668 L670 L679	I664-R668 HydrophobicContact CB-CB 4.36Å; I664-R668 PolarHBondContact N-O 2.86Å; I664-L670 HydrophobicContact CD1-CD2 3.96Å; I664-L670 HydrophobicContact CD1-CG 4.05Å; I664-L670 HydrophobicContact CG1-CD1 4.43Å; I664-L670 HydrophobicContact CG1-CD2 4.48Å; I664-L670 HydrophobicContact CG1-CG 4.02Å; I664-L679 HydrophobicContact CD1-CD1 3.67Å; I664-L679 HydrophobicContact CG1-CD1 4.45Å
665	D	85	Confident	89.4	Confident	44 Å²	44	53.5 Å²	53.5	24%	0.235	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	179.5	167.3	59.6	63.4	0	0	0	109.7	T667 R668	D665-T667 PolarHBondContact O-N 3.34Å; D665-T667 WeakPolarHBondContact OD1-CA 3.45Å; D665-T667 WeakPolarHBondContact OD1-CB 3.47Å; D665-T667 PolarHBondContact OD1-N 3.3Å; D665-T667 PolarHBondContact OD1-OG1 2.87Å; D665-R668 PolarHBondContact N-O 3.42Å; D665-R668 PolarHBondContact O-N 3.5Å; D665-R668 VanDerWaalsContact O-N 3.11Å; D665-R668 PolarHBondContact OD1-N 3.48Å; D665-R668 VanDerWaalsContact OD1-N 3.08Å; D665-R668 IonicContact OD1-NE 3.45Å; D665-R668 IonicContact OD2-CZ 3.42Å; D665-R668 IonicContact OD2-NE 2.75Å; D665-R668 PolarHBondContact OD2-NE 3.33Å; D665-R668 IonicContact OD2-NH2 3.16Å; D665-R668 PolarHBondContact OD2-NH2 2.83Å
666	E	81.3	Confident	89.4	Confident	55 Å²	55	55.6 Å²	55.6	26%	0.257	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-29.7	179.2	-60.1	176.3	144.9	0	0	113.4	V821 S823 S824	E666-V821 WeakPolarHBondContact O-CG1 3.34Å; E666-S823 VanDerWaalsContact OE2-CA 3.3Å; E666-S823 WeakPolarHBondContact OE2-CA 3.27Å; E666-S824 PolarHBondContact OE2-N 3.36Å
667	T	86.7	Confident	89.4	Confident	27 Å²	27	54.8 Å²	54.8	17%	0.166	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-6.7	-175.1	70.4	0	0	0	0	115.1	D665 L682 V821 S822 S823	D665-T667 PolarHBondContact O-N 3.34Å; D665-T667 WeakPolarHBondContact OD1-CA 3.45Å; D665-T667 WeakPolarHBondContact OD1-CB 3.47Å; D665-T667 PolarHBondContact OD1-N 3.3Å; D665-T667 PolarHBondContact OD1-OG1 2.87Å; T667-L682 WeakPolarHBondContact O-CB 3.21Å; T667-L682 PolarHBondContact O-N 3.19Å; T667-V821 HydrophobicContact CG2-CG1 4.48Å; T667-S822 VanDerWaalsContact CG2-C 3.44Å; T667-S823 WeakPolarHBondContact CG2-OG 3.39Å
668	R	91.1	Very high	89.6	Confident	102 Å²	102	53.3 Å²	53.3	39%	0.385	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	125	-172.7	-70.5	-173.8	-65.3	176.9	0.6	111.7	I664 D665 L679 I680	I664-R668 HydrophobicContact CB-CB 4.36Å; I664-R668 PolarHBondContact N-O 2.86Å; D665-R668 PolarHBondContact N-O 3.42Å; D665-R668 PolarHBondContact O-N 3.5Å; D665-R668 VanDerWaalsContact O-N 3.11Å; D665-R668 PolarHBondContact OD1-N 3.48Å; D665-R668 VanDerWaalsContact OD1-N 3.08Å; D665-R668 IonicContact OD1-NE 3.45Å; D665-R668 IonicContact OD2-CZ 3.42Å; D665-R668 IonicContact OD2-NE 2.75Å; D665-R668 PolarHBondContact OD2-NE 3.33Å; D665-R668 IonicContact OD2-NH2 3.16Å; D665-R668 PolarHBondContact OD2-NH2 2.83Å; R668-L679 HydrophobicContact CB-CD1 3.95Å; R668-L679 HydrophobicContact CG-CD1 4.43Å; R668-I680 WeakPolarHBondContact CA-O 3.42Å
669	C	93.1	Very high	89.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	164.6	175.2	67	0	0	0	0	113	F660 G662 F663 I680 L682	F660-C669 HydrophobicContact CD2-CB 4.27Å; F660-C669 HydrophobicContact CE2-CB 3.45Å; F660-C669 VanDerWaalsContact CE2-CB 3.45Å; F660-C669 HydrophobicContact CZ-CB 4Å; G662-C669 CarbonylContact O-C 3.56Å; G662-C669 WeakPolarHBondContact O-CA 3.47Å; G662-C669 WeakPolarHBondContact O-CB 3.43Å; F663-C669 HydrophobicContact CD1-CB 4.33Å; C669-I680 PolarHBondContact N-O 3.27Å; C669-I680 PolarHBondContact O-N 2.93Å; C669-L682 HydrophobicContact CB-CD1 4.17Å
670	L	93.7	Very high	89.9	Confident	36 Å²	36	47 Å²	47	19%	0.188	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.4	167.9	-69.3	176	0	0	0	110	I661 G662 I664 L677 L678 L679 L905	I661-L670 HydrophobicContact CB-CB 4.04Å; I661-L670 WeakPolarHBondContact CB-O 3.39Å; I661-L670 HydrophobicContact CD1-CB 4.33Å; I661-L670 HydrophobicContact CG2-CB 4.49Å; I661-L670 PolarHBondContact N-O 2.8Å; G662-L670 PolarHBondContact O-N 3.32Å; I664-L670 HydrophobicContact CD1-CD2 3.96Å; I664-L670 HydrophobicContact CD1-CG 4.05Å; I664-L670 HydrophobicContact CG1-CD1 4.43Å; I664-L670 HydrophobicContact CG1-CD2 4.48Å; I664-L670 HydrophobicContact CG1-CG 4.02Å; L670-L677 HydrophobicContact CB-CD1 4.33Å; L670-L677 HydrophobicContact CD2-CD1 4.22Å; L670-L677 HydrophobicContact CD2-CG 4.38Å; L670-L678 WeakPolarHBondContact CA-O 3.34Å; L670-L679 HydrophobicContact CD2-CB 4.48Å; L670-L905 HydrophobicContact CD2-CD1 3.5Å
671	A	92.6	Very high	89.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.7	171.3	0	0	0	0	0	111.9	C658 K659 L678 I680 W868	C658-A671 HydrophobicContact CB-CB 4.17Å; K659-A671 CarbonylContact O-C 3.55Å; K659-A671 WeakPolarHBondContact O-CA 3.39Å; K659-A671 WeakPolarHBondContact O-CB 3.47Å; A671-L678 PolarHBondContact N-O 3.24Å; A671-L678 PolarHBondContact O-N 3.43Å; A671-I680 HydrophobicContact CB-CD1 3.68Å; A671-W868 HydrophobicContact CB-CH2 3.79Å; A671-W868 HydrophobicContact CB-CZ2 4.11Å
672	Q	91.3	Very high	90	Very high	93 Å²	93	44.9 Å²	44.9	44%	0.435	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126	169.8	-177.2	-175.9	4	0	0	109.1	C658 K659 I661 H674	C658-Q672 CarbonylContact C-O 3.58Å; C658-Q672 WeakPolarHBondContact CA-O 3.42Å; K659-Q672 HydrophobicContact CB-CB 4.47Å; K659-Q672 PolarHBondContact N-O 3.4Å; K659-Q672 PolarHBondContact O-N 3.11Å; I661-Q672 HydrophobicContact CD1-CB 4.07Å; I661-Q672 HydrophobicContact CG1-CB 4.41Å; Q672-H674 PolarHBondContact NE2-O 3.27Å
673	H	89.6	Confident	90.1	Very high	26 Å²	26	47.2 Å²	47.2	12%	0.12	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	103.4	170.2	173.9	-113.6	0	0	0	108.8	S657 T675 E676 L678	S657-H673 PolarHBondContact OG-CD2 3.01Å; S657-H673 PolarHBondContact OG-NE2 3.36Å; H673-T675 PolarHBondContact O-N 3.35Å; H673-E676 IonicContact CE1-OE2 3.28Å; H673-E676 PolarHBondContact N-O 2.76Å; H673-E676 IonicContact ND1-OE2 2.69Å; H673-E676 PolarHBondContact ND1-OE2 3.1Å; H673-E676 WeakPolarHBondContact O-CA 3.39Å; H673-E676 WeakPolarHBondContact O-CB 3.29Å; H673-E676 PolarHBondContact O-N 3Å; H673-L678 HydrophobicContact CB-CD1 3.53Å; H673-L678 HydrophobicContact CB-CG 3.84Å
674	H	89.2	Confident	90.2	Very high	125 Å²	125	46.3 Å²	46.3	58%	0.579	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	-106	-172.9	-60.4	87.4	0	0	0	112.4	S657 Q672	S657-H674 PolarHBondContact OG-CE1 3.4Å; Q672-H674 PolarHBondContact NE2-O 3.27Å
675	T	87.3	Confident	90.3	Very high	81 Å²	81	42.1 Å²	42.1	50%	0.497	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	2	177	52.1	0	0	0	0	113.6	H673 S907 L908	H673-T675 PolarHBondContact O-N 3.35Å; T675-S907 CarbonylContact O-C 3.59Å; T675-S907 VanDerWaalsContact O-CA 3.29Å; T675-S907 WeakPolarHBondContact O-CA 3.25Å; T675-L908 HydrophobicContact CG2-CD2 4.49Å; T675-L908 PolarHBondContact O-N 3.27Å
676	E	88.8	Confident	90.7	Very high	47 Å²	47	40 Å²	40	22%	0.22	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146	-177.3	-54.9	-179.3	126.8	0	0	111.8	H673 L678 R904	H673-E676 IonicContact CE1-OE2 3.28Å; H673-E676 PolarHBondContact N-O 2.76Å; H673-E676 IonicContact ND1-OE2 2.69Å; H673-E676 PolarHBondContact ND1-OE2 3.1Å; H673-E676 WeakPolarHBondContact O-CA 3.39Å; H673-E676 WeakPolarHBondContact O-CB 3.29Å; H673-E676 PolarHBondContact O-N 3Å; E676-L678 HydrophobicContact CB-CD2 4.11Å; E676-R904 WeakPolarHBondContact OE1-CD 3.43Å; E676-R904 IonicContact OE1-CZ 3.17Å; E676-R904 IonicContact OE1-NE 2.95Å; E676-R904 IonicContact OE1-NH1 3.88Å; E676-R904 PolarHBondContact OE1-NH1 2.92Å
677	L	90.7	Very high	91.2	Very high	49 Å²	49	38.3 Å²	38.3	26%	0.257	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.7	167.4	179.5	62.7	0	0	0	108.7	I661 L670 L905 T906	I661-L677 HydrophobicContact CD1-CD1 3.3Å; L670-L677 HydrophobicContact CB-CD1 4.33Å; L670-L677 HydrophobicContact CD2-CD1 4.22Å; L670-L677 HydrophobicContact CD2-CG 4.38Å; L677-L905 HydrophobicContact CD2-CB 4.46Å; L677-L905 HydrophobicContact CD2-CD1 4.27Å; L677-L905 HydrophobicContact CG-CB 4.42Å; L677-L905 HydrophobicContact CG-CD1 4.36Å; L677-L905 PolarHBondContact O-N 3.23Å; L677-T906 HydrophobicContact CB-CG2 3.92Å; L677-T906 HydrophobicContact CD2-CG2 4.14Å; L677-T906 PolarHBondContact N-O 3.21Å
678	L	92.8	Very high	91.5	Very high	7 Å²	7	37 Å²	37	4%	0.037	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.2	179.7	-53.6	-172.8	0	0	0	110.8	T654 L670 A671 H673 E676 I680 F902 R904	T654-L678 HydrophobicContact CG2-CD1 3.84Å; L670-L678 WeakPolarHBondContact CA-O 3.34Å; A671-L678 PolarHBondContact N-O 3.24Å; A671-L678 PolarHBondContact O-N 3.43Å; H673-L678 HydrophobicContact CB-CD1 3.53Å; H673-L678 HydrophobicContact CB-CG 3.84Å; E676-L678 HydrophobicContact CB-CD2 4.11Å; L678-I680 HydrophobicContact CB-CD1 4.36Å; L678-I680 HydrophobicContact CB-CG1 4.13Å; L678-F902 HydrophobicContact CD1-CD1 4.28Å; L678-R904 HydrophobicContact CD2-CB 3.91Å
679	L	93.2	Very high	91.6	Very high	21 Å²	21	32.2 Å²	32.2	11%	0.11	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	124.4	158.7	168.6	58.3	0	0	0	108.3	I664 R668 L670 I903 L905	I664-L679 HydrophobicContact CD1-CD1 3.67Å; I664-L679 HydrophobicContact CG1-CD1 4.45Å; R668-L679 HydrophobicContact CB-CD1 3.95Å; R668-L679 HydrophobicContact CG-CD1 4.43Å; L670-L679 HydrophobicContact CD2-CB 4.48Å; L679-I903 HydrophobicContact CB-CB 4.17Å; L679-I903 HydrophobicContact CD2-CD1 4.36Å; L679-I903 PolarHBondContact N-O 2.9Å; L679-I903 PolarHBondContact O-N 3.37Å; L679-L905 HydrophobicContact CB-CD1 4.01Å; L679-L905 HydrophobicContact CB-CD2 3.87Å; L679-L905 HydrophobicContact CB-CG 3.84Å; L679-L905 HydrophobicContact CD2-CD2 4.24Å
680	I	93.1	Very high	91.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	126.5	-175.6	-67.1	176.4	0	0	0	110.5	R668 C669 A671 L678 L685 W868 C901 F902	R668-I680 WeakPolarHBondContact CA-O 3.42Å; C669-I680 PolarHBondContact N-O 3.27Å; C669-I680 PolarHBondContact O-N 2.93Å; A671-I680 HydrophobicContact CB-CD1 3.68Å; L678-I680 HydrophobicContact CB-CD1 4.36Å; L678-I680 HydrophobicContact CB-CG1 4.13Å; I680-L685 HydrophobicContact CG2-CD1 3.37Å; I680-W868 HydrophobicContact CD1-CH2 3.81Å; I680-W868 HydrophobicContact CD1-CZ3 4.26Å; I680-W868 HydrophobicContact CG2-CZ3 4.42Å; I680-C901 WeakPolarHBondContact CA-O 3.48Å; I680-F902 HydrophobicContact CD1-CD1 3.8Å; I680-F902 HydrophobicContact CD1-CE1 3.87Å; I680-F902 HydrophobicContact CG1-CD1 3.81Å; I680-F902 HydrophobicContact CG1-CE1 4.22Å
681	R	92	Very high	91.7	Very high	86 Å²	86	30.6 Å²	30.6	33%	0.325	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	110.9	173.3	-61.3	-166.3	-72.6	148.8	-3.6	109.7	S900 C901	R681-S900 PolarHBondContact NE-O 3.03Å; R681-S900 PolarHBondContact NH2-O 3.43Å; R681-S900 PolarHBondContact NH2-OG 3.28Å; R681-C901 HydrophobicContact CB-CB 4.43Å; R681-C901 PolarHBondContact N-O 2.9Å
682	L	91.8	Very high	91.6	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-74.5	-35.9	-173.4	-69.2	165.5	0	0	0	113.2	F663 T667 C669 L685 S686 V821 I863 W868 L871	F663-L682 HydrophobicContact CD1-CD1 4.43Å; F663-L682 HydrophobicContact CE1-CD1 4.06Å; T667-L682 WeakPolarHBondContact O-CB 3.21Å; T667-L682 PolarHBondContact O-N 3.19Å; C669-L682 HydrophobicContact CB-CD1 4.17Å; L682-L685 PolarHBondContact O-N 3.38Å; L682-S686 WeakPolarHBondContact O-CB 3.41Å; L682-S686 PolarHBondContact O-N 2.82Å; L682-S686 PolarHBondContact O-OG 2.87Å; L682-V821 HydrophobicContact CB-CB 4.18Å; L682-V821 HydrophobicContact CB-CG1 4.06Å; L682-V821 HydrophobicContact CB-CG2 4.3Å; L682-I863 HydrophobicContact CD1-CG2 3.93Å; L682-W868 HydrophobicContact CD2-CE3 4.21Å; L682-W868 HydrophobicContact CD2-CZ3 4.43Å; L682-L871 HydrophobicContact CD2-CD1 4.36Å
683	K	91.2	Very high	91.6	Very high	68 Å²	68	27.3 Å²	27.3	30%	0.296	13%	0.132	S	C	.	.	H	α-helix	trans	-53.4	-56.1	-174.7	-178.6	161.4	-173	167.9	0	113	L685 S686 Q687 A820 V821	K683-L685 PolarHBondContact O-N 2.98Å; K683-S686 PolarHBondContact O-N 2.64Å; K683-S686 PolarHBondContact O-OG 2.98Å; K683-Q687 HydrophobicContact CG-CG 4.49Å; K683-Q687 WeakPolarHBondContact O-CG 3.47Å; K683-Q687 PolarHBondContact O-N 3.47Å; K683-A820 HydrophobicContact CG-CB 4.48Å; K683-V821 VanDerWaalsContact CB-O 3.22Å; K683-V821 WeakPolarHBondContact CB-O 3.49Å; K683-V821 WeakPolarHBondContact CD-O 3.48Å; K683-V821 WeakPolarHBondContact CG-O 3.36Å
684	P	90.6	Very high	91.7	Very high	16 Å²	16	26 Å²	26	10%	0.104	13%	0.126	C	C	.	.	H	α-helix	trans	-69.8	-31.7	-177	-15.3	30.8	0	0	0	113.7	Q687 A688 F896 L898	P684-Q687 PolarHBondContact O-N 3.17Å; P684-A688 VanDerWaalsContact O-CB 3.32Å; P684-A688 WeakPolarHBondContact O-CB 3.25Å; P684-A688 PolarHBondContact O-N 2.9Å; P684-F896 HydrophobicContact CB-CD1 4.22Å; P684-F896 HydrophobicContact CB-CE1 3.51Å; P684-F896 HydrophobicContact CB-CZ 4.13Å; P684-F896 HydrophobicContact CG-CE1 4.05Å; P684-F896 HydrophobicContact CG-CZ 4.15Å; P684-L898 HydrophobicContact CB-CD2 4.26Å
685	L	91.4	Very high	91.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.5	-41.1	173.4	-72	171.5	0	0	0	111.5	L655 I680 L682 K683 L689 L871 L875 L898 C901 F902	L655-L685 HydrophobicContact CD1-CD2 4.37Å; I680-L685 HydrophobicContact CG2-CD1 3.37Å; L682-L685 PolarHBondContact O-N 3.38Å; K683-L685 PolarHBondContact O-N 2.98Å; L685-L689 WeakPolarHBondContact O-CB 3.24Å; L685-L689 PolarHBondContact O-N 3.42Å; L685-L871 HydrophobicContact CB-CD2 4.06Å; L685-L871 WeakPolarHBondContact O-CD2 3.36Å; L685-L875 HydrophobicContact CB-CD2 4.49Å; L685-L875 HydrophobicContact CD2-CD2 3.76Å; L685-L898 HydrophobicContact CD2-CD1 4.11Å; L685-L898 HydrophobicContact CD2-CD2 4.04Å; L685-L898 HydrophobicContact CD2-CG 4.47Å; L685-C901 HydrophobicContact CD1-CB 4.24Å; L685-C901 HydrophobicContact CG-CB 4.1Å; L685-F902 HydrophobicContact CD1-CE1 4.47Å; L685-F902 HydrophobicContact CD1-CZ 4Å; L685-F902 HydrophobicContact CD2-CE2 4.09Å; L685-F902 HydrophobicContact CD2-CZ 3.87Å
686	S	92.4	Very high	91.7	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-69.5	-41.3	176	67	0	0	0	0	112.7	L682 K683 A688 L689 F690 A820 V821	L682-S686 WeakPolarHBondContact O-CB 3.41Å; L682-S686 PolarHBondContact O-N 2.82Å; L682-S686 PolarHBondContact O-OG 2.87Å; K683-S686 PolarHBondContact O-N 2.64Å; K683-S686 PolarHBondContact O-OG 2.98Å; S686-A688 PolarHBondContact O-N 3Å; S686-L689 PolarHBondContact O-N 3.24Å; S686-F690 WeakPolarHBondContact O-CD2 3.35Å; S686-F690 PolarHBondContact O-N 3.32Å; S686-A820 WeakPolarHBondContact OG-CA 3.42Å; S686-A820 WeakPolarHBondContact OG-CB 3.32Å; S686-V821 PolarHBondContact OG-N 2.98Å
687	Q	93.2	Very high	91.6	Very high	20 Å²	20	15.1 Å²	15.1	9%	0.093	7%	0.071	C	C	.	.	H	α-helix	trans	-56.1	-50.5	171.7	-70	170.8	-38.4	0	0	110.8	K683 P684 L689 F690 Y691 A816 N817 A820 F884	K683-Q687 HydrophobicContact CG-CG 4.49Å; K683-Q687 WeakPolarHBondContact O-CG 3.47Å; K683-Q687 PolarHBondContact O-N 3.47Å; P684-Q687 PolarHBondContact O-N 3.17Å; Q687-L689 VanDerWaalsContact C-N 3.33Å; Q687-L689 PolarHBondContact O-N 2.93Å; Q687-F690 PolarHBondContact O-N 2.95Å; Q687-Y691 WeakPolarHBondContact O-CB 3.41Å; Q687-Y691 PolarHBondContact O-N 3.47Å; Q687-A816 WeakPolarHBondContact O-CB 3.08Å; Q687-N817 PolarHBondContact NE2-OD1 2.86Å; Q687-A820 HydrophobicContact CG-CB 3.56Å; Q687-F884 HydrophobicContact CB-CD1 4.34Å; Q687-F884 HydrophobicContact CB-CD2 3.54Å; Q687-F884 HydrophobicContact CB-CE1 4.48Å; Q687-F884 HydrophobicContact CB-CE2 3.68Å; Q687-F884 HydrophobicContact CB-CG 3.89Å; Q687-F884 HydrophobicContact CB-CZ 4.16Å; Q687-F884 HydrophobicContact CG-CB 4.4Å; Q687-F884 HydrophobicContact CG-CD2 4.18Å; Q687-F884 HydrophobicContact CG-CG 4.25Å
688	A	91.9	Very high	91.5	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-58.4	-40.3	177.5	0	0	0	0	0	113.3	P684 S686 Q692 L875 Y881 L898	P684-A688 VanDerWaalsContact O-CB 3.32Å; P684-A688 WeakPolarHBondContact O-CB 3.25Å; P684-A688 PolarHBondContact O-N 2.9Å; S686-A688 PolarHBondContact O-N 3Å; A688-Q692 WeakPolarHBondContact O-CB 3.5Å; A688-Q692 WeakPolarHBondContact O-CG 3.46Å; A688-Q692 PolarHBondContact O-N 3.13Å; A688-Q692 VanDerWaalsContact O-N 3.11Å; A688-L875 HydrophobicContact CB-CD1 3.98Å; A688-Y881 HydrophobicContact CB-CD1 3.98Å; A688-Y881 HydrophobicContact CB-CD2 4.42Å; A688-Y881 HydrophobicContact CB-CE1 3.52Å; A688-Y881 HydrophobicContact CB-CE2 4.01Å; A688-Y881 HydrophobicContact CB-CG 4.41Å; A688-L898 HydrophobicContact CB-CD1 4Å; A688-L898 HydrophobicContact CB-CD2 4.11Å
689	L	93.2	Very high	91.2	Very high	1 Å²	1	13 Å²	13	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-66.9	-50.5	176.6	176.9	65.9	0	0	0	112	L685 S686 Q687 Y691 Q692 L693 I778 L867 I870 L871 L875	L685-L689 WeakPolarHBondContact O-CB 3.24Å; L685-L689 PolarHBondContact O-N 3.42Å; S686-L689 PolarHBondContact O-N 3.24Å; Q687-L689 VanDerWaalsContact C-N 3.33Å; Q687-L689 PolarHBondContact O-N 2.93Å; L689-Y691 VanDerWaalsContact C-N 3.32Å; L689-Y691 PolarHBondContact O-N 2.88Å; L689-Q692 PolarHBondContact O-N 3.41Å; L689-L693 HydrophobicContact CD1-CD1 4.01Å; L689-L693 HydrophobicContact CD1-CG 4.11Å; L689-L693 HydrophobicContact CG-CD1 3.97Å; L689-L693 HydrophobicContact CG-CG 4.41Å; L689-L693 WeakPolarHBondContact O-CG 3.39Å; L689-L693 PolarHBondContact O-N 2.88Å; L689-I778 HydrophobicContact CD2-CD1 4.35Å; L689-L867 HydrophobicContact CD2-CD1 3.81Å; L689-I870 HydrophobicContact CD1-CG2 4.07Å; L689-I870 HydrophobicContact CD2-CB 4.31Å; L689-I870 HydrophobicContact CD2-CG2 3.78Å; L689-I870 HydrophobicContact CG-CG2 4.5Å; L689-L871 HydrophobicContact CB-CD2 3.79Å; L689-L871 HydrophobicContact CD2-CD2 3.72Å; L689-L871 HydrophobicContact CD2-CG 4.01Å; L689-L871 HydrophobicContact CG-CD2 4.31Å; L689-L875 HydrophobicContact CB-CD1 4.22Å; L689-L875 HydrophobicContact CD1-CB 4.36Å
690	F	94.3	Very high	90.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.2	-36.8	-179.1	-72.7	-65.1	0	0	0	111.7	S686 Q687 Q692 L693 L694 I777 I778 Y781 A816 Y819 L867	S686-F690 WeakPolarHBondContact O-CD2 3.35Å; S686-F690 PolarHBondContact O-N 3.32Å; Q687-F690 PolarHBondContact O-N 2.95Å; F690-Q692 PolarHBondContact O-N 3.37Å; F690-L693 PolarHBondContact O-N 3.3Å; F690-L694 WeakPolarHBondContact O-CB 3.29Å; F690-L694 WeakPolarHBondContact O-CD1 3.33Å; F690-L694 WeakPolarHBondContact O-CG 3.1Å; F690-L694 PolarHBondContact O-N 3.3Å; F690-I777 HydrophobicContact CD1-CB 4.3Å; F690-I777 HydrophobicContact CD1-CD1 3.97Å; F690-I777 HydrophobicContact CD1-CG2 4.07Å; F690-I777 HydrophobicContact CE1-CB 4.48Å; F690-I778 HydrophobicContact CD1-CD1 4.33Å; F690-I778 HydrophobicContact CE1-CD1 3.45Å; F690-I778 VanDerWaalsContact CE1-CD1 3.45Å; F690-I778 HydrophobicContact CE1-CG1 3.96Å; F690-I778 HydrophobicContact CZ-CD1 3.85Å; F690-Y781 HydrophobicContact CE1-CD1 4.19Å; F690-Y781 HydrophobicContact CE1-CE1 4.29Å; F690-Y781 HydrophobicContact CE2-CE1 4.01Å; F690-Y781 AromaticContact CZ-CD1 3.68Å; F690-Y781 HydrophobicContact CZ-CD1 3.68Å; F690-Y781 AromaticContact CZ-CE1 3.45Å; F690-Y781 HydrophobicContact CZ-CE1 3.45Å; F690-Y781 VanDerWaalsContact CZ-CE1 3.45Å; F690-Y781 HydrophobicContact CZ-CE2 4.37Å; F690-Y781 HydrophobicContact CZ-CG 4.26Å; F690-Y781 AromaticContact CZ-CZ 3.84Å; F690-A816 HydrophobicContact CB-CB 4.01Å; F690-Y819 HydrophobicContact CD1-CD1 4.41Å; F690-Y819 HydrophobicContact CD1-CG 4.42Å; F690-Y819 WeakPolarHBondContact CD2-O 3.43Å; F690-Y819 HydrophobicContact CE1-CD1 4.22Å; F690-Y819 WeakPolarHBondContact CE2-O 3.34Å; F690-L867 HydrophobicContact CE2-CD1 3.88Å; F690-L867 HydrophobicContact CZ-CD1 3.79Å
691	Y	94.1	Very high	90.3	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.008	7%	0.066	C	C	.	.	H	α-helix	trans	-58	-47.6	171.8	-172.5	-114.9	0	0	0	111.8	L643 Q687 L689 L694 L695 E809 C812 C813 Y881 P882 F884	L643-Y691 HydrophobicContact CD1-CD1 4.02Å; L643-Y691 HydrophobicContact CD1-CE1 3.91Å; L643-Y691 HydrophobicContact CD2-CE1 4.38Å; Q687-Y691 WeakPolarHBondContact O-CB 3.41Å; Q687-Y691 PolarHBondContact O-N 3.47Å; L689-Y691 VanDerWaalsContact C-N 3.32Å; L689-Y691 PolarHBondContact O-N 2.88Å; Y691-L694 PolarHBondContact O-N 2.82Å; Y691-L695 HydrophobicContact CD1-CD1 4.17Å; Y691-L695 HydrophobicContact CE1-CD1 3.66Å; Y691-L695 HydrophobicContact CE2-CD1 4.3Å; Y691-L695 PolarHBondContact O-N 3.04Å; Y691-L695 VanDerWaalsContact O-N 3.08Å; Y691-E809 WeakPolarHBondContact OH-CG 3.21Å; Y691-E809 PolarHBondContact OH-OE1 3.16Å; Y691-C812 HydrophobicContact CD2-CB 3.63Å; Y691-C812 HydrophobicContact CE2-CB 3.44Å; Y691-C812 VanDerWaalsContact CE2-CB 3.44Å; Y691-C813 WeakPolarHBondContact CE2-SG 3.45Å; Y691-Y881 HydrophobicContact CD1-CD1 4.21Å; Y691-P882 HydrophobicContact CD1-CG 4.47Å; Y691-P882 HydrophobicContact CE1-CG 3.86Å; Y691-P882 HydrophobicContact CE2-CG 4.14Å; Y691-F884 HydrophobicContact CD1-CE1 4.43Å; Y691-F884 HydrophobicContact CD1-CZ 4.38Å; Y691-F884 AromaticContact CD2-CE1 3.91Å; Y691-F884 HydrophobicContact CD2-CE1 3.91Å; Y691-F884 AromaticContact CG-CE1 3.77Å; Y691-F884 HydrophobicContact CG-CE1 3.77Å; Y691-F884 HydrophobicContact CG-CZ 4.05Å
692	Q	91.6	Very high	89.7	Confident	9 Å²	9	9.8 Å²	9.8	4%	0.042	5%	0.052	C	C	.	.	H	α-helix	trans	-63.4	-42.5	176.4	-82.2	179.9	2.3	0	0	112.8	L643 A688 L689 F690 T696 L876 Y881	L643-Q692 HydrophobicContact CD1-CG 3.84Å; A688-Q692 WeakPolarHBondContact O-CB 3.5Å; A688-Q692 WeakPolarHBondContact O-CG 3.46Å; A688-Q692 PolarHBondContact O-N 3.13Å; A688-Q692 VanDerWaalsContact O-N 3.11Å; L689-Q692 PolarHBondContact O-N 3.41Å; F690-Q692 PolarHBondContact O-N 3.37Å; Q692-T696 WeakPolarHBondContact O-CA 3.29Å; Q692-T696 WeakPolarHBondContact O-CB 3.35Å; Q692-T696 PolarHBondContact O-N 2.95Å; Q692-T696 PolarHBondContact O-OG1 3.22Å; Q692-L876 PolarHBondContact NE2-O 3.08Å; Q692-Y881 PolarHBondContact NE2-OH 3.01Å
693	L	91.4	Very high	89.4	Confident	14 Å²	14	11 Å²	11	7%	0.073	6%	0.057	C	C	.	.	H	α-helix	trans	-68.3	-34.1	178.9	-68.1	176.4	0	0	0	112.6	I585 L689 F690 N697 I777 I778	I585-L693 HydrophobicContact CD1-CD1 4.17Å; I585-L693 HydrophobicContact CD1-CD2 3.75Å; L689-L693 HydrophobicContact CD1-CD1 4.01Å; L689-L693 HydrophobicContact CD1-CG 4.11Å; L689-L693 HydrophobicContact CG-CD1 3.97Å; L689-L693 HydrophobicContact CG-CG 4.41Å; L689-L693 WeakPolarHBondContact O-CG 3.39Å; L689-L693 PolarHBondContact O-N 2.88Å; F690-L693 PolarHBondContact O-N 3.3Å; L693-N697 WeakPolarHBondContact O-CB 3.36Å; L693-N697 PolarHBondContact O-N 3.27Å; L693-I777 HydrophobicContact CB-CG2 3.54Å; L693-I777 HydrophobicContact CD1-CG2 4.05Å; L693-I777 HydrophobicContact CG-CG2 4.45Å; L693-I778 HydrophobicContact CD1-CD1 3.67Å; L693-I778 HydrophobicContact CD1-CG1 3.65Å
694	L	92.2	Very high	89.3	Confident	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-65	-51.5	174.4	-75.1	161.2	0	0	0	111.6	F690 Y691 F698 H701 I777 C812 T815 A816	F690-L694 WeakPolarHBondContact O-CB 3.29Å; F690-L694 WeakPolarHBondContact O-CD1 3.33Å; F690-L694 WeakPolarHBondContact O-CG 3.1Å; F690-L694 PolarHBondContact O-N 3.3Å; Y691-L694 PolarHBondContact O-N 2.82Å; L694-F698 WeakPolarHBondContact O-CA 3.42Å; L694-F698 PolarHBondContact O-N 3.08Å; L694-F698 VanDerWaalsContact O-N 3.07Å; L694-H701 PolarHBondContact O-NE2 3.43Å; L694-I777 HydrophobicContact CD1-CD1 4.25Å; L694-I777 HydrophobicContact CD2-CD1 3.83Å; L694-I777 HydrophobicContact CD2-CG1 4.31Å; L694-I777 HydrophobicContact CG-CD1 3.98Å; L694-C812 HydrophobicContact CB-CB 4.43Å; L694-C812 WeakPolarHBondContact CD1-O 3.26Å; L694-T815 HydrophobicContact CD1-CG2 3.78Å; L694-T815 HydrophobicContact CD2-CG2 4.03Å; L694-A816 HydrophobicContact CD1-CB 4.27Å
695	L	91.2	Very high	89.3	Confident	1 Å²	1	13.4 Å²	13.4	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-62.8	-45.8	174.4	-69.4	174.4	0	0	0	111.5	I636 L639 K640 L643 Y691 F698	I636-L695 HydrophobicContact CD1-CD2 4.25Å; L639-L695 HydrophobicContact CB-CD1 4.03Å; L639-L695 HydrophobicContact CB-CD2 3.9Å; L639-L695 HydrophobicContact CD1-CD2 3.98Å; K640-L695 VanDerWaalsContact CE-C 3.45Å; K640-L695 WeakPolarHBondContact CE-O 3.38Å; K640-L695 HydrophobicContact CG-CB 4.39Å; K640-L695 PolarHBondContact NZ-O 3.43Å; L643-L695 HydrophobicContact CD1-CD1 3.74Å; Y691-L695 HydrophobicContact CD1-CD1 4.17Å; Y691-L695 HydrophobicContact CE1-CD1 3.66Å; Y691-L695 HydrophobicContact CE2-CD1 4.3Å; Y691-L695 PolarHBondContact O-N 3.04Å; Y691-L695 VanDerWaalsContact O-N 3.08Å; L695-F698 WeakPolarHBondContact O-CB 3.48Å; L695-F698 PolarHBondContact O-N 3.44Å
696	T	85.4	Confident	89.2	Confident	14 Å²	14	14.6 Å²	14.6	9%	0.086	8%	0.077	C	C	.	.	H	α-helix	trans	-56.9	-55.4	-177.6	-68.5	0	0	0	0	111.6	I600 L604 K640 Q692	I600-T696 HydrophobicContact CG2-CG2 3.44Å; I600-T696 VanDerWaalsContact CG2-CG2 3.44Å; I600-T696 WeakPolarHBondContact CG2-OG1 3.36Å; L604-T696 HydrophobicContact CD1-CG2 3.68Å; L604-T696 HydrophobicContact CD2-CG2 3.78Å; L604-T696 HydrophobicContact CG-CG2 3.85Å; K640-T696 PolarHBondContact NZ-O 2.93Å; Q692-T696 WeakPolarHBondContact O-CA 3.29Å; Q692-T696 WeakPolarHBondContact O-CB 3.35Å; Q692-T696 PolarHBondContact O-N 2.95Å; Q692-T696 PolarHBondContact O-OG1 3.22Å
697	N	85.8	Confident	88.8	Confident	8 Å²	8	25.7 Å²	25.7	4%	0.043	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	24.8	-177.3	-67.2	-42.8	0	0	0	113.4	L604 L693 G699 N700 H701	L604-N697 WeakPolarHBondContact CD2-OD1 3.26Å; L693-N697 WeakPolarHBondContact O-CB 3.36Å; L693-N697 PolarHBondContact O-N 3.27Å; N697-G699 PolarHBondContact O-N 3.24Å; N697-N700 WeakPolarHBondContact O-CA 3.46Å; N697-N700 VanDerWaalsContact O-CB 3.32Å; N697-N700 WeakPolarHBondContact O-CB 3.49Å; N697-N700 PolarHBondContact O-N 2.72Å; N697-H701 VanDerWaalsContact C-CE1 3.45Å; N697-H701 PolarHBondContact O-CE1 2.96Å; N697-H701 PolarHBondContact O-NE2 2.79Å
698	F	89.1	Confident	88.5	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.009	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	129.1	-178.3	-168.7	-94.9	0	0	0	111.6	V631 L633 I636 L694 L695 N700 Y756 F757 F808	V631-F698 HydrophobicContact CG1-CD1 4Å; V631-F698 HydrophobicContact CG1-CE1 4.45Å; V631-F698 HydrophobicContact CG2-CD1 4.26Å; L633-F698 HydrophobicContact CD1-CE1 3.82Å; I636-F698 HydrophobicContact CD1-CD1 4.22Å; I636-F698 HydrophobicContact CD1-CD2 3.7Å; I636-F698 HydrophobicContact CD1-CE1 3.98Å; I636-F698 HydrophobicContact CD1-CE2 3.43Å; I636-F698 VanDerWaalsContact CD1-CE2 3.43Å; I636-F698 HydrophobicContact CD1-CG 4.08Å; I636-F698 HydrophobicContact CD1-CZ 3.59Å; I636-F698 HydrophobicContact CG1-CD1 3.92Å; I636-F698 HydrophobicContact CG1-CD2 4.28Å; I636-F698 HydrophobicContact CG1-CE1 3.75Å; I636-F698 HydrophobicContact CG1-CE2 4.15Å; I636-F698 HydrophobicContact CG1-CG 4.16Å; I636-F698 HydrophobicContact CG1-CZ 3.89Å; I636-F698 HydrophobicContact CG2-CB 4.24Å; I636-F698 HydrophobicContact CG2-CG 4.28Å; L694-F698 WeakPolarHBondContact O-CA 3.42Å; L694-F698 PolarHBondContact O-N 3.08Å; L694-F698 VanDerWaalsContact O-N 3.07Å; L695-F698 WeakPolarHBondContact O-CB 3.48Å; L695-F698 PolarHBondContact O-N 3.44Å; F698-N700 PolarHBondContact O-N 3.26Å; F698-N700 PolarHBondContact O-ND2 3.26Å; F698-Y756 AromaticContact CD1-CD1 3.79Å; F698-Y756 HydrophobicContact CD1-CD1 3.79Å; F698-Y756 HydrophobicContact CD1-CE1 4.44Å; F698-Y756 AromaticContact CE1-CD1 3.14Å; F698-Y756 HydrophobicContact CE1-CD1 3.14Å; F698-Y756 AromaticContact CE1-CE1 3.72Å; F698-Y756 HydrophobicContact CE1-CE1 3.72Å; F698-Y756 AromaticContact CE1-CG 3.74Å; F698-Y756 HydrophobicContact CE1-CG 3.74Å; F698-Y756 AromaticContact CZ-CD1 3.82Å; F698-Y756 HydrophobicContact CZ-CD1 3.82Å; F698-Y756 AromaticContact CZ-CG 3.92Å; F698-Y756 HydrophobicContact CZ-CG 3.92Å; F698-F757 HydrophobicContact CD2-CE1 4.18Å; F698-F757 HydrophobicContact CD2-CZ 4.36Å; F698-F757 AromaticContact CE2-CE1 3.72Å; F698-F757 HydrophobicContact CE2-CE1 3.72Å; F698-F757 HydrophobicContact CE2-CE2 4.17Å; F698-F757 AromaticContact CE2-CZ 3.47Å; F698-F757 HydrophobicContact CE2-CZ 3.47Å; F698-F757 VanDerWaalsContact CE2-CZ 3.47Å; F698-F757 HydrophobicContact CZ-CE2 4.47Å; F698-F757 HydrophobicContact CZ-CZ 4.15Å; F698-F808 HydrophobicContact CE2-CB 4.3Å; F698-F808 HydrophobicContact CE2-CD1 4.18Å; F698-F808 HydrophobicContact CE2-CG 4.1Å; F698-F808 AromaticContact CZ-CD1 3.79Å; F698-F808 HydrophobicContact CZ-CD1 3.79Å; F698-F808 AromaticContact CZ-CD2 3.95Å; F698-F808 HydrophobicContact CZ-CD2 3.95Å; F698-F808 AromaticContact CZ-CE1 3.88Å; F698-F808 HydrophobicContact CZ-CE1 3.88Å; F698-F808 HydrophobicContact CZ-CE2 4.02Å; F698-F808 AromaticContact CZ-CG 3.84Å; F698-F808 HydrophobicContact CZ-CG 3.84Å; F698-F808 AromaticContact CZ-CZ 3.99Å; F698-F808 HydrophobicContact CZ-CZ 3.99Å
699	G	84.9	Confident	88.4	Confident	9 Å²	9	34.9 Å²	34.9	9%	0.093	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	8	-174.7	0	0	0	0	0	116	N697 Y756	N697-G699 PolarHBondContact O-N 3.24Å; G699-Y756 VanDerWaalsContact CA-O 3.25Å; G699-Y756 WeakPolarHBondContact CA-O 3.3Å; G699-Y756 PolarHBondContact N-O 2.8Å
700	N	85.1	Confident	88.3	Confident	35 Å²	35	35.7 Å²	35.7	19%	0.187	18%	0.175	C	C	.	.			trans	-130.3	10	-174.2	-68.1	-87.4	0	0	0	114	H628 R629 N697 F698	H628-N700 WeakPolarHBondContact CA-OD1 3.35Å; H628-N700 VanDerWaalsContact CD2-CG 3.47Å; H628-N700 PolarHBondContact CD2-OD1 2.95Å; H628-N700 VanDerWaalsContact CD2-OD1 3.29Å; H628-N700 PolarHBondContact CE1-ND2 3.16Å; H628-N700 VanDerWaalsContact CG-OD1 3.31Å; H628-N700 VanDerWaalsContact NE2-CG 3.31Å; R629-N700 PolarHBondContact N-OD1 3.44Å; R629-N700 PolarHBondContact O-ND2 3.12Å; N697-N700 WeakPolarHBondContact O-CA 3.46Å; N697-N700 VanDerWaalsContact O-CB 3.32Å; N697-N700 WeakPolarHBondContact O-CB 3.49Å; N697-N700 PolarHBondContact O-N 2.72Å; F698-N700 PolarHBondContact O-N 3.26Å; F698-N700 PolarHBondContact O-ND2 3.26Å
701	H	82.3	Confident	88.4	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.019	19%	0.192	C	C	.	.			trans	-66.9	153.3	175.4	-49.3	-57.4	0	0	0	112	L694 N697 S758	L694-H701 PolarHBondContact O-NE2 3.43Å; N697-H701 VanDerWaalsContact C-CE1 3.45Å; N697-H701 PolarHBondContact O-CE1 2.96Å; N697-H701 PolarHBondContact O-NE2 2.79Å; H701-S758 PolarHBondContact O-OG 2.92Å
702	G	80.3	Confident	88.3	Confident	2 Å²	2	38.3 Å²	38.3	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-175.6	163	0	0	0	0	0	111.2	S758 L776	G702-S758 VanDerWaalsContact O-CB 3.3Å; G702-S758 WeakPolarHBondContact O-CB 3.16Å; G702-L776 VanDerWaalsContact C-CB 3.49Å; G702-L776 PolarHBondContact N-O 2.83Å; G702-L776 PolarHBondContact O-N 2.86Å
703	E	85.7	Confident	88.4	Confident	25 Å²	25	39.9 Å²	39.9	12%	0.117	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	116.8	-176.2	-165.5	173.9	128.3	0	0	109.6	R444 I705 W754 K760	R444-E703 IonicContact CZ-OE2 3.77Å; R444-E703 IonicContact NE-OE2 3.8Å; R444-E703 IonicContact NH2-OE2 3.87Å; R444-E703 PolarHBondContact NH2-OE2 3.38Å; E703-I705 HydrophobicContact CG-CG1 4.33Å; E703-I705 PolarHBondContact O-N 3.36Å; E703-W754 PolarHBondContact OE2-NE1 2.94Å; E703-K760 WeakPolarHBondContact OE1-CD 3.23Å; E703-K760 IonicContact OE1-NZ 2.93Å
704	I	88.1	Confident	88.5	Confident	35 Å²	35	43.6 Å²	43.6	18%	0.179	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	101.2	168.5	-51.7	-179.3	0	0	0	106.6	G773 I774 L776	I704-G773 WeakPolarHBondContact O-CA 3.37Å; I704-I774 HydrophobicContact CB-CG1 3.79Å; I704-I774 HydrophobicContact CD1-CD1 4.49Å; I704-I774 HydrophobicContact CD1-CG1 4.3Å; I704-I774 HydrophobicContact CG1-CG1 4.39Å; I704-I774 HydrophobicContact CG2-CG1 4.38Å; I704-I774 PolarHBondContact N-O 3.02Å; I704-I774 PolarHBondContact O-N 2.9Å; I704-L776 HydrophobicContact CD1-CD1 4Å; I704-L776 HydrophobicContact CG1-CB 3.73Å; I704-L776 HydrophobicContact CG1-CD1 3.83Å; I704-L776 HydrophobicContact CG1-CG 4.22Å
705	I	91.1	Very high	88.6	Confident	100 Å²	100	44.4 Å²	44.4	51%	0.513	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.8	178.7	-58.9	173.9	0	0	0	109.1	T580 E703 R707 T772	T580-I705 HydrophobicContact CG2-CD1 4.12Å; E703-I705 HydrophobicContact CG-CG1 4.33Å; E703-I705 PolarHBondContact O-N 3.36Å; I705-R707 PolarHBondContact O-N 2.81Å; I705-T772 CarbonylContact C-O 3.31Å; I705-T772 WeakPolarHBondContact CA-O 3.29Å
706	L	89	Confident	88.7	Confident	25 Å²	25	44.4 Å²	44.4	13%	0.131	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	122.8	174.1	-59.5	-178.5	0	0	0	109.1	E708 A710 L771 T772 L788	L706-E708 PolarHBondContact O-N 3.06Å; L706-A710 HydrophobicContact CD1-CB 4.15Å; L706-L771 HydrophobicContact CD1-CD2 4.17Å; L706-L771 HydrophobicContact CD1-CG 4.18Å; L706-T772 PolarHBondContact N-O 3.28Å; L706-L788 HydrophobicContact CD1-CD2 4.3Å
707	R	84.2	Confident	89	Confident	233 Å²	233	46 Å²	46	88%	0.879	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-57	-38.7	-178.8	177.8	-178.5	172.5	-176.2	-3.5	112.3	I705	I705-R707 PolarHBondContact O-N 2.81Å
708	E	86.9	Confident	89.3	Confident	150 Å²	150	50.2 Å²	50.2	70%	0.701	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	115.7	172.6	-74.2	166.7	-153.7	0	0	106.4	L706 A710	L706-E708 PolarHBondContact O-N 3.06Å; E708-A710 PolarHBondContact O-N 3.43Å
709	P	89.8	Confident	89.3	Confident	63 Å²	63	50.1 Å²	50.1	41%	0.409	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	121.8	-179.5	-25.6	35.8	0	0	0	111.1	P711 V770 L771 T772	P709-P711 WeakPolarHBondContact O-CD 3.39Å; P709-V770 HydrophobicContact CB-CB 3.71Å; P709-V770 HydrophobicContact CB-CG1 4.3Å; P709-V770 HydrophobicContact CB-CG2 3.67Å; P709-L771 CarbonylContact C-O 3.51Å; P709-L771 WeakPolarHBondContact CA-O 3.44Å; P709-T772 HydrophobicContact CB-CG2 3.75Å; P709-T772 HydrophobicContact CG-CG2 3.88Å
710	A	92.7	Very high	89.4	Confident	19 Å²	19	49.7 Å²	49.7	16%	0.157	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	122.6	-172.9	0	0	0	0	0	110.7	L706 E708 L712 L715 V770 L771	L706-A710 HydrophobicContact CD1-CB 4.15Å; E708-A710 PolarHBondContact O-N 3.43Å; A710-L712 PolarHBondContact O-N 3.04Å; A710-L715 HydrophobicContact CB-CD1 3.8Å; A710-L715 HydrophobicContact CB-CD2 4.48Å; A710-L715 HydrophobicContact CB-CG 4.26Å; A710-V770 CarbonylContact O-C 3.58Å; A710-V770 WeakPolarHBondContact O-CA 3.12Å; A710-L771 PolarHBondContact N-O 3.23Å; A710-L771 PolarHBondContact O-N 3.33Å
711	P	94.4	Very high	89.5	Confident	54 Å²	54	54.9 Å²	54.9	35%	0.351	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	124.8	178.7	-23.9	34.8	0	0	0	111.9	P709 A713 D714 L715	P709-P711 WeakPolarHBondContact O-CD 3.39Å; P711-A713 PolarHBondContact O-N 3.27Å; P711-D714 HydrophobicContact CB-CB 4.25Å; P711-D714 WeakPolarHBondContact CB-OD2 3.46Å; P711-D714 WeakPolarHBondContact CG-OD2 3.35Å; P711-D714 PolarHBondContact O-N 2.92Å; P711-L715 PolarHBondContact O-N 3.03Å; P711-L715 VanDerWaalsContact O-N 3.15Å
712	L	93.8	Very high	89.6	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-33	-174.8	-160.2	73.6	0	0	0	111.4	A710 L716 T743 L746 I761 Q769 V792	A710-L712 PolarHBondContact O-N 3.04Å; L712-L716 HydrophobicContact CD2-CD1 4.45Å; L712-L716 HydrophobicContact CG-CD1 4.07Å; L712-L716 VanDerWaalsContact O-CB 3.3Å; L712-L716 WeakPolarHBondContact O-CB 3.4Å; L712-L716 WeakPolarHBondContact O-CD1 3.4Å; L712-L716 WeakPolarHBondContact O-CG 3.36Å; L712-L716 PolarHBondContact O-N 2.81Å; L712-T743 HydrophobicContact CD2-CG2 4.23Å; L712-L746 HydrophobicContact CD1-CD1 4.1Å; L712-L746 HydrophobicContact CD2-CB 4.21Å; L712-L746 HydrophobicContact CD2-CD1 4.06Å; L712-L746 HydrophobicContact CG-CD1 4.36Å; L712-I761 HydrophobicContact CD2-CD1 4.46Å; L712-Q769 HydrophobicContact CB-CB 4.36Å; L712-Q769 VanDerWaalsContact CB-O 3.26Å; L712-Q769 WeakPolarHBondContact CB-O 3.38Å; L712-Q769 HydrophobicContact CD2-CB 4.4Å; L712-Q769 PolarHBondContact N-O 3.14Å; L712-V792 HydrophobicContact CD1-CG1 3.66Å; L712-V792 HydrophobicContact CG-CG1 4.49Å
713	A	92.9	Very high	89.7	Confident	42 Å²	42	60.2 Å²	60.2	35%	0.347	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-42.3	175.5	0	0	0	0	0	112.7	P711 L716 S717 I739	P711-A713 PolarHBondContact O-N 3.27Å; A713-L716 PolarHBondContact O-N 2.88Å; A713-S717 WeakPolarHBondContact O-CB 3.14Å; A713-S717 PolarHBondContact O-N 2.78Å; A713-I739 HydrophobicContact CB-CG2 3.86Å
714	D	93.2	Very high	89.4	Confident	93 Å²	93	64.6 Å²	64.6	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-72.1	-42.6	-178.3	-59.7	-18.6	0	0	0	110.8	P711 L716 S717 I718	P711-D714 HydrophobicContact CB-CB 4.25Å; P711-D714 WeakPolarHBondContact CB-OD2 3.46Å; P711-D714 WeakPolarHBondContact CG-OD2 3.35Å; P711-D714 PolarHBondContact O-N 2.92Å; D714-L716 VanDerWaalsContact C-N 3.34Å; D714-L716 PolarHBondContact O-N 2.87Å; D714-S717 PolarHBondContact O-N 3.14Å; D714-I718 WeakPolarHBondContact O-CG1 3.43Å; D714-I718 PolarHBondContact O-N 3.42Å
715	L	93.9	Very high	88.6	Confident	17 Å²	17	72.4 Å²	72.4	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-58.8	-44.2	172.8	-67.7	179.6	0	0	0	111.9	A710 P711 G719 L771 L788 P789 V792	A710-L715 HydrophobicContact CB-CD1 3.8Å; A710-L715 HydrophobicContact CB-CD2 4.48Å; A710-L715 HydrophobicContact CB-CG 4.26Å; P711-L715 PolarHBondContact O-N 3.03Å; P711-L715 VanDerWaalsContact O-N 3.15Å; L715-G719 PolarHBondContact O-N 3.39Å; L715-L771 HydrophobicContact CD1-CB 4.39Å; L715-L771 HydrophobicContact CD1-CD2 4.17Å; L715-L788 HydrophobicContact CD1-CD2 4.23Å; L715-L788 HydrophobicContact CD1-CG 4.33Å; L715-L788 HydrophobicContact CD2-CD2 4.21Å; L715-L788 HydrophobicContact CD2-CG 4.31Å; L715-P789 HydrophobicContact CD2-CB 4.49Å; L715-P789 HydrophobicContact CD2-CG 3.92Å; L715-P789 WeakPolarHBondContact O-CB 3.37Å; L715-V792 HydrophobicContact CB-CG1 4.47Å; L715-V792 HydrophobicContact CD1-CG2 4.11Å
716	L	93.9	Very high	87.5	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-70.2	-31.2	177.2	-72.8	169.2	0	0	0	112.6	L712 A713 D714 H720 F738 I739 A742 T743 V792 A796	L712-L716 HydrophobicContact CD2-CD1 4.45Å; L712-L716 HydrophobicContact CG-CD1 4.07Å; L712-L716 VanDerWaalsContact O-CB 3.3Å; L712-L716 WeakPolarHBondContact O-CB 3.4Å; L712-L716 WeakPolarHBondContact O-CD1 3.4Å; L712-L716 WeakPolarHBondContact O-CG 3.36Å; L712-L716 PolarHBondContact O-N 2.81Å; A713-L716 PolarHBondContact O-N 2.88Å; D714-L716 VanDerWaalsContact C-N 3.34Å; D714-L716 PolarHBondContact O-N 2.87Å; L716-H720 WeakPolarHBondContact O-CB 3.17Å; L716-H720 PolarHBondContact O-N 2.92Å; L716-F738 HydrophobicContact CD2-CE1 4.38Å; L716-I739 HydrophobicContact CB-CG1 4.04Å; L716-A742 HydrophobicContact CD1-CB 3.73Å; L716-A742 HydrophobicContact CD2-CB 3.73Å; L716-A742 HydrophobicContact CG-CB 4.33Å; L716-T743 WeakPolarHBondContact CD1-OG1 3.35Å; L716-V792 HydrophobicContact CD2-CG1 4.02Å; L716-V792 HydrophobicContact CG-CG1 4.22Å; L716-A796 HydrophobicContact CD2-CB 4.23Å
717	S	92.1	Very high	86.4	Confident	47 Å²	47	71.9 Å²	71.9	33%	0.329	36%	0.358	S	S	.	.	H	α-helix	trans	-67	-50.3	174.9	-166.2	0	0	0	0	111.6	A713 D714 G719 H720 E721	A713-S717 WeakPolarHBondContact O-CB 3.14Å; A713-S717 PolarHBondContact O-N 2.78Å; D714-S717 PolarHBondContact O-N 3.14Å; S717-G719 PolarHBondContact O-N 3.07Å; S717-H720 WeakPolarHBondContact O-CB 3.2Å; S717-H720 PolarHBondContact O-N 3.19Å; S717-E721 PolarHBondContact O-N 2.82Å
718	I	91.1	Very high	85.4	Confident	97 Å²	97	70 Å²	70	50%	0.497	35%	0.351	S	S	.	.	H	α-helix	trans	-64.5	-42.4	178.8	-64.4	163.6	0	0	0	110.5	D714 E721 Y722 P789	D714-I718 WeakPolarHBondContact O-CG1 3.43Å; D714-I718 PolarHBondContact O-N 3.42Å; I718-E721 PolarHBondContact O-N 2.87Å; I718-Y722 WeakPolarHBondContact O-CB 3.42Å; I718-Y722 PolarHBondContact O-N 3.39Å; I718-P789 HydrophobicContact CB-CB 3.97Å; I718-P789 HydrophobicContact CB-CG 4.22Å; I718-P789 HydrophobicContact CG2-CB 3.79Å; I718-P789 HydrophobicContact CG2-CG 3.84Å
719	G	88.8	Confident	84.5	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-69.5	-33.2	176.9	0	0	0	0	0	113.6	L715 S717 L723 T793	L715-G719 PolarHBondContact O-N 3.39Å; S717-G719 PolarHBondContact O-N 3.07Å; G719-L723 WeakPolarHBondContact O-CB 3.29Å; G719-L723 WeakPolarHBondContact O-CG 3.3Å; G719-L723 PolarHBondContact O-N 3.46Å; G719-T793 WeakPolarHBondContact CA-OG1 3.37Å
720	H	88.6	Confident	83.5	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-55.6	169	-176.2	-109.7	0	0	0	110.2	L716 S717 Y722 L723 R724 L730 S735 F738	L716-H720 WeakPolarHBondContact O-CB 3.17Å; L716-H720 PolarHBondContact O-N 2.92Å; S717-H720 WeakPolarHBondContact O-CB 3.2Å; S717-H720 PolarHBondContact O-N 3.19Å; H720-Y722 VanDerWaalsContact C-N 3.29Å; H720-Y722 PolarHBondContact O-N 3.14Å; H720-L723 PolarHBondContact O-N 3.32Å; H720-R724 WeakPolarHBondContact O-CB 3.41Å; H720-R724 PolarHBondContact O-N 3.06Å; H720-L730 PolarHBondContact NE2-O 3.18Å; H720-S735 PolarHBondContact CE1-OG 3.23Å; H720-S735 PolarHBondContact ND1-OG 2.86Å; H720-F738 HydrophobicContact CB-CD1 3.73Å; H720-F738 HydrophobicContact CB-CE1 3.88Å; H720-F738 AromaticContact CD2-CD1 3.46Å; H720-F738 VanDerWaalsContact CD2-CD1 3.46Å; H720-F738 WeakPolarHBondContact CD2-CD1 3.4Å; H720-F738 AromaticContact CD2-CE1 3.99Å; H720-F738 AromaticContact CD2-CG 3.65Å; H720-F738 AromaticContact CG-CD1 3.76Å
721	E	86.4	Confident	82.3	Confident	144 Å²	144	66.5 Å²	66.5	67%	0.673	33%	0.327	S	S	*	.	H	α-helix	trans	-55.9	-42.7	-179.1	-174.3	176.2	-179.5	0	0	112.4	S717 I718	S717-E721 PolarHBondContact O-N 2.82Å; I718-E721 PolarHBondContact O-N 2.87Å
722	Y	83.8	Confident	81.1	Confident	109 Å²	109	70.2 Å²	70.2	43%	0.427	34%	0.343	S	S	.	.	H	α-helix	trans	-64.9	-51.9	178	-170.8	-88.6	0	0	0	112.5	I718 H720 I790 L825	I718-Y722 WeakPolarHBondContact O-CB 3.42Å; I718-Y722 PolarHBondContact O-N 3.39Å; H720-Y722 VanDerWaalsContact C-N 3.29Å; H720-Y722 PolarHBondContact O-N 3.14Å; Y722-I790 HydrophobicContact CD1-CD1 3.63Å; Y722-I790 HydrophobicContact CD1-CG1 3.82Å; Y722-I790 HydrophobicContact CD2-CD1 4.49Å; Y722-I790 HydrophobicContact CE1-CD1 3.49Å; Y722-I790 VanDerWaalsContact CE1-CD1 3.49Å; Y722-I790 HydrophobicContact CE1-CG1 4.19Å; Y722-I790 HydrophobicContact CE2-CD1 4.38Å; Y722-I790 HydrophobicContact CG-CD1 4.15Å; Y722-I790 HydrophobicContact CG-CG1 4.24Å; Y722-L825 HydrophobicContact CE2-CD1 4.4Å
723	L	83	Confident	80.2	Confident	9 Å²	9	71.7 Å²	71.7	5%	0.047	35%	0.351	C	S	.	.	H	α-helix	trans	-80.5	-15.1	-175	-66.5	174.9	0	0	0	113.8	G719 H720 K725 S726 S727 L730 I790 T793 K794	G719-L723 WeakPolarHBondContact O-CB 3.29Å; G719-L723 WeakPolarHBondContact O-CG 3.3Å; G719-L723 PolarHBondContact O-N 3.46Å; H720-L723 PolarHBondContact O-N 3.32Å; L723-K725 PolarHBondContact O-N 3.13Å; L723-K725 VanDerWaalsContact O-N 3.11Å; L723-S726 PolarHBondContact O-N 3.18Å; L723-S727 PolarHBondContact O-N 3.48Å; L723-L730 HydrophobicContact CB-CD1 3.5Å; L723-L730 HydrophobicContact CD1-CD1 4.39Å; L723-I790 HydrophobicContact CD1-CG2 4.31Å; L723-I790 HydrophobicContact CD2-CG2 4.23Å; L723-I790 HydrophobicContact CG-CG2 4.49Å; L723-T793 HydrophobicContact CD1-CG2 3.83Å; L723-K794 HydrophobicContact CD1-CG 4.23Å
724	R	79	Confident	79.6	Confident	116 Å²	116	72.1 Å²	72.1	44%	0.438	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.5	179.1	-170.8	173.5	-167.6	-168.8	1.3	114.1	H720 S731	H720-R724 WeakPolarHBondContact O-CB 3.41Å; H720-R724 PolarHBondContact O-N 3.06Å; R724-S731 PolarHBondContact NH2-O 3.36Å
725	K	71.5	Confident	79.2	Confident	200 Å²	200	69.6 Å²	69.6	87%	0.87	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-23.8	175.9	-65.1	177	-175.2	169	0	113.3	L723	L723-K725 PolarHBondContact O-N 3.13Å; L723-K725 VanDerWaalsContact O-N 3.11Å
726	S	67.4	Low	78.8	Confident	90 Å²	90	74.4 Å²	74.4	63%	0.629	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-36.7	-174.6	-54.3	0	0	0	0	112.7	L723	L723-S726 PolarHBondContact O-N 3.18Å
727	S	67.2	Low	78.5	Confident	23 Å²	23	80.2 Å²	80.2	16%	0.161	39%	0.393	C	S	.	.			trans	-95.2	117.5	-175.7	-179.2	0	0	0	0	112.9	L723 Y729 L730 S731	L723-S727 PolarHBondContact O-N 3.48Å; S727-Y729 PolarHBondContact O-N 3.2Å; S727-Y729 PolarHBondContact OG-N 2.95Å; S727-L730 PolarHBondContact O-N 2.83Å; S727-S731 PolarHBondContact O-N 3.34Å; S727-S731 VanDerWaalsContact O-N 3.17Å
728	R	63.9	Low	78.4	Confident	193 Å²	193	78.1 Å²	78.1	73%	0.728	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-13.3	173	-73.2	-174.8	-82.6	151.9	-7	114.4	S731 N732 N889	R728-S731 PolarHBondContact O-OG 3.43Å; R728-S731 VanDerWaalsContact O-OG 3.09Å; R728-N732 PolarHBondContact O-ND2 2.85Å; R728-N889 PolarHBondContact NH2-OD1 3.43Å
729	Y	67.3	Low	78.4	Confident	113 Å²	113	74.8 Å²	74.8	44%	0.443	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-50.8	173	173.8	-104.3	0	0	0	110.3	S727 S731 N732 L733	S727-Y729 PolarHBondContact O-N 3.2Å; S727-Y729 PolarHBondContact OG-N 2.95Å; Y729-S731 VanDerWaalsContact C-N 3.26Å; Y729-S731 PolarHBondContact O-N 3.03Å; Y729-N732 PolarHBondContact O-N 2.94Å; Y729-L733 HydrophobicContact CD2-CD1 4.36Å; Y729-L733 HydrophobicContact CE1-CD1 4.45Å; Y729-L733 HydrophobicContact CE2-CD1 4.03Å
730	L	69.3	Low	78.5	Confident	3 Å²	3	81.5 Å²	81.5	2%	0.016	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-21.7	-177.6	-57.7	-180	0	0	0	113.9	H720 L723 S727 N732 F738 T797	H720-L730 PolarHBondContact NE2-O 3.18Å; L723-L730 HydrophobicContact CB-CD1 3.5Å; L723-L730 HydrophobicContact CD1-CD1 4.39Å; S727-L730 PolarHBondContact O-N 2.83Å; L730-N732 PolarHBondContact O-N 2.78Å; L730-F738 HydrophobicContact CD2-CD2 3.76Å; L730-F738 HydrophobicContact CD2-CE2 3.37Å; L730-F738 HydrophobicContact CD2-CZ 3.84Å; L730-T797 HydrophobicContact CD2-CG2 4.3Å
731	S	66.5	Low	78.6	Confident	43 Å²	43	86.3 Å²	86.3	30%	0.301	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.6	173.9	56.2	0	0	0	0	113.4	R724 S727 R728 Y729	R724-S731 PolarHBondContact NH2-O 3.36Å; S727-S731 PolarHBondContact O-N 3.34Å; S727-S731 VanDerWaalsContact O-N 3.17Å; R728-S731 PolarHBondContact O-OG 3.43Å; R728-S731 VanDerWaalsContact O-OG 3.09Å; Y729-S731 VanDerWaalsContact C-N 3.26Å; Y729-S731 PolarHBondContact O-N 3.03Å
732	N	70.5	Confident	78.9	Confident	132 Å²	132	79.6 Å²	79.6	71%	0.706	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-25.3	-163.4	-60.1	-7.1	0	0	0	114.2	R728 Y729 L730	R728-N732 PolarHBondContact O-ND2 2.85Å; Y729-N732 PolarHBondContact O-N 2.94Å; L730-N732 PolarHBondContact O-N 2.78Å
733	L	73.3	Confident	79.4	Confident	34 Å²	34	75.8 Å²	75.8	18%	0.178	37%	0.37	C	S	.	.	S	Bend	trans	-79.4	146	175.7	-79.4	74.4	0	0	0	110.7	Y729 F738	Y729-L733 HydrophobicContact CD2-CD1 4.36Å; Y729-L733 HydrophobicContact CE1-CD1 4.45Å; Y729-L733 HydrophobicContact CE2-CD1 4.03Å; L733-F738 HydrophobicContact CB-CB 4.22Å; L733-F738 HydrophobicContact CD2-CB 4.24Å; L733-F738 HydrophobicContact CD2-CD2 4.22Å
734	S	81.2	Confident	79.8	Confident	50 Å²	50	78.2 Å²	78.2	35%	0.35	39%	0.392	S	S	.	.			trans	-70	144.1	164.1	81.5	0	0	0	0	109.7	I736 E737 F738	S734-I736 PolarHBondContact O-N 3.42Å; S734-I736 VanDerWaalsContact O-N 3.16Å; S734-E737 VanDerWaalsContact CB-OE2 3.24Å; S734-E737 WeakPolarHBondContact CB-OE2 3.39Å; S734-E737 PolarHBondContact O-N 2.93Å; S734-E737 VanDerWaalsContact O-N 3.15Å; S734-E737 WeakPolarHBondContact OG-CG 3.38Å; S734-E737 PolarHBondContact OG-N 3.02Å; S734-E737 PolarHBondContact OG-OE2 3.32Å; S734-F738 WeakPolarHBondContact O-CB 3.48Å; S734-F738 PolarHBondContact O-N 3.37Å
735	S	83.9	Confident	80.5	Confident	40 Å²	40	74.5 Å²	74.5	28%	0.28	38%	0.382	S	S	.	.	H	α-helix	trans	-59.4	-30.9	-178.1	-50.7	0	0	0	0	112.3	H720 I739	H720-S735 PolarHBondContact CE1-OG 3.23Å; H720-S735 PolarHBondContact ND1-OG 2.86Å; S735-I739 VanDerWaalsContact O-CB 3.32Å; S735-I739 WeakPolarHBondContact O-CB 3.21Å; S735-I739 VanDerWaalsContact O-CD1 3.24Å; S735-I739 WeakPolarHBondContact O-CD1 3.3Å; S735-I739 WeakPolarHBondContact O-CG1 3.38Å; S735-I739 PolarHBondContact O-N 2.94Å
736	I	87	Confident	81.6	Confident	119 Å²	119	65.1 Å²	65.1	61%	0.61	34%	0.341	S	S	*	.	H	α-helix	trans	-71.1	-39.2	178.9	-62.4	172.2	0	0	0	111.8	S734 K740	S734-I736 PolarHBondContact O-N 3.42Å; S734-I736 VanDerWaalsContact O-N 3.16Å; I736-K740 WeakPolarHBondContact O-CD 3.31Å; I736-K740 VanDerWaalsContact O-CG 3.28Å; I736-K740 WeakPolarHBondContact O-CG 3.28Å; I736-K740 PolarHBondContact O-N 3.18Å
737	E	87.2	Confident	82.9	Confident	121 Å²	121	63.6 Å²	63.6	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-71.1	-46	175.3	-70.2	159.3	145.3	0	0	110.3	S734 I739 K740 E741	S734-E737 VanDerWaalsContact CB-OE2 3.24Å; S734-E737 WeakPolarHBondContact CB-OE2 3.39Å; S734-E737 PolarHBondContact O-N 2.93Å; S734-E737 VanDerWaalsContact O-N 3.15Å; S734-E737 WeakPolarHBondContact OG-CG 3.38Å; S734-E737 PolarHBondContact OG-N 3.02Å; S734-E737 PolarHBondContact OG-OE2 3.32Å; E737-I739 PolarHBondContact O-N 3.35Å; E737-K740 WeakPolarHBondContact O-CB 3.2Å; E737-K740 PolarHBondContact O-N 2.93Å; E737-E741 PolarHBondContact O-N 3.42Å
738	F	89.6	Confident	84.2	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-55.5	-50.6	176.5	176.3	-103.2	0	0	0	112.6	L716 H720 L730 L733 S734 K740 E741 A742 T793 T797	L716-F738 HydrophobicContact CD2-CE1 4.38Å; H720-F738 HydrophobicContact CB-CD1 3.73Å; H720-F738 HydrophobicContact CB-CE1 3.88Å; H720-F738 AromaticContact CD2-CD1 3.46Å; H720-F738 VanDerWaalsContact CD2-CD1 3.46Å; H720-F738 WeakPolarHBondContact CD2-CD1 3.4Å; H720-F738 AromaticContact CD2-CE1 3.99Å; H720-F738 AromaticContact CD2-CG 3.65Å; H720-F738 AromaticContact CG-CD1 3.76Å; L730-F738 HydrophobicContact CD2-CD2 3.76Å; L730-F738 HydrophobicContact CD2-CE2 3.37Å; L730-F738 HydrophobicContact CD2-CZ 3.84Å; L733-F738 HydrophobicContact CB-CB 4.22Å; L733-F738 HydrophobicContact CD2-CB 4.24Å; L733-F738 HydrophobicContact CD2-CD2 4.22Å; S734-F738 WeakPolarHBondContact O-CB 3.48Å; S734-F738 PolarHBondContact O-N 3.37Å; F738-K740 VanDerWaalsContact C-N 3.26Å; F738-K740 PolarHBondContact O-N 3.31Å; F738-E741 PolarHBondContact O-N 3.01Å; F738-A742 HydrophobicContact CE1-CB 4.26Å; F738-A742 HydrophobicContact CE2-CB 4.19Å; F738-A742 HydrophobicContact CZ-CB 3.94Å; F738-A742 VanDerWaalsContact O-CB 3.26Å; F738-A742 WeakPolarHBondContact O-CB 3.45Å; F738-A742 PolarHBondContact O-N 2.75Å; F738-T793 HydrophobicContact CE1-CG2 4.04Å; F738-T793 HydrophobicContact CZ-CG2 3.78Å; F738-T797 HydrophobicContact CE2-CG2 3.51Å; F738-T797 HydrophobicContact CZ-CG2 3.7Å
739	I	90.8	Very high	85.6	Confident	27 Å²	27	58.4 Å²	58.4	14%	0.138	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-38.3	-180	-71.2	161.8	0	0	0	111	A713 L716 S735 E737 T743	A713-I739 HydrophobicContact CB-CG2 3.86Å; L716-I739 HydrophobicContact CB-CG1 4.04Å; S735-I739 VanDerWaalsContact O-CB 3.32Å; S735-I739 WeakPolarHBondContact O-CB 3.21Å; S735-I739 VanDerWaalsContact O-CD1 3.24Å; S735-I739 WeakPolarHBondContact O-CD1 3.3Å; S735-I739 WeakPolarHBondContact O-CG1 3.38Å; S735-I739 PolarHBondContact O-N 2.94Å; E737-I739 PolarHBondContact O-N 3.35Å; I739-T743 WeakPolarHBondContact O-CB 3.38Å; I739-T743 PolarHBondContact O-N 2.89Å; I739-T743 PolarHBondContact O-OG1 3.27Å
740	K	90.8	Very high	86.8	Confident	140 Å²	140	53.8 Å²	53.8	61%	0.609	29%	0.293	S	S	*	.	H	α-helix	trans	-66.9	-47.3	177.4	-73.2	170.5	-177.9	177	0	112.1	I736 E737 F738 A744	I736-K740 WeakPolarHBondContact O-CD 3.31Å; I736-K740 VanDerWaalsContact O-CG 3.28Å; I736-K740 WeakPolarHBondContact O-CG 3.28Å; I736-K740 PolarHBondContact O-N 3.18Å; E737-K740 WeakPolarHBondContact O-CB 3.2Å; E737-K740 PolarHBondContact O-N 2.93Å; F738-K740 VanDerWaalsContact C-N 3.26Å; F738-K740 PolarHBondContact O-N 3.31Å; K740-A744 WeakPolarHBondContact O-CB 3.46Å; K740-A744 PolarHBondContact O-N 2.69Å
741	E	90.9	Very high	87.8	Confident	102 Å²	102	56.3 Å²	56.3	48%	0.477	31%	0.311	S	S	.	.	H	α-helix	trans	-64.6	-49.6	179.6	-175.3	172.7	-171.7	0	0	111.4	E737 F738 T743 A744 T745	E737-E741 PolarHBondContact O-N 3.42Å; F738-E741 PolarHBondContact O-N 3.01Å; E741-T743 PolarHBondContact O-N 3.02Å; E741-A744 PolarHBondContact O-N 3.15Å; E741-T745 PolarHBondContact O-N 3.45Å; E741-T745 PolarHBondContact O-OG1 3.3Å
742	A	92.4	Very high	89	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-40.1	177.3	0	0	0	0	0	112.5	L716 F738 T745 L746 A796	L716-A742 HydrophobicContact CD1-CB 3.73Å; L716-A742 HydrophobicContact CD2-CB 3.73Å; L716-A742 HydrophobicContact CG-CB 4.33Å; F738-A742 HydrophobicContact CE1-CB 4.26Å; F738-A742 HydrophobicContact CE2-CB 4.19Å; F738-A742 HydrophobicContact CZ-CB 3.94Å; F738-A742 VanDerWaalsContact O-CB 3.26Å; F738-A742 WeakPolarHBondContact O-CB 3.45Å; F738-A742 PolarHBondContact O-N 2.75Å; A742-T745 PolarHBondContact O-N 2.71Å; A742-L746 WeakPolarHBondContact O-CG 3.28Å; A742-L746 PolarHBondContact O-N 3.31Å; A742-A796 HydrophobicContact CB-CB 3.65Å
743	T	93.7	Very high	90.1	Very high	28 Å²	28	48 Å²	48	17%	0.172	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-47.5	172.8	-65	0	0	0	0	111.1	L712 L716 I739 E741 T745 L746 V747 Q769	L712-T743 HydrophobicContact CD2-CG2 4.23Å; L716-T743 WeakPolarHBondContact CD1-OG1 3.35Å; I739-T743 WeakPolarHBondContact O-CB 3.38Å; I739-T743 PolarHBondContact O-N 2.89Å; I739-T743 PolarHBondContact O-OG1 3.27Å; E741-T743 PolarHBondContact O-N 3.02Å; T743-T745 PolarHBondContact O-N 3.28Å; T743-L746 PolarHBondContact O-N 3.26Å; T743-V747 HydrophobicContact CG2-CG2 4.14Å; T743-V747 WeakPolarHBondContact O-CB 3.49Å; T743-V747 WeakPolarHBondContact O-CG2 3.35Å; T743-V747 PolarHBondContact O-N 3.23Å; T743-Q769 HydrophobicContact CG2-CB 4.35Å; T743-Q769 HydrophobicContact CG2-CG 4.16Å
744	A	93.3	Very high	91	Very high	61 Å²	61	48.3 Å²	48.3	50%	0.504	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-42.6	179.6	0	0	0	0	0	112.1	K740 E741 V747 K748	K740-A744 WeakPolarHBondContact O-CB 3.46Å; K740-A744 PolarHBondContact O-N 2.69Å; E741-A744 PolarHBondContact O-N 3.15Å; A744-V747 PolarHBondContact O-N 3.07Å; A744-K748 WeakPolarHBondContact O-CB 3.45Å; A744-K748 PolarHBondContact O-N 2.92Å
745	T	93.2	Very high	91.4	Very high	37 Å²	37	46.7 Å²	46.7	23%	0.227	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-43.5	177.4	-67.6	0	0	0	0	112.5	E741 A742 T743 H749 W801	E741-T745 PolarHBondContact O-N 3.45Å; E741-T745 PolarHBondContact O-OG1 3.3Å; A742-T745 PolarHBondContact O-N 2.71Å; T743-T745 PolarHBondContact O-N 3.28Å; T745-H749 PolarHBondContact O-ND1 3.42Å; T745-W801 HydrophobicContact CG2-CZ2 4.18Å; T745-W801 VanDerWaalsContact CG2-NE1 3.34Å
746	L	94.8	Very high	91.7	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-70.1	-40.9	176.9	-71.2	177.2	0	0	0	112.3	L712 A742 T743 H749 A750 L753 I761 V792 L795 A796	L712-L746 HydrophobicContact CD1-CD1 4.1Å; L712-L746 HydrophobicContact CD2-CB 4.21Å; L712-L746 HydrophobicContact CD2-CD1 4.06Å; L712-L746 HydrophobicContact CG-CD1 4.36Å; A742-L746 WeakPolarHBondContact O-CG 3.28Å; A742-L746 PolarHBondContact O-N 3.31Å; T743-L746 PolarHBondContact O-N 3.26Å; L746-H749 PolarHBondContact O-N 2.84Å; L746-A750 PolarHBondContact O-N 2.96Å; L746-L753 HydrophobicContact CD2-CD1 4.31Å; L746-I761 HydrophobicContact CB-CD1 3.88Å; L746-V792 HydrophobicContact CD1-CG1 3.73Å; L746-L795 HydrophobicContact CD2-CB 4.04Å; L746-A796 HydrophobicContact CD1-CB 3.99Å; L746-A796 HydrophobicContact CD2-CB 4.26Å; L746-A796 HydrophobicContact CG-CB 3.91Å
747	V	94.2	Very high	92	Very high	58 Å²	58	39.6 Å²	39.6	35%	0.352	21%	0.209	S	C	.	.	H	α-helix	trans	-64.2	-40.8	177.2	170.9	0	0	0	0	111.5	T743 A744 H749 A750 Q769	T743-V747 HydrophobicContact CG2-CG2 4.14Å; T743-V747 WeakPolarHBondContact O-CB 3.49Å; T743-V747 WeakPolarHBondContact O-CG2 3.35Å; T743-V747 PolarHBondContact O-N 3.23Å; A744-V747 PolarHBondContact O-N 3.07Å; V747-H749 PolarHBondContact O-N 3.24Å; V747-A750 WeakPolarHBondContact O-CB 3.39Å; V747-A750 PolarHBondContact O-N 3.29Å; V747-Q769 HydrophobicContact CG2-CB 4.28Å; V747-Q769 HydrophobicContact CG2-CG 3.76Å
748	K	93.4	Very high	92.2	Very high	103 Å²	103	33.9 Å²	33.9	45%	0.448	18%	0.182	S	C	.	.	H	α-helix	trans	-54.6	-41	176.8	-175.8	-172.5	172.1	-157.3	0	111.9	L462 A744	L462-K748 WeakPolarHBondContact O-CE 3.37Å; L462-K748 PolarHBondContact O-NZ 3.19Å; A744-K748 WeakPolarHBondContact O-CB 3.45Å; A744-K748 PolarHBondContact O-N 2.92Å
749	H	93.8	Very high	92.4	Very high	5 Å²	5	33.9 Å²	33.9	2%	0.023	18%	0.182	C	C	.	.	H	α-helix	trans	-101.6	4	-174.8	-51.8	108	0	0	0	113.8	T745 L746 V747 S751 M752 L753 W801	T745-H749 PolarHBondContact O-ND1 3.42Å; L746-H749 PolarHBondContact O-N 2.84Å; V747-H749 PolarHBondContact O-N 3.24Å; H749-S751 PolarHBondContact O-N 3.38Å; H749-S751 VanDerWaalsContact O-N 3.13Å; H749-M752 WeakPolarHBondContact O-CB 3.28Å; H749-M752 PolarHBondContact O-N 3.38Å; H749-L753 HydrophobicContact CB-CD1 4.46Å; H749-L753 WeakPolarHBondContact O-CG 3.36Å; H749-L753 PolarHBondContact O-N 3.25Å; H749-W801 HydrophobicContact CB-CE3 3.92Å; H749-W801 HydrophobicContact CB-CH2 4.01Å; H749-W801 HydrophobicContact CB-CZ3 3.51Å; H749-W801 AromaticContact CD2-CE3 3.82Å; H749-W801 AromaticContact CE1-CD2 3.49Å; H749-W801 VanDerWaalsContact CE1-CD2 3.49Å; H749-W801 AromaticContact CE1-CE3 3.76Å; H749-W801 AromaticContact CE1-CG 3.56Å; H749-W801 AromaticContact CG-CD2 3.95Å; H749-W801 AromaticContact CG-CE3 3.45Å; H749-W801 VanDerWaalsContact CG-CE3 3.45Å; H749-W801 AromaticContact CG-CZ3 3.6Å; H749-W801 AromaticContact ND1-CD2 3.43Å; H749-W801 AromaticContact ND1-CE2 3.74Å; H749-W801 AromaticContact ND1-CE3 3.44Å; H749-W801 AromaticContact ND1-CZ3 3.77Å
750	A	93.3	Very high	92.6	Very high	16 Å²	16	34.7 Å²	34.7	13%	0.132	19%	0.185	C	C	.	.	H	α-helix	trans	-56	-33.1	-174.2	0	0	0	0	0	114.4	L746 V747 W754 I761	L746-A750 PolarHBondContact O-N 2.96Å; V747-A750 WeakPolarHBondContact O-CB 3.39Å; V747-A750 PolarHBondContact O-N 3.29Å; A750-W754 WeakPolarHBondContact O-CB 3.09Å; A750-W754 PolarHBondContact O-N 3.05Å; A750-I761 HydrophobicContact CB-CB 4.11Å; A750-I761 HydrophobicContact CB-CD1 4.41Å
751	S	89.1	Confident	92.8	Very high	56 Å²	56	29.1 Å²	29.1	39%	0.392	16%	0.161	S	C	.	.	H	α-helix	trans	-68.6	-38.2	177.1	53.6	0	0	0	0	113.1	H749 D755	H749-S751 PolarHBondContact O-N 3.38Å; H749-S751 VanDerWaalsContact O-N 3.13Å; S751-D755 WeakPolarHBondContact O-CB 3.07Å; S751-D755 PolarHBondContact O-N 2.78Å
752	M	92.5	Very high	92.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-72.1	-44.6	175.5	-175.1	-75	-77.7	0	0	110.5	L458 F461 H749 W754 D755 Y756 F757 W801 F808 I811	L458-M752 HydrophobicContact CD1-CE 4.3Å; L458-M752 HydrophobicContact CD1-CG 3.85Å; F461-M752 HydrophobicContact CD1-CB 3.99Å; F461-M752 HydrophobicContact CD2-CB 4.45Å; F461-M752 HydrophobicContact CD2-CG 4.41Å; F461-M752 HydrophobicContact CE1-CB 4.18Å; F461-M752 HydrophobicContact CG-CB 4.13Å; F461-M752 HydrophobicContact CZ-CB 4.49Å; H749-M752 WeakPolarHBondContact O-CB 3.28Å; H749-M752 PolarHBondContact O-N 3.38Å; M752-W754 VanDerWaalsContact C-N 3.27Å; M752-W754 PolarHBondContact O-N 3.48Å; M752-D755 PolarHBondContact O-N 2.68Å; M752-Y756 HydrophobicContact CG-CD2 3.77Å; M752-Y756 HydrophobicContact CG-CE2 4.09Å; M752-Y756 PolarHBondContact O-N 3.49Å; M752-Y756 HydrophobicContact SD-CD2 3.95Å; M752-F757 HydrophobicContact SD-CD2 4.35Å; M752-F757 HydrophobicContact SD-CE2 3.96Å; M752-W801 HydrophobicContact CE-CE3 4.3Å; M752-W801 HydrophobicContact CE-CZ3 3.78Å; M752-F808 HydrophobicContact CE-CE1 4.47Å; M752-F808 HydrophobicContact SD-CE1 3.85Å; M752-I811 HydrophobicContact CE-CD1 3.82Å
753	L	94.2	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.7	-37.6	174.5	-70.7	173.4	0	0	0	112.3	L746 H749 F757 S758 I759 W801 I811	L746-L753 HydrophobicContact CD2-CD1 4.31Å; H749-L753 HydrophobicContact CB-CD1 4.46Å; H749-L753 WeakPolarHBondContact O-CG 3.36Å; H749-L753 PolarHBondContact O-N 3.25Å; L753-F757 HydrophobicContact CD2-CD2 4.43Å; L753-F757 CarbonylContact O-C 3.6Å; L753-F757 WeakPolarHBondContact O-CA 3.32Å; L753-F757 WeakPolarHBondContact O-CB 3.48Å; L753-F757 PolarHBondContact O-N 2.83Å; L753-F757 VanDerWaalsContact O-N 3.15Å; L753-S758 PolarHBondContact O-N 3.4Å; L753-I759 CarbonylContact C-O 3.57Å; L753-I759 VanDerWaalsContact C-O 3.31Å; L753-I759 HydrophobicContact CB-CB 4.15Å; L753-I759 HydrophobicContact CB-CG2 4.46Å; L753-I759 HydrophobicContact CD2-CD1 4.16Å; L753-I759 PolarHBondContact O-N 3.05Å; L753-W801 HydrophobicContact CD1-CH2 4.24Å; L753-W801 HydrophobicContact CD2-CH2 4.25Å; L753-W801 HydrophobicContact CD2-CZ3 4.46Å; L753-W801 HydrophobicContact CG-CH2 4.5Å; L753-I811 HydrophobicContact CD2-CD1 4.02Å; L753-I811 HydrophobicContact CD2-CG2 4.47Å
754	W	92.7	Very high	92.6	Very high	41 Å²	41	31 Å²	31	16%	0.155	18%	0.178	C	C	.	.	H	α-helix	trans	-76.2	-45.5	175.9	-170.5	38.4	0	0	0	112.8	R444 P445 E703 A750 M752 S758 I759 K760	R444-W754 HydrophobicContact CG-CH2 3.99Å; R444-W754 HydrophobicContact CG-CZ2 3.69Å; P445-W754 HydrophobicContact CG-CE3 4.19Å; P445-W754 HydrophobicContact CG-CZ3 4.17Å; E703-W754 PolarHBondContact OE2-NE1 2.94Å; A750-W754 WeakPolarHBondContact O-CB 3.09Å; A750-W754 PolarHBondContact O-N 3.05Å; M752-W754 VanDerWaalsContact C-N 3.27Å; M752-W754 PolarHBondContact O-N 3.48Å; W754-S758 VanDerWaalsContact O-CA 3.31Å; W754-S758 WeakPolarHBondContact O-CA 3.26Å; W754-S758 PolarHBondContact O-N 3.32Å; W754-I759 VanDerWaalsContact CA-O 3.31Å; W754-I759 WeakPolarHBondContact CA-O 3.24Å; W754-I759 PolarHBondContact N-O 3.28Å; W754-K760 HydrophobicContact CD2-CG 4.25Å; W754-K760 HydrophobicContact CG-CB 4.24Å; W754-K760 HydrophobicContact CG-CG 4.13Å; W754-K760 HydrophobicContact CZ2-CD 4.2Å
755	D	87.8	Confident	92.3	Very high	16 Å²	16	33.6 Å²	33.6	9%	0.086	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-36.1	-175.9	-175.2	57	0	0	0	113.9	N446 R629 S751 M752	N446-D755 PolarHBondContact ND2-OD1 2.76Å; R629-D755 IonicContact CZ-OD2 2.79Å; R629-D755 VanDerWaalsContact CZ-OD2 3.27Å; R629-D755 PolarHBondContact NH1-O 3.5Å; R629-D755 IonicContact NH1-OD1 2.94Å; R629-D755 PolarHBondContact NH1-OD1 2.69Å; R629-D755 VanDerWaalsContact NH1-OD1 3.12Å; R629-D755 IonicContact NH1-OD2 3.59Å; R629-D755 PolarHBondContact NH1-OD2 2.8Å; R629-D755 IonicContact NH2-OD2 3.74Å; R629-D755 PolarHBondContact NH2-OD2 2.98Å; S751-D755 WeakPolarHBondContact O-CB 3.07Å; S751-D755 PolarHBondContact O-N 2.78Å; M752-D755 PolarHBondContact O-N 2.68Å
756	Y	90.4	Very high	91.9	Very high	9 Å²	9	37.6 Å²	37.6	4%	0.035	21%	0.213	C	C	.	.	H	α-helix	trans	-99.4	-36.3	-178.3	-67.2	-71.4	0	0	0	114	Q456 R629 L633 F698 G699 M752	Q456-Y756 PolarHBondContact O-OH 2.96Å; R629-Y756 VanDerWaalsContact NH2-CE1 3.27Å; R629-Y756 PolarHBondContact NH2-OH 3.22Å; L633-Y756 HydrophobicContact CD1-CE1 3.98Å; F698-Y756 AromaticContact CD1-CD1 3.79Å; F698-Y756 HydrophobicContact CD1-CD1 3.79Å; F698-Y756 HydrophobicContact CD1-CE1 4.44Å; F698-Y756 AromaticContact CE1-CD1 3.14Å; F698-Y756 HydrophobicContact CE1-CD1 3.14Å; F698-Y756 AromaticContact CE1-CE1 3.72Å; F698-Y756 HydrophobicContact CE1-CE1 3.72Å; F698-Y756 AromaticContact CE1-CG 3.74Å; F698-Y756 HydrophobicContact CE1-CG 3.74Å; F698-Y756 AromaticContact CZ-CD1 3.82Å; F698-Y756 HydrophobicContact CZ-CD1 3.82Å; F698-Y756 AromaticContact CZ-CG 3.92Å; F698-Y756 HydrophobicContact CZ-CG 3.92Å; G699-Y756 VanDerWaalsContact CA-O 3.25Å; G699-Y756 WeakPolarHBondContact CA-O 3.3Å; G699-Y756 PolarHBondContact N-O 2.8Å; M752-Y756 HydrophobicContact CG-CD2 3.77Å; M752-Y756 HydrophobicContact CG-CE2 4.09Å; M752-Y756 PolarHBondContact O-N 3.49Å; M752-Y756 HydrophobicContact SD-CD2 3.95Å
757	F	93.1	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-112	-9.7	-173.2	-57.4	-85.3	0	0	0	114.1	F698 M752 L753 I759 P775 F808 I811	F698-F757 HydrophobicContact CD2-CE1 4.18Å; F698-F757 HydrophobicContact CD2-CZ 4.36Å; F698-F757 AromaticContact CE2-CE1 3.72Å; F698-F757 HydrophobicContact CE2-CE1 3.72Å; F698-F757 HydrophobicContact CE2-CE2 4.17Å; F698-F757 AromaticContact CE2-CZ 3.47Å; F698-F757 HydrophobicContact CE2-CZ 3.47Å; F698-F757 VanDerWaalsContact CE2-CZ 3.47Å; F698-F757 HydrophobicContact CZ-CE2 4.47Å; F698-F757 HydrophobicContact CZ-CZ 4.15Å; M752-F757 HydrophobicContact SD-CD2 4.35Å; M752-F757 HydrophobicContact SD-CE2 3.96Å; L753-F757 HydrophobicContact CD2-CD2 4.43Å; L753-F757 CarbonylContact O-C 3.6Å; L753-F757 WeakPolarHBondContact O-CA 3.32Å; L753-F757 WeakPolarHBondContact O-CB 3.48Å; L753-F757 PolarHBondContact O-N 2.83Å; L753-F757 VanDerWaalsContact O-N 3.15Å; F757-I759 HydrophobicContact CB-CD1 3.7Å; F757-I759 HydrophobicContact CB-CG1 3.93Å; F757-I759 HydrophobicContact CG-CD1 4.38Å; F757-I759 PolarHBondContact O-N 2.82Å; F757-P775 WeakPolarHBondContact O-CB 3.4Å; F757-P775 VanDerWaalsContact O-CG 3.3Å; F757-P775 WeakPolarHBondContact O-CG 3.47Å; F757-F808 HydrophobicContact CE2-CD1 4.15Å; F757-F808 HydrophobicContact CZ-CD1 4.03Å; F757-I811 HydrophobicContact CD1-CG2 3.73Å; F757-I811 HydrophobicContact CD2-CG2 3.9Å; F757-I811 HydrophobicContact CE1-CB 4.09Å; F757-I811 HydrophobicContact CE1-CG2 3.54Å; F757-I811 HydrophobicContact CE2-CB 4.17Å; F757-I811 HydrophobicContact CE2-CD1 3.83Å; F757-I811 HydrophobicContact CE2-CG2 3.71Å; F757-I811 HydrophobicContact CG-CG2 3.89Å; F757-I811 HydrophobicContact CZ-CB 3.75Å; F757-I811 HydrophobicContact CZ-CD1 4.14Å; F757-I811 HydrophobicContact CZ-CG2 3.51Å
758	S	92.1	Very high	91.3	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.014	24%	0.242	C	C	.	.			trans	58.8	26.7	-168.9	-58.2	0	0	0	0	114.2	R444 H701 G702 L753 W754	R444-S758 PolarHBondContact NH1-OG 2.84Å; R444-S758 PolarHBondContact NH2-OG 3.48Å; H701-S758 PolarHBondContact O-OG 2.92Å; G702-S758 VanDerWaalsContact O-CB 3.3Å; G702-S758 WeakPolarHBondContact O-CB 3.16Å; L753-S758 PolarHBondContact O-N 3.4Å; W754-S758 VanDerWaalsContact O-CA 3.31Å; W754-S758 WeakPolarHBondContact O-CA 3.26Å; W754-S758 PolarHBondContact O-N 3.32Å
759	I	94.7	Very high	91.3	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.021	23%	0.232	C	C	.	.			trans	-85.9	108.5	168.9	-60.3	161.2	0	0	0	107.2	L753 W754 F757 L771 G773 P775 Y791 L795 I811	L753-I759 CarbonylContact C-O 3.57Å; L753-I759 VanDerWaalsContact C-O 3.31Å; L753-I759 HydrophobicContact CB-CB 4.15Å; L753-I759 HydrophobicContact CB-CG2 4.46Å; L753-I759 HydrophobicContact CD2-CD1 4.16Å; L753-I759 PolarHBondContact O-N 3.05Å; W754-I759 VanDerWaalsContact CA-O 3.31Å; W754-I759 WeakPolarHBondContact CA-O 3.24Å; W754-I759 PolarHBondContact N-O 3.28Å; F757-I759 HydrophobicContact CB-CD1 3.7Å; F757-I759 HydrophobicContact CB-CG1 3.93Å; F757-I759 HydrophobicContact CG-CD1 4.38Å; F757-I759 PolarHBondContact O-N 2.82Å; I759-L771 HydrophobicContact CG2-CD1 4.1Å; I759-G773 WeakPolarHBondContact CA-O 3.49Å; I759-P775 HydrophobicContact CG1-CG 3.89Å; I759-Y791 VanDerWaalsContact CD1-OH 3.29Å; I759-Y791 WeakPolarHBondContact CD1-OH 3.49Å; I759-L795 HydrophobicContact CD1-CD1 4.17Å; I759-I811 HydrophobicContact CD1-CG2 4.46Å
760	K	93.8	Very high	91.4	Very high	44 Å²	44	38.9 Å²	38.9	19%	0.191	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.7	-169.8	-168.9	-179.6	178.4	176.6	0	111.7	E703 W754 T762 T772 G773	E703-K760 WeakPolarHBondContact OE1-CD 3.23Å; E703-K760 IonicContact OE1-NZ 2.93Å; W754-K760 HydrophobicContact CD2-CG 4.25Å; W754-K760 HydrophobicContact CG-CB 4.24Å; W754-K760 HydrophobicContact CG-CG 4.13Å; W754-K760 HydrophobicContact CZ2-CD 4.2Å; K760-T762 HydrophobicContact CG-CG2 4.21Å; K760-T772 WeakPolarHBondContact CG-OG1 3.29Å; K760-T772 PolarHBondContact O-N 3.15Å; K760-T772 PolarHBondContact O-OG1 2.84Å; K760-G773 PolarHBondContact N-O 3.03Å; K760-G773 PolarHBondContact O-N 3.39Å
761	I	94.9	Very high	91.4	Very high	22 Å²	22	38.2 Å²	38.2	11%	0.113	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.6	172.1	-55.9	173.3	0	0	0	107.8	L712 L746 A750 Q769 V770 L771	L712-I761 HydrophobicContact CD2-CD1 4.46Å; L746-I761 HydrophobicContact CB-CD1 3.88Å; A750-I761 HydrophobicContact CB-CB 4.11Å; A750-I761 HydrophobicContact CB-CD1 4.41Å; I761-Q769 HydrophobicContact CG2-CB 4.45Å; I761-V770 WeakPolarHBondContact CA-O 3.43Å; I761-L771 HydrophobicContact CG1-CD1 4.1Å
762	T	92.9	Very high	91.6	Very high	47 Å²	47	36.5 Å²	36.5	29%	0.288	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	165.4	178.5	53.1	0	0	0	0	110.3	K760 Q769 V770 T772	K760-T762 HydrophobicContact CG-CG2 4.21Å; T762-Q769 PolarHBondContact O-OE1 2.65Å; T762-V770 PolarHBondContact N-O 2.72Å; T762-V770 VanDerWaalsContact O-CG2 3.28Å; T762-V770 WeakPolarHBondContact O-CG2 3.49Å; T762-V770 PolarHBondContact O-N 3.13Å; T762-T772 WeakPolarHBondContact OG1-CG2 3.38Å; T762-T772 PolarHBondContact OG1-OG1 3.43Å
763	T	92.5	Very high	91.6	Very high	78 Å²	78	36.5 Å²	36.5	48%	0.479	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	137.5	171	-46.3	0	0	0	0	110.3	G767 N768 Q769	T763-G767 VanDerWaalsContact CG2-C 3.45Å; T763-G767 WeakPolarHBondContact CG2-O 3.3Å; T763-N768 CarbonylContact C-O 3.52Å; T763-N768 VanDerWaalsContact CA-O 3.28Å; T763-N768 WeakPolarHBondContact CA-O 3.19Å; T763-N768 WeakPolarHBondContact CG2-O 3.2Å; T763-Q769 PolarHBondContact OG1-NE2 3.48Å; T763-Q769 PolarHBondContact OG1-OE1 2.78Å
764	D	88.1	Confident	91.6	Very high	48 Å²	48	36.5 Å²	36.5	26%	0.257	21%	0.214	S	C	.	.			trans	-78.2	-177.7	176.7	79.5	-6.8	0	0	0	112.4	N766 G767 N768 V770	D764-N766 PolarHBondContact O-N 2.91Å; D764-N766 VanDerWaalsContact O-N 3.15Å; D764-N766 VanDerWaalsContact OD1-CA 3.29Å; D764-N766 WeakPolarHBondContact OD1-CA 3.35Å; D764-N766 WeakPolarHBondContact OD1-CB 3.43Å; D764-N766 PolarHBondContact OD1-N 2.78Å; D764-N766 PolarHBondContact OD2-ND2 2.76Å; D764-N766 VanDerWaalsContact OD2-ND2 3.11Å; D764-G767 PolarHBondContact O-N 2.74Å; D764-G767 PolarHBondContact OD1-N 3.12Å; D764-N768 PolarHBondContact N-O 3.39Å; D764-N768 PolarHBondContact OD1-N 2.76Å; D764-N768 PolarHBondContact OD2-ND2 2.7Å; D764-V770 HydrophobicContact CB-CG1 4.07Å; D764-V770 HydrophobicContact CB-CG2 4.3Å
765	S	86	Confident	91.6	Very high	117 Å²	117	34.5 Å²	34.5	82%	0.818	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.7	176.1	55.2	0	0	0	0	114.6
766	N	85.5	Confident	91.8	Very high	121 Å²	121	35.4 Å²	35.4	65%	0.647	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.7	-5.6	-170.6	-47.1	-37.9	0	0	0	111.9	D764	D764-N766 PolarHBondContact O-N 2.91Å; D764-N766 VanDerWaalsContact O-N 3.15Å; D764-N766 VanDerWaalsContact OD1-CA 3.29Å; D764-N766 WeakPolarHBondContact OD1-CA 3.35Å; D764-N766 WeakPolarHBondContact OD1-CB 3.43Å; D764-N766 PolarHBondContact OD1-N 2.78Å; D764-N766 PolarHBondContact OD2-ND2 2.76Å; D764-N766 VanDerWaalsContact OD2-ND2 3.11Å
767	G	86.6	Confident	91.7	Very high	50 Å²	50	35.3 Å²	35.3	52%	0.515	21%	0.211	S	C	.	.	S	Bend	trans	94.8	0.3	-176.8	0	0	0	0	0	114.9	T763 D764	T763-G767 VanDerWaalsContact CG2-C 3.45Å; T763-G767 WeakPolarHBondContact CG2-O 3.3Å; D764-G767 PolarHBondContact O-N 2.74Å; D764-G767 PolarHBondContact OD1-N 3.12Å
768	N	90.2	Very high	91.5	Very high	86 Å²	86	35.4 Å²	35.4	46%	0.46	21%	0.212	S	C	.	.			trans	-78.3	146.8	178.3	-51.7	-57.2	0	0	0	110.9	T763 D764	T763-N768 CarbonylContact C-O 3.52Å; T763-N768 VanDerWaalsContact CA-O 3.28Å; T763-N768 WeakPolarHBondContact CA-O 3.19Å; T763-N768 WeakPolarHBondContact CG2-O 3.2Å; D764-N768 PolarHBondContact N-O 3.39Å; D764-N768 PolarHBondContact OD1-N 2.76Å; D764-N768 PolarHBondContact OD2-ND2 2.7Å
769	Q	93	Very high	90.8	Very high	51 Å²	51	36.1 Å²	36.1	24%	0.238	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	127.5	172.2	-54.7	-58.3	-27.8	0	0	109.6	L712 T743 V747 I761 T762 T763	L712-Q769 HydrophobicContact CB-CB 4.36Å; L712-Q769 VanDerWaalsContact CB-O 3.26Å; L712-Q769 WeakPolarHBondContact CB-O 3.38Å; L712-Q769 HydrophobicContact CD2-CB 4.4Å; L712-Q769 PolarHBondContact N-O 3.14Å; T743-Q769 HydrophobicContact CG2-CB 4.35Å; T743-Q769 HydrophobicContact CG2-CG 4.16Å; V747-Q769 HydrophobicContact CG2-CB 4.28Å; V747-Q769 HydrophobicContact CG2-CG 3.76Å; I761-Q769 HydrophobicContact CG2-CB 4.45Å; T762-Q769 PolarHBondContact O-OE1 2.65Å; T763-Q769 PolarHBondContact OG1-NE2 3.48Å; T763-Q769 PolarHBondContact OG1-OE1 2.78Å
770	V	95.1	Very high	90	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.048	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.2	-176.2	-64.9	0	0	0	0	110.5	P709 A710 I761 T762 D764 T772	P709-V770 HydrophobicContact CB-CB 3.71Å; P709-V770 HydrophobicContact CB-CG1 4.3Å; P709-V770 HydrophobicContact CB-CG2 3.67Å; A710-V770 CarbonylContact O-C 3.58Å; A710-V770 WeakPolarHBondContact O-CA 3.12Å; I761-V770 WeakPolarHBondContact CA-O 3.43Å; T762-V770 PolarHBondContact N-O 2.72Å; T762-V770 VanDerWaalsContact O-CG2 3.28Å; T762-V770 WeakPolarHBondContact O-CG2 3.49Å; T762-V770 PolarHBondContact O-N 3.13Å; D764-V770 HydrophobicContact CB-CG1 4.07Å; D764-V770 HydrophobicContact CB-CG2 4.3Å; V770-T772 HydrophobicContact CG2-CG2 4.25Å
771	L	95.2	Very high	89.7	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.016	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	122	168.6	-175.1	70.1	0	0	0	108.4	L706 P709 A710 L715 I759 I761 I774 L788 V792	L706-L771 HydrophobicContact CD1-CD2 4.17Å; L706-L771 HydrophobicContact CD1-CG 4.18Å; P709-L771 CarbonylContact C-O 3.51Å; P709-L771 WeakPolarHBondContact CA-O 3.44Å; A710-L771 PolarHBondContact N-O 3.23Å; A710-L771 PolarHBondContact O-N 3.33Å; L715-L771 HydrophobicContact CD1-CB 4.39Å; L715-L771 HydrophobicContact CD1-CD2 4.17Å; I759-L771 HydrophobicContact CG2-CD1 4.1Å; I761-L771 HydrophobicContact CG1-CD1 4.1Å; L771-I774 HydrophobicContact CD2-CG2 3.88Å; L771-I774 HydrophobicContact CG-CG2 4.38Å; L771-L788 HydrophobicContact CD2-CD1 3.94Å; L771-L788 HydrophobicContact CD2-CD2 4.22Å; L771-L788 HydrophobicContact CD2-CG 4.33Å; L771-V792 HydrophobicContact CD2-CG2 4.05Å
772	T	92.9	Very high	89.3	Confident	19 Å²	19	43.5 Å²	43.5	12%	0.117	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-22.3	179.9	41.5	0	0	0	0	113.9	I705 L706 P709 K760 T762 V770	I705-T772 CarbonylContact C-O 3.31Å; I705-T772 WeakPolarHBondContact CA-O 3.29Å; L706-T772 PolarHBondContact N-O 3.28Å; P709-T772 HydrophobicContact CB-CG2 3.75Å; P709-T772 HydrophobicContact CG-CG2 3.88Å; K760-T772 WeakPolarHBondContact CG-OG1 3.29Å; K760-T772 PolarHBondContact O-N 3.15Å; K760-T772 PolarHBondContact O-OG1 2.84Å; T762-T772 WeakPolarHBondContact OG1-CG2 3.38Å; T762-T772 PolarHBondContact OG1-OG1 3.43Å; V770-T772 HydrophobicContact CG2-CG2 4.25Å
773	G	91.8	Very high	89.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	143.5	-177.2	0	0	0	0	0	113.5	I704 I759 K760	I704-G773 WeakPolarHBondContact O-CA 3.37Å; I759-G773 WeakPolarHBondContact CA-O 3.49Å; K760-G773 PolarHBondContact N-O 3.03Å; K760-G773 PolarHBondContact O-N 3.39Å
774	I	94.5	Very high	89	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	162	172.6	65.2	175.1	0	0	0	110.5	I704 L771 L776 P783 L785 L788 F818	I704-I774 HydrophobicContact CB-CG1 3.79Å; I704-I774 HydrophobicContact CD1-CD1 4.49Å; I704-I774 HydrophobicContact CD1-CG1 4.3Å; I704-I774 HydrophobicContact CG1-CG1 4.39Å; I704-I774 HydrophobicContact CG2-CG1 4.38Å; I704-I774 PolarHBondContact N-O 3.02Å; I704-I774 PolarHBondContact O-N 2.9Å; L771-I774 HydrophobicContact CD2-CG2 3.88Å; L771-I774 HydrophobicContact CG-CG2 4.38Å; I774-L776 PolarHBondContact O-N 2.9Å; I774-P783 HydrophobicContact CD1-CG 4.07Å; I774-L785 HydrophobicContact CD1-CD2 3.84Å; I774-L788 HydrophobicContact CG2-CD1 4.17Å; I774-F818 HydrophobicContact CD1-CE1 4.21Å
775	P	93.4	Very high	89.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	133	-172	-17.9	27.3	0	0	0	113.8	F757 I759 I777 T815 Y819	F757-P775 WeakPolarHBondContact O-CB 3.4Å; F757-P775 VanDerWaalsContact O-CG 3.3Å; F757-P775 WeakPolarHBondContact O-CG 3.47Å; I759-P775 HydrophobicContact CG1-CG 3.89Å; P775-I777 HydrophobicContact CB-CD1 4.43Å; P775-I777 HydrophobicContact CB-CG1 3.92Å; P775-T815 HydrophobicContact CG-CG2 4.1Å; P775-Y819 WeakPolarHBondContact CD-OH 3.4Å; P775-Y819 WeakPolarHBondContact O-CE1 3.24Å; P775-Y819 VanDerWaalsContact O-CZ 3.26Å; P775-Y819 PolarHBondContact O-OH 2.97Å
776	L	90.5	Very high	89.2	Confident	35 Å²	35	37.9 Å²	37.9	18%	0.183	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	94.2	167.3	-175.7	51.2	0	0	0	109.4	P583 G702 I704 I774 I778	P583-L776 HydrophobicContact CB-CG 4.1Å; P583-L776 HydrophobicContact CG-CD1 4.33Å; P583-L776 HydrophobicContact CG-CD2 3.84Å; P583-L776 HydrophobicContact CG-CG 3.79Å; G702-L776 VanDerWaalsContact C-CB 3.49Å; G702-L776 PolarHBondContact N-O 2.83Å; G702-L776 PolarHBondContact O-N 2.86Å; I704-L776 HydrophobicContact CD1-CD1 4Å; I704-L776 HydrophobicContact CG1-CB 3.73Å; I704-L776 HydrophobicContact CG1-CD1 3.83Å; I704-L776 HydrophobicContact CG1-CG 4.22Å; I774-L776 PolarHBondContact O-N 2.9Å; L776-I778 WeakPolarHBondContact CD1-O 3.41Å
777	I	89.8	Confident	89.4	Confident	7 Å²	7	33.1 Å²	33.1	4%	0.036	19%	0.188	C	C	.	.			trans	-87.8	-40.7	-172.1	-46.2	175.8	0	0	0	112.1	F690 L693 L694 P775 T815 Y819	F690-I777 HydrophobicContact CD1-CB 4.3Å; F690-I777 HydrophobicContact CD1-CD1 3.97Å; F690-I777 HydrophobicContact CD1-CG2 4.07Å; F690-I777 HydrophobicContact CE1-CB 4.48Å; L693-I777 HydrophobicContact CB-CG2 3.54Å; L693-I777 HydrophobicContact CD1-CG2 4.05Å; L693-I777 HydrophobicContact CG-CG2 4.45Å; L694-I777 HydrophobicContact CD1-CD1 4.25Å; L694-I777 HydrophobicContact CD2-CD1 3.83Å; L694-I777 HydrophobicContact CD2-CG1 4.31Å; L694-I777 HydrophobicContact CG-CD1 3.98Å; P775-I777 HydrophobicContact CB-CD1 4.43Å; P775-I777 HydrophobicContact CB-CG1 3.92Å; I777-T815 HydrophobicContact CD1-CG2 4.36Å; I777-Y819 HydrophobicContact CD1-CD1 3.65Å; I777-Y819 HydrophobicContact CD1-CD2 4.06Å; I777-Y819 HydrophobicContact CD1-CE1 3.86Å; I777-Y819 HydrophobicContact CD1-CE2 4.27Å; I777-Y819 HydrophobicContact CD1-CG 3.77Å; I777-Y819 HydrophobicContact CG1-CD1 4.22Å; I777-Y819 HydrophobicContact CG1-CE1 4.05Å
778	I	87.3	Confident	89.7	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.01	17%	0.166	C	C	.	.	S	Bend	trans	-130.1	143.3	-179.6	-63.3	178.8	0	0	0	108	L689 F690 L693 L776 I866 L867 I870	L689-I778 HydrophobicContact CD2-CD1 4.35Å; F690-I778 HydrophobicContact CD1-CD1 4.33Å; F690-I778 HydrophobicContact CE1-CD1 3.45Å; F690-I778 VanDerWaalsContact CE1-CD1 3.45Å; F690-I778 HydrophobicContact CE1-CG1 3.96Å; F690-I778 HydrophobicContact CZ-CD1 3.85Å; L693-I778 HydrophobicContact CD1-CD1 3.67Å; L693-I778 HydrophobicContact CD1-CG1 3.65Å; L776-I778 WeakPolarHBondContact CD1-O 3.41Å; I778-I866 HydrophobicContact CG2-CG2 3.86Å; I778-L867 HydrophobicContact CD1-CD1 4.37Å; I778-I870 HydrophobicContact CD1-CD1 4.01Å; I778-I870 HydrophobicContact CD1-CG2 4.37Å; I778-I870 HydrophobicContact CG1-CD1 4.42Å; I778-I870 HydrophobicContact CG2-CD1 3.41Å; I778-I870 VanDerWaalsContact CG2-CD1 3.41Å
779	A	77.8	Confident	89.9	Confident	17 Å²	17	27.8 Å²	27.8	14%	0.14	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	136.6	174.6	0	0	0	0	0	111.4	P583 I585 Y781	P583-A779 HydrophobicContact CG-CB 3.82Å; I585-A779 VanDerWaalsContact O-CB 3.23Å; I585-A779 WeakPolarHBondContact O-CB 3.38Å; A779-Y781 PolarHBondContact O-N 2.85Å
780	D	78	Confident	89.8	Confident	130 Å²	130	26.4 Å²	26.4	70%	0.695	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	7.7	174	-48.6	-44.2	0	0	0	116	I866	D780-I866 HydrophobicContact CB-CD1 3.79Å
781	Y	87.2	Confident	89.8	Confident	3 Å²	3	26.3 Å²	26.3	1%	0.012	14%	0.141	C	C	.	.			trans	-93.9	119.1	170.4	-173.1	-85.4	0	0	0	110.7	F690 A779 Y819 R859 M862 L867	F690-Y781 HydrophobicContact CE1-CD1 4.19Å; F690-Y781 HydrophobicContact CE1-CE1 4.29Å; F690-Y781 HydrophobicContact CE2-CE1 4.01Å; F690-Y781 AromaticContact CZ-CD1 3.68Å; F690-Y781 HydrophobicContact CZ-CD1 3.68Å; F690-Y781 AromaticContact CZ-CE1 3.45Å; F690-Y781 HydrophobicContact CZ-CE1 3.45Å; F690-Y781 VanDerWaalsContact CZ-CE1 3.45Å; F690-Y781 HydrophobicContact CZ-CE2 4.37Å; F690-Y781 HydrophobicContact CZ-CG 4.26Å; F690-Y781 AromaticContact CZ-CZ 3.84Å; A779-Y781 PolarHBondContact O-N 2.85Å; Y781-Y819 HydrophobicContact CD1-CD1 4.45Å; Y781-Y819 HydrophobicContact CE1-CD1 4.48Å; Y781-Y819 WeakPolarHBondContact CE1-O 3.36Å; Y781-Y819 PolarHBondContact OH-O 2.95Å; Y781-R859 PolarHBondContact OH-NH1 2.78Å; Y781-R859 PolarHBondContact OH-NH2 2.84Å; Y781-M862 HydrophobicContact CD2-CE 4Å; Y781-M862 HydrophobicContact CD2-CG 3.91Å; Y781-M862 HydrophobicContact CD2-SD 3.99Å; Y781-M862 HydrophobicContact CE2-CE 3.87Å; Y781-M862 HydrophobicContact CE2-CG 4.37Å; Y781-M862 HydrophobicContact CE2-SD 4.45Å; Y781-M862 HydrophobicContact CG-SD 4.37Å; Y781-L867 HydrophobicContact CD2-CB 4.41Å; Y781-L867 HydrophobicContact CE2-CB 4.16Å; Y781-L867 HydrophobicContact CE2-CD1 4.27Å; Y781-L867 HydrophobicContact CE2-CD2 4.13Å; Y781-L867 HydrophobicContact CE2-CG 4.43Å
782	I	87.7	Confident	89.8	Confident	92 Å²	92	26.4 Å²	26.4	47%	0.472	14%	0.142	S	C	.	.			trans	-111.5	130.5	177.6	-54.7	-179.6	0	0	0	109	L785 R859 M862	I782-L785 HydrophobicContact CG2-CD1 4.43Å; I782-L785 HydrophobicContact CG2-CG 4.37Å; I782-R859 PolarHBondContact O-NH1 2.75Å; I782-M862 VanDerWaalsContact O-CE 3.31Å; I782-M862 WeakPolarHBondContact O-CE 3.39Å
783	P	91.1	Very high	89.8	Confident	6 Å²	6	25.5 Å²	25.5	4%	0.039	14%	0.136	C	C	.	.			trans	-68.5	166.5	175.3	31.4	-37.3	0	0	0	111.7	I774 L785 F818 Y819	I774-P783 HydrophobicContact CD1-CG 4.07Å; P783-L785 HydrophobicContact CG-CD2 4.14Å; P783-L785 PolarHBondContact O-N 2.92Å; P783-F818 HydrophobicContact CB-CD1 4.5Å; P783-F818 HydrophobicContact CB-CE1 4.12Å; P783-F818 HydrophobicContact CB-CE2 4.21Å; P783-F818 HydrophobicContact CB-CZ 3.96Å; P783-F818 HydrophobicContact CG-CE1 3.85Å; P783-F818 HydrophobicContact CG-CZ 3.81Å; P783-Y819 HydrophobicContact CB-CD1 4.11Å; P783-Y819 HydrophobicContact CB-CD2 4.28Å; P783-Y819 HydrophobicContact CB-CE1 4.25Å; P783-Y819 HydrophobicContact CB-CE2 4.4Å; P783-Y819 HydrophobicContact CB-CG 4.12Å; P783-Y819 HydrophobicContact CG-CD1 4.2Å; P783-Y819 HydrophobicContact CG-CD2 4.49Å; P783-Y819 HydrophobicContact CG-CE1 3.82Å; P783-Y819 HydrophobicContact CG-CE2 4.13Å
784	E	87.9	Confident	89.8	Confident	23 Å²	23	26 Å²	26	11%	0.107	14%	0.138	C	C	.	.			trans	-71.1	92.4	175.8	-82.2	167.8	-139	0	0	110.6	N786 Q787 F818 R859	E784-N786 WeakPolarHBondContact CB-OD1 3.41Å; E784-N786 PolarHBondContact O-N 3.24Å; E784-N786 PolarHBondContact O-OD1 3.3Å; E784-Q787 HydrophobicContact CB-CG 4.18Å; E784-Q787 WeakPolarHBondContact O-CB 3.23Å; E784-Q787 PolarHBondContact O-N 2.93Å; E784-Q787 PolarHBondContact OE2-NE2 3.24Å; E784-F818 WeakPolarHBondContact O-CE2 3.37Å; E784-R859 IonicContact OE1-CZ 2.75Å; E784-R859 IonicContact OE1-NE 3.27Å; E784-R859 PolarHBondContact OE1-NE 3.33Å; E784-R859 IonicContact OE1-NH2 2.73Å; E784-R859 PolarHBondContact OE1-NH2 2.66Å
785	L	90.2	Very high	89.8	Confident	79 Å²	79	26.2 Å²	26.2	41%	0.414	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-62.7	-15.2	-174.1	-61.1	-179.1	0	0	0	114.4	I774 I782 P783 Q787 L788 F818	I774-L785 HydrophobicContact CD1-CD2 3.84Å; I782-L785 HydrophobicContact CG2-CD1 4.43Å; I782-L785 HydrophobicContact CG2-CG 4.37Å; P783-L785 HydrophobicContact CG-CD2 4.14Å; P783-L785 PolarHBondContact O-N 2.92Å; L785-Q787 PolarHBondContact O-N 3.41Å; L785-L788 WeakPolarHBondContact O-CB 3.48Å; L785-L788 PolarHBondContact O-N 3.43Å; L785-L788 VanDerWaalsContact O-N 3.15Å; L785-F818 HydrophobicContact CD2-CZ 4.35Å
786	N	88.1	Confident	89.8	Confident	63 Å²	63	26.8 Å²	26.8	34%	0.337	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-66.9	-19.1	169.1	62.1	1	0	0	0	112.8	E784 F826	E784-N786 WeakPolarHBondContact CB-OD1 3.41Å; E784-N786 PolarHBondContact O-N 3.24Å; E784-N786 PolarHBondContact O-OD1 3.3Å; N786-F826 HydrophobicContact CB-CD2 4.06Å; N786-F826 HydrophobicContact CB-CE2 4.02Å
787	Q	89.6	Confident	89.7	Confident	21 Å²	21	27.4 Å²	27.4	10%	0.098	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-89	-2.8	172.5	-52.8	-165.9	39.8	0	0	113.3	E784 L785 P789 I790 Y791 F818 S822 L825	E784-Q787 HydrophobicContact CB-CG 4.18Å; E784-Q787 WeakPolarHBondContact O-CB 3.23Å; E784-Q787 PolarHBondContact O-N 2.93Å; E784-Q787 PolarHBondContact OE2-NE2 3.24Å; L785-Q787 PolarHBondContact O-N 3.41Å; Q787-P789 VanDerWaalsContact C-CD 3.44Å; Q787-I790 WeakPolarHBondContact O-CB 3.38Å; Q787-I790 PolarHBondContact O-N 2.82Å; Q787-Y791 PolarHBondContact O-N 2.98Å; Q787-F818 HydrophobicContact CB-CD2 4.02Å; Q787-F818 HydrophobicContact CB-CE2 4.12Å; Q787-S822 PolarHBondContact NE2-OG 3.4Å; Q787-L825 HydrophobicContact CG-CD1 4.16Å
788	L	93.1	Very high	89.6	Confident	11 Å²	11	28.5 Å²	28.5	6%	0.058	15%	0.154	C	C	.	.	H	α-helix	trans	-55.2	-39.2	-179.8	-172.3	70.7	0	0	0	114	L706 L715 L771 I774 L785 I790 Y791 V792 F818	L706-L788 HydrophobicContact CD1-CD2 4.3Å; L715-L788 HydrophobicContact CD1-CD2 4.23Å; L715-L788 HydrophobicContact CD1-CG 4.33Å; L715-L788 HydrophobicContact CD2-CD2 4.21Å; L715-L788 HydrophobicContact CD2-CG 4.31Å; L771-L788 HydrophobicContact CD2-CD1 3.94Å; L771-L788 HydrophobicContact CD2-CD2 4.22Å; L771-L788 HydrophobicContact CD2-CG 4.33Å; I774-L788 HydrophobicContact CG2-CD1 4.17Å; L785-L788 WeakPolarHBondContact O-CB 3.48Å; L785-L788 PolarHBondContact O-N 3.43Å; L785-L788 VanDerWaalsContact O-N 3.15Å; L788-I790 VanDerWaalsContact C-N 3.33Å; L788-I790 PolarHBondContact O-N 3.29Å; L788-Y791 HydrophobicContact CD1-CD1 4.12Å; L788-Y791 PolarHBondContact O-N 2.89Å; L788-V792 WeakPolarHBondContact O-CG2 3.3Å; L788-V792 PolarHBondContact O-N 2.81Å; L788-F818 HydrophobicContact CB-CE2 4.42Å; L788-F818 HydrophobicContact CB-CZ 4.28Å; L788-F818 HydrophobicContact CD1-CE1 4.08Å; L788-F818 HydrophobicContact CD1-CZ 3.74Å
789	P	93.6	Very high	89.8	Confident	14 Å²	14	28.9 Å²	28.9	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-58.3	-41.6	172.2	-25.7	36.1	0	0	0	113.2	L715 I718 Q787 T793	L715-P789 HydrophobicContact CD2-CB 4.49Å; L715-P789 HydrophobicContact CD2-CG 3.92Å; L715-P789 WeakPolarHBondContact O-CB 3.37Å; I718-P789 HydrophobicContact CB-CB 3.97Å; I718-P789 HydrophobicContact CB-CG 4.22Å; I718-P789 HydrophobicContact CG2-CB 3.79Å; I718-P789 HydrophobicContact CG2-CG 3.84Å; Q787-P789 VanDerWaalsContact C-CD 3.44Å; P789-T793 VanDerWaalsContact O-CB 3.28Å; P789-T793 WeakPolarHBondContact O-CB 3.15Å; P789-T793 PolarHBondContact O-N 3.21Å; P789-T793 PolarHBondContact O-OG1 2.94Å
790	I	91.6	Very high	90.4	Very high	22 Å²	22	30.3 Å²	30.3	11%	0.113	17%	0.166	C	C	.	.	H	α-helix	trans	-68.3	-45.3	-179.8	-56.3	169.7	0	0	0	109.6	Y722 L723 Q787 L788 T793 K794 L825	Y722-I790 HydrophobicContact CD1-CD1 3.63Å; Y722-I790 HydrophobicContact CD1-CG1 3.82Å; Y722-I790 HydrophobicContact CD2-CD1 4.49Å; Y722-I790 HydrophobicContact CE1-CD1 3.49Å; Y722-I790 VanDerWaalsContact CE1-CD1 3.49Å; Y722-I790 HydrophobicContact CE1-CG1 4.19Å; Y722-I790 HydrophobicContact CE2-CD1 4.38Å; Y722-I790 HydrophobicContact CG-CD1 4.15Å; Y722-I790 HydrophobicContact CG-CG1 4.24Å; L723-I790 HydrophobicContact CD1-CG2 4.31Å; L723-I790 HydrophobicContact CD2-CG2 4.23Å; L723-I790 HydrophobicContact CG-CG2 4.49Å; Q787-I790 WeakPolarHBondContact O-CB 3.38Å; Q787-I790 PolarHBondContact O-N 2.82Å; L788-I790 VanDerWaalsContact C-N 3.33Å; L788-I790 PolarHBondContact O-N 3.29Å; I790-T793 PolarHBondContact O-N 3.06Å; I790-K794 HydrophobicContact CG2-CD 4.33Å; I790-K794 HydrophobicContact CG2-CG 4.46Å; I790-K794 WeakPolarHBondContact O-CB 3.41Å; I790-K794 WeakPolarHBondContact O-CG 3.34Å; I790-K794 PolarHBondContact O-N 2.81Å; I790-L825 HydrophobicContact CD1-CD1 3.94Å
791	Y	94.5	Very high	91	Very high	6 Å²	6	25.8 Å²	25.8	2%	0.024	14%	0.139	C	C	.	.	H	α-helix	trans	-57.5	-51.9	177.2	172.4	-122	0	0	0	112.5	I759 Q787 L788 T793 K794 L795 I814 T815 F818	I759-Y791 VanDerWaalsContact CD1-OH 3.29Å; I759-Y791 WeakPolarHBondContact CD1-OH 3.49Å; Q787-Y791 PolarHBondContact O-N 2.98Å; L788-Y791 HydrophobicContact CD1-CD1 4.12Å; L788-Y791 PolarHBondContact O-N 2.89Å; Y791-T793 VanDerWaalsContact C-N 3.31Å; Y791-T793 PolarHBondContact O-N 2.82Å; Y791-K794 PolarHBondContact O-N 3.13Å; Y791-L795 HydrophobicContact CD1-CD1 4.38Å; Y791-L795 HydrophobicContact CD2-CD1 4.4Å; Y791-L795 HydrophobicContact CD2-CG 4.28Å; Y791-L795 HydrophobicContact CE1-CD1 3.86Å; Y791-L795 HydrophobicContact CE2-CD1 3.83Å; Y791-L795 HydrophobicContact CE2-CD2 4.18Å; Y791-L795 HydrophobicContact CE2-CG 3.9Å; Y791-L795 WeakPolarHBondContact O-CG 3.45Å; Y791-L795 PolarHBondContact O-N 2.7Å; Y791-I814 HydrophobicContact CD2-CG2 3.79Å; Y791-I814 HydrophobicContact CE2-CG2 3.97Å; Y791-T815 HydrophobicContact CE2-CG2 4.27Å; Y791-T815 WeakPolarHBondContact CE2-OG1 3.5Å; Y791-T815 WeakPolarHBondContact OH-CG2 3.46Å; Y791-T815 PolarHBondContact OH-OG1 2.68Å; Y791-F818 AromaticContact CD1-CD1 3.47Å; Y791-F818 HydrophobicContact CD1-CD1 3.47Å; Y791-F818 VanDerWaalsContact CD1-CD1 3.47Å; Y791-F818 AromaticContact CD1-CE1 3.69Å; Y791-F818 HydrophobicContact CD1-CE1 3.69Å; Y791-F818 HydrophobicContact CD1-CG 4.05Å; Y791-F818 HydrophobicContact CD1-CZ 4.4Å; Y791-F818 HydrophobicContact CD2-CB 3.5Å; Y791-F818 AromaticContact CD2-CD1 3.8Å; Y791-F818 HydrophobicContact CD2-CD1 3.8Å; Y791-F818 AromaticContact CD2-CG 3.8Å; Y791-F818 HydrophobicContact CD2-CG 3.8Å; Y791-F818 AromaticContact CE1-CD1 3.77Å; Y791-F818 HydrophobicContact CE1-CD1 3.77Å; Y791-F818 HydrophobicContact CE1-CE1 4.03Å; Y791-F818 HydrophobicContact CE2-CB 4.15Å; Y791-F818 HydrophobicContact CE2-CD1 4.11Å; Y791-F818 HydrophobicContact CE2-CG 4.47Å; Y791-F818 HydrophobicContact CG-CB 3.79Å; Y791-F818 AromaticContact CG-CD1 3.46Å; Y791-F818 HydrophobicContact CG-CD1 3.46Å; Y791-F818 VanDerWaalsContact CG-CD1 3.46Å; Y791-F818 HydrophobicContact CG-CD2 4.2Å; Y791-F818 HydrophobicContact CG-CE1 4.08Å; Y791-F818 AromaticContact CG-CG 3.55Å; Y791-F818 HydrophobicContact CG-CG 3.55Å
792	V	95.2	Very high	91	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.03	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-39	179.1	170.7	0	0	0	0	111.4	L712 L715 L716 L746 L771 L788 L795 A796	L712-V792 HydrophobicContact CD1-CG1 3.66Å; L712-V792 HydrophobicContact CG-CG1 4.49Å; L715-V792 HydrophobicContact CB-CG1 4.47Å; L715-V792 HydrophobicContact CD1-CG2 4.11Å; L716-V792 HydrophobicContact CD2-CG1 4.02Å; L716-V792 HydrophobicContact CG-CG1 4.22Å; L746-V792 HydrophobicContact CD1-CG1 3.73Å; L771-V792 HydrophobicContact CD2-CG2 4.05Å; L788-V792 WeakPolarHBondContact O-CG2 3.3Å; L788-V792 PolarHBondContact O-N 2.81Å; V792-L795 PolarHBondContact O-N 2.6Å; V792-A796 PolarHBondContact O-N 3.34Å; V792-A796 VanDerWaalsContact O-N 3.1Å
793	T	92.7	Very high	91	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68.4	-40.7	177.9	-56.3	0	0	0	0	111.9	G719 L723 F738 P789 I790 Y791 A796 T797	G719-T793 WeakPolarHBondContact CA-OG1 3.37Å; L723-T793 HydrophobicContact CD1-CG2 3.83Å; F738-T793 HydrophobicContact CE1-CG2 4.04Å; F738-T793 HydrophobicContact CZ-CG2 3.78Å; P789-T793 VanDerWaalsContact O-CB 3.28Å; P789-T793 WeakPolarHBondContact O-CB 3.15Å; P789-T793 PolarHBondContact O-N 3.21Å; P789-T793 PolarHBondContact O-OG1 2.94Å; I790-T793 PolarHBondContact O-N 3.06Å; Y791-T793 VanDerWaalsContact C-N 3.31Å; Y791-T793 PolarHBondContact O-N 2.82Å; T793-A796 PolarHBondContact O-N 2.82Å; T793-T797 WeakPolarHBondContact O-CB 3.39Å; T793-T797 WeakPolarHBondContact O-CG2 3.46Å; T793-T797 PolarHBondContact O-N 2.94Å; T793-T797 PolarHBondContact O-OG1 3Å
794	K	92.5	Very high	90.8	Very high	11 Å²	11	30.2 Å²	30.2	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-64	-43.5	172.8	-75.8	-171.6	166.6	-118.9	0	111.7	L723 I790 Y791 A796 T797 Q798 I814 D885 D887	L723-K794 HydrophobicContact CD1-CG 4.23Å; I790-K794 HydrophobicContact CG2-CD 4.33Å; I790-K794 HydrophobicContact CG2-CG 4.46Å; I790-K794 WeakPolarHBondContact O-CB 3.41Å; I790-K794 WeakPolarHBondContact O-CG 3.34Å; I790-K794 PolarHBondContact O-N 2.81Å; Y791-K794 PolarHBondContact O-N 3.13Å; K794-A796 VanDerWaalsContact C-N 3.26Å; K794-A796 PolarHBondContact O-N 2.79Å; K794-T797 PolarHBondContact O-N 3.23Å; K794-T797 VanDerWaalsContact O-N 3.14Å; K794-Q798 VanDerWaalsContact CD-OE1 3.3Å; K794-Q798 WeakPolarHBondContact O-CB 3.4Å; K794-Q798 PolarHBondContact O-N 3.17Å; K794-I814 HydrophobicContact CB-CG1 4.46Å; K794-I814 HydrophobicContact CB-CG2 3.7Å; K794-D885 IonicContact NZ-OD1 2.72Å; K794-D885 PolarHBondContact NZ-OD1 2.86Å; K794-D887 VanDerWaalsContact CE-OD2 3.24Å; K794-D887 WeakPolarHBondContact CE-OD2 3.39Å; K794-D887 IonicContact NZ-OD2 2.7Å; K794-D887 PolarHBondContact NZ-OD2 2.93Å
795	L	94.2	Very high	90.8	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-57.1	-38.6	174.4	-76	179.5	0	0	0	112.6	L746 I759 Y791 V792 T797 V799 W801 I811 I814	L746-L795 HydrophobicContact CD2-CB 4.04Å; I759-L795 HydrophobicContact CD1-CD1 4.17Å; Y791-L795 HydrophobicContact CD1-CD1 4.38Å; Y791-L795 HydrophobicContact CD2-CD1 4.4Å; Y791-L795 HydrophobicContact CD2-CG 4.28Å; Y791-L795 HydrophobicContact CE1-CD1 3.86Å; Y791-L795 HydrophobicContact CE2-CD1 3.83Å; Y791-L795 HydrophobicContact CE2-CD2 4.18Å; Y791-L795 HydrophobicContact CE2-CG 3.9Å; Y791-L795 WeakPolarHBondContact O-CG 3.45Å; Y791-L795 PolarHBondContact O-N 2.7Å; V792-L795 PolarHBondContact O-N 2.6Å; L795-T797 VanDerWaalsContact C-N 3.34Å; L795-V799 HydrophobicContact CD2-CG2 4.23Å; L795-V799 VanDerWaalsContact O-CG2 3.31Å; L795-V799 WeakPolarHBondContact O-CG2 3.47Å; L795-W801 WeakPolarHBondContact O-CZ2 3.42Å; L795-I811 HydrophobicContact CD2-CG1 4.39Å; L795-I811 HydrophobicContact CD2-CG2 4.16Å; L795-I814 HydrophobicContact CD2-CB 4.27Å; L795-I814 HydrophobicContact CD2-CG2 3.9Å; L795-I814 HydrophobicContact CG-CG2 4.03Å
796	A	92.7	Very high	90.7	Very high	11 Å²	11	31.3 Å²	31.3	9%	0.091	18%	0.181	C	C	.	.	H	α-helix	trans	-73.5	-21.9	179.6	0	0	0	0	0	114.3	L716 A742 L746 V792 T793 K794	L716-A796 HydrophobicContact CD2-CB 4.23Å; A742-A796 HydrophobicContact CB-CB 3.65Å; L746-A796 HydrophobicContact CD1-CB 3.99Å; L746-A796 HydrophobicContact CD2-CB 4.26Å; L746-A796 HydrophobicContact CG-CB 3.91Å; V792-A796 PolarHBondContact O-N 3.34Å; V792-A796 VanDerWaalsContact O-N 3.1Å; T793-A796 PolarHBondContact O-N 2.82Å; K794-A796 VanDerWaalsContact C-N 3.26Å; K794-A796 PolarHBondContact O-N 2.79Å
797	T	88.8	Confident	91	Very high	49 Å²	49	28.3 Å²	28.3	30%	0.301	17%	0.165	S	C	.	.	H	α-helix	trans	-123.5	-28.3	-164.8	55.2	0	0	0	0	115.5	L730 F738 T793 K794 L795	L730-T797 HydrophobicContact CD2-CG2 4.3Å; F738-T797 HydrophobicContact CE2-CG2 3.51Å; F738-T797 HydrophobicContact CZ-CG2 3.7Å; T793-T797 WeakPolarHBondContact O-CB 3.39Å; T793-T797 WeakPolarHBondContact O-CG2 3.46Å; T793-T797 PolarHBondContact O-N 2.94Å; T793-T797 PolarHBondContact O-OG1 3Å; K794-T797 PolarHBondContact O-N 3.23Å; K794-T797 VanDerWaalsContact O-N 3.14Å; L795-T797 VanDerWaalsContact C-N 3.34Å
798	Q	88.4	Confident	91.2	Very high	30 Å²	30	27.3 Å²	27.3	14%	0.14	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-8.7	-175.4	-63.2	-179.5	-12.2	0	0	112.8	K794 I814 L886 D887	K794-Q798 VanDerWaalsContact CD-OE1 3.3Å; K794-Q798 WeakPolarHBondContact O-CB 3.4Å; K794-Q798 PolarHBondContact O-N 3.17Å; Q798-I814 HydrophobicContact CB-CD1 3.84Å; Q798-L886 HydrophobicContact CB-CB 4.47Å; Q798-L886 HydrophobicContact CB-CD1 3.87Å; Q798-L886 HydrophobicContact CG-CB 4.49Å; Q798-D887 PolarHBondContact NE2-OD1 3.48Å; Q798-D887 PolarHBondContact NE2-OD2 3.23Å
799	V	91.4	Very high	91.1	Very high	9 Å²	9	29.6 Å²	29.6	6%	0.055	17%	0.17	C	C	.	.			trans	-83.3	116.2	175.1	179.8	0	0	0	0	110	L795 W801 N810 I811 I814	L795-V799 HydrophobicContact CD2-CG2 4.23Å; L795-V799 VanDerWaalsContact O-CG2 3.31Å; L795-V799 WeakPolarHBondContact O-CG2 3.47Å; V799-W801 HydrophobicContact CB-CD2 4.32Å; V799-W801 HydrophobicContact CB-CH2 4.34Å; V799-W801 HydrophobicContact CB-CZ2 3.81Å; V799-W801 HydrophobicContact CG1-CD2 3.7Å; V799-W801 HydrophobicContact CG1-CE3 3.86Å; V799-W801 HydrophobicContact CG1-CG 4.29Å; V799-W801 HydrophobicContact CG1-CH2 4Å; V799-W801 HydrophobicContact CG1-CZ2 3.85Å; V799-W801 HydrophobicContact CG1-CZ3 4Å; V799-W801 HydrophobicContact CG2-CZ2 4.33Å; V799-W801 PolarHBondContact O-N 2.92Å; V799-W801 PolarHBondContact O-NE1 3.31Å; V799-N810 HydrophobicContact CB-CB 4.41Å; V799-N810 HydrophobicContact CG1-CB 4.39Å; V799-N810 HydrophobicContact CG2-CB 4.19Å; V799-I811 HydrophobicContact CG1-CD1 4.16Å; V799-I811 HydrophobicContact CG1-CG1 3.87Å; V799-I811 HydrophobicContact CG2-CG1 3.75Å; V799-I814 HydrophobicContact CG2-CD1 3.65Å
800	S	90.5	Very high	91.1	Very high	48 Å²	48	29.9 Å²	29.9	34%	0.336	17%	0.171	S	C	.	.			trans	-76.3	109.6	164.4	-176.2	0	0	0	0	110	S802 C807 N810	S800-S802 PolarHBondContact OG-OG 3.45Å; S800-C807 VanDerWaalsContact O-CA 3.27Å; S800-C807 WeakPolarHBondContact O-CA 3.39Å; S800-C807 VanDerWaalsContact O-CB 3.31Å; S800-C807 WeakPolarHBondContact O-CB 3.39Å; S800-N810 PolarHBondContact N-ND2 2.91Å
801	W	90.4	Very high	91.3	Very high	34 Å²	34	28.8 Å²	28.8	13%	0.129	17%	0.166	C	C	.	.			trans	-82.9	-5.6	-175.9	-55.9	95.1	0	0	0	114.3	L462 T745 H749 M752 L753 L795 V799 I811	L462-W801 VanDerWaalsContact CD1-O 3.3Å; L462-W801 WeakPolarHBondContact CD1-O 3.42Å; L462-W801 WeakPolarHBondContact CD2-O 3.48Å; T745-W801 HydrophobicContact CG2-CZ2 4.18Å; T745-W801 VanDerWaalsContact CG2-NE1 3.34Å; H749-W801 HydrophobicContact CB-CE3 3.92Å; H749-W801 HydrophobicContact CB-CH2 4.01Å; H749-W801 HydrophobicContact CB-CZ3 3.51Å; H749-W801 AromaticContact CD2-CE3 3.82Å; H749-W801 AromaticContact CE1-CD2 3.49Å; H749-W801 VanDerWaalsContact CE1-CD2 3.49Å; H749-W801 AromaticContact CE1-CE3 3.76Å; H749-W801 AromaticContact CE1-CG 3.56Å; H749-W801 AromaticContact CG-CD2 3.95Å; H749-W801 AromaticContact CG-CE3 3.45Å; H749-W801 VanDerWaalsContact CG-CE3 3.45Å; H749-W801 AromaticContact CG-CZ3 3.6Å; H749-W801 AromaticContact ND1-CD2 3.43Å; H749-W801 AromaticContact ND1-CE2 3.74Å; H749-W801 AromaticContact ND1-CE3 3.44Å; H749-W801 AromaticContact ND1-CZ3 3.77Å; M752-W801 HydrophobicContact CE-CE3 4.3Å; M752-W801 HydrophobicContact CE-CZ3 3.78Å; L753-W801 HydrophobicContact CD1-CH2 4.24Å; L753-W801 HydrophobicContact CD2-CH2 4.25Å; L753-W801 HydrophobicContact CD2-CZ3 4.46Å; L753-W801 HydrophobicContact CG-CH2 4.5Å; L795-W801 WeakPolarHBondContact O-CZ2 3.42Å; V799-W801 HydrophobicContact CB-CD2 4.32Å; V799-W801 HydrophobicContact CB-CH2 4.34Å; V799-W801 HydrophobicContact CB-CZ2 3.81Å; V799-W801 HydrophobicContact CG1-CD2 3.7Å; V799-W801 HydrophobicContact CG1-CE3 3.86Å; V799-W801 HydrophobicContact CG1-CG 4.29Å; V799-W801 HydrophobicContact CG1-CH2 4Å; V799-W801 HydrophobicContact CG1-CZ2 3.85Å; V799-W801 HydrophobicContact CG1-CZ3 4Å; V799-W801 HydrophobicContact CG2-CZ2 4.33Å; V799-W801 PolarHBondContact O-N 2.92Å; V799-W801 PolarHBondContact O-NE1 3.31Å; W801-I811 HydrophobicContact CH2-CD1 4.46Å; W801-I811 HydrophobicContact CZ3-CD1 4.08Å
802	S	87.2	Confident	91.3	Very high	88 Å²	88	28.5 Å²	28.5	62%	0.615	17%	0.165	S	C	*	.	S	Bend	trans	-83.4	-28.7	-170.5	53.3	0	0	0	0	115	S800	S800-S802 PolarHBondContact OG-OG 3.45Å
803	V	86.4	Confident	91.2	Very high	64 Å²	64	28.4 Å²	28.4	39%	0.388	16%	0.164	S	C	.	.	S	Bend	trans	-122.8	126.8	-174.4	178.3	0	0	0	0	109.4	S805 I806 C807	V803-S805 PolarHBondContact O-N 3.06Å; V803-I806 HydrophobicContact CB-CB 4.25Å; V803-I806 HydrophobicContact CB-CD1 4.09Å; V803-I806 HydrophobicContact CB-CG1 4.26Å; V803-I806 HydrophobicContact CG1-CB 4.43Å; V803-I806 HydrophobicContact CG1-CD1 4.03Å; V803-I806 HydrophobicContact CG1-CG1 4.03Å; V803-I806 HydrophobicContact CG2-CD1 4.49Å; V803-I806 PolarHBondContact O-N 2.95Å; V803-C807 WeakPolarHBondContact O-CB 3.31Å; V803-C807 PolarHBondContact O-N 3.28Å
804	E	88.5	Confident	91.3	Very high	43 Å²	43	28.7 Å²	28.7	20%	0.201	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-47.8	-168.6	-173.9	-179.2	104.5	0	0	114	L458 S635 C807 F808	L458-E804 HydrophobicContact CB-CB 4.12Å; L458-E804 HydrophobicContact CB-CG 3.81Å; L458-E804 VanDerWaalsContact CB-OE2 3.3Å; L458-E804 WeakPolarHBondContact CB-OE2 3.34Å; L458-E804 HydrophobicContact CD2-CB 4.02Å; L458-E804 HydrophobicContact CD2-CG 4.12Å; L458-E804 PolarHBondContact N-OE2 3.01Å; S635-E804 WeakPolarHBondContact CB-OE1 3.48Å; S635-E804 PolarHBondContact OG-OE1 2.84Å; E804-C807 PolarHBondContact O-N 3.39Å; E804-F808 HydrophobicContact CG-CD2 3.76Å; E804-F808 HydrophobicContact CG-CE2 3.23Å; E804-F808 HydrophobicContact CG-CZ 3.82Å; E804-F808 WeakPolarHBondContact O-CD2 3.48Å; E804-F808 WeakPolarHBondContact O-CG 3.5Å; E804-F808 PolarHBondContact O-N 2.56Å
805	S	87.3	Confident	91.4	Very high	47 Å²	47	28.1 Å²	28.1	33%	0.329	16%	0.163	S	C	.	.	H	α-helix	trans	-60.6	-49.2	178	47.4	0	0	0	0	112.2	V803 C807 F808 E809	V803-S805 PolarHBondContact O-N 3.06Å; S805-C807 VanDerWaalsContact C-N 3.34Å; S805-C807 PolarHBondContact O-N 3.43Å; S805-F808 PolarHBondContact O-N 2.99Å; S805-E809 WeakPolarHBondContact O-CB 3.48Å; S805-E809 PolarHBondContact O-N 3.41Å
806	I	88.8	Confident	91.5	Very high	77 Å²	77	28 Å²	28	40%	0.395	16%	0.162	S	C	.	.	H	α-helix	trans	-66.8	-36.3	-179.1	-56.8	177.8	0	0	0	110.8	V803 N810	V803-I806 HydrophobicContact CB-CB 4.25Å; V803-I806 HydrophobicContact CB-CD1 4.09Å; V803-I806 HydrophobicContact CB-CG1 4.26Å; V803-I806 HydrophobicContact CG1-CB 4.43Å; V803-I806 HydrophobicContact CG1-CD1 4.03Å; V803-I806 HydrophobicContact CG1-CG1 4.03Å; V803-I806 HydrophobicContact CG2-CD1 4.49Å; V803-I806 PolarHBondContact O-N 2.95Å; I806-N810 WeakPolarHBondContact CG2-ND2 3.25Å; I806-N810 VanDerWaalsContact O-CB 3.31Å; I806-N810 WeakPolarHBondContact O-CB 3.41Å; I806-N810 VanDerWaalsContact O-CG 3.25Å; I806-N810 PolarHBondContact O-N 3.12Å; I806-N810 PolarHBondContact O-ND2 2.8Å
807	C	92.7	Very high	91.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-52.8	174.7	-177.6	0	0	0	0	111.1	L458 S800 V803 E804 S805 N810 I811	L458-C807 HydrophobicContact CD2-CB 4.11Å; S800-C807 VanDerWaalsContact O-CA 3.27Å; S800-C807 WeakPolarHBondContact O-CA 3.39Å; S800-C807 VanDerWaalsContact O-CB 3.31Å; S800-C807 WeakPolarHBondContact O-CB 3.39Å; V803-C807 WeakPolarHBondContact O-CB 3.31Å; V803-C807 PolarHBondContact O-N 3.28Å; E804-C807 PolarHBondContact O-N 3.39Å; S805-C807 VanDerWaalsContact C-N 3.34Å; S805-C807 PolarHBondContact O-N 3.43Å; C807-N810 PolarHBondContact O-N 3.23Å; C807-I811 WeakPolarHBondContact O-CD1 3.4Å; C807-I811 VanDerWaalsContact O-CG1 3.3Å; C807-I811 WeakPolarHBondContact O-CG1 3.49Å; C807-I811 PolarHBondContact O-N 3.37Å; C807-I811 VanDerWaalsContact O-N 3.07Å
808	F	93.8	Very high	91.8	Very high	1 Å²	1	26.3 Å²	26.3	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-68.6	-37.8	180	-61.9	-31.7	0	0	0	113	L458 L633 I636 F698 M752 F757 E804 S805 I811 C812	L458-F808 HydrophobicContact CD1-CE1 4.37Å; L458-F808 HydrophobicContact CD1-CZ 4.41Å; L633-F808 HydrophobicContact CD1-CE2 3.91Å; L633-F808 HydrophobicContact CD1-CZ 4.32Å; I636-F808 HydrophobicContact CD1-CB 3.74Å; I636-F808 HydrophobicContact CD1-CD2 3.54Å; I636-F808 HydrophobicContact CD1-CE2 4.38Å; I636-F808 HydrophobicContact CD1-CG 3.89Å; I636-F808 HydrophobicContact CG1-CD2 3.98Å; I636-F808 HydrophobicContact CG1-CE2 4.4Å; F698-F808 HydrophobicContact CE2-CB 4.3Å; F698-F808 HydrophobicContact CE2-CD1 4.18Å; F698-F808 HydrophobicContact CE2-CG 4.1Å; F698-F808 AromaticContact CZ-CD1 3.79Å; F698-F808 HydrophobicContact CZ-CD1 3.79Å; F698-F808 AromaticContact CZ-CD2 3.95Å; F698-F808 HydrophobicContact CZ-CD2 3.95Å; F698-F808 AromaticContact CZ-CE1 3.88Å; F698-F808 HydrophobicContact CZ-CE1 3.88Å; F698-F808 HydrophobicContact CZ-CE2 4.02Å; F698-F808 AromaticContact CZ-CG 3.84Å; F698-F808 HydrophobicContact CZ-CG 3.84Å; F698-F808 AromaticContact CZ-CZ 3.99Å; F698-F808 HydrophobicContact CZ-CZ 3.99Å; M752-F808 HydrophobicContact CE-CE1 4.47Å; M752-F808 HydrophobicContact SD-CE1 3.85Å; F757-F808 HydrophobicContact CE2-CD1 4.15Å; F757-F808 HydrophobicContact CZ-CD1 4.03Å; E804-F808 HydrophobicContact CG-CD2 3.76Å; E804-F808 HydrophobicContact CG-CE2 3.23Å; E804-F808 HydrophobicContact CG-CZ 3.82Å; E804-F808 WeakPolarHBondContact O-CD2 3.48Å; E804-F808 WeakPolarHBondContact O-CG 3.5Å; E804-F808 PolarHBondContact O-N 2.56Å; S805-F808 PolarHBondContact O-N 2.99Å; F808-I811 PolarHBondContact O-N 2.93Å; F808-C812 VanDerWaalsContact O-CB 3.28Å; F808-C812 WeakPolarHBondContact O-CB 3.43Å; F808-C812 PolarHBondContact O-N 3.25Å; F808-C812 PolarHBondContact O-SG 3.46Å
809	E	92.1	Very high	92	Very high	58 Å²	58	25 Å²	25	27%	0.271	14%	0.144	S	C	.	.	H	α-helix	trans	-61.3	-48.5	173.7	178.3	151.4	-125.8	0	0	111.3	L639 Y691 S805 I811 C812 C813	L639-E809 HydrophobicContact CD1-CB 4.08Å; L639-E809 HydrophobicContact CD2-CB 4.12Å; L639-E809 HydrophobicContact CD2-CG 4.37Å; Y691-E809 WeakPolarHBondContact OH-CG 3.21Å; Y691-E809 PolarHBondContact OH-OE1 3.16Å; S805-E809 WeakPolarHBondContact O-CB 3.48Å; S805-E809 PolarHBondContact O-N 3.41Å; E809-I811 PolarHBondContact O-N 3.04Å; E809-C812 PolarHBondContact O-N 2.89Å; E809-C813 WeakPolarHBondContact O-CB 3.46Å; E809-C813 PolarHBondContact O-N 2.84Å; E809-C813 PolarHBondContact O-SG 2.81Å
810	N	93.7	Very high	92.1	Very high	20 Å²	20	24.7 Å²	24.7	11%	0.107	14%	0.142	C	C	.	.	H	α-helix	trans	-58.9	-47	177.2	-78	-44.3	0	0	0	112.4	V799 S800 I806 C807 C812 C813 I814 L886	V799-N810 HydrophobicContact CB-CB 4.41Å; V799-N810 HydrophobicContact CG1-CB 4.39Å; V799-N810 HydrophobicContact CG2-CB 4.19Å; S800-N810 PolarHBondContact N-ND2 2.91Å; I806-N810 WeakPolarHBondContact CG2-ND2 3.25Å; I806-N810 VanDerWaalsContact O-CB 3.31Å; I806-N810 WeakPolarHBondContact O-CB 3.41Å; I806-N810 VanDerWaalsContact O-CG 3.25Å; I806-N810 PolarHBondContact O-N 3.12Å; I806-N810 PolarHBondContact O-ND2 2.8Å; C807-N810 PolarHBondContact O-N 3.23Å; N810-C812 VanDerWaalsContact C-N 3.34Å; N810-C812 PolarHBondContact O-N 3.17Å; N810-C813 PolarHBondContact O-N 3.08Å; N810-I814 HydrophobicContact CB-CD1 4.45Å; N810-I814 WeakPolarHBondContact O-CB 3.44Å; N810-I814 WeakPolarHBondContact O-CD1 3.38Å; N810-I814 VanDerWaalsContact O-CG1 3.23Å; N810-I814 WeakPolarHBondContact O-CG1 3.26Å; N810-I814 PolarHBondContact O-N 2.63Å; N810-L886 WeakPolarHBondContact OD1-CD1 3.15Å
811	I	94.9	Very high	92.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.1	-40.9	179.2	-62.7	162.9	0	0	0	110.6	M752 L753 F757 I759 L795 V799 W801 C807 F808 E809 T815	M752-I811 HydrophobicContact CE-CD1 3.82Å; L753-I811 HydrophobicContact CD2-CD1 4.02Å; L753-I811 HydrophobicContact CD2-CG2 4.47Å; F757-I811 HydrophobicContact CD1-CG2 3.73Å; F757-I811 HydrophobicContact CD2-CG2 3.9Å; F757-I811 HydrophobicContact CE1-CB 4.09Å; F757-I811 HydrophobicContact CE1-CG2 3.54Å; F757-I811 HydrophobicContact CE2-CB 4.17Å; F757-I811 HydrophobicContact CE2-CD1 3.83Å; F757-I811 HydrophobicContact CE2-CG2 3.71Å; F757-I811 HydrophobicContact CG-CG2 3.89Å; F757-I811 HydrophobicContact CZ-CB 3.75Å; F757-I811 HydrophobicContact CZ-CD1 4.14Å; F757-I811 HydrophobicContact CZ-CG2 3.51Å; I759-I811 HydrophobicContact CD1-CG2 4.46Å; L795-I811 HydrophobicContact CD2-CG1 4.39Å; L795-I811 HydrophobicContact CD2-CG2 4.16Å; V799-I811 HydrophobicContact CG1-CD1 4.16Å; V799-I811 HydrophobicContact CG1-CG1 3.87Å; V799-I811 HydrophobicContact CG2-CG1 3.75Å; W801-I811 HydrophobicContact CH2-CD1 4.46Å; W801-I811 HydrophobicContact CZ3-CD1 4.08Å; C807-I811 WeakPolarHBondContact O-CD1 3.4Å; C807-I811 VanDerWaalsContact O-CG1 3.3Å; C807-I811 WeakPolarHBondContact O-CG1 3.49Å; C807-I811 PolarHBondContact O-N 3.37Å; C807-I811 VanDerWaalsContact O-N 3.07Å; F808-I811 PolarHBondContact O-N 2.93Å; E809-I811 PolarHBondContact O-N 3.04Å; I811-T815 WeakPolarHBondContact O-CB 3.42Å; I811-T815 PolarHBondContact O-N 3.24Å; I811-T815 PolarHBondContact O-OG1 3.47Å
812	C	94.6	Very high	91.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.9	-44.4	173.7	-75.7	0	0	0	0	111.9	Y691 L694 F808 E809 N810 A816	Y691-C812 HydrophobicContact CD2-CB 3.63Å; Y691-C812 HydrophobicContact CE2-CB 3.44Å; Y691-C812 VanDerWaalsContact CE2-CB 3.44Å; L694-C812 HydrophobicContact CB-CB 4.43Å; L694-C812 WeakPolarHBondContact CD1-O 3.26Å; F808-C812 VanDerWaalsContact O-CB 3.28Å; F808-C812 WeakPolarHBondContact O-CB 3.43Å; F808-C812 PolarHBondContact O-N 3.25Å; F808-C812 PolarHBondContact O-SG 3.46Å; E809-C812 PolarHBondContact O-N 2.89Å; N810-C812 VanDerWaalsContact C-N 3.34Å; N810-C812 PolarHBondContact O-N 3.17Å; C812-A816 WeakPolarHBondContact O-CB 3.2Å; C812-A816 PolarHBondContact O-N 2.76Å
813	C	94	Very high	91.1	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.02	12%	0.115	C	C	.	.	H	α-helix	trans	-65.6	-48.8	179	-73.9	0	0	0	0	112.9	Y691 E809 N810 T815 A816 N817 P882 F884	Y691-C813 WeakPolarHBondContact CE2-SG 3.45Å; E809-C813 WeakPolarHBondContact O-CB 3.46Å; E809-C813 PolarHBondContact O-N 2.84Å; E809-C813 PolarHBondContact O-SG 2.81Å; N810-C813 PolarHBondContact O-N 3.08Å; C813-T815 VanDerWaalsContact C-N 3.32Å; C813-T815 PolarHBondContact O-N 2.83Å; C813-A816 PolarHBondContact O-N 2.68Å; C813-N817 WeakPolarHBondContact O-CB 3.27Å; C813-N817 PolarHBondContact O-N 3.13Å; C813-P882 WeakPolarHBondContact SG-CG 3.28Å; C813-F884 HydrophobicContact CB-CD1 4.07Å
814	I	94.5	Very high	90	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.026	11%	0.108	C	C	.	.	H	α-helix	trans	-63.7	-40.2	-179.8	-66.7	161.6	0	0	0	110.3	Y791 K794 L795 Q798 V799 N810 F818 L886	Y791-I814 HydrophobicContact CD2-CG2 3.79Å; Y791-I814 HydrophobicContact CE2-CG2 3.97Å; K794-I814 HydrophobicContact CB-CG1 4.46Å; K794-I814 HydrophobicContact CB-CG2 3.7Å; L795-I814 HydrophobicContact CD2-CB 4.27Å; L795-I814 HydrophobicContact CD2-CG2 3.9Å; L795-I814 HydrophobicContact CG-CG2 4.03Å; Q798-I814 HydrophobicContact CB-CD1 3.84Å; V799-I814 HydrophobicContact CG2-CD1 3.65Å; N810-I814 HydrophobicContact CB-CD1 4.45Å; N810-I814 WeakPolarHBondContact O-CB 3.44Å; N810-I814 WeakPolarHBondContact O-CD1 3.38Å; N810-I814 VanDerWaalsContact O-CG1 3.23Å; N810-I814 WeakPolarHBondContact O-CG1 3.26Å; N810-I814 PolarHBondContact O-N 2.63Å; I814-F818 PolarHBondContact O-N 3.05Å; I814-F818 VanDerWaalsContact O-N 3.13Å; I814-L886 HydrophobicContact CD1-CD1 4.24Å; I814-L886 HydrophobicContact CG1-CD1 4.18Å
815	T	95.5	Very high	88.3	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.3	-42.2	175.3	-52.6	0	0	0	0	111.7	L694 P775 I777 Y791 I811 C813 N817 F818 Y819	L694-T815 HydrophobicContact CD1-CG2 3.78Å; L694-T815 HydrophobicContact CD2-CG2 4.03Å; P775-T815 HydrophobicContact CG-CG2 4.1Å; I777-T815 HydrophobicContact CD1-CG2 4.36Å; Y791-T815 HydrophobicContact CE2-CG2 4.27Å; Y791-T815 WeakPolarHBondContact CE2-OG1 3.5Å; Y791-T815 WeakPolarHBondContact OH-CG2 3.46Å; Y791-T815 PolarHBondContact OH-OG1 2.68Å; I811-T815 WeakPolarHBondContact O-CB 3.42Å; I811-T815 PolarHBondContact O-N 3.24Å; I811-T815 PolarHBondContact O-OG1 3.47Å; C813-T815 VanDerWaalsContact C-N 3.32Å; C813-T815 PolarHBondContact O-N 2.83Å; T815-N817 VanDerWaalsContact C-N 3.27Å; T815-N817 PolarHBondContact O-N 2.87Å; T815-F818 PolarHBondContact O-N 3.39Å; T815-Y819 HydrophobicContact CG2-CD2 3.91Å; T815-Y819 HydrophobicContact CG2-CE2 3.9Å; T815-Y819 VanDerWaalsContact O-CD2 3.3Å; T815-Y819 WeakPolarHBondContact O-CD2 3.32Å; T815-Y819 PolarHBondContact O-N 2.85Å
816	A	94.7	Very high	86.2	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-36.4	175.3	0	0	0	0	0	112.7	Q687 F690 L694 C812 C813 A820 F884	Q687-A816 WeakPolarHBondContact O-CB 3.08Å; F690-A816 HydrophobicContact CB-CB 4.01Å; L694-A816 HydrophobicContact CD1-CB 4.27Å; C812-A816 WeakPolarHBondContact O-CB 3.2Å; C812-A816 PolarHBondContact O-N 2.76Å; C813-A816 PolarHBondContact O-N 2.68Å; A816-A820 PolarHBondContact O-N 2.95Å; A816-A820 VanDerWaalsContact O-N 3.14Å; A816-F884 HydrophobicContact CB-CD1 4.34Å; A816-F884 HydrophobicContact CB-CE1 4.16Å
817	N	93.4	Very high	83.8	Confident	20 Å²	20	24.7 Å²	24.7	11%	0.107	13%	0.133	C	C	.	.	H	α-helix	trans	-69.4	-38.2	175.2	-167.2	29	0	0	0	112.6	Q687 C813 T815 A820 F884	Q687-N817 PolarHBondContact NE2-OD1 2.86Å; C813-N817 WeakPolarHBondContact O-CB 3.27Å; C813-N817 PolarHBondContact O-N 3.13Å; T815-N817 VanDerWaalsContact C-N 3.27Å; T815-N817 PolarHBondContact O-N 2.87Å; N817-A820 WeakPolarHBondContact O-CB 3.31Å; N817-A820 PolarHBondContact O-N 3.43Å; N817-F884 PolarHBondContact ND2-O 2.9Å
818	F	94.4	Very high	80.7	Confident	6 Å²	6	32 Å²	32	3%	0.026	17%	0.172	C	C	.	.	H	α-helix	trans	-68.9	-33.5	175.9	171.7	-128.4	0	0	0	113.4	I774 P783 E784 L785 Q787 L788 Y791 I814 T815 A820	I774-F818 HydrophobicContact CD1-CE1 4.21Å; P783-F818 HydrophobicContact CB-CD1 4.5Å; P783-F818 HydrophobicContact CB-CE1 4.12Å; P783-F818 HydrophobicContact CB-CE2 4.21Å; P783-F818 HydrophobicContact CB-CZ 3.96Å; P783-F818 HydrophobicContact CG-CE1 3.85Å; P783-F818 HydrophobicContact CG-CZ 3.81Å; E784-F818 WeakPolarHBondContact O-CE2 3.37Å; L785-F818 HydrophobicContact CD2-CZ 4.35Å; Q787-F818 HydrophobicContact CB-CD2 4.02Å; Q787-F818 HydrophobicContact CB-CE2 4.12Å; L788-F818 HydrophobicContact CB-CE2 4.42Å; L788-F818 HydrophobicContact CB-CZ 4.28Å; L788-F818 HydrophobicContact CD1-CE1 4.08Å; L788-F818 HydrophobicContact CD1-CZ 3.74Å; Y791-F818 AromaticContact CD1-CD1 3.47Å; Y791-F818 HydrophobicContact CD1-CD1 3.47Å; Y791-F818 VanDerWaalsContact CD1-CD1 3.47Å; Y791-F818 AromaticContact CD1-CE1 3.69Å; Y791-F818 HydrophobicContact CD1-CE1 3.69Å; Y791-F818 HydrophobicContact CD1-CG 4.05Å; Y791-F818 HydrophobicContact CD1-CZ 4.4Å; Y791-F818 HydrophobicContact CD2-CB 3.5Å; Y791-F818 AromaticContact CD2-CD1 3.8Å; Y791-F818 HydrophobicContact CD2-CD1 3.8Å; Y791-F818 AromaticContact CD2-CG 3.8Å; Y791-F818 HydrophobicContact CD2-CG 3.8Å; Y791-F818 AromaticContact CE1-CD1 3.77Å; Y791-F818 HydrophobicContact CE1-CD1 3.77Å; Y791-F818 HydrophobicContact CE1-CE1 4.03Å; Y791-F818 HydrophobicContact CE2-CB 4.15Å; Y791-F818 HydrophobicContact CE2-CD1 4.11Å; Y791-F818 HydrophobicContact CE2-CG 4.47Å; Y791-F818 HydrophobicContact CG-CB 3.79Å; Y791-F818 AromaticContact CG-CD1 3.46Å; Y791-F818 HydrophobicContact CG-CD1 3.46Å; Y791-F818 VanDerWaalsContact CG-CD1 3.46Å; Y791-F818 HydrophobicContact CG-CD2 4.2Å; Y791-F818 HydrophobicContact CG-CE1 4.08Å; Y791-F818 AromaticContact CG-CG 3.55Å; Y791-F818 HydrophobicContact CG-CG 3.55Å; I814-F818 PolarHBondContact O-N 3.05Å; I814-F818 VanDerWaalsContact O-N 3.13Å; T815-F818 PolarHBondContact O-N 3.39Å; F818-A820 VanDerWaalsContact C-N 3.34Å
819	Y	94.2	Very high	77.5	Confident	2 Å²	2	38 Å²	38	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-83.8	-10.3	176.4	-78	-111.7	0	0	0	113.2	F690 P775 I777 Y781 P783 T815	F690-Y819 HydrophobicContact CD1-CD1 4.41Å; F690-Y819 HydrophobicContact CD1-CG 4.42Å; F690-Y819 WeakPolarHBondContact CD2-O 3.43Å; F690-Y819 HydrophobicContact CE1-CD1 4.22Å; F690-Y819 WeakPolarHBondContact CE2-O 3.34Å; P775-Y819 WeakPolarHBondContact CD-OH 3.4Å; P775-Y819 WeakPolarHBondContact O-CE1 3.24Å; P775-Y819 VanDerWaalsContact O-CZ 3.26Å; P775-Y819 PolarHBondContact O-OH 2.97Å; I777-Y819 HydrophobicContact CD1-CD1 3.65Å; I777-Y819 HydrophobicContact CD1-CD2 4.06Å; I777-Y819 HydrophobicContact CD1-CE1 3.86Å; I777-Y819 HydrophobicContact CD1-CE2 4.27Å; I777-Y819 HydrophobicContact CD1-CG 3.77Å; I777-Y819 HydrophobicContact CG1-CD1 4.22Å; I777-Y819 HydrophobicContact CG1-CE1 4.05Å; Y781-Y819 HydrophobicContact CD1-CD1 4.45Å; Y781-Y819 HydrophobicContact CE1-CD1 4.48Å; Y781-Y819 WeakPolarHBondContact CE1-O 3.36Å; Y781-Y819 PolarHBondContact OH-O 2.95Å; P783-Y819 HydrophobicContact CB-CD1 4.11Å; P783-Y819 HydrophobicContact CB-CD2 4.28Å; P783-Y819 HydrophobicContact CB-CE1 4.25Å; P783-Y819 HydrophobicContact CB-CE2 4.4Å; P783-Y819 HydrophobicContact CB-CG 4.12Å; P783-Y819 HydrophobicContact CG-CD1 4.2Å; P783-Y819 HydrophobicContact CG-CD2 4.49Å; P783-Y819 HydrophobicContact CG-CE1 3.82Å; P783-Y819 HydrophobicContact CG-CE2 4.13Å; T815-Y819 HydrophobicContact CG2-CD2 3.91Å; T815-Y819 HydrophobicContact CG2-CE2 3.9Å; T815-Y819 VanDerWaalsContact O-CD2 3.3Å; T815-Y819 WeakPolarHBondContact O-CD2 3.32Å; T815-Y819 PolarHBondContact O-N 2.85Å
820	A	92.7	Very high	74.4	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	24%	0.237	C	C	.	.	S	Bend	trans	-62.8	163.4	-179.5	0	0	0	0	0	113.7	K683 S686 Q687 A816 N817 F818 R859	K683-A820 HydrophobicContact CG-CB 4.48Å; S686-A820 WeakPolarHBondContact OG-CA 3.42Å; S686-A820 WeakPolarHBondContact OG-CB 3.32Å; Q687-A820 HydrophobicContact CG-CB 3.56Å; A816-A820 PolarHBondContact O-N 2.95Å; A816-A820 VanDerWaalsContact O-N 3.14Å; N817-A820 WeakPolarHBondContact O-CB 3.31Å; N817-A820 PolarHBondContact O-N 3.43Å; F818-A820 VanDerWaalsContact C-N 3.34Å; A820-R859 PolarHBondContact O-NH2 3.05Å
821	V	90	Very high	71.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.267	C	S	.	.			trans	-70.1	130.8	165.4	177.8	0	0	0	0	109.1	E666 T667 L682 K683 S686 I863 L867	E666-V821 WeakPolarHBondContact O-CG1 3.34Å; T667-V821 HydrophobicContact CG2-CG1 4.48Å; L682-V821 HydrophobicContact CB-CB 4.18Å; L682-V821 HydrophobicContact CB-CG1 4.06Å; L682-V821 HydrophobicContact CB-CG2 4.3Å; K683-V821 VanDerWaalsContact CB-O 3.22Å; K683-V821 WeakPolarHBondContact CB-O 3.49Å; K683-V821 WeakPolarHBondContact CD-O 3.48Å; K683-V821 WeakPolarHBondContact CG-O 3.36Å; S686-V821 PolarHBondContact OG-N 2.98Å; V821-I863 HydrophobicContact CG1-CD1 3.89Å; V821-I863 HydrophobicContact CG2-CD1 3.99Å; V821-I863 HydrophobicContact CG2-CG1 4.09Å; V821-L867 HydrophobicContact CG2-CD2 3.35Å
822	S	83.7	Confident	67.9	Low	13 Å²	13	49.4 Å²	49.4	9%	0.091	30%	0.3	C	S	.	.			trans	-134.8	171.7	177.9	-164.1	0	0	0	0	110.1	T667 Q787	T667-S822 VanDerWaalsContact CG2-C 3.44Å; Q787-S822 PolarHBondContact NE2-OG 3.4Å
823	S	74.1	Confident	64.6	Low	61 Å²	61	55.7 Å²	55.7	43%	0.427	34%	0.341	S	S	.	.			trans	-83.6	140.8	162.4	-54.3	0	0	0	0	109.3	E666 T667 L825	E666-S823 VanDerWaalsContact OE2-CA 3.3Å; E666-S823 WeakPolarHBondContact OE2-CA 3.27Å; T667-S823 WeakPolarHBondContact CG2-OG 3.39Å; S823-L825 PolarHBondContact O-N 3.01Å
824	S	63.6	Low	61.6	Low	33 Å²	33	63.4 Å²	63.4	23%	0.231	38%	0.38	C	S	.	.			trans	-60.4	118.6	176.1	177.1	0	0	0	0	111.5	E666 F826 N827	E666-S824 PolarHBondContact OE2-N 3.36Å; S824-F826 PolarHBondContact O-N 3.14Å; S824-F826 VanDerWaalsContact O-N 3.17Å; S824-N827 WeakPolarHBondContact CB-OD1 2.95Å; S824-N827 PolarHBondContact OG-OD1 2.93Å
825	L	51.9	Low	58.5	Low	69 Å²	69	68.2 Å²	68.2	36%	0.361	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-2.6	-177.7	-64.5	176.2	0	0	0	114.8	Y722 Q787 I790 S823	Y722-L825 HydrophobicContact CE2-CD1 4.4Å; Q787-L825 HydrophobicContact CG-CD1 4.16Å; I790-L825 HydrophobicContact CD1-CD1 3.94Å; S823-L825 PolarHBondContact O-N 3.01Å
826	F	43.8	Very low	55.4	Low	124 Å²	124	73.3 Å²	73.3	54%	0.544	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.2	17.1	-164.8	-66.6	-77	0	0	0	115.8	N786 S824 D828	N786-F826 HydrophobicContact CB-CD2 4.06Å; N786-F826 HydrophobicContact CB-CE2 4.02Å; S824-F826 PolarHBondContact O-N 3.14Å; S824-F826 VanDerWaalsContact O-N 3.17Å; F826-D828 VanDerWaalsContact C-N 3.27Å; F826-D828 PolarHBondContact O-N 3.25Å
827	N	37.1	Very low	52.3	Low	102 Å²	102	78.4 Å²	78.4	55%	0.545	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-12	-174.4	-83.2	4.3	0	0	0	115.9	S824 C829 S830	S824-N827 WeakPolarHBondContact CB-OD1 2.95Å; S824-N827 PolarHBondContact OG-OD1 2.93Å; N827-C829 PolarHBondContact O-N 2.92Å; N827-C829 VanDerWaalsContact O-N 3.17Å; N827-S830 PolarHBondContact O-OG 2.96Å
828	D	28.1	Very low	49.3	Very low	153 Å²	153	83.5 Å²	83.5	82%	0.818	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-11.4	179.8	-71.7	-34	0	0	0	114.3	F826 S830	F826-D828 VanDerWaalsContact C-N 3.27Å; F826-D828 PolarHBondContact O-N 3.25Å; D828-S830 PolarHBondContact O-N 2.85Å
829	C	25.7	Very low	46.1	Very low	128 Å²	128	87.6 Å²	87.6	87%	0.865	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	46.4	-178.1	-142.1	0	0	0	0	113.7	N827	N827-C829 PolarHBondContact O-N 2.92Å; N827-C829 VanDerWaalsContact O-N 3.17Å
830	S	27.2	Very low	43.3	Very low	111 Å²	111	94.3 Å²	94.3	78%	0.776	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.2	23.4	178.3	59.7	0	0	0	0	114.7	N827 D828	N827-S830 PolarHBondContact O-OG 2.96Å; D828-S830 PolarHBondContact O-N 2.85Å
831	S	26.4	Very low	40.6	Very low	106 Å²	106	100.3 Å²	100.3	74%	0.741	61%	0.612	S	S	*	*			trans	-132.7	53.9	-174.1	57.2	0	0	0	0	114.6
832	S	26	Very low	37.7	Very low	100 Å²	100	107 Å²	107	70%	0.699	65%	0.647	S	S	*	*			trans	-138	126	163.1	61.3	0	0	0	0	112.3	I834	S832-I834 PolarHBondContact O-N 2.96Å
833	P	25.9	Very low	35.3	Very low	132 Å²	132	111.6 Å²	111.6	86%	0.857	67%	0.671	S	S	*	*			trans	-87.2	108.7	-176.3	32.2	-32.4	0	0	0	111.5
834	I	30.6	Very low	33.4	Very low	164 Å²	164	116.3 Å²	116.3	84%	0.841	68%	0.684	S	S	*	*			trans	-87.1	114.3	170.6	-61.3	-178.9	0	0	0	109.2	S832	S832-I834 PolarHBondContact O-N 2.96Å
835	S	28.5	Very low	31.8	Very low	107 Å²	107	119.4 Å²	119.4	75%	0.748	71%	0.706	S	S	*	*			trans	-84.9	135.9	-177.3	48.9	0	0	0	0	113.1
836	S	30.3	Very low	30.9	Very low	107 Å²	107	122.5 Å²	122.5	75%	0.748	72%	0.723	S	S	*	*			trans	172.8	140.1	133.4	42.7	0	0	0	0	112.7
837	S	30.2	Very low	30.3	Very low	107 Å²	107	124.7 Å²	124.7	75%	0.748	73%	0.732	S	S	*	*			trans	54.6	125	157.8	45	0	0	0	0	119.3
838	T	30.5	Very low	30	Very low	127 Å²	127	128.8 Å²	128.8	78%	0.779	75%	0.748	S	S	*	*			cis	-152.5	158.7	6.9	-64.3	0	0	0	0	110.3
839	S	28.3	Very low	29.9	Very low	91 Å²	91	129.3 Å²	129.3	64%	0.636	75%	0.751	S	S	*	*			trans	-52.5	157.6	172.1	47.4	0	0	0	0	113.9
840	I	34.7	Very low	30.1	Very low	144 Å²	144	129.5 Å²	129.5	74%	0.738	75%	0.748	S	S	*	*				-159.6	113.6	75.3	-86.1	169.4	0	0	0	108.5
841	I	35	Very low	30.1	Very low	127 Å²	127	131.6 Å²	131.6	65%	0.651	76%	0.756	S	S	*	*				73	107.3	105.6	-65.1	168.8	0	0	0	114.6
842	D	30.6	Very low	30.3	Very low	140 Å²	140	131.6 Å²	131.6	75%	0.749	76%	0.756	S	S	*	*			trans	52.1	154.2	130.8	-45.8	-22.5	0	0	0	121.2
843	D	32.6	Very low	30.6	Very low	110 Å²	110	132.5 Å²	132.5	59%	0.588	76%	0.762	S	S	*	*			cis	-147	173	9.4	-148.5	1.9	0	0	0	115.5
844	K	35.3	Very low	31.4	Very low	161 Å²	161	131.3 Å²	131.3	70%	0.7	76%	0.757	S	S	*	*			trans	-25.8	158.9	156.6	-64.5	165.9	-144.7	75.4	0	116
845	S	28.9	Very low	32.7	Very low	98 Å²	98	129.1 Å²	129.1	69%	0.685	76%	0.756	S	S	*	*			cis	176.2	133.9	-20.2	56.1	0	0	0	0	107.4
846	D	32.8	Very low	34.5	Very low	134 Å²	134	127.3 Å²	127.3	72%	0.717	74%	0.737	S	S	*	*			trans	-164.1	168.7	145.3	-124.3	-35.2	0	0	0	115.7
847	K	31.1	Very low	37	Very low	170 Å²	170	124.2 Å²	124.2	74%	0.739	72%	0.716	S	S	*	*			trans	-69.3	145.5	-170.2	-46.8	138.1	-169.4	96.5	0	113.3
848	E	30.3	Very low	39.4	Very low	187 Å²	187	124.6 Å²	124.6	87%	0.874	72%	0.716	S	S	*	*				-176.9	170	109.1	-101.2	178.7	-166.4	0	0	113.2
849	N	26.7	Very low	42	Very low	165 Å²	165	120.4 Å²	120.4	88%	0.882	69%	0.686	S	S	*	*			trans	-81.3	117.8	-165.5	-66.7	-55.1	0	0	0	114.1
850	T	29.7	Very low	44.8	Very low	132 Å²	132	118.5 Å²	118.5	81%	0.81	67%	0.667	S	S	*	*			trans	-136.8	125.7	153.4	49.5	0	0	0	0	110.2	S852	T850-S852 PolarHBondContact O-N 2.83Å; T850-S852 VanDerWaalsContact O-N 3.15Å
851	V	28.3	Very low	47.3	Very low	154 Å²	154	118.1 Å²	118.1	93%	0.933	66%	0.656	S	S	*	*			trans	-77.3	100.8	176.8	178.5	0	0	0	0	108.6	S853	V851-S853 PolarHBondContact O-N 3.33Å
852	S	30	Very low	49.8	Very low	107 Å²	107	113.2 Å²	113.2	75%	0.748	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-69.6	125.2	176.2	54.7	0	0	0	0	111	T850 S854	T850-S852 PolarHBondContact O-N 2.83Å; T850-S852 VanDerWaalsContact O-N 3.15Å; S852-S854 PolarHBondContact O-N 3.25Å
853	S	33	Very low	52.6	Low	118 Å²	118	106.6 Å²	106.6	83%	0.825	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-56.1	125.3	177.4	52.2	0	0	0	0	112.2	V851 S855	V851-S853 PolarHBondContact O-N 3.33Å; S853-S855 PolarHBondContact O-N 3.02Å
854	S	42.3	Very low	55.3	Low	108 Å²	108	103.6 Å²	103.6	76%	0.755	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-65.7	126.3	-179.7	45.3	0	0	0	0	112.6	S852 L856	S852-S854 PolarHBondContact O-N 3.25Å; S854-L856 PolarHBondContact O-N 3.44Å
855	S	57.5	Low	57.8	Low	117 Å²	117	99.6 Å²	99.6	82%	0.818	56%	0.562	S	S	*	*			trans	-77.9	105.4	168.6	53.9	0	0	0	0	110	S853	S853-S855 PolarHBondContact O-N 3.02Å
856	L	66.8	Low	60.5	Low	69 Å²	69	95.3 Å²	95.3	36%	0.361	53%	0.531	S	S	.	.			trans	-59.3	144.6	172.1	-68.7	130	0	0	0	111	F663 S854 E860	F663-L856 HydrophobicContact CD2-CD2 3.89Å; F663-L856 HydrophobicContact CE2-CD2 3.85Å; S854-L856 PolarHBondContact O-N 3.44Å; L856-E860 HydrophobicContact CB-CB 4.28Å; L856-E860 HydrophobicContact CD2-CB 3.86Å
857	S	81.8	Confident	63.2	Low	42 Å²	42	89 Å²	89	29%	0.294	50%	0.497	S	S	.	.			trans	-66.7	159.9	169.6	68.8	0	0	0	0	111.6	R859 E860 W861	S857-R859 PolarHBondContact O-N 3.02Å; S857-E860 WeakPolarHBondContact CB-OE2 3.32Å; S857-E860 PolarHBondContact N-OE2 3.42Å; S857-E860 PolarHBondContact O-N 2.65Å; S857-E860 WeakPolarHBondContact OG-CB 3.31Å; S857-E860 VanDerWaalsContact OG-CG 3.27Å; S857-E860 WeakPolarHBondContact OG-CG 3.31Å; S857-E860 PolarHBondContact OG-N 3.21Å; S857-E860 PolarHBondContact OG-OE2 2.84Å; S857-W861 WeakPolarHBondContact O-CB 3.43Å; S857-W861 PolarHBondContact O-N 2.99Å
858	P	82.1	Confident	66.1	Low	116 Å²	116	81.7 Å²	81.7	75%	0.753	47%	0.465	S	S	*	.	H	α-helix	trans	-58.8	-32.5	176.7	-26.1	35.6	0	0	0	114	M862	P858-M862 WeakPolarHBondContact O-CB 3.38Å; P858-M862 PolarHBondContact O-N 3.37Å
859	R	83.5	Confident	68.9	Low	38 Å²	38	74.3 Å²	74.3	14%	0.143	43%	0.433	C	S	.	.	H	α-helix	trans	-71.8	-46.1	177.9	-170.5	67.5	169.8	147.2	9.1	110.9	Y781 I782 E784 A820 S857 M862 I863	Y781-R859 PolarHBondContact OH-NH1 2.78Å; Y781-R859 PolarHBondContact OH-NH2 2.84Å; I782-R859 PolarHBondContact O-NH1 2.75Å; E784-R859 IonicContact OE1-CZ 2.75Å; E784-R859 IonicContact OE1-NE 3.27Å; E784-R859 PolarHBondContact OE1-NE 3.33Å; E784-R859 IonicContact OE1-NH2 2.73Å; E784-R859 PolarHBondContact OE1-NH2 2.66Å; A820-R859 PolarHBondContact O-NH2 3.05Å; S857-R859 PolarHBondContact O-N 3.02Å; R859-M862 PolarHBondContact O-N 3.01Å; R859-I863 HydrophobicContact CG-CD1 4.1Å; R859-I863 VanDerWaalsContact O-CG1 3.27Å; R859-I863 WeakPolarHBondContact O-CG1 3.41Å; R859-I863 PolarHBondContact O-N 2.74Å
860	E	87.2	Confident	71.8	Confident	51 Å²	51	66.5 Å²	66.5	24%	0.238	39%	0.391	C	S	.	.	H	α-helix	trans	-60.1	-45.6	173.2	-73.7	168.1	114.9	0	0	111.9	F663 L856 S857 M862 I863 Q864	F663-E860 HydrophobicContact CD1-CG 4.44Å; F663-E860 HydrophobicContact CD2-CB 3.82Å; F663-E860 HydrophobicContact CD2-CG 3.73Å; F663-E860 HydrophobicContact CE2-CB 3.5Å; F663-E860 VanDerWaalsContact CE2-CB 3.5Å; F663-E860 HydrophobicContact CE2-CG 3.88Å; F663-E860 WeakPolarHBondContact CE2-O 3.45Å; F663-E860 HydrophobicContact CG-CG 4.04Å; F663-E860 HydrophobicContact CZ-CB 3.99Å; F663-E860 HydrophobicContact CZ-CG 4.3Å; F663-E860 VanDerWaalsContact CZ-O 3.26Å; F663-E860 WeakPolarHBondContact CZ-O 3.46Å; L856-E860 HydrophobicContact CB-CB 4.28Å; L856-E860 HydrophobicContact CD2-CB 3.86Å; S857-E860 WeakPolarHBondContact CB-OE2 3.32Å; S857-E860 PolarHBondContact N-OE2 3.42Å; S857-E860 PolarHBondContact O-N 2.65Å; S857-E860 WeakPolarHBondContact OG-CB 3.31Å; S857-E860 VanDerWaalsContact OG-CG 3.27Å; S857-E860 WeakPolarHBondContact OG-CG 3.31Å; S857-E860 PolarHBondContact OG-N 3.21Å; S857-E860 PolarHBondContact OG-OE2 2.84Å; E860-M862 VanDerWaalsContact C-N 3.35Å; E860-M862 PolarHBondContact O-N 2.92Å; E860-I863 PolarHBondContact O-N 2.9Å; E860-Q864 WeakPolarHBondContact O-CB 3.37Å; E860-Q864 PolarHBondContact O-N 3.21Å
861	W	88.6	Confident	74.7	Confident	137 Å²	137	60.3 Å²	60.3	52%	0.519	35%	0.353	S	S	.	.	H	α-helix	trans	-58.1	-47.1	177.1	-173.8	92.7	0	0	0	111.4	S857 I863 Q864 H865 I866	S857-W861 WeakPolarHBondContact O-CB 3.43Å; S857-W861 PolarHBondContact O-N 2.99Å; W861-I863 VanDerWaalsContact C-N 3.34Å; W861-I863 PolarHBondContact O-N 3.43Å; W861-Q864 PolarHBondContact O-N 3.27Å; W861-H865 AromaticContact CD1-CD2 3.4Å; W861-H865 VanDerWaalsContact CD1-CD2 3.4Å; W861-H865 AromaticContact CD1-NE2 3.86Å; W861-H865 HydrophobicContact CD2-CB 4.35Å; W861-H865 AromaticContact CD2-CD2 3.92Å; W861-H865 AromaticContact CE2-CD2 3.65Å; W861-H865 AromaticContact CE2-CG 4Å; W861-H865 AromaticContact CG-CD2 3.76Å; W861-H865 HydrophobicContact CH2-CB 4.25Å; W861-H865 HydrophobicContact CZ2-CB 4.05Å; W861-H865 HydrophobicContact CZ3-CB 4.49Å; W861-H865 AromaticContact NE1-CD2 3.32Å; W861-H865 PolarHBondContact NE1-CD2 3.26Å; W861-H865 VanDerWaalsContact NE1-CD2 3.32Å; W861-H865 AromaticContact NE1-NE2 3.78Å; W861-H865 WeakPolarHBondContact O-CB 3.41Å; W861-H865 PolarHBondContact O-CD2 3.42Å; W861-H865 PolarHBondContact O-N 2.91Å; W861-I866 HydrophobicContact CZ3-CD1 4.29Å; W861-I866 HydrophobicContact CZ3-CG1 4.31Å
862	M	87.7	Confident	77.6	Confident	24 Å²	24	53.9 Å²	53.9	12%	0.118	32%	0.315	C	S	.	.	H	α-helix	trans	-64.5	-37.3	177.6	-173.4	173.2	68.6	0	0	112.3	Y781 I782 P858 R859 E860 I866 L867	Y781-M862 HydrophobicContact CD2-CE 4Å; Y781-M862 HydrophobicContact CD2-CG 3.91Å; Y781-M862 HydrophobicContact CD2-SD 3.99Å; Y781-M862 HydrophobicContact CE2-CE 3.87Å; Y781-M862 HydrophobicContact CE2-CG 4.37Å; Y781-M862 HydrophobicContact CE2-SD 4.45Å; Y781-M862 HydrophobicContact CG-SD 4.37Å; I782-M862 VanDerWaalsContact O-CE 3.31Å; I782-M862 WeakPolarHBondContact O-CE 3.39Å; P858-M862 WeakPolarHBondContact O-CB 3.38Å; P858-M862 PolarHBondContact O-N 3.37Å; R859-M862 PolarHBondContact O-N 3.01Å; E860-M862 VanDerWaalsContact C-N 3.35Å; E860-M862 PolarHBondContact O-N 2.92Å; M862-I866 HydrophobicContact CG-CB 4.35Å; M862-I866 HydrophobicContact CG-CD1 4.09Å; M862-I866 HydrophobicContact CG-CG1 4.34Å; M862-I866 WeakPolarHBondContact O-CA 3.31Å; M862-I866 VanDerWaalsContact O-CB 3.27Å; M862-I866 WeakPolarHBondContact O-CB 3.18Å; M862-I866 PolarHBondContact O-N 2.87Å; M862-L867 PolarHBondContact O-N 2.84Å; M862-L867 VanDerWaalsContact O-N 3.09Å
863	I	88.8	Confident	80.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-67.9	-43.9	175.2	-67.8	164.8	0	0	0	110.9	F663 L682 V821 R859 E860 W861 L867 W868	F663-I863 HydrophobicContact CE1-CB 4.1Å; F663-I863 HydrophobicContact CE1-CG2 3.68Å; F663-I863 HydrophobicContact CZ-CB 3.91Å; F663-I863 HydrophobicContact CZ-CG2 3.82Å; L682-I863 HydrophobicContact CD1-CG2 3.93Å; V821-I863 HydrophobicContact CG1-CD1 3.89Å; V821-I863 HydrophobicContact CG2-CD1 3.99Å; V821-I863 HydrophobicContact CG2-CG1 4.09Å; R859-I863 HydrophobicContact CG-CD1 4.1Å; R859-I863 VanDerWaalsContact O-CG1 3.27Å; R859-I863 WeakPolarHBondContact O-CG1 3.41Å; R859-I863 PolarHBondContact O-N 2.74Å; E860-I863 PolarHBondContact O-N 2.9Å; W861-I863 VanDerWaalsContact C-N 3.34Å; W861-I863 PolarHBondContact O-N 3.43Å; I863-L867 PolarHBondContact O-N 2.81Å; I863-W868 VanDerWaalsContact O-CB 3.28Å; I863-W868 WeakPolarHBondContact O-CB 3.49Å; I863-W868 PolarHBondContact O-N 3.26Å
864	Q	89	Confident	82.5	Confident	48 Å²	48	45.3 Å²	45.3	22%	0.224	26%	0.255	C	S	.	.	I	π-helix	trans	-71.4	-38.9	-178	178.6	173.2	-6.1	0	0	113.4	F660 F663 E860 W861 P869	F660-Q864 HydrophobicContact CD1-CG 3.81Å; F660-Q864 HydrophobicContact CE1-CB 4.18Å; F660-Q864 HydrophobicContact CE1-CG 3.73Å; F660-Q864 HydrophobicContact CG-CG 4.45Å; F660-Q864 HydrophobicContact CZ-CB 4.33Å; F660-Q864 HydrophobicContact CZ-CG 4.33Å; F663-Q864 HydrophobicContact CE2-CB 4.04Å; F663-Q864 HydrophobicContact CZ-CB 4.08Å; E860-Q864 WeakPolarHBondContact O-CB 3.37Å; E860-Q864 PolarHBondContact O-N 3.21Å; W861-Q864 PolarHBondContact O-N 3.27Å; Q864-P869 WeakPolarHBondContact O-CD 3.35Å
865	H	87.4	Confident	84.7	Confident	77 Å²	77	40.3 Å²	40.3	36%	0.356	22%	0.22	S	C	.	.	I	π-helix	trans	-105.4	-17.3	-170.9	-64.5	-73.5	0	0	0	114.7	W861	W861-H865 AromaticContact CD1-CD2 3.4Å; W861-H865 VanDerWaalsContact CD1-CD2 3.4Å; W861-H865 AromaticContact CD1-NE2 3.86Å; W861-H865 HydrophobicContact CD2-CB 4.35Å; W861-H865 AromaticContact CD2-CD2 3.92Å; W861-H865 AromaticContact CE2-CD2 3.65Å; W861-H865 AromaticContact CE2-CG 4Å; W861-H865 AromaticContact CG-CD2 3.76Å; W861-H865 HydrophobicContact CH2-CB 4.25Å; W861-H865 HydrophobicContact CZ2-CB 4.05Å; W861-H865 HydrophobicContact CZ3-CB 4.49Å; W861-H865 AromaticContact NE1-CD2 3.32Å; W861-H865 PolarHBondContact NE1-CD2 3.26Å; W861-H865 VanDerWaalsContact NE1-CD2 3.32Å; W861-H865 AromaticContact NE1-NE2 3.78Å; W861-H865 WeakPolarHBondContact O-CB 3.41Å; W861-H865 PolarHBondContact O-CD2 3.42Å; W861-H865 PolarHBondContact O-N 2.91Å
866	I	86.4	Confident	86.1	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.041	18%	0.184	C	C	.	.	I	π-helix	trans	-112.1	-58.7	174.9	-50.4	-167.1	0	0	0	111.1	T587 I778 D780 W861 M862 I870	T587-I866 HydrophobicContact CG2-CB 4.12Å; T587-I866 HydrophobicContact CG2-CG1 4.22Å; T587-I866 HydrophobicContact CG2-CG2 3.83Å; I778-I866 HydrophobicContact CG2-CG2 3.86Å; D780-I866 HydrophobicContact CB-CD1 3.79Å; W861-I866 HydrophobicContact CZ3-CD1 4.29Å; W861-I866 HydrophobicContact CZ3-CG1 4.31Å; M862-I866 HydrophobicContact CG-CB 4.35Å; M862-I866 HydrophobicContact CG-CD1 4.09Å; M862-I866 HydrophobicContact CG-CG1 4.34Å; M862-I866 WeakPolarHBondContact O-CA 3.31Å; M862-I866 VanDerWaalsContact O-CB 3.27Å; M862-I866 WeakPolarHBondContact O-CB 3.18Å; M862-I866 PolarHBondContact O-N 2.87Å; I866-I870 HydrophobicContact CG2-CD1 4.27Å; I866-I870 VanDerWaalsContact O-CD1 3.31Å; I866-I870 WeakPolarHBondContact O-CD1 3.39Å; I866-I870 VanDerWaalsContact O-CG1 3.3Å; I866-I870 WeakPolarHBondContact O-CG1 3.48Å
867	L	89.5	Confident	87	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	I	π-helix	trans	-72.2	-45.5	-171.1	-170.8	65.1	0	0	0	113	L689 F690 I778 Y781 V821 M862 I863 I870 L871	L689-L867 HydrophobicContact CD2-CD1 3.81Å; F690-L867 HydrophobicContact CE2-CD1 3.88Å; F690-L867 HydrophobicContact CZ-CD1 3.79Å; I778-L867 HydrophobicContact CD1-CD1 4.37Å; Y781-L867 HydrophobicContact CD2-CB 4.41Å; Y781-L867 HydrophobicContact CE2-CB 4.16Å; Y781-L867 HydrophobicContact CE2-CD1 4.27Å; Y781-L867 HydrophobicContact CE2-CD2 4.13Å; Y781-L867 HydrophobicContact CE2-CG 4.43Å; V821-L867 HydrophobicContact CG2-CD2 3.35Å; M862-L867 PolarHBondContact O-N 2.84Å; M862-L867 VanDerWaalsContact O-N 3.09Å; I863-L867 PolarHBondContact O-N 2.81Å; L867-I870 PolarHBondContact O-N 2.98Å; L867-L871 HydrophobicContact CD2-CD1 4.45Å; L867-L871 HydrophobicContact CG-CD1 4.04Å; L867-L871 HydrophobicContact CG-CG 4.3Å; L867-L871 WeakPolarHBondContact O-CG 3.47Å; L867-L871 PolarHBondContact O-N 2.74Å
868	W	90.6	Very high	87	Confident	17 Å²	17	30 Å²	30	6%	0.064	15%	0.153	C	C	.	.	H	α-helix	trans	-61.9	-46.4	-176	175.9	-86.2	0	0	0	113.8	C658 F660 A671 I680 L682 I863 I870 L871 C872	C658-W868 HydrophobicContact CB-CH2 4.13Å; C658-W868 HydrophobicContact CB-CZ2 3.88Å; F660-W868 HydrophobicContact CB-CD2 4.31Å; F660-W868 HydrophobicContact CB-CG 4.38Å; F660-W868 HydrophobicContact CB-CZ2 4.4Å; F660-W868 AromaticContact CD2-CD2 3.67Å; F660-W868 HydrophobicContact CD2-CD2 3.67Å; F660-W868 AromaticContact CD2-CE3 3.86Å; F660-W868 HydrophobicContact CD2-CE3 3.86Å; F660-W868 AromaticContact CD2-CG 3.97Å; F660-W868 HydrophobicContact CD2-CG 3.97Å; F660-W868 HydrophobicContact CD2-CZ3 4.38Å; F660-W868 HydrophobicContact CE2-CE3 4.41Å; F660-W868 HydrophobicContact CG-CD2 4.44Å; A671-W868 HydrophobicContact CB-CH2 3.79Å; A671-W868 HydrophobicContact CB-CZ2 4.11Å; I680-W868 HydrophobicContact CD1-CH2 3.81Å; I680-W868 HydrophobicContact CD1-CZ3 4.26Å; I680-W868 HydrophobicContact CG2-CZ3 4.42Å; L682-W868 HydrophobicContact CD2-CE3 4.21Å; L682-W868 HydrophobicContact CD2-CZ3 4.43Å; I863-W868 VanDerWaalsContact O-CB 3.28Å; I863-W868 WeakPolarHBondContact O-CB 3.49Å; I863-W868 PolarHBondContact O-N 3.26Å; W868-I870 PolarHBondContact O-N 3.19Å; W868-L871 WeakPolarHBondContact O-CB 3.33Å; W868-L871 PolarHBondContact O-N 2.68Å; W868-C872 VanDerWaalsContact CE2-SG 3.55Å; W868-C872 PolarHBondContact O-N 2.91Å
869	P	89.1	Confident	86.8	Confident	32 Å²	32	30 Å²	30	21%	0.208	14%	0.137	C	C	.	.	H	α-helix	trans	-57	-36.3	173.8	-26.8	35.8	0	0	0	113.1	Q864 S873	Q864-P869 WeakPolarHBondContact O-CD 3.35Å; P869-S873 WeakPolarHBondContact O-CB 3.46Å; P869-S873 PolarHBondContact O-N 2.93Å; P869-S873 PolarHBondContact O-OG 3.27Å
870	I	88.2	Confident	86.4	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-74.5	-38.3	179.5	-58.9	170.8	0	0	0	110.7	I585 L689 I778 I866 L867 W868 C872 S873 S874	I585-I870 HydrophobicContact CD1-CG2 4.43Å; I585-I870 HydrophobicContact CG2-CD1 3.64Å; I585-I870 HydrophobicContact CG2-CG1 3.88Å; L689-I870 HydrophobicContact CD1-CG2 4.07Å; L689-I870 HydrophobicContact CD2-CB 4.31Å; L689-I870 HydrophobicContact CD2-CG2 3.78Å; L689-I870 HydrophobicContact CG-CG2 4.5Å; I778-I870 HydrophobicContact CD1-CD1 4.01Å; I778-I870 HydrophobicContact CD1-CG2 4.37Å; I778-I870 HydrophobicContact CG1-CD1 4.42Å; I778-I870 HydrophobicContact CG2-CD1 3.41Å; I778-I870 VanDerWaalsContact CG2-CD1 3.41Å; I866-I870 HydrophobicContact CG2-CD1 4.27Å; I866-I870 VanDerWaalsContact O-CD1 3.31Å; I866-I870 WeakPolarHBondContact O-CD1 3.39Å; I866-I870 VanDerWaalsContact O-CG1 3.3Å; I866-I870 WeakPolarHBondContact O-CG1 3.48Å; L867-I870 PolarHBondContact O-N 2.98Å; W868-I870 PolarHBondContact O-N 3.19Å; I870-C872 PolarHBondContact O-N 2.92Å; I870-S873 WeakPolarHBondContact CA-OG 3.47Å; I870-S873 PolarHBondContact O-N 3.3Å; I870-S874 WeakPolarHBondContact O-CA 3.37Å; I870-S874 VanDerWaalsContact O-CB 3.25Å; I870-S874 WeakPolarHBondContact O-CB 3.45Å; I870-S874 PolarHBondContact O-N 3.47Å
871	L	90.1	Very high	86.1	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-57.7	-46.3	171	-74.2	171.3	0	0	0	112	L682 L685 L689 L867 W868 L875	L682-L871 HydrophobicContact CD2-CD1 4.36Å; L685-L871 HydrophobicContact CB-CD2 4.06Å; L685-L871 WeakPolarHBondContact O-CD2 3.36Å; L689-L871 HydrophobicContact CB-CD2 3.79Å; L689-L871 HydrophobicContact CD2-CD2 3.72Å; L689-L871 HydrophobicContact CD2-CG 4.01Å; L689-L871 HydrophobicContact CG-CD2 4.31Å; L867-L871 HydrophobicContact CD2-CD1 4.45Å; L867-L871 HydrophobicContact CG-CD1 4.04Å; L867-L871 HydrophobicContact CG-CG 4.3Å; L867-L871 WeakPolarHBondContact O-CG 3.47Å; L867-L871 PolarHBondContact O-N 2.74Å; W868-L871 WeakPolarHBondContact O-CB 3.33Å; W868-L871 PolarHBondContact O-N 2.68Å; L871-L875 HydrophobicContact CD2-CD2 3.99Å; L871-L875 VanDerWaalsContact O-CB 3.29Å; L871-L875 WeakPolarHBondContact O-CB 3.42Å
872	C	90	Very high	85.5	Confident	19 Å²	19	28.2 Å²	28.2	13%	0.128	13%	0.132	C	C	.	.	H	α-helix	trans	-69.9	-37.7	177.6	-70.1	0	0	0	0	113.4	L655 R656 W868 I870	L655-C872 PolarHBondContact O-SG 3.22Å; R656-C872 WeakPolarHBondContact CD-O 3.2Å; R656-C872 PolarHBondContact NE-O 3.11Å; W868-C872 VanDerWaalsContact CE2-SG 3.55Å; W868-C872 PolarHBondContact O-N 2.91Å; I870-C872 PolarHBondContact O-N 2.92Å
873	S	84.2	Confident	85	Confident	20 Å²	20	29.9 Å²	29.9	14%	0.14	14%	0.142	C	C	.	.	H	α-helix	trans	-92.1	-22.4	-171.8	63.4	0	0	0	0	115.7	R656 P869 I870	R656-S873 VanDerWaalsContact CZ-O 3.24Å; R656-S873 PolarHBondContact NH1-O 3.12Å; R656-S873 PolarHBondContact NH2-O 2.99Å; P869-S873 WeakPolarHBondContact O-CB 3.46Å; P869-S873 PolarHBondContact O-N 2.93Å; P869-S873 PolarHBondContact O-OG 3.27Å; I870-S873 WeakPolarHBondContact CA-OG 3.47Å; I870-S873 PolarHBondContact O-N 3.3Å
874	S	82.2	Confident	84.5	Confident	26 Å²	26	30.6 Å²	30.6	18%	0.182	15%	0.145	C	C	.	.	H	α-helix	trans	-131.3	-23.9	-164.5	-54.3	0	0	0	0	115	I870 L876	I870-S874 WeakPolarHBondContact O-CA 3.37Å; I870-S874 VanDerWaalsContact O-CB 3.25Å; I870-S874 WeakPolarHBondContact O-CB 3.45Å; I870-S874 PolarHBondContact O-N 3.47Å; S874-L876 PolarHBondContact O-N 3.33Å
875	L	88	Confident	83.5	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.01	15%	0.149	C	C	.	.			trans	-65.9	132.4	175.8	-178	59.2	0	0	0	110.6	L655 L685 A688 L689 L871 P877 L898	L655-L875 HydrophobicContact CD1-CD2 3.84Å; L655-L875 HydrophobicContact CD1-CG 4.35Å; L685-L875 HydrophobicContact CB-CD2 4.49Å; L685-L875 HydrophobicContact CD2-CD2 3.76Å; A688-L875 HydrophobicContact CB-CD1 3.98Å; L689-L875 HydrophobicContact CB-CD1 4.22Å; L689-L875 HydrophobicContact CD1-CB 4.36Å; L871-L875 HydrophobicContact CD2-CD2 3.99Å; L871-L875 VanDerWaalsContact O-CB 3.29Å; L871-L875 WeakPolarHBondContact O-CB 3.42Å; L875-P877 WeakPolarHBondContact O-CD 3.38Å; L875-L898 HydrophobicContact CD2-CD1 4.35Å
876	L	86.4	Confident	82.2	Confident	11 Å²	11	30.5 Å²	30.5	6%	0.058	15%	0.149	C	C	.	.			trans	-112.9	85.9	174.8	-69.6	176.9	0	0	0	108.9	I600 L647 K652 Q692 S874 S878 Y881	I600-L876 HydrophobicContact CD1-CD1 4.18Å; I600-L876 HydrophobicContact CG1-CD1 3.57Å; L647-L876 HydrophobicContact CD2-CB 3.81Å; L647-L876 WeakPolarHBondContact CD2-O 3.44Å; K652-L876 HydrophobicContact CD-CD2 4.42Å; Q692-L876 PolarHBondContact NE2-O 3.08Å; S874-L876 PolarHBondContact O-N 3.33Å; L876-S878 PolarHBondContact O-N 3.17Å; L876-Y881 PolarHBondContact O-OH 3.4Å
877	P	85.5	Confident	80.8	Confident	1 Å²	1	33 Å²	33	1%	0.006	16%	0.162	C	C	.	.			trans	-64	111.4	-168.2	24.5	-34.1	0	0	0	112.4	D648 I651 K652 L655 L875 Y881 L898	D648-P877 PolarHBondContact N-O 3.25Å; I651-P877 HydrophobicContact CB-CB 3.96Å; I651-P877 HydrophobicContact CB-CG 3.83Å; I651-P877 HydrophobicContact CG2-CB 3.67Å; I651-P877 HydrophobicContact CG2-CG 3.77Å; K652-P877 HydrophobicContact CB-CG 3.87Å; L655-P877 HydrophobicContact CD1-CG 4.37Å; L875-P877 WeakPolarHBondContact O-CD 3.38Å; P877-Y881 WeakPolarHBondContact CA-OH 3.34Å; P877-L898 HydrophobicContact CB-CD1 3.72Å
878	S	83.5	Confident	78.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-79	151.9	168.6	174.9	0	0	0	0	111	D646 L876 R880 Y881	D646-S878 CarbonylContact O-C 3.54Å; D646-S878 WeakPolarHBondContact O-CA 3.11Å; L876-S878 PolarHBondContact O-N 3.17Å; S878-R880 VanDerWaalsContact C-N 3.25Å; S878-R880 PolarHBondContact OG-N 2.94Å; S878-R880 PolarHBondContact OG-O 3.02Å; S878-Y881 PolarHBondContact N-OH 3.17Å; S878-Y881 VanDerWaalsContact N-OH 3.12Å; S878-Y881 VanDerWaalsContact O-CE2 3.26Å; S878-Y881 WeakPolarHBondContact O-CE2 3.29Å
879	R	77.2	Confident	76.5	Confident	115 Å²	115	43.1 Å²	43.1	43%	0.434	21%	0.213	S	C	.	.	S	Bend	trans	-68.7	-26.2	167.1	-61.5	-170	-175.8	-72.8	-10.9	112.5	D646 D648	D646-R879 PolarHBondContact O-N 3.29Å; D646-R879 VanDerWaalsContact OD1-CD 3.23Å; D646-R879 WeakPolarHBondContact OD1-CD 3.45Å; D646-R879 WeakPolarHBondContact OD1-CG 3.34Å; D646-R879 IonicContact OD1-NE 2.73Å; D648-R879 HydrophobicContact CB-CG 4.16Å; D648-R879 IonicContact OD2-CZ 3.34Å; D648-R879 VanDerWaalsContact OD2-CZ 3.28Å; D648-R879 IonicContact OD2-NH1 2.98Å; D648-R879 PolarHBondContact OD2-NH1 3.47Å; D648-R879 IonicContact OD2-NH2 3.73Å; D648-R879 PolarHBondContact OD2-NH2 2.85Å
880	R	74.4	Confident	74.3	Confident	156 Å²	156	49.4 Å²	49.4	59%	0.589	24%	0.239	S	C	*	.			trans	-123.8	108.6	-177.5	-75.6	-177.9	-87.3	-173.5	-6.8	110.5	D646 S878	D646-R880 IonicContact OD2-CZ 2.85Å; D646-R880 IonicContact OD2-NE 3.12Å; D646-R880 PolarHBondContact OD2-NE 3.03Å; D646-R880 IonicContact OD2-NH2 3.79Å; D646-R880 PolarHBondContact OD2-NH2 2.87Å; S878-R880 VanDerWaalsContact C-N 3.25Å; S878-R880 PolarHBondContact OG-N 2.94Å; S878-R880 PolarHBondContact OG-O 3.02Å
881	Y	81	Confident	72.1	Confident	3 Å²	3	56.4 Å²	56.4	1%	0.012	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-104.8	150.6	159.1	-70.4	-88.1	0	0	0	109.6	L643 A688 Y691 Q692 L876 P877 S878 F884 L898	L643-Y881 HydrophobicContact CD2-CD1 4.09Å; L643-Y881 HydrophobicContact CD2-CE1 3.94Å; A688-Y881 HydrophobicContact CB-CD1 3.98Å; A688-Y881 HydrophobicContact CB-CD2 4.42Å; A688-Y881 HydrophobicContact CB-CE1 3.52Å; A688-Y881 HydrophobicContact CB-CE2 4.01Å; A688-Y881 HydrophobicContact CB-CG 4.41Å; Y691-Y881 HydrophobicContact CD1-CD1 4.21Å; Q692-Y881 PolarHBondContact NE2-OH 3.01Å; L876-Y881 PolarHBondContact O-OH 3.4Å; P877-Y881 WeakPolarHBondContact CA-OH 3.34Å; S878-Y881 PolarHBondContact N-OH 3.17Å; S878-Y881 VanDerWaalsContact N-OH 3.12Å; S878-Y881 VanDerWaalsContact O-CE2 3.26Å; S878-Y881 WeakPolarHBondContact O-CE2 3.29Å; Y881-F884 HydrophobicContact CD1-CE2 4.4Å; Y881-F884 HydrophobicContact CD1-CZ 4.05Å; Y881-F884 HydrophobicContact CG-CE2 4.39Å; Y881-F884 HydrophobicContact CG-CZ 4.45Å; Y881-L898 HydrophobicContact CD2-CD1 4.27Å; Y881-L898 HydrophobicContact CD2-CG 4.07Å; Y881-L898 HydrophobicContact CE2-CD1 3.42Å; Y881-L898 VanDerWaalsContact CE2-CD1 3.42Å; Y881-L898 HydrophobicContact CE2-CG 3.71Å
882	P	76.9	Confident	70	Confident	30 Å²	30	60.9 Å²	60.9	20%	0.195	30%	0.301	C	S	.	.			trans	-60.2	159.9	167	28.4	-36.3	0	0	0	110.9	Y691 C813 F884	Y691-P882 HydrophobicContact CD1-CG 4.47Å; Y691-P882 HydrophobicContact CE1-CG 3.86Å; Y691-P882 HydrophobicContact CE2-CG 4.14Å; C813-P882 WeakPolarHBondContact SG-CG 3.28Å; P882-F884 HydrophobicContact CG-CE1 4.32Å; P882-F884 PolarHBondContact O-N 3.39Å
883	N	76.4	Confident	68	Low	60 Å²	60	66.7 Å²	66.7	32%	0.321	33%	0.33	S	S	.	.			trans	-72	116.5	172	178.5	16.2	0	0	0	109.7	D885	N883-D885 PolarHBondContact ND2-O 3.3Å; N883-D885 PolarHBondContact O-N 3.33Å; N883-D885 PolarHBondContact OD1-N 3.4Å
884	F	78.1	Confident	66.5	Low	15 Å²	15	72.6 Å²	72.6	7%	0.066	35%	0.354	C	S	.	.	S	Bend	trans	-74.8	-8.7	179	-64.6	-65	0	0	0	114.4	Q687 Y691 C813 A816 N817 Y881 P882	Q687-F884 HydrophobicContact CB-CD1 4.34Å; Q687-F884 HydrophobicContact CB-CD2 3.54Å; Q687-F884 HydrophobicContact CB-CE1 4.48Å; Q687-F884 HydrophobicContact CB-CE2 3.68Å; Q687-F884 HydrophobicContact CB-CG 3.89Å; Q687-F884 HydrophobicContact CB-CZ 4.16Å; Q687-F884 HydrophobicContact CG-CB 4.4Å; Q687-F884 HydrophobicContact CG-CD2 4.18Å; Q687-F884 HydrophobicContact CG-CG 4.25Å; Y691-F884 HydrophobicContact CD1-CE1 4.43Å; Y691-F884 HydrophobicContact CD1-CZ 4.38Å; Y691-F884 AromaticContact CD2-CE1 3.91Å; Y691-F884 HydrophobicContact CD2-CE1 3.91Å; Y691-F884 AromaticContact CG-CE1 3.77Å; Y691-F884 HydrophobicContact CG-CE1 3.77Å; Y691-F884 HydrophobicContact CG-CZ 4.05Å; C813-F884 HydrophobicContact CB-CD1 4.07Å; A816-F884 HydrophobicContact CB-CD1 4.34Å; A816-F884 HydrophobicContact CB-CE1 4.16Å; N817-F884 PolarHBondContact ND2-O 2.9Å; Y881-F884 HydrophobicContact CD1-CE2 4.4Å; Y881-F884 HydrophobicContact CD1-CZ 4.05Å; Y881-F884 HydrophobicContact CG-CE2 4.39Å; Y881-F884 HydrophobicContact CG-CZ 4.45Å; P882-F884 HydrophobicContact CG-CE1 4.32Å; P882-F884 PolarHBondContact O-N 3.39Å
885	D	69	Low	65.7	Low	58 Å²	58	74.4 Å²	74.4	31%	0.31	37%	0.366	S	S	.	.			trans	-123.4	90	177.5	-146	6.7	0	0	0	112.2	K794 N883 D887	K794-D885 IonicContact NZ-OD1 2.72Å; K794-D885 PolarHBondContact NZ-OD1 2.86Å; N883-D885 PolarHBondContact ND2-O 3.3Å; N883-D885 PolarHBondContact O-N 3.33Å; N883-D885 PolarHBondContact OD1-N 3.4Å; D885-D887 PolarHBondContact O-N 3.49Å; D885-D887 VanDerWaalsContact O-N 3.11Å
886	L	60.8	Low	64.8	Low	65 Å²	65	77.6 Å²	77.6	34%	0.34	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	1.2	-174.1	-59	168.7	0	0	0	114.4	Q798 N810 I814	Q798-L886 HydrophobicContact CB-CB 4.47Å; Q798-L886 HydrophobicContact CB-CD1 3.87Å; Q798-L886 HydrophobicContact CG-CB 4.49Å; N810-L886 WeakPolarHBondContact OD1-CD1 3.15Å; I814-L886 HydrophobicContact CD1-CD1 4.24Å; I814-L886 HydrophobicContact CG1-CD1 4.18Å
887	D	55	Low	64.2	Low	59 Å²	59	79 Å²	79	32%	0.316	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-9.9	177.6	-72.2	-70.5	0	0	0	113.8	K794 Q798 D885	K794-D887 VanDerWaalsContact CE-OD2 3.24Å; K794-D887 WeakPolarHBondContact CE-OD2 3.39Å; K794-D887 IonicContact NZ-OD2 2.7Å; K794-D887 PolarHBondContact NZ-OD2 2.93Å; Q798-D887 PolarHBondContact NE2-OD1 3.48Å; Q798-D887 PolarHBondContact NE2-OD2 3.23Å; D885-D887 PolarHBondContact O-N 3.49Å; D885-D887 VanDerWaalsContact O-N 3.11Å
888	H	49.7	Very low	64.1	Low	134 Å²	134	79 Å²	79	62%	0.62	39%	0.39	S	S	*	.	S	Bend	trans	-83.7	135.3	176.2	-83.3	-72.6	0	0	0	112
889	N	41.6	Very low	64.1	Low	96 Å²	96	85 Å²	85	51%	0.513	42%	0.419	S	S	.	.			trans	-54.8	146.7	-171.7	-50.6	-81.3	0	0	0	113.5	R728 N891 D892	R728-N889 PolarHBondContact NH2-OD1 3.43Å; N889-N891 PolarHBondContact O-N 2.93Å; N889-D892 PolarHBondContact O-N 3.35Å
890	E	42.9	Very low	64.3	Low	164 Å²	164	82 Å²	82	77%	0.766	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-50.3	-21	-173.9	-60.9	159.1	136.2	0	0	115.7	D892 N893	E890-D892 PolarHBondContact O-N 3.12Å; E890-N893 VanDerWaalsContact O-CG 3.3Å; E890-N893 PolarHBondContact O-ND2 3.13Å
891	N	41.1	Very low	64.9	Low	149 Å²	149	74.6 Å²	74.6	80%	0.797	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-69.9	-12.4	177.3	-66.6	-26	0	0	0	114.4	N889	N889-N891 PolarHBondContact O-N 2.93Å
892	D	46.3	Very low	65.4	Low	95 Å²	95	76.2 Å²	76.2	51%	0.508	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-113.8	42.5	177.6	-99.3	-49.1	0	0	0	113.1	N889 E890 K894	N889-D892 PolarHBondContact O-N 3.35Å; E890-D892 PolarHBondContact O-N 3.12Å; D892-K894 PolarHBondContact O-N 3.29Å; D892-K894 IonicContact OD1-NZ 3.79Å; D892-K894 PolarHBondContact OD1-NZ 2.9Å
893	N	48.1	Very low	66	Low	141 Å²	141	78.3 Å²	78.3	75%	0.754	40%	0.404	S	S	*	.			trans	-64.7	36.7	167.2	-77.8	-20.1	0	0	0	114.2	E890 S895	E890-N893 VanDerWaalsContact O-CG 3.3Å; E890-N893 PolarHBondContact O-ND2 3.13Å; N893-S895 PolarHBondContact O-N 2.74Å
894	K	53.6	Low	66.7	Low	145 Å²	145	81.4 Å²	81.4	63%	0.63	41%	0.411	S	S	*	.			trans	-87.4	107.1	179	-62.9	-176.1	-178.1	71.8	0	109.7	D892 F896	D892-K894 PolarHBondContact O-N 3.29Å; D892-K894 IonicContact OD1-NZ 3.79Å; D892-K894 PolarHBondContact OD1-NZ 2.9Å; K894-F896 PolarHBondContact O-N 2.77Å
895	S	63.5	Low	67.2	Low	63 Å²	63	84.9 Å²	84.9	44%	0.441	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-50.1	126.3	170.7	55.7	0	0	0	0	111.5	N893	N893-S895 PolarHBondContact O-N 2.74Å
896	F	70	Confident	68.1	Low	70 Å²	70	83.6 Å²	83.6	31%	0.307	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-82.2	126.5	-174.3	-179.6	-96.4	0	0	0	112	P684 K894 L898 S900	P684-F896 HydrophobicContact CB-CD1 4.22Å; P684-F896 HydrophobicContact CB-CE1 3.51Å; P684-F896 HydrophobicContact CB-CZ 4.13Å; P684-F896 HydrophobicContact CG-CE1 4.05Å; P684-F896 HydrophobicContact CG-CZ 4.15Å; K894-F896 PolarHBondContact O-N 2.77Å; F896-L898 HydrophobicContact CE1-CD2 4.25Å; F896-S900 VanDerWaalsContact CE2-OG 3.26Å; F896-S900 WeakPolarHBondContact CE2-OG 3.5Å; F896-S900 WeakPolarHBondContact CZ-OG 3.4Å
897	S	74.6	Confident	69.2	Low	39 Å²	39	80.6 Å²	80.6	27%	0.273	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-89.7	126.6	172.5	172.3	0	0	0	0	111.7	Q899 S900	S897-Q899 PolarHBondContact O-N 3.05Å; S897-Q899 VanDerWaalsContact O-N 3.08Å; S897-Q899 WeakPolarHBondContact OG-CB 3.4Å; S897-Q899 PolarHBondContact OG-N 2.85Å; S897-S900 PolarHBondContact O-N 3Å; S897-S900 PolarHBondContact O-OG 3.14Å
898	L	83.2	Confident	70.2	Confident	1 Å²	1	82.9 Å²	82.9	1%	0.005	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-60.4	-15.5	174.8	-69.6	-179.3	0	0	0	113.7	I651 P684 L685 A688 L875 P877 Y881 F896 S900 C901 F902	I651-L898 HydrophobicContact CD1-CB 4.08Å; P684-L898 HydrophobicContact CB-CD2 4.26Å; L685-L898 HydrophobicContact CD2-CD1 4.11Å; L685-L898 HydrophobicContact CD2-CD2 4.04Å; L685-L898 HydrophobicContact CD2-CG 4.47Å; A688-L898 HydrophobicContact CB-CD1 4Å; A688-L898 HydrophobicContact CB-CD2 4.11Å; L875-L898 HydrophobicContact CD2-CD1 4.35Å; P877-L898 HydrophobicContact CB-CD1 3.72Å; Y881-L898 HydrophobicContact CD2-CD1 4.27Å; Y881-L898 HydrophobicContact CD2-CG 4.07Å; Y881-L898 HydrophobicContact CE2-CD1 3.42Å; Y881-L898 VanDerWaalsContact CE2-CD1 3.42Å; Y881-L898 HydrophobicContact CE2-CG 3.71Å; F896-L898 HydrophobicContact CE1-CD2 4.25Å; L898-S900 PolarHBondContact O-N 2.73Å; L898-C901 WeakPolarHBondContact O-CB 3.44Å; L898-C901 PolarHBondContact O-N 2.96Å; L898-C901 PolarHBondContact O-SG 2.89Å; L898-C901 VanDerWaalsContact O-SG 3.34Å; L898-F902 WeakPolarHBondContact O-CD2 3.16Å; L898-F902 WeakPolarHBondContact O-CE2 3.42Å
899	Q	82.3	Confident	71.5	Confident	127 Å²	127	80.8 Å²	80.8	59%	0.593	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-55.7	-36.7	179	-166.6	176.9	4.1	0	0	111.8	I651 S897 C901 F902	I651-Q899 HydrophobicContact CD1-CB 3.93Å; S897-Q899 PolarHBondContact O-N 3.05Å; S897-Q899 VanDerWaalsContact O-N 3.08Å; S897-Q899 WeakPolarHBondContact OG-CB 3.4Å; S897-Q899 PolarHBondContact OG-N 2.85Å; Q899-C901 PolarHBondContact O-N 2.94Å; Q899-F902 PolarHBondContact O-N 2.98Å
900	S	82.7	Confident	73.2	Confident	53 Å²	53	79 Å²	79	37%	0.371	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-72	-3.1	177.8	73.3	0	0	0	0	114.5	R681 F896 S897 L898 F902	R681-S900 PolarHBondContact NE-O 3.03Å; R681-S900 PolarHBondContact NH2-O 3.43Å; R681-S900 PolarHBondContact NH2-OG 3.28Å; F896-S900 VanDerWaalsContact CE2-OG 3.26Å; F896-S900 WeakPolarHBondContact CE2-OG 3.5Å; F896-S900 WeakPolarHBondContact CZ-OG 3.4Å; S897-S900 PolarHBondContact O-N 3Å; S897-S900 PolarHBondContact O-OG 3.14Å; L898-S900 PolarHBondContact O-N 2.73Å; S900-F902 VanDerWaalsContact C-N 3.33Å
901	C	86.9	Confident	74.5	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-77.6	-21.1	173.8	-57.5	0	0	0	0	112.4	I680 R681 L685 L898 Q899	I680-C901 WeakPolarHBondContact CA-O 3.48Å; R681-C901 HydrophobicContact CB-CB 4.43Å; R681-C901 PolarHBondContact N-O 2.9Å; L685-C901 HydrophobicContact CD1-CB 4.24Å; L685-C901 HydrophobicContact CG-CB 4.1Å; L898-C901 WeakPolarHBondContact O-CB 3.44Å; L898-C901 PolarHBondContact O-N 2.96Å; L898-C901 PolarHBondContact O-SG 2.89Å; L898-C901 VanDerWaalsContact O-SG 3.34Å; Q899-C901 PolarHBondContact O-N 2.94Å
902	F	90.4	Very high	75.7	Confident	36 Å²	36	74.1 Å²	74.1	16%	0.158	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	110.8	-173.8	-55.1	-95.3	0	0	0	109.7	I651 T654 L655 L678 I680 L685 L898 Q899 S900	I651-F902 HydrophobicContact CG2-CD2 4.4Å; I651-F902 HydrophobicContact CG2-CE2 3.52Å; I651-F902 HydrophobicContact CG2-CZ 3.84Å; T654-F902 HydrophobicContact CG2-CD1 4.04Å; T654-F902 HydrophobicContact CG2-CE1 4.25Å; L655-F902 HydrophobicContact CD1-CZ 4.21Å; L655-F902 HydrophobicContact CD2-CE1 3.87Å; L655-F902 HydrophobicContact CD2-CZ 3.74Å; L655-F902 HydrophobicContact CG-CE1 4.08Å; L655-F902 HydrophobicContact CG-CZ 3.74Å; L678-F902 HydrophobicContact CD1-CD1 4.28Å; I680-F902 HydrophobicContact CD1-CD1 3.8Å; I680-F902 HydrophobicContact CD1-CE1 3.87Å; I680-F902 HydrophobicContact CG1-CD1 3.81Å; I680-F902 HydrophobicContact CG1-CE1 4.22Å; L685-F902 HydrophobicContact CD1-CE1 4.47Å; L685-F902 HydrophobicContact CD1-CZ 4Å; L685-F902 HydrophobicContact CD2-CE2 4.09Å; L685-F902 HydrophobicContact CD2-CZ 3.87Å; L898-F902 WeakPolarHBondContact O-CD2 3.16Å; L898-F902 WeakPolarHBondContact O-CE2 3.42Å; Q899-F902 PolarHBondContact O-N 2.98Å; S900-F902 VanDerWaalsContact C-N 3.33Å
903	I	90.8	Very high	76.7	Confident	75 Å²	75	75.1 Å²	75.1	39%	0.385	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	106.5	-178.2	-59.6	168.9	0	0	0	107.5	L679 L905	L679-I903 HydrophobicContact CB-CB 4.17Å; L679-I903 HydrophobicContact CD2-CD1 4.36Å; L679-I903 PolarHBondContact N-O 2.9Å; L679-I903 PolarHBondContact O-N 3.37Å; I903-L905 HydrophobicContact CG2-CD2 4.46Å; I903-L905 PolarHBondContact O-N 2.94Å
904	R	90.4	Very high	77.6	Confident	125 Å²	125	72 Å²	72	47%	0.472	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	120.5	172.4	172.6	176.2	164.2	165.3	-12.1	109.4	E676 L678 S907 D910	E676-R904 WeakPolarHBondContact OE1-CD 3.43Å; E676-R904 IonicContact OE1-CZ 3.17Å; E676-R904 IonicContact OE1-NE 2.95Å; E676-R904 IonicContact OE1-NH1 3.88Å; E676-R904 PolarHBondContact OE1-NH1 2.92Å; L678-R904 HydrophobicContact CD2-CB 3.91Å; R904-S907 PolarHBondContact NH2-OG 3.14Å; R904-S907 VanDerWaalsContact NH2-OG 3.11Å; R904-D910 IonicContact CZ-OD2 2.6Å; R904-D910 IonicContact NH2-OD2 2.73Å; R904-D910 PolarHBondContact NH2-OD2 3.25Å
905	L	89.1	Confident	78.2	Confident	87 Å²	87	72.4 Å²	72.4	46%	0.455	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-43.9	174.5	-64.5	-174.9	0	0	0	111.7	L670 L677 L679 I903	L670-L905 HydrophobicContact CD2-CD1 3.5Å; L677-L905 HydrophobicContact CD2-CB 4.46Å; L677-L905 HydrophobicContact CD2-CD1 4.27Å; L677-L905 HydrophobicContact CG-CB 4.42Å; L677-L905 HydrophobicContact CG-CD1 4.36Å; L677-L905 PolarHBondContact O-N 3.23Å; L679-L905 HydrophobicContact CB-CD1 4.01Å; L679-L905 HydrophobicContact CB-CD2 3.87Å; L679-L905 HydrophobicContact CB-CG 3.84Å; L679-L905 HydrophobicContact CD2-CD2 4.24Å; I903-L905 HydrophobicContact CG2-CD2 4.46Å; I903-L905 PolarHBondContact O-N 2.94Å
906	T	87.2	Confident	78.3	Confident	31 Å²	31	75.9 Å²	75.9	19%	0.19	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	174.8	-179	-170.5	0	0	0	0	110.5	L677 L911	L677-T906 HydrophobicContact CB-CG2 3.92Å; L677-T906 HydrophobicContact CD2-CG2 4.14Å; L677-T906 PolarHBondContact N-O 3.21Å; T906-L911 HydrophobicContact CG2-CD1 3.91Å; T906-L911 HydrophobicContact CG2-CD2 4.28Å; T906-L911 HydrophobicContact CG2-CG 3.99Å
907	S	84.7	Confident	78.1	Confident	3 Å²	3	83 Å²	83	2%	0.021	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	163.5	167	75.7	0	0	0	0	111.6	T675 R904 T909 D910 L911	T675-S907 CarbonylContact O-C 3.59Å; T675-S907 VanDerWaalsContact O-CA 3.29Å; T675-S907 WeakPolarHBondContact O-CA 3.25Å; R904-S907 PolarHBondContact NH2-OG 3.14Å; R904-S907 VanDerWaalsContact NH2-OG 3.11Å; S907-T909 PolarHBondContact O-N 2.82Å; S907-T909 PolarHBondContact OG-OG1 2.92Å; S907-D910 PolarHBondContact N-OD2 3.2Å; S907-D910 WeakPolarHBondContact O-CA 3.33Å; S907-D910 WeakPolarHBondContact O-CB 3.26Å; S907-D910 PolarHBondContact O-N 3.16Å; S907-D910 VanDerWaalsContact OG-CG 3.27Å; S907-D910 PolarHBondContact OG-OD2 3.35Å; S907-L911 PolarHBondContact O-N 3.45Å
908	L	75.6	Confident	77.2	Confident	107 Å²	107	88.6 Å²	88.6	56%	0.56	44%	0.435	S	S	*	.	H	α-helix	trans	-58	-33.5	179.5	-172	63.6	0	0	0	112.8	T675 D910 Y912	T675-L908 HydrophobicContact CG2-CD2 4.49Å; T675-L908 PolarHBondContact O-N 3.27Å; L908-D910 VanDerWaalsContact C-N 3.31Å; L908-Y912 WeakPolarHBondContact O-CB 3.29Å; L908-Y912 PolarHBondContact O-N 3.37Å
909	T	75.9	Confident	76.9	Confident	89 Å²	89	93 Å²	93	55%	0.546	46%	0.457	S	S	.	.	H	α-helix	trans	-74.9	-20.1	176.3	49	0	0	0	0	113.5	S907 K913	S907-T909 PolarHBondContact O-N 2.82Å; S907-T909 PolarHBondContact OG-OG1 2.92Å; T909-K913 WeakPolarHBondContact O-CE 3.41Å
910	D	77.4	Confident	76.6	Confident	59 Å²	59	91.2 Å²	91.2	32%	0.316	45%	0.449	S	S	.	.	H	α-helix	trans	-85.7	-41.2	173	-55.6	-44.8	0	0	0	110.1	R904 S907 L908 K913	R904-D910 IonicContact CZ-OD2 2.6Å; R904-D910 IonicContact NH2-OD2 2.73Å; R904-D910 PolarHBondContact NH2-OD2 3.25Å; S907-D910 PolarHBondContact N-OD2 3.2Å; S907-D910 WeakPolarHBondContact O-CA 3.33Å; S907-D910 WeakPolarHBondContact O-CB 3.26Å; S907-D910 PolarHBondContact O-N 3.16Å; S907-D910 VanDerWaalsContact OG-CG 3.27Å; S907-D910 PolarHBondContact OG-OD2 3.35Å; L908-D910 VanDerWaalsContact C-N 3.31Å; D910-K913 PolarHBondContact O-N 3.38Å
911	L	71.3	Confident	76.3	Confident	62 Å²	62	93.3 Å²	93.3	33%	0.325	45%	0.454	S	S	.	.	H	α-helix	trans	-64	-37.3	173.2	-74.1	172.2	0	0	0	113.1	T906 S907 K913 V914 F915	T906-L911 HydrophobicContact CG2-CD1 3.91Å; T906-L911 HydrophobicContact CG2-CD2 4.28Å; T906-L911 HydrophobicContact CG2-CG 3.99Å; S907-L911 PolarHBondContact O-N 3.45Å; L911-K913 PolarHBondContact O-N 2.73Å; L911-V914 WeakPolarHBondContact O-CA 3.38Å; L911-V914 WeakPolarHBondContact O-CB 3.5Å; L911-V914 PolarHBondContact O-N 3.04Å; L911-F915 HydrophobicContact CB-CD2 4.34Å; L911-F915 HydrophobicContact CB-CE2 4.17Å; L911-F915 VanDerWaalsContact O-CD2 3.25Å; L911-F915 WeakPolarHBondContact O-CD2 3.36Å; L911-F915 PolarHBondContact O-N 3.22Å
912	Y	66.3	Low	75.6	Confident	148 Å²	148	98.8 Å²	98.8	58%	0.58	48%	0.48	S	S	*	.	H	α-helix	trans	-57.4	-39.5	177.5	-170.3	-84.7	0	0	0	111.6	L908 V914 F915 E916	L908-Y912 WeakPolarHBondContact O-CB 3.29Å; L908-Y912 PolarHBondContact O-N 3.37Å; Y912-V914 PolarHBondContact O-N 2.79Å; Y912-F915 CarbonylContact O-C 3.36Å; Y912-F915 PolarHBondContact O-N 3.32Å; Y912-E916 HydrophobicContact CE1-CB 4.39Å; Y912-E916 VanDerWaalsContact O-CB 3.28Å; Y912-E916 WeakPolarHBondContact O-CB 3.49Å; Y912-E916 PolarHBondContact O-N 3.19Å
913	K	66.1	Low	74.7	Confident	116 Å²	116	102.8 Å²	102.8	50%	0.504	50%	0.501	S	S	.	.	H	α-helix	trans	-69.9	-11.9	175.5	-61.1	168.2	-171.4	160.2	0	114	T909 D910 L911 R917	T909-K913 WeakPolarHBondContact O-CE 3.41Å; D910-K913 PolarHBondContact O-N 3.38Å; L911-K913 PolarHBondContact O-N 2.73Å; K913-R917 VanDerWaalsContact O-CD 3.28Å; K913-R917 WeakPolarHBondContact O-CD 3.29Å; K913-R917 VanDerWaalsContact O-CG 3.31Å; K913-R917 WeakPolarHBondContact O-CG 3.4Å
914	V	68.2	Low	73.7	Confident	76 Å²	76	104.6 Å²	104.6	46%	0.461	51%	0.508	S	S	.	.	H	α-helix	trans	-88.7	-47.3	169.5	-177.2	0	0	0	0	109.3	L911 Y912 E916 R917 C918	L911-V914 WeakPolarHBondContact O-CA 3.38Å; L911-V914 WeakPolarHBondContact O-CB 3.5Å; L911-V914 PolarHBondContact O-N 3.04Å; Y912-V914 PolarHBondContact O-N 2.79Å; V914-E916 PolarHBondContact O-N 3.43Å; V914-R917 CarbonylContact O-C 3.6Å; V914-R917 WeakPolarHBondContact O-CA 3.37Å; V914-R917 PolarHBondContact O-N 3.08Å; V914-C918 PolarHBondContact O-N 3.12Å; V914-C918 PolarHBondContact O-SG 2.9Å
915	F	65.4	Low	72.5	Confident	154 Å²	154	103.1 Å²	103.1	68%	0.675	51%	0.511	S	S	*	.	H	α-helix	trans	-64.7	-20.6	174.8	-68.7	-63.2	0	0	0	114.4	L911 Y912 R917	L911-F915 HydrophobicContact CB-CD2 4.34Å; L911-F915 HydrophobicContact CB-CE2 4.17Å; L911-F915 VanDerWaalsContact O-CD2 3.25Å; L911-F915 WeakPolarHBondContact O-CD2 3.36Å; L911-F915 PolarHBondContact O-N 3.22Å; Y912-F915 CarbonylContact O-C 3.36Å; Y912-F915 PolarHBondContact O-N 3.32Å; F915-R917 VanDerWaalsContact C-N 3.32Å
916	E	66.4	Low	71.2	Confident	136 Å²	136	104.4 Å²	104.4	64%	0.636	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.1	171.5	-168.8	172.3	-127.1	0	0	112.8	Y912 V914	Y912-E916 HydrophobicContact CE1-CB 4.39Å; Y912-E916 VanDerWaalsContact O-CB 3.28Å; Y912-E916 WeakPolarHBondContact O-CB 3.49Å; Y912-E916 PolarHBondContact O-N 3.19Å; V914-E916 PolarHBondContact O-N 3.43Å
917	R	64.6	Low	69.8	Low	220 Å²	220	110.5 Å²	110.5	83%	0.83	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-6.1	178.8	-75.8	-178.7	170.2	168.4	-5.9	114.2	K913 V914 F915	K913-R917 VanDerWaalsContact O-CD 3.28Å; K913-R917 WeakPolarHBondContact O-CD 3.29Å; K913-R917 VanDerWaalsContact O-CG 3.31Å; K913-R917 WeakPolarHBondContact O-CG 3.4Å; V914-R917 CarbonylContact O-C 3.6Å; V914-R917 WeakPolarHBondContact O-CA 3.37Å; V914-R917 PolarHBondContact O-N 3.08Å; F915-R917 VanDerWaalsContact C-N 3.32Å
918	C	56.2	Low	68.5	Low	156 Å²	156	120.3 Å²	120.3	100%	1.054	59%	0.59	S	S	*	*			trans	-108.1	0	178.7	-69.4	0	0	0	0	110.5	V914	V914-C918 PolarHBondContact O-N 3.12Å; V914-C918 PolarHBondContact O-SG 2.9Å

Retrieved 918 of 918 residues in 1359.9 ms (Link to these results)

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